smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[NH+](CC)[C@H](CNC(=O)N1CCC[N@@H+](CC)CC1)Cc1ccccc1 ZINC000159621192 508867121 /nfs/dbraw/zinc/86/71/21/508867121.db2.gz YPVIEYIBAZQUMU-FQEVSTJZSA-N 2 1 360.546 2.677 20 70 FFIDMP CC[NH+](CC)[C@H](CNC(=O)N1CCC[N@@H+](CC)CC1)c1ccsc1 ZINC000159620123 508867235 /nfs/dbraw/zinc/86/72/35/508867235.db2.gz PFKOMXVYIJDOED-QGZVFWFLSA-N 2 1 352.548 2.868 20 70 FFIDMP Cc1cnn([C@@H]2CC[NH+](Cc3ccccc3)C2)c1NC(=O)C[N@H+](C)C(C)C ZINC000159749810 508884737 /nfs/dbraw/zinc/88/47/37/508884737.db2.gz MKVNHENGBZTMKE-LJQANCHMSA-N 2 1 369.513 2.917 20 70 FFIDMP Cc1cnn([C@@H]2CC[N@H+](Cc3ccccc3)C2)c1NC(=O)C[NH+](C)C(C)C ZINC000159749810 508884738 /nfs/dbraw/zinc/88/47/38/508884738.db2.gz MKVNHENGBZTMKE-LJQANCHMSA-N 2 1 369.513 2.917 20 70 FFIDMP Cc1cnn([C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1NC(=O)C[NH+](C)C(C)C ZINC000159749810 508884739 /nfs/dbraw/zinc/88/47/39/508884739.db2.gz MKVNHENGBZTMKE-LJQANCHMSA-N 2 1 369.513 2.917 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C[N@H+]1C1CC1 ZINC000160002767 508923371 /nfs/dbraw/zinc/92/33/71/508923371.db2.gz FTDSPKQTNHVQLD-PKOBYXMFSA-N 2 1 362.562 2.909 20 70 FFIDMP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCN(CC)CC2)cc1)c1cnn(C)c1 ZINC000160307103 508968520 /nfs/dbraw/zinc/96/85/20/508968520.db2.gz AJMWVOHACPSAIO-NRFANRHFSA-N 2 1 355.530 2.799 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[NH+](C)[C@@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC000160407701 508982542 /nfs/dbraw/zinc/98/25/42/508982542.db2.gz DOHKKAHERQSWDN-RAUXBKROSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000160407701 508982543 /nfs/dbraw/zinc/98/25/43/508982543.db2.gz DOHKKAHERQSWDN-RAUXBKROSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000160407701 508982546 /nfs/dbraw/zinc/98/25/46/508982546.db2.gz DOHKKAHERQSWDN-RAUXBKROSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCC4(CC3)OCCO4)c2)CCO1 ZINC000161362029 509106724 /nfs/dbraw/zinc/10/67/24/509106724.db2.gz SDSFWZKYXJODTI-KRWDZBQOSA-N 2 1 360.498 2.683 20 70 FFIDMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCC4(CC3)OCCO4)c2)CCO1 ZINC000161362029 509106728 /nfs/dbraw/zinc/10/67/28/509106728.db2.gz SDSFWZKYXJODTI-KRWDZBQOSA-N 2 1 360.498 2.683 20 70 FFIDMP CCN(C(=O)NC[C@@H](C)[NH+](C)C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160069712 508934301 /nfs/dbraw/zinc/93/43/01/508934301.db2.gz TWEWYMWCLWEATI-XLIONFOSSA-N 2 1 358.530 2.775 20 70 FFIDMP CCN(C(=O)NC[C@@H](C)[N@H+](C)C1CC1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000160069712 508934306 /nfs/dbraw/zinc/93/43/06/508934306.db2.gz TWEWYMWCLWEATI-XLIONFOSSA-N 2 1 358.530 2.775 20 70 FFIDMP CCN(C(=O)NC[C@@H](C)[N@@H+](C)C1CC1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000160069712 508934312 /nfs/dbraw/zinc/93/43/12/508934312.db2.gz TWEWYMWCLWEATI-XLIONFOSSA-N 2 1 358.530 2.775 20 70 FFIDMP CNS(=O)(=O)c1cccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000160270282 508963627 /nfs/dbraw/zinc/96/36/27/508963627.db2.gz JDGRRHBMVNSGIP-CVEARBPZSA-N 2 1 353.532 2.510 20 70 FFIDMP CNS(=O)(=O)c1cccc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)c1 ZINC000160270282 508963629 /nfs/dbraw/zinc/96/36/29/508963629.db2.gz JDGRRHBMVNSGIP-CVEARBPZSA-N 2 1 353.532 2.510 20 70 FFIDMP O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCN(Cc2ccccc2)CC1 ZINC000160853511 509040069 /nfs/dbraw/zinc/04/00/69/509040069.db2.gz HIMCPYZDKZVAMC-IBGZPJMESA-N 2 1 356.514 2.531 20 70 FFIDMP O=C(N[C@H]1CC[N@@H+](C2CCCC2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000160853511 509040071 /nfs/dbraw/zinc/04/00/71/509040071.db2.gz HIMCPYZDKZVAMC-IBGZPJMESA-N 2 1 356.514 2.531 20 70 FFIDMP O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000160853511 509040074 /nfs/dbraw/zinc/04/00/74/509040074.db2.gz HIMCPYZDKZVAMC-IBGZPJMESA-N 2 1 356.514 2.531 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)CC1 ZINC000159783704 508890611 /nfs/dbraw/zinc/89/06/11/508890611.db2.gz NTCDOBUWWAGHFK-QGZVFWFLSA-N 2 1 364.559 2.697 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000159783704 508890614 /nfs/dbraw/zinc/89/06/14/508890614.db2.gz NTCDOBUWWAGHFK-QGZVFWFLSA-N 2 1 364.559 2.697 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000159783704 508890618 /nfs/dbraw/zinc/89/06/18/508890618.db2.gz NTCDOBUWWAGHFK-QGZVFWFLSA-N 2 1 364.559 2.697 20 70 FFIDMP C[C@H]1C[C@H](NC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C[N@H+]1C1CC1 ZINC000160002490 508923841 /nfs/dbraw/zinc/92/38/41/508923841.db2.gz FTDSPKQTNHVQLD-HKUYNNGSSA-N 2 1 362.562 2.909 20 70 FFIDMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(C(=O)OC(C)(C)C)cc3)C2)CC1 ZINC000160050822 508930585 /nfs/dbraw/zinc/93/05/85/508930585.db2.gz AKGUCUKYCMPEAO-HXUWFJFHSA-N 2 1 373.541 2.854 20 70 FFIDMP FC(F)(F)CN1CCC([NH2+]Cc2ccccc2C[NH+]2CCOCC2)CC1 ZINC000160433170 508986104 /nfs/dbraw/zinc/98/61/04/508986104.db2.gz QEJMISBOOQFIPB-UHFFFAOYSA-N 2 1 371.447 2.635 20 70 FFIDMP CCN1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCCc4c3cnn4C)cc2)CC1 ZINC000160331346 508971709 /nfs/dbraw/zinc/97/17/09/508971709.db2.gz QDIFLQZWKFPSGH-OAQYLSRUSA-N 2 1 367.541 2.725 20 70 FFIDMP CCC[NH+]1CCC([NH2+]Cc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000160924837 509049181 /nfs/dbraw/zinc/04/91/81/509049181.db2.gz ZJHBVKRYLXMMHC-ROUUACIJSA-N 2 1 373.541 2.900 20 70 FFIDMP C[C@@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)[N@@H+](C)C1CC1 ZINC000159864613 508902467 /nfs/dbraw/zinc/90/24/67/508902467.db2.gz GBIIEJWRRVNKIN-KRWDZBQOSA-N 2 1 350.551 2.767 20 70 FFIDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000159999930 508923204 /nfs/dbraw/zinc/92/32/04/508923204.db2.gz ZSJDDKIBUORRSO-NQIIRXRSSA-N 2 1 372.557 2.880 20 70 FFIDMP CC[C@@H](c1ccncc1)[N@H+](C)CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000160146084 508945232 /nfs/dbraw/zinc/94/52/32/508945232.db2.gz IQNWFEJJSPHZIZ-PMACEKPBSA-N 2 1 354.498 2.884 20 70 FFIDMP CC[C@@H](c1ccncc1)[N@@H+](C)CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000160146084 508945234 /nfs/dbraw/zinc/94/52/34/508945234.db2.gz IQNWFEJJSPHZIZ-PMACEKPBSA-N 2 1 354.498 2.884 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)CC2CC[NH+](C)CC2)C[N@H+]1Cc1ccccc1 ZINC000160339270 508972561 /nfs/dbraw/zinc/97/25/61/508972561.db2.gz JKBWJKPIIOLXPW-FXAWDEMLSA-N 2 1 358.530 2.633 20 70 FFIDMP CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N1CCC([NH+]2CCCC2)CC1 ZINC000160921962 509047969 /nfs/dbraw/zinc/04/79/69/509047969.db2.gz MYIKNDAEEOZKDC-IBGZPJMESA-N 2 1 350.551 2.767 20 70 FFIDMP COc1cc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)ccc1S(C)(=O)=O ZINC000161069722 509067235 /nfs/dbraw/zinc/06/72/35/509067235.db2.gz OZSZQELTTUPSJD-BPUTZDHNSA-N 2 1 354.516 2.622 20 70 FFIDMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)CC1 ZINC000161286497 509097188 /nfs/dbraw/zinc/09/71/88/509097188.db2.gz WSVGOWGYYIFJAW-UWVAXJGDSA-N 2 1 373.545 2.731 20 70 FFIDMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000160000068 508923513 /nfs/dbraw/zinc/92/35/13/508923513.db2.gz ZSJDDKIBUORRSO-RXVVDRJESA-N 2 1 372.557 2.880 20 70 FFIDMP C[NH+](C)CCN(C(=O)NCC[N@H+]1CCc2ccccc2C1)C1CCCC1 ZINC000160240033 508959123 /nfs/dbraw/zinc/95/91/23/508959123.db2.gz CQOVCUAFQXXXSJ-UHFFFAOYSA-N 2 1 358.530 2.561 20 70 FFIDMP C[NH+](C)CCCC1CCN(C(=O)NCC[N@H+]2CCc3ccccc3C2)CC1 ZINC000160289769 508965524 /nfs/dbraw/zinc/96/55/24/508965524.db2.gz VMVUXJQWAQJXMC-UHFFFAOYSA-N 2 1 372.557 2.808 20 70 FFIDMP Cc1ccc(NCCCNC(=O)N2CCC(CCC[NH+](C)C)CC2)[nH+]c1 ZINC000160399323 508982243 /nfs/dbraw/zinc/98/22/43/508982243.db2.gz FRSRXWGSFGQWON-UHFFFAOYSA-N 2 1 361.534 2.955 20 70 FFIDMP C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)NC2CC[NH+](C)CC2)CC1 ZINC000160715294 509024165 /nfs/dbraw/zinc/02/41/65/509024165.db2.gz HHDIDEGYLFTAEJ-KRWDZBQOSA-N 2 1 350.551 2.767 20 70 FFIDMP CCCC[N@@H+](C)CC1CCN(C(=O)N[C@H]2CC[NH+](CC3CC3)C2)CC1 ZINC000160714730 509024354 /nfs/dbraw/zinc/02/43/54/509024354.db2.gz BKRJNGSKCRDEQD-IBGZPJMESA-N 2 1 350.551 2.624 20 70 FFIDMP CCCC[NH+](C)CC1CCN(C(=O)N[C@H]2CC[N@H+](CC3CC3)C2)CC1 ZINC000160714730 509024355 /nfs/dbraw/zinc/02/43/55/509024355.db2.gz BKRJNGSKCRDEQD-IBGZPJMESA-N 2 1 350.551 2.624 20 70 FFIDMP CCCC[NH+](C)CC1CCN(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)CC1 ZINC000160714730 509024356 /nfs/dbraw/zinc/02/43/56/509024356.db2.gz BKRJNGSKCRDEQD-IBGZPJMESA-N 2 1 350.551 2.624 20 70 FFIDMP CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N(CC[NH+](C)C)Cc1ccco1 ZINC000160996443 509057891 /nfs/dbraw/zinc/05/78/91/509057891.db2.gz NPLVOJBZISLURP-GOSISDBHSA-N 2 1 364.534 2.863 20 70 FFIDMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@H]1CC[NH+](C)[C@@H](C)C1 ZINC000159962071 508918539 /nfs/dbraw/zinc/91/85/39/508918539.db2.gz PFUVIBBFPJTURR-QGZVKYPTSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000159962071 508918544 /nfs/dbraw/zinc/91/85/44/508918544.db2.gz PFUVIBBFPJTURR-QGZVKYPTSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000159962071 508918548 /nfs/dbraw/zinc/91/85/48/508918548.db2.gz PFUVIBBFPJTURR-QGZVKYPTSA-N 2 1 358.530 2.631 20 70 FFIDMP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@@H]3C)cc2)CC1 ZINC000160316842 508969221 /nfs/dbraw/zinc/96/92/21/508969221.db2.gz OFVOONMPFUHXBX-NNMXDRDESA-N 3 1 358.574 2.642 20 70 FFIDMP CCN1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCc3c2cnn3C)CC1 ZINC000160363579 508976024 /nfs/dbraw/zinc/97/60/24/508976024.db2.gz WUSBOWMHDDSISD-OAQYLSRUSA-N 2 1 367.541 2.725 20 70 FFIDMP CC1CC[NH+](C[C@H]2CCCN(C(=O)N[C@@H]3CC[N@@H+](CC4CC4)C3)C2)CC1 ZINC000160630122 509012365 /nfs/dbraw/zinc/01/23/65/509012365.db2.gz SARLNBIBYZDHKL-WOJBJXKFSA-N 2 1 362.562 2.624 20 70 FFIDMP C[NH+](C)CCN(CC1CCCCC1)C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000160663705 509016953 /nfs/dbraw/zinc/01/69/53/509016953.db2.gz GXADHSPWIDWVRH-LJQANCHMSA-N 2 1 350.551 2.624 20 70 FFIDMP C[C@H]1CCCN(Cc2csc(NC(=O)C[N@H+](C)[C@@H]3CCSC3)n2)C1 ZINC000159421711 508839747 /nfs/dbraw/zinc/83/97/47/508839747.db2.gz OCEKRJHNPPYQKQ-DZGCQCFKSA-N 2 1 368.572 2.751 20 70 FFIDMP C[C@H]1CCCN(Cc2csc(NC(=O)C[N@@H+](C)[C@@H]3CCSC3)n2)C1 ZINC000159421711 508839751 /nfs/dbraw/zinc/83/97/51/508839751.db2.gz OCEKRJHNPPYQKQ-DZGCQCFKSA-N 2 1 368.572 2.751 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000159561727 508858843 /nfs/dbraw/zinc/85/88/43/508858843.db2.gz XSJJUAUYJNMHAX-UHFFFAOYSA-N 2 1 358.530 2.910 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@@H](c2ccc(C)cc2)[NH+]2CCCC2)CC1 ZINC000159781159 508889225 /nfs/dbraw/zinc/88/92/25/508889225.db2.gz JEUBMIVUSBJHLL-FQEVSTJZSA-N 2 1 358.530 2.869 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000159955499 508916675 /nfs/dbraw/zinc/91/66/75/508916675.db2.gz YVKOMWBZPHMTOB-QUCCMNQESA-N 2 1 358.530 2.777 20 70 FFIDMP CC[NH+]1CCCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000159955499 508916677 /nfs/dbraw/zinc/91/66/77/508916677.db2.gz YVKOMWBZPHMTOB-QUCCMNQESA-N 2 1 358.530 2.777 20 70 FFIDMP CC[NH+]1CCCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000159955499 508916679 /nfs/dbraw/zinc/91/66/79/508916679.db2.gz YVKOMWBZPHMTOB-QUCCMNQESA-N 2 1 358.530 2.777 20 70 FFIDMP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCN(CC)CC1)c1cnn(C)c1 ZINC000160338343 508972544 /nfs/dbraw/zinc/97/25/44/508972544.db2.gz SNKZUSFRZUAQDR-OAQYLSRUSA-N 2 1 355.530 2.799 20 70 FFIDMP CC1CC[NH+](C[C@@H]2CCCN(C(=O)N[C@@H]3CC[N@@H+](CC4CC4)C3)C2)CC1 ZINC000160630039 509012135 /nfs/dbraw/zinc/01/21/35/509012135.db2.gz SARLNBIBYZDHKL-VQTJNVASSA-N 2 1 362.562 2.624 20 70 FFIDMP CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC([NH+]2CCCC2)CC1 ZINC000160921829 509048023 /nfs/dbraw/zinc/04/80/23/509048023.db2.gz MYIKNDAEEOZKDC-LJQANCHMSA-N 2 1 350.551 2.767 20 70 FFIDMP CC[N@@H+](C)C[C@H]1CCN(C(=O)NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)C1 ZINC000161160980 509078882 /nfs/dbraw/zinc/07/88/82/509078882.db2.gz XZJHXRWGTBKIRY-ZWKOTPCHSA-N 2 1 373.545 2.590 20 70 FFIDMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000159725607 508880567 /nfs/dbraw/zinc/88/05/67/508880567.db2.gz AMHZYQJEDKBLBV-KNQAVFIVSA-N 3 1 359.558 2.988 20 70 FFIDMP C[C@@H]1CN(C)CC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000159725607 508880570 /nfs/dbraw/zinc/88/05/70/508880570.db2.gz AMHZYQJEDKBLBV-KNQAVFIVSA-N 2 1 359.558 2.988 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@H]2CCC[NH+](C)[C@@H]2c2cccs2)CC1 ZINC000159903723 508909433 /nfs/dbraw/zinc/90/94/33/508909433.db2.gz JSIGTDJJLQUMFU-AEFFLSMTSA-N 2 1 364.559 2.868 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000159903723 508909437 /nfs/dbraw/zinc/90/94/37/508909437.db2.gz JSIGTDJJLQUMFU-AEFFLSMTSA-N 2 1 364.559 2.868 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CC1 ZINC000159903723 508909442 /nfs/dbraw/zinc/90/94/42/508909442.db2.gz JSIGTDJJLQUMFU-AEFFLSMTSA-N 2 1 364.559 2.868 20 70 FFIDMP C[NH+](C)CCN(C(=O)NCCC[N@H+]1CCc2ccccc2C1)C1CCCC1 ZINC000160291700 508965614 /nfs/dbraw/zinc/96/56/14/508965614.db2.gz QPTWCOKLOPHEJG-UHFFFAOYSA-N 2 1 372.557 2.951 20 70 FFIDMP FC(F)(F)CN1CCC([NH2+]Cc2ccc(C[NH+]3CCOCC3)cc2)CC1 ZINC000160577666 509005328 /nfs/dbraw/zinc/00/53/28/509005328.db2.gz JPAYANDFHLKQSI-UHFFFAOYSA-N 2 1 371.447 2.635 20 70 FFIDMP O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000160689999 509021350 /nfs/dbraw/zinc/02/13/50/509021350.db2.gz MPGCBWBNMYFNNX-WOJBJXKFSA-N 2 1 362.562 2.768 20 70 FFIDMP CCCn1c(C)nnc1CN1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000160702265 509022590 /nfs/dbraw/zinc/02/25/90/509022590.db2.gz OALZAEYMAIQDCP-CALCHBBNSA-N 2 1 363.550 2.708 20 70 FFIDMP Cc1ccc(CN(CC[NH+](C)C)C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)o1 ZINC000160779054 509031870 /nfs/dbraw/zinc/03/18/70/509031870.db2.gz DYWLAQGQVUQBCH-QGZVFWFLSA-N 2 1 362.518 2.678 20 70 FFIDMP C[NH+]1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)CC1 ZINC000160804525 509034729 /nfs/dbraw/zinc/03/47/29/509034729.db2.gz TZULAQHZJJLMAE-QGZVFWFLSA-N 2 1 374.529 2.902 20 70 FFIDMP CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000160939214 509051081 /nfs/dbraw/zinc/05/10/81/509051081.db2.gz VOYVIHCBVHBJJI-GUDVDZBRSA-N 2 1 350.551 2.623 20 70 FFIDMP CC(C)C[NH+]1CCCC[C@@H]1CNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000160939214 509051084 /nfs/dbraw/zinc/05/10/84/509051084.db2.gz VOYVIHCBVHBJJI-GUDVDZBRSA-N 2 1 350.551 2.623 20 70 FFIDMP CC(C)C[NH+]1CCCC[C@@H]1CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000160939214 509051089 /nfs/dbraw/zinc/05/10/89/509051089.db2.gz VOYVIHCBVHBJJI-GUDVDZBRSA-N 2 1 350.551 2.623 20 70 FFIDMP NC(=O)[C@@H]1CCC[N@@H+]1C1CCN(CCCOc2cccc(Cl)c2)CC1 ZINC000159427607 508840968 /nfs/dbraw/zinc/84/09/68/508840968.db2.gz CGUXDCHQGSIKNC-SFHVURJKSA-N 2 1 365.905 2.523 20 70 FFIDMP CC[NH+](CC)[C@@H](CNC(=O)N1CCC[N@@H+](CC)CC1)Cc1ccccc1 ZINC000159621063 508866801 /nfs/dbraw/zinc/86/68/01/508866801.db2.gz YPVIEYIBAZQUMU-HXUWFJFHSA-N 2 1 360.546 2.677 20 70 FFIDMP C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)C[N@@H+](C)[C@H]1CCSC1 ZINC000159625310 508867859 /nfs/dbraw/zinc/86/78/59/508867859.db2.gz DMNAWRURUOVPBL-KRWDZBQOSA-N 2 1 369.962 2.668 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N(C)[C@@H]2CC[NH+](C)C[C@@H]2C)C[N@H+]1Cc1ccccc1 ZINC000159920299 508911962 /nfs/dbraw/zinc/91/19/62/508911962.db2.gz ODANHKNDQCAKCD-KVPLUYHFSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC([NH+]2CCCC2)CC1 ZINC000159975112 508920044 /nfs/dbraw/zinc/92/00/44/508920044.db2.gz JSAZSHCQHMXASM-NQIIRXRSSA-N 2 1 370.541 2.777 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[NH+](C)C[C@@H]2C)C[N@H+]1Cc1ccccc1 ZINC000159920692 508911629 /nfs/dbraw/zinc/91/16/29/508911629.db2.gz ODANHKNDQCAKCD-RAUXBKROSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N2CCC([NH+]3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000159947034 508915641 /nfs/dbraw/zinc/91/56/41/508915641.db2.gz LDSFFKBCMFMULP-UYAOXDASSA-N 2 1 370.541 2.919 20 70 FFIDMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC000159961807 508918291 /nfs/dbraw/zinc/91/82/91/508918291.db2.gz PFUVIBBFPJTURR-RAUXBKROSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000159961807 508918293 /nfs/dbraw/zinc/91/82/93/508918293.db2.gz PFUVIBBFPJTURR-RAUXBKROSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000159961807 508918296 /nfs/dbraw/zinc/91/82/96/508918296.db2.gz PFUVIBBFPJTURR-RAUXBKROSA-N 2 1 358.530 2.631 20 70 FFIDMP CCn1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCN(CC)CC2)cn1 ZINC000160337217 508972805 /nfs/dbraw/zinc/97/28/05/508972805.db2.gz POJUKCLDUZDADB-GOSISDBHSA-N 2 1 355.530 2.891 20 70 FFIDMP COC(=O)c1ccc2[nH]cc(C(=O)C[NH+]3CCC(CC[NH+](C)C)CC3)c2c1 ZINC000160664724 509016535 /nfs/dbraw/zinc/01/65/35/509016535.db2.gz RSDYJUIOQYZADG-UHFFFAOYSA-N 2 1 371.481 2.801 20 70 FFIDMP O=C1Nc2ccccc2C12CCC([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)CC2 ZINC000160746366 509028039 /nfs/dbraw/zinc/02/80/39/509028039.db2.gz ILNMIZMDEUTONI-WUZYXKQASA-N 2 1 371.525 2.646 20 70 FFIDMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)C1 ZINC000161160862 509078861 /nfs/dbraw/zinc/07/88/61/509078861.db2.gz XZJHXRWGTBKIRY-ROUUACIJSA-N 2 1 373.545 2.590 20 70 FFIDMP CN(C)c1cccc(C[N@H+](C)CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c1 ZINC000159392340 508836130 /nfs/dbraw/zinc/83/61/30/508836130.db2.gz STQLCAOIDIKVQM-NRFANRHFSA-N 2 1 368.525 2.604 20 70 FFIDMP CN(C)c1cccc(C[N@@H+](C)CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c1 ZINC000159392340 508836133 /nfs/dbraw/zinc/83/61/33/508836133.db2.gz STQLCAOIDIKVQM-NRFANRHFSA-N 2 1 368.525 2.604 20 70 FFIDMP C[NH+](C)CCCC1CCN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC1 ZINC000159782753 508890580 /nfs/dbraw/zinc/89/05/80/508890580.db2.gz GQGHHSSNVUVBDH-KRWDZBQOSA-N 2 1 350.507 2.646 20 70 FFIDMP CC(C)[C@@H]1CN(C)CCN1C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C ZINC000160122728 508941294 /nfs/dbraw/zinc/94/12/94/508941294.db2.gz ZRCYXOYHTMDMPK-IRXDYDNUSA-N 2 1 368.472 2.549 20 70 FFIDMP COc1cc([C@@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)ccc1S(C)(=O)=O ZINC000161069850 509067093 /nfs/dbraw/zinc/06/70/93/509067093.db2.gz OZSZQELTTUPSJD-KBMXLJTQSA-N 2 1 354.516 2.622 20 70 FFIDMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCC4(CC3)OCCO4)c2)CCO1 ZINC000161361892 509107216 /nfs/dbraw/zinc/10/72/16/509107216.db2.gz SDSFWZKYXJODTI-QGZVFWFLSA-N 2 1 360.498 2.683 20 70 FFIDMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCC4(CC3)OCCO4)c2)CCO1 ZINC000161361892 509107220 /nfs/dbraw/zinc/10/72/20/509107220.db2.gz SDSFWZKYXJODTI-QGZVFWFLSA-N 2 1 360.498 2.683 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC2CC[NH+]([C@H](C)c3ccccc3)CC2)CC1 ZINC000159870620 508903504 /nfs/dbraw/zinc/90/35/04/508903504.db2.gz SFOKSPSILDFXDL-GOSISDBHSA-N 2 1 358.530 2.949 20 70 FFIDMP CCN(C(=O)N[C@@H]1C[C@H](C)[NH+](C2CC2)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160642682 509013304 /nfs/dbraw/zinc/01/33/04/509013304.db2.gz UCEFKVADVDJSGF-DSKINZAPSA-N 2 1 370.541 2.918 20 70 FFIDMP CCN(C(=O)N[C@@H]1C[C@H](C)[N@@H+](C2CC2)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000160642682 509013306 /nfs/dbraw/zinc/01/33/06/509013306.db2.gz UCEFKVADVDJSGF-DSKINZAPSA-N 2 1 370.541 2.918 20 70 FFIDMP CCN(C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000160642682 509013307 /nfs/dbraw/zinc/01/33/07/509013307.db2.gz UCEFKVADVDJSGF-DSKINZAPSA-N 2 1 370.541 2.918 20 70 FFIDMP CN(C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000160683138 509019314 /nfs/dbraw/zinc/01/93/14/509019314.db2.gz QJOQREOPBHEQIG-HXUWFJFHSA-N 2 1 370.541 2.777 20 70 FFIDMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)N[C@H]2CC[N@@H+](C3CCCC3)C2)C1 ZINC000160824889 509036979 /nfs/dbraw/zinc/03/69/79/509036979.db2.gz DRGURMFUSQNBEL-WMZOPIPTSA-N 2 1 359.518 2.809 20 70 FFIDMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)C1 ZINC000160824889 509036982 /nfs/dbraw/zinc/03/69/82/509036982.db2.gz DRGURMFUSQNBEL-WMZOPIPTSA-N 2 1 359.518 2.809 20 70 FFIDMP C[N@@H+](CCN1CCN(CCC[NH+]2CCCCC2)CC1)Cc1ccccc1 ZINC000161031021 509062277 /nfs/dbraw/zinc/06/22/77/509062277.db2.gz AUXANCZAKJIZJA-UHFFFAOYSA-N 2 1 358.574 2.612 20 70 FFIDMP COc1cc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)ccc1S(C)(=O)=O ZINC000161069484 509067312 /nfs/dbraw/zinc/06/73/12/509067312.db2.gz OZSZQELTTUPSJD-IMJJTQAJSA-N 2 1 354.516 2.622 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[NH+](C)C[C@@H]2C)C[N@H+]1Cc1ccccc1 ZINC000159920572 508911997 /nfs/dbraw/zinc/91/19/97/508911997.db2.gz ODANHKNDQCAKCD-ONCXSQPRSA-N 2 1 358.530 2.631 20 70 FFIDMP CC(C)OCCCNC(=O)C1CC[NH+](CCC[NH+]2CCCCC2)CC1 ZINC000160565973 509003723 /nfs/dbraw/zinc/00/37/23/509003723.db2.gz DWKDNZNXRTWQLP-UHFFFAOYSA-N 2 1 353.551 2.506 20 70 FFIDMP CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000160981522 509056729 /nfs/dbraw/zinc/05/67/29/509056729.db2.gz ZEEFXOZIKYSTDN-MOPGFXCFSA-N 2 1 350.551 2.624 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@@H](c2cccc(OC)c2)[NH+]2CCCC2)CC1 ZINC000159540115 508855634 /nfs/dbraw/zinc/85/56/34/508855634.db2.gz RLCNJQNCGKHMSY-FQEVSTJZSA-N 2 1 374.529 2.569 20 70 FFIDMP C[C@@H](CNC(=O)c1ccc(C[NH+](C)C)cc1)[N@H+]1CCc2ccccc2C1 ZINC000159906964 508909017 /nfs/dbraw/zinc/90/90/17/508909017.db2.gz XGJLPEHNIXZDSK-KRWDZBQOSA-N 2 1 351.494 2.925 20 70 FFIDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cccc(N2CCCC2=O)c1 ZINC000160714738 509024179 /nfs/dbraw/zinc/02/41/79/509024179.db2.gz NSDFPJMZKIDFQI-YLJYHZDGSA-N 2 1 359.514 2.701 20 70 FFIDMP CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000160986454 509057239 /nfs/dbraw/zinc/05/72/39/509057239.db2.gz WQSDNGBNXVTTCW-LJQANCHMSA-N 2 1 352.567 2.870 20 70 FFIDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000159924518 508912486 /nfs/dbraw/zinc/91/24/86/508912486.db2.gz KGRUXTPSBMXAGR-NRSPTQNISA-N 2 1 370.541 2.634 20 70 FFIDMP CCN(C(=O)NC[C@@H](C)[NH+](C)C1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160069595 508934102 /nfs/dbraw/zinc/93/41/02/508934102.db2.gz TWEWYMWCLWEATI-YLJYHZDGSA-N 2 1 358.530 2.775 20 70 FFIDMP CCN(C(=O)NC[C@@H](C)[N@H+](C)C1CC1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000160069595 508934105 /nfs/dbraw/zinc/93/41/05/508934105.db2.gz TWEWYMWCLWEATI-YLJYHZDGSA-N 2 1 358.530 2.775 20 70 FFIDMP CCN(C(=O)NC[C@@H](C)[N@@H+](C)C1CC1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000160069595 508934108 /nfs/dbraw/zinc/93/41/08/508934108.db2.gz TWEWYMWCLWEATI-YLJYHZDGSA-N 2 1 358.530 2.775 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C[N@H+]1C1CC1 ZINC000160002617 508923479 /nfs/dbraw/zinc/92/34/79/508923479.db2.gz FTDSPKQTNHVQLD-IEBWSBKVSA-N 2 1 362.562 2.909 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N(C)CC2CC[NH+](C)CC2)C[N@H+]1Cc1ccccc1 ZINC000160338886 508972504 /nfs/dbraw/zinc/97/25/04/508972504.db2.gz JKBWJKPIIOLXPW-XLIONFOSSA-N 2 1 358.530 2.633 20 70 FFIDMP CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N(CC[NH+](C)C)Cc1ccco1 ZINC000160996569 509057864 /nfs/dbraw/zinc/05/78/64/509057864.db2.gz NPLVOJBZISLURP-SFHVURJKSA-N 2 1 364.534 2.863 20 70 FFIDMP CCn1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCN(CC)CC2)cn1 ZINC000160337338 508972632 /nfs/dbraw/zinc/97/26/32/508972632.db2.gz POJUKCLDUZDADB-SFHVURJKSA-N 2 1 355.530 2.891 20 70 FFIDMP C[NH+](C)CCN(CC1CCCCC1)C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000160663824 509016564 /nfs/dbraw/zinc/01/65/64/509016564.db2.gz GXADHSPWIDWVRH-IBGZPJMESA-N 2 1 350.551 2.624 20 70 FFIDMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)N[C@@H]2CC[NH+](CC3CC3)C2)C1 ZINC000160748697 509028216 /nfs/dbraw/zinc/02/82/16/509028216.db2.gz ZUHGAROPNJPNJK-YZGWKJHDSA-N 2 1 362.562 2.767 20 70 FFIDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(C(=O)N[C@@H]2CC[N@H+](CC3CC3)C2)C1 ZINC000160748697 509028219 /nfs/dbraw/zinc/02/82/19/509028219.db2.gz ZUHGAROPNJPNJK-YZGWKJHDSA-N 2 1 362.562 2.767 20 70 FFIDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)C1 ZINC000160748697 509028222 /nfs/dbraw/zinc/02/82/22/509028222.db2.gz ZUHGAROPNJPNJK-YZGWKJHDSA-N 2 1 362.562 2.767 20 70 FFIDMP C[NH+](C)CCCC1CCN(C(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000160860628 509040786 /nfs/dbraw/zinc/04/07/86/509040786.db2.gz JZGLIFRTTXFMJB-UHFFFAOYSA-N 2 1 360.546 2.882 20 70 FFIDMP CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000160981384 509056489 /nfs/dbraw/zinc/05/64/89/509056489.db2.gz ZEEFXOZIKYSTDN-RTBURBONSA-N 2 1 350.551 2.624 20 70 FFIDMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c(F)c1 ZINC000161209530 509086455 /nfs/dbraw/zinc/08/64/55/509086455.db2.gz TUCLOLRHUKXGIH-HNNXBMFYSA-N 2 1 373.472 2.977 20 70 FFIDMP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C1CC[NH+](C)CC1 ZINC000161419771 509114310 /nfs/dbraw/zinc/11/43/10/509114310.db2.gz SIJYIBFDUWQOTH-LBPRGKRZSA-N 2 1 354.292 2.850 20 70 FFIDMP CC(C)[N@@H+](CCc1nccs1)CC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000159510444 508851420 /nfs/dbraw/zinc/85/14/20/508851420.db2.gz KKKDQGVPUWLSOJ-GOSISDBHSA-N 2 1 374.554 2.815 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159949124 508915761 /nfs/dbraw/zinc/91/57/61/508915761.db2.gz BGRCTQNTJLOXIQ-ICSRJNTNSA-N 2 1 358.530 2.634 20 70 FFIDMP CC[NH+]1CCCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159949124 508915762 /nfs/dbraw/zinc/91/57/62/508915762.db2.gz BGRCTQNTJLOXIQ-ICSRJNTNSA-N 2 1 358.530 2.634 20 70 FFIDMP CC[NH+]1CCCN(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159949124 508915765 /nfs/dbraw/zinc/91/57/65/508915765.db2.gz BGRCTQNTJLOXIQ-ICSRJNTNSA-N 2 1 358.530 2.634 20 70 FFIDMP CCN1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCCc4c3cnn4C)cc2)CC1 ZINC000160331485 508971658 /nfs/dbraw/zinc/97/16/58/508971658.db2.gz QDIFLQZWKFPSGH-NRFANRHFSA-N 2 1 367.541 2.725 20 70 FFIDMP COc1ccc(CNC(=O)C2CC[NH+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC000161362478 509106694 /nfs/dbraw/zinc/10/66/94/509106694.db2.gz RHSHWUNAIBHIHX-UHFFFAOYSA-N 2 1 373.541 2.899 20 70 FFIDMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000159369669 508832633 /nfs/dbraw/zinc/83/26/33/508832633.db2.gz QFNPZIZLXYTQGD-RYRKJORJSA-N 2 1 367.559 2.850 20 70 FFIDMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000159369669 508832636 /nfs/dbraw/zinc/83/26/36/508832636.db2.gz QFNPZIZLXYTQGD-RYRKJORJSA-N 2 1 367.559 2.850 20 70 FFIDMP CC(C)N(CC[NH+](C)C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000159446483 508843249 /nfs/dbraw/zinc/84/32/49/508843249.db2.gz AMBLULKLODAZSO-QUCCMNQESA-N 2 1 360.546 2.879 20 70 FFIDMP COc1c(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c(C)nn1C ZINC000160196894 508952730 /nfs/dbraw/zinc/95/27/30/508952730.db2.gz XABMFRFBSVXSRO-UHFFFAOYSA-N 2 1 371.529 2.557 20 70 FFIDMP O=C1Nc2ccccc2C12CCC([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)CC2 ZINC000160746508 509028382 /nfs/dbraw/zinc/02/83/82/509028382.db2.gz ILNMIZMDEUTONI-DKTYTTGXSA-N 2 1 371.525 2.646 20 70 FFIDMP CCC(CC)(C[NH3+])C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000161298443 509099017 /nfs/dbraw/zinc/09/90/17/509099017.db2.gz IYRPTVQNDLACHW-SFHVURJKSA-N 2 1 374.529 2.556 20 70 FFIDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000159993826 508921439 /nfs/dbraw/zinc/92/14/39/508921439.db2.gz MSBMVSORQVDZRH-GIVPXCGWSA-N 2 1 370.541 2.777 20 70 FFIDMP CC[NH+]1CCN([C@@H]2CC[N@@H+](CCc3cccc(OC(F)(F)F)c3)C2)CC1 ZINC000160053177 508930855 /nfs/dbraw/zinc/93/08/55/508930855.db2.gz SJNBWRJQFRAGJR-QGZVFWFLSA-N 2 1 371.447 2.840 20 70 FFIDMP C[C@@H](CNC(=O)N1CCC(CCC[NH+](C)C)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000160304392 508967619 /nfs/dbraw/zinc/96/76/19/508967619.db2.gz BGCUPNWEKWPTIK-ROUUACIJSA-N 2 1 352.567 2.870 20 70 FFIDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cnn(Cc2ccccc2)c1 ZINC000160738796 509026793 /nfs/dbraw/zinc/02/67/93/509026793.db2.gz WANWWVYPXZLOTD-WIYYLYMNSA-N 2 1 356.514 2.819 20 70 FFIDMP CNS(=O)(=O)c1cccc([C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC000159618754 508867082 /nfs/dbraw/zinc/86/70/82/508867082.db2.gz IWTKFEYQRVVGPZ-ZDUSSCGKSA-N 2 1 353.532 2.555 20 70 FFIDMP CC[N@@H+]1CCCN(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000159962858 508918158 /nfs/dbraw/zinc/91/81/58/508918158.db2.gz XKQCASBMDCPFHO-MRXNPFEDSA-N 2 1 355.486 2.979 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000159962858 508918161 /nfs/dbraw/zinc/91/81/61/508918161.db2.gz XKQCASBMDCPFHO-MRXNPFEDSA-N 2 1 355.486 2.979 20 70 FFIDMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC000159961685 508918486 /nfs/dbraw/zinc/91/84/86/508918486.db2.gz PFUVIBBFPJTURR-ONCXSQPRSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000159961685 508918488 /nfs/dbraw/zinc/91/84/88/508918488.db2.gz PFUVIBBFPJTURR-ONCXSQPRSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000159961685 508918491 /nfs/dbraw/zinc/91/84/91/508918491.db2.gz PFUVIBBFPJTURR-ONCXSQPRSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@@H]1CCCN(Cc2csc(NC(=O)C[N@H+](C)[C@@H]3CCSC3)n2)C1 ZINC000159421609 508839893 /nfs/dbraw/zinc/83/98/93/508839893.db2.gz OCEKRJHNPPYQKQ-UKRRQHHQSA-N 2 1 368.572 2.751 20 70 FFIDMP C[C@@H]1CCCN(Cc2csc(NC(=O)C[N@@H+](C)[C@@H]3CCSC3)n2)C1 ZINC000159421609 508839897 /nfs/dbraw/zinc/83/98/97/508839897.db2.gz OCEKRJHNPPYQKQ-UKRRQHHQSA-N 2 1 368.572 2.751 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H]([NH+]3CCCC3)C2)C[N@H+]1Cc1ccccc1 ZINC000160362054 508976179 /nfs/dbraw/zinc/97/61/79/508976179.db2.gz WTDPZXBVIBWTQG-HOJAQTOUSA-N 2 1 356.514 2.529 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]([NH+]3CCCC3)C2)C[N@H+]1Cc1ccccc1 ZINC000160154432 508946881 /nfs/dbraw/zinc/94/68/81/508946881.db2.gz PDZJEYQBVSDZRL-GIVPXCGWSA-N 2 1 370.541 2.919 20 70 FFIDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000160683042 509019681 /nfs/dbraw/zinc/01/96/81/509019681.db2.gz AEYIRQZQOJFUKI-DOTOQJQBSA-N 2 1 359.514 2.804 20 70 FFIDMP O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000160690124 509021376 /nfs/dbraw/zinc/02/13/76/509021376.db2.gz MPGCBWBNMYFNNX-PMACEKPBSA-N 2 1 362.562 2.768 20 70 FFIDMP C[NH+]1CCC(N(Cc2ccco2)C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)CC1 ZINC000160804627 509034695 /nfs/dbraw/zinc/03/46/95/509034695.db2.gz TZULAQHZJJLMAE-KRWDZBQOSA-N 2 1 374.529 2.902 20 70 FFIDMP O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCN(Cc2ccccc2)CC1 ZINC000160853389 509040143 /nfs/dbraw/zinc/04/01/43/509040143.db2.gz HIMCPYZDKZVAMC-LJQANCHMSA-N 2 1 356.514 2.531 20 70 FFIDMP O=C(N[C@@H]1CC[N@@H+](C2CCCC2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000160853389 509040147 /nfs/dbraw/zinc/04/01/47/509040147.db2.gz HIMCPYZDKZVAMC-LJQANCHMSA-N 2 1 356.514 2.531 20 70 FFIDMP O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000160853389 509040149 /nfs/dbraw/zinc/04/01/49/509040149.db2.gz HIMCPYZDKZVAMC-LJQANCHMSA-N 2 1 356.514 2.531 20 70 FFIDMP CC(C)N(CC[NH+](C)C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159446620 508843277 /nfs/dbraw/zinc/84/32/77/508843277.db2.gz AMBLULKLODAZSO-ICSRJNTNSA-N 2 1 360.546 2.879 20 70 FFIDMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000159955687 508916643 /nfs/dbraw/zinc/91/66/43/508916643.db2.gz ITQVAHHREUDHLL-FYZZASKESA-N 2 1 370.541 2.775 20 70 FFIDMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000159955687 508916645 /nfs/dbraw/zinc/91/66/45/508916645.db2.gz ITQVAHHREUDHLL-FYZZASKESA-N 2 1 370.541 2.775 20 70 FFIDMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159955687 508916647 /nfs/dbraw/zinc/91/66/47/508916647.db2.gz ITQVAHHREUDHLL-FYZZASKESA-N 2 1 370.541 2.775 20 70 FFIDMP CC[N@@H+](C)C[C@H]1CCN(C(=O)N[C@@H]2C[C@H](C)[NH+](Cc3ccccc3)C2)C1 ZINC000160011919 508925009 /nfs/dbraw/zinc/92/50/09/508925009.db2.gz WLEVYAOKLILYMW-DFQSSKMNSA-N 2 1 358.530 2.633 20 70 FFIDMP CC[NH+](C)C[C@H]1CCN(C(=O)N[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)C1 ZINC000160011919 508925012 /nfs/dbraw/zinc/92/50/12/508925012.db2.gz WLEVYAOKLILYMW-DFQSSKMNSA-N 2 1 358.530 2.633 20 70 FFIDMP CC[NH+](C)C[C@H]1CCN(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000160011919 508925016 /nfs/dbraw/zinc/92/50/16/508925016.db2.gz WLEVYAOKLILYMW-DFQSSKMNSA-N 2 1 358.530 2.633 20 70 FFIDMP CCC[NH+]1CCC([NH2+]Cc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000160924572 509048702 /nfs/dbraw/zinc/04/87/02/509048702.db2.gz ZJHBVKRYLXMMHC-HDICACEKSA-N 2 1 373.541 2.900 20 70 FFIDMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000160952349 509052587 /nfs/dbraw/zinc/05/25/87/509052587.db2.gz CMELFLITUZUDFB-ROUUACIJSA-N 2 1 373.541 2.898 20 70 FFIDMP C[NH+](Cc1ccc(C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)cc1)C[C@@H]1CCC[C@@H]1O ZINC000159785610 508890381 /nfs/dbraw/zinc/89/03/81/508890381.db2.gz JAAOBYNTKSQKIS-CMOCDZPBSA-N 2 1 360.542 2.872 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)CC1 ZINC000159870468 508903397 /nfs/dbraw/zinc/90/33/97/508903397.db2.gz SFOKSPSILDFXDL-SFHVURJKSA-N 2 1 358.530 2.949 20 70 FFIDMP CC(C)[NH2+]C1CCN(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000160093113 508937290 /nfs/dbraw/zinc/93/72/90/508937290.db2.gz YXIIESKPGYYECW-PXNSSMCTSA-N 2 1 358.530 2.821 20 70 FFIDMP CC(C)[C@H]1CN(C)CCN1C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C ZINC000160122814 508941432 /nfs/dbraw/zinc/94/14/32/508941432.db2.gz ZRCYXOYHTMDMPK-DLBZAZTESA-N 2 1 368.472 2.549 20 70 FFIDMP C[N@@H+]1CCN(C(=O)N[C@@H]2CC[NH+](C3CCCC3)C2)[C@@H](c2ccccc2)C1 ZINC000160788832 509033215 /nfs/dbraw/zinc/03/32/15/509033215.db2.gz NZTWKJQHCBYJKN-UYAOXDASSA-N 2 1 356.514 2.702 20 70 FFIDMP C[N@H+]1CCN(C(=O)N[C@@H]2CC[NH+](C3CCCC3)C2)[C@@H](c2ccccc2)C1 ZINC000160788832 509033222 /nfs/dbraw/zinc/03/32/22/509033222.db2.gz NZTWKJQHCBYJKN-UYAOXDASSA-N 2 1 356.514 2.702 20 70 FFIDMP C[NH+]1CCN(C(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)[C@@H](c2ccccc2)C1 ZINC000160788832 509033224 /nfs/dbraw/zinc/03/32/24/509033224.db2.gz NZTWKJQHCBYJKN-UYAOXDASSA-N 2 1 356.514 2.702 20 70 FFIDMP C[NH+]1CCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)[C@@H](c2ccccc2)C1 ZINC000160788832 509033227 /nfs/dbraw/zinc/03/32/27/509033227.db2.gz NZTWKJQHCBYJKN-UYAOXDASSA-N 2 1 356.514 2.702 20 70 FFIDMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)C1 ZINC000160824608 509037096 /nfs/dbraw/zinc/03/70/96/509037096.db2.gz DRGURMFUSQNBEL-AEFFLSMTSA-N 2 1 359.518 2.809 20 70 FFIDMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)C1 ZINC000160824608 509037097 /nfs/dbraw/zinc/03/70/97/509037097.db2.gz DRGURMFUSQNBEL-AEFFLSMTSA-N 2 1 359.518 2.809 20 70 FFIDMP CC[NH2+]CC1CCN(C(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000161066824 509066659 /nfs/dbraw/zinc/06/66/59/509066659.db2.gz SUVXFWCDTJIIET-ROUUACIJSA-N 2 1 373.541 2.758 20 70 FFIDMP CCN1CC[NH+](Cc2ccccc2C[NH2+]C2CCC3(CC2)OCCO3)CC1 ZINC000161302290 509099535 /nfs/dbraw/zinc/09/95/35/509099535.db2.gz DMFAEYLZJIFCGV-UHFFFAOYSA-N 2 1 373.541 2.599 20 70 FFIDMP CNS(=O)(=O)c1cccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000160270421 508963250 /nfs/dbraw/zinc/96/32/50/508963250.db2.gz JDGRRHBMVNSGIP-HOTGVXAUSA-N 2 1 353.532 2.510 20 70 FFIDMP CNS(=O)(=O)c1cccc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000160270421 508963253 /nfs/dbraw/zinc/96/32/53/508963253.db2.gz JDGRRHBMVNSGIP-HOTGVXAUSA-N 2 1 353.532 2.510 20 70 FFIDMP Cc1cccc(CN(CC[NH+](C)C)C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)c1 ZINC000160684269 509020360 /nfs/dbraw/zinc/02/03/60/509020360.db2.gz DFIUUWIKWREPNM-HXUWFJFHSA-N 2 1 358.530 2.553 20 70 FFIDMP CCCC[N@@H+](C)CC1CCN(C(=O)N[C@@H]2CC[NH+](CC3CC3)C2)CC1 ZINC000160714587 509024320 /nfs/dbraw/zinc/02/43/20/509024320.db2.gz BKRJNGSKCRDEQD-LJQANCHMSA-N 2 1 350.551 2.624 20 70 FFIDMP CCCC[NH+](C)CC1CCN(C(=O)N[C@@H]2CC[N@H+](CC3CC3)C2)CC1 ZINC000160714587 509024323 /nfs/dbraw/zinc/02/43/23/509024323.db2.gz BKRJNGSKCRDEQD-LJQANCHMSA-N 2 1 350.551 2.624 20 70 FFIDMP CCCC[NH+](C)CC1CCN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)CC1 ZINC000160714587 509024325 /nfs/dbraw/zinc/02/43/25/509024325.db2.gz BKRJNGSKCRDEQD-LJQANCHMSA-N 2 1 350.551 2.624 20 70 FFIDMP CCN(CC(F)(F)F)C(=O)[C@H]1CCC[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC000161276125 509095701 /nfs/dbraw/zinc/09/57/01/509095701.db2.gz HZVRALMVYRHFDP-INIZCTEOSA-N 2 1 363.468 2.985 20 70 FFIDMP C[C@H](CNC(=O)c1ccc(C[NH+](C)C)cc1)[N@H+]1CCc2ccccc2C1 ZINC000159907105 508909187 /nfs/dbraw/zinc/90/91/87/508909187.db2.gz XGJLPEHNIXZDSK-QGZVFWFLSA-N 2 1 351.494 2.925 20 70 FFIDMP C[C@H]1C[C@H](NC(=O)N(C)[C@@H]2CC[NH+](C)C[C@@H]2C)C[N@H+]1Cc1ccccc1 ZINC000159920439 508911695 /nfs/dbraw/zinc/91/16/95/508911695.db2.gz ODANHKNDQCAKCD-QGZVKYPTSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000160013191 508925869 /nfs/dbraw/zinc/92/58/69/508925869.db2.gz JAFWJAAZWWUEIM-AYWYSENESA-N 2 1 370.541 2.633 20 70 FFIDMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000160013191 508925872 /nfs/dbraw/zinc/92/58/72/508925872.db2.gz JAFWJAAZWWUEIM-AYWYSENESA-N 2 1 370.541 2.633 20 70 FFIDMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000160013191 508925875 /nfs/dbraw/zinc/92/58/75/508925875.db2.gz JAFWJAAZWWUEIM-AYWYSENESA-N 2 1 370.541 2.633 20 70 FFIDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(N2CCOC2=O)cc1 ZINC000160678710 509018675 /nfs/dbraw/zinc/01/86/75/509018675.db2.gz ILOFWRWQQATNIY-QFBILLFUSA-N 2 1 361.486 2.531 20 70 FFIDMP O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000160689854 509020985 /nfs/dbraw/zinc/02/09/85/509020985.db2.gz MPGCBWBNMYFNNX-VQTJNVASSA-N 2 1 362.562 2.768 20 70 FFIDMP CCN(CC(F)(F)F)C(=O)[C@@H]1CCC[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC000161276002 509095679 /nfs/dbraw/zinc/09/56/79/509095679.db2.gz HZVRALMVYRHFDP-MRXNPFEDSA-N 2 1 363.468 2.985 20 70 FFIDMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)CC1 ZINC000161352915 509106303 /nfs/dbraw/zinc/10/63/03/509106303.db2.gz MKBDBMRDIGWHCG-UWVAXJGDSA-N 2 1 373.545 2.589 20 70 FFIDMP CCN(C(=O)NCC[NH+](CC)C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159952955 508916461 /nfs/dbraw/zinc/91/64/61/508916461.db2.gz YOQQNVAQIXCSIK-FQEVSTJZSA-N 2 1 358.530 2.777 20 70 FFIDMP CCN(C(=O)NCC[N@H+](CC)C1CC1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000159952955 508916465 /nfs/dbraw/zinc/91/64/65/508916465.db2.gz YOQQNVAQIXCSIK-FQEVSTJZSA-N 2 1 358.530 2.777 20 70 FFIDMP CCN(C(=O)NCC[N@@H+](CC)C1CC1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000159952955 508916466 /nfs/dbraw/zinc/91/64/66/508916466.db2.gz YOQQNVAQIXCSIK-FQEVSTJZSA-N 2 1 358.530 2.777 20 70 FFIDMP CC(C)[NH2+]C1CCN(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000160093390 508937521 /nfs/dbraw/zinc/93/75/21/508937521.db2.gz YXIIESKPGYYECW-FXAWDEMLSA-N 2 1 358.530 2.821 20 70 FFIDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(NC(=O)NC2CC2)cc1 ZINC000160677554 509018654 /nfs/dbraw/zinc/01/86/54/509018654.db2.gz GRTNLEWIYQJPPX-OXJNMPFZSA-N 2 1 374.529 2.858 20 70 FFIDMP COc1ccc(CNC(=O)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000160957570 509053153 /nfs/dbraw/zinc/05/31/53/509053153.db2.gz PVSAWIVUFMPJMS-UHFFFAOYSA-N 2 1 359.514 2.698 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@H](c2cccc(OC)c2)[NH+]2CCCC2)CC1 ZINC000159540243 508855446 /nfs/dbraw/zinc/85/54/46/508855446.db2.gz RLCNJQNCGKHMSY-HXUWFJFHSA-N 2 1 374.529 2.569 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N(C)C[C@@H]2CCC[NH+](C)C2)C[N@H+]1Cc1ccccc1 ZINC000159884568 508906103 /nfs/dbraw/zinc/90/61/03/508906103.db2.gz SRYOLRFVOHHQDG-RLLQIKCJSA-N 2 1 358.530 2.633 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N(C)C[C@@H]2CCC[N@H+](C)C2)C[NH+]1Cc1ccccc1 ZINC000159884568 508906108 /nfs/dbraw/zinc/90/61/08/508906108.db2.gz SRYOLRFVOHHQDG-RLLQIKCJSA-N 2 1 358.530 2.633 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)C[NH+]1Cc1ccccc1 ZINC000159884568 508906111 /nfs/dbraw/zinc/90/61/11/508906111.db2.gz SRYOLRFVOHHQDG-RLLQIKCJSA-N 2 1 358.530 2.633 20 70 FFIDMP CC[N@H+]1CC[C@H](N(C)C(=O)N[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C)[C@H](C)C1 ZINC000159936824 508914225 /nfs/dbraw/zinc/91/42/25/508914225.db2.gz XYSFMRUBSIRFCW-ZSXPUABSSA-N 2 1 372.557 2.879 20 70 FFIDMP CC[NH+]1CC[C@H](N(C)C(=O)N[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)[C@H](C)C1 ZINC000159936824 508914228 /nfs/dbraw/zinc/91/42/28/508914228.db2.gz XYSFMRUBSIRFCW-ZSXPUABSSA-N 2 1 372.557 2.879 20 70 FFIDMP CC[NH+]1CC[C@H](N(C)C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)[C@H](C)C1 ZINC000159936824 508914234 /nfs/dbraw/zinc/91/42/34/508914234.db2.gz XYSFMRUBSIRFCW-ZSXPUABSSA-N 2 1 372.557 2.879 20 70 FFIDMP CC[C@H](c1ccncc1)[N@H+](C)CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000160146208 508945177 /nfs/dbraw/zinc/94/51/77/508945177.db2.gz IQNWFEJJSPHZIZ-UXHICEINSA-N 2 1 354.498 2.884 20 70 FFIDMP CC[C@H](c1ccncc1)[N@@H+](C)CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000160146208 508945179 /nfs/dbraw/zinc/94/51/79/508945179.db2.gz IQNWFEJJSPHZIZ-UXHICEINSA-N 2 1 354.498 2.884 20 70 FFIDMP CCN1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCCc3c2cnn3C)CC1 ZINC000160363728 508976249 /nfs/dbraw/zinc/97/62/49/508976249.db2.gz WUSBOWMHDDSISD-NRFANRHFSA-N 2 1 367.541 2.725 20 70 FFIDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(NC(=O)NC2CC2)cc1 ZINC000160677674 509018761 /nfs/dbraw/zinc/01/87/61/509018761.db2.gz GRTNLEWIYQJPPX-OXQOHEQNSA-N 2 1 374.529 2.858 20 70 FFIDMP C[C@@H](NC1CC[NH+](C)CC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000161509051 509123453 /nfs/dbraw/zinc/12/34/53/509123453.db2.gz FIUPIHAFQSIJNO-MRXNPFEDSA-N 2 1 365.543 2.606 20 70 FFIDMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000161509051 509123458 /nfs/dbraw/zinc/12/34/58/509123458.db2.gz FIUPIHAFQSIJNO-MRXNPFEDSA-N 2 1 365.543 2.606 20 70 FFIDMP Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000160158214 508947767 /nfs/dbraw/zinc/94/77/67/508947767.db2.gz HMYHCPSAVKLBLY-MOPGFXCFSA-N 2 1 369.513 2.583 20 70 FFIDMP Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000160158214 508947770 /nfs/dbraw/zinc/94/77/70/508947770.db2.gz HMYHCPSAVKLBLY-MOPGFXCFSA-N 2 1 369.513 2.583 20 70 FFIDMP O=C(Nc1ccc2c(c1)OCO2)C1CC[NH+](CCC[NH+]2CCCCC2)CC1 ZINC000160434184 508987092 /nfs/dbraw/zinc/98/70/92/508987092.db2.gz ZKCWBGDPBMMGMA-UHFFFAOYSA-N 2 1 373.497 2.942 20 70 FFIDMP CC1CC[NH+](C[C@H]2CCCN(C(=O)N[C@H]3CC[N@@H+](CC4CC4)C3)C2)CC1 ZINC000160630363 509012426 /nfs/dbraw/zinc/01/24/26/509012426.db2.gz SARLNBIBYZDHKL-UXHICEINSA-N 2 1 362.562 2.624 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NCC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000159782126 508890206 /nfs/dbraw/zinc/89/02/06/508890206.db2.gz UEXYUTSICAPQBZ-UHFFFAOYSA-N 2 1 364.559 2.697 20 70 FFIDMP CCNC(=O)c1cccc(C[NH2+][C@@H]2CC[N@H+](CCCOCC)C[C@@H]2C)c1 ZINC000160174540 508949872 /nfs/dbraw/zinc/94/98/72/508949872.db2.gz ZIBYIRKXZYQIBI-FXAWDEMLSA-N 2 1 361.530 2.663 20 70 FFIDMP CCNC(=O)c1cccc(C[NH2+][C@@H]2CC[N@@H+](CCCOCC)C[C@@H]2C)c1 ZINC000160174540 508949874 /nfs/dbraw/zinc/94/98/74/508949874.db2.gz ZIBYIRKXZYQIBI-FXAWDEMLSA-N 2 1 361.530 2.663 20 70 FFIDMP C[NH+](C)Cc1ccc(C(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)cc1 ZINC000160799191 509034134 /nfs/dbraw/zinc/03/41/34/509034134.db2.gz HZTLUDOBQHJTJW-UHFFFAOYSA-N 2 1 367.493 2.875 20 70 FFIDMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000159369251 508831776 /nfs/dbraw/zinc/83/17/76/508831776.db2.gz QFNPZIZLXYTQGD-JFIYKMOQSA-N 2 1 367.559 2.850 20 70 FFIDMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000159369251 508831779 /nfs/dbraw/zinc/83/17/79/508831779.db2.gz QFNPZIZLXYTQGD-JFIYKMOQSA-N 2 1 367.559 2.850 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC000159846244 508900236 /nfs/dbraw/zinc/90/02/36/508900236.db2.gz OKOSWNJECRRSSA-SEJPIABJSA-N 2 1 370.541 2.919 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000159846244 508900238 /nfs/dbraw/zinc/90/02/38/508900238.db2.gz OKOSWNJECRRSSA-SEJPIABJSA-N 2 1 370.541 2.919 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000159846244 508900242 /nfs/dbraw/zinc/90/02/42/508900242.db2.gz OKOSWNJECRRSSA-SEJPIABJSA-N 2 1 370.541 2.919 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[NH+](C)[C@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC000160407577 508983068 /nfs/dbraw/zinc/98/30/68/508983068.db2.gz DOHKKAHERQSWDN-PIKOESSRSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000160407577 508983072 /nfs/dbraw/zinc/98/30/72/508983072.db2.gz DOHKKAHERQSWDN-PIKOESSRSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000160407577 508983075 /nfs/dbraw/zinc/98/30/75/508983075.db2.gz DOHKKAHERQSWDN-PIKOESSRSA-N 2 1 358.530 2.774 20 70 FFIDMP COC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1 ZINC000160604676 509009002 /nfs/dbraw/zinc/00/90/02/509009002.db2.gz JIAPATSHIWAPPR-QFIPXVFZSA-N 2 1 354.494 2.866 20 70 FFIDMP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C1CC[NH+](C)CC1 ZINC000161419914 509114003 /nfs/dbraw/zinc/11/40/03/509114003.db2.gz SIJYIBFDUWQOTH-GFCCVEGCSA-N 2 1 354.292 2.850 20 70 FFIDMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC([NH+]2CCCC2)CC1 ZINC000159975265 508920059 /nfs/dbraw/zinc/92/00/59/508920059.db2.gz JSAZSHCQHMXASM-RXVVDRJESA-N 2 1 370.541 2.777 20 70 FFIDMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)C1 ZINC000160824484 509037157 /nfs/dbraw/zinc/03/71/57/509037157.db2.gz DRGURMFUSQNBEL-SJLPKXTDSA-N 2 1 359.518 2.809 20 70 FFIDMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)C1 ZINC000160824484 509037159 /nfs/dbraw/zinc/03/71/59/509037159.db2.gz DRGURMFUSQNBEL-SJLPKXTDSA-N 2 1 359.518 2.809 20 70 FFIDMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000160952228 509052321 /nfs/dbraw/zinc/05/23/21/509052321.db2.gz CMELFLITUZUDFB-HDICACEKSA-N 2 1 373.541 2.898 20 70 FFIDMP CC(=O)NC1CCC([NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000161256202 509093225 /nfs/dbraw/zinc/09/32/25/509093225.db2.gz SKZWCBSDAWTXMK-RGMRCXJASA-N 2 1 373.541 2.833 20 70 FFIDMP O=C(C[N@H+]1CC[C@@H]2CCCC[C@@H]21)Nc1ccc(CN2CCOCC2)cc1 ZINC000159616567 508866234 /nfs/dbraw/zinc/86/62/34/508866234.db2.gz AQKUIOBXCODWLB-ICSRJNTNSA-N 2 1 357.498 2.722 20 70 FFIDMP Cc1cnn([C@H]2CC[NH+](Cc3ccccc3)C2)c1NC(=O)C[N@H+](C)C(C)C ZINC000159749946 508884727 /nfs/dbraw/zinc/88/47/27/508884727.db2.gz MKVNHENGBZTMKE-IBGZPJMESA-N 2 1 369.513 2.917 20 70 FFIDMP Cc1cnn([C@H]2CC[N@H+](Cc3ccccc3)C2)c1NC(=O)C[NH+](C)C(C)C ZINC000159749946 508884728 /nfs/dbraw/zinc/88/47/28/508884728.db2.gz MKVNHENGBZTMKE-IBGZPJMESA-N 2 1 369.513 2.917 20 70 FFIDMP Cc1cnn([C@H]2CC[N@@H+](Cc3ccccc3)C2)c1NC(=O)C[NH+](C)C(C)C ZINC000159749946 508884729 /nfs/dbraw/zinc/88/47/29/508884729.db2.gz MKVNHENGBZTMKE-IBGZPJMESA-N 2 1 369.513 2.917 20 70 FFIDMP CC[N@@H+]1CCCN(C(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)CC1 ZINC000159754495 508885565 /nfs/dbraw/zinc/88/55/65/508885565.db2.gz FUQUCBUJZNVIQI-UHFFFAOYSA-N 2 1 359.449 2.557 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)CC1 ZINC000159754495 508885567 /nfs/dbraw/zinc/88/55/67/508885567.db2.gz FUQUCBUJZNVIQI-UHFFFAOYSA-N 2 1 359.449 2.557 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@H](c2ccc(C)cc2)[NH+]2CCCC2)CC1 ZINC000159781266 508889940 /nfs/dbraw/zinc/88/99/40/508889940.db2.gz JEUBMIVUSBJHLL-HXUWFJFHSA-N 2 1 358.530 2.869 20 70 FFIDMP COC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1 ZINC000160604550 509009392 /nfs/dbraw/zinc/00/93/92/509009392.db2.gz JIAPATSHIWAPPR-JOCHJYFZSA-N 2 1 354.494 2.866 20 70 FFIDMP CC1CC[NH+](C[C@@H]2CCCN(C(=O)N[C@H]3CC[N@@H+](CC4CC4)C3)C2)CC1 ZINC000160630230 509012385 /nfs/dbraw/zinc/01/23/85/509012385.db2.gz SARLNBIBYZDHKL-PMACEKPBSA-N 2 1 362.562 2.624 20 70 FFIDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000160683191 509019599 /nfs/dbraw/zinc/01/95/99/509019599.db2.gz AEYIRQZQOJFUKI-NVXWUHKLSA-N 2 1 359.514 2.804 20 70 FFIDMP CC[N@@H+]1CCCN(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000159962705 508918572 /nfs/dbraw/zinc/91/85/72/508918572.db2.gz XKQCASBMDCPFHO-INIZCTEOSA-N 2 1 355.486 2.979 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000159962705 508918576 /nfs/dbraw/zinc/91/85/76/508918576.db2.gz XKQCASBMDCPFHO-INIZCTEOSA-N 2 1 355.486 2.979 20 70 FFIDMP CC(C)[NH2+]C1CCN(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000160092986 508937455 /nfs/dbraw/zinc/93/74/55/508937455.db2.gz YXIIESKPGYYECW-XLIONFOSSA-N 2 1 358.530 2.821 20 70 FFIDMP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCN(CC)CC2)cc1)c1cnn(C)c1 ZINC000160307218 508968107 /nfs/dbraw/zinc/96/81/07/508968107.db2.gz AJMWVOHACPSAIO-OAQYLSRUSA-N 2 1 355.530 2.799 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@H]2CC[NH+](C)[C@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC000160407793 508983229 /nfs/dbraw/zinc/98/32/29/508983229.db2.gz DOHKKAHERQSWDN-BWPNAZKDSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@H]2CC[N@H+](C)[C@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000160407793 508983233 /nfs/dbraw/zinc/98/32/33/508983233.db2.gz DOHKKAHERQSWDN-BWPNAZKDSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000160407793 508983235 /nfs/dbraw/zinc/98/32/35/508983235.db2.gz DOHKKAHERQSWDN-BWPNAZKDSA-N 2 1 358.530 2.774 20 70 FFIDMP CC[N@H+]1CC[C@H](N(C)C(=O)NC[C@@H]2CCCC[NH+]2CC(C)C)[C@H](C)C1 ZINC000160929082 509049813 /nfs/dbraw/zinc/04/98/13/509049813.db2.gz SGWKBPDFPFEYPK-QYZOEREBSA-N 2 1 352.567 2.869 20 70 FFIDMP CC[NH+]1CC[C@H](N(C)C(=O)NC[C@@H]2CCCC[N@@H+]2CC(C)C)[C@H](C)C1 ZINC000160929082 509049816 /nfs/dbraw/zinc/04/98/16/509049816.db2.gz SGWKBPDFPFEYPK-QYZOEREBSA-N 2 1 352.567 2.869 20 70 FFIDMP CC[NH+]1CC[C@H](N(C)C(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)[C@H](C)C1 ZINC000160929082 509049818 /nfs/dbraw/zinc/04/98/18/509049818.db2.gz SGWKBPDFPFEYPK-QYZOEREBSA-N 2 1 352.567 2.869 20 70 FFIDMP CC[NH2+]CC1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000161122179 509074429 /nfs/dbraw/zinc/07/44/29/509074429.db2.gz HBFKOZIHNYGERU-LJQANCHMSA-N 2 1 361.505 2.886 20 70 FFIDMP CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000161246555 509091911 /nfs/dbraw/zinc/09/19/11/509091911.db2.gz OYOJROFTZZJGCM-PXNSSMCTSA-N 2 1 373.545 2.589 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC2CC[NH+](Cc3ccccc3C)CC2)CC1 ZINC000159597395 508863941 /nfs/dbraw/zinc/86/39/41/508863941.db2.gz KQIRHHXCCPIMNG-UHFFFAOYSA-N 2 1 358.530 2.697 20 70 FFIDMP C[C@@H](CNC(=O)N1CCC(CCC[NH+](C)C)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000160304292 508967353 /nfs/dbraw/zinc/96/73/53/508967353.db2.gz BGCUPNWEKWPTIK-MSOLQXFVSA-N 2 1 352.567 2.870 20 70 FFIDMP CCC(CC)(C[NH3+])C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000161272436 509094731 /nfs/dbraw/zinc/09/47/31/509094731.db2.gz AYJBSYRICZELOM-UHFFFAOYSA-N 2 1 353.457 2.811 20 70 FFIDMP CCOCCC[N@H+]1CC[C@H](Nc2nc(C(C)C)nc(N(C)C)n2)[C@H](C)C1 ZINC000159802411 508892974 /nfs/dbraw/zinc/89/29/74/508892974.db2.gz ICTWKINFZICFKJ-CVEARBPZSA-N 2 1 364.538 2.610 20 70 FFIDMP C[C@H]1C[C@H](NC(=O)N(C)C[C@@H]2CCC[NH+](C)C2)C[N@H+]1Cc1ccccc1 ZINC000159884716 508905814 /nfs/dbraw/zinc/90/58/14/508905814.db2.gz SRYOLRFVOHHQDG-SXLOBPIMSA-N 2 1 358.530 2.633 20 70 FFIDMP C[C@H]1C[C@H](NC(=O)N(C)C[C@@H]2CCC[N@H+](C)C2)C[NH+]1Cc1ccccc1 ZINC000159884716 508905819 /nfs/dbraw/zinc/90/58/19/508905819.db2.gz SRYOLRFVOHHQDG-SXLOBPIMSA-N 2 1 358.530 2.633 20 70 FFIDMP C[C@H]1C[C@H](NC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)C[NH+]1Cc1ccccc1 ZINC000159884716 508905821 /nfs/dbraw/zinc/90/58/21/508905821.db2.gz SRYOLRFVOHHQDG-SXLOBPIMSA-N 2 1 358.530 2.633 20 70 FFIDMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cc1 ZINC000160220723 508955811 /nfs/dbraw/zinc/95/58/11/508955811.db2.gz GTLHENTXMAMNLQ-QGZVFWFLSA-N 3 1 355.530 2.857 20 70 FFIDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(N2CCOC2=O)cc1 ZINC000160678827 509018201 /nfs/dbraw/zinc/01/82/01/509018201.db2.gz ILOFWRWQQATNIY-VQIMIIECSA-N 2 1 361.486 2.531 20 70 FFIDMP CC[NH2+]CC1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)CC1 ZINC000161122286 509074105 /nfs/dbraw/zinc/07/41/05/509074105.db2.gz HBFKOZIHNYGERU-IBGZPJMESA-N 2 1 361.505 2.886 20 70 FFIDMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000159369526 508831483 /nfs/dbraw/zinc/83/14/83/508831483.db2.gz QFNPZIZLXYTQGD-NUJGCVRESA-N 2 1 367.559 2.850 20 70 FFIDMP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000159369526 508831485 /nfs/dbraw/zinc/83/14/85/508831485.db2.gz QFNPZIZLXYTQGD-NUJGCVRESA-N 2 1 367.559 2.850 20 70 FFIDMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]C2CCN(C(N)=O)CC2)C1 ZINC000160430536 508986229 /nfs/dbraw/zinc/98/62/29/508986229.db2.gz SSKDNPHYYDVSQY-CALCHBBNSA-N 2 1 358.530 2.797 20 70 FFIDMP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccnc1Cl ZINC000161231641 509089591 /nfs/dbraw/zinc/08/95/91/509089591.db2.gz VLAWDACNIASBDN-CQSZACIVSA-N 2 1 360.889 2.877 20 70 FFIDMP CCC(CC)(C[NH3+])C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000161298333 509098956 /nfs/dbraw/zinc/09/89/56/509098956.db2.gz IYRPTVQNDLACHW-GOSISDBHSA-N 2 1 374.529 2.556 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@@H]2CCC[NH+](C)[C@@H]2c2cccs2)CC1 ZINC000159903590 508909037 /nfs/dbraw/zinc/90/90/37/508909037.db2.gz JSIGTDJJLQUMFU-WMZOPIPTSA-N 2 1 364.559 2.868 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000159903590 508909040 /nfs/dbraw/zinc/90/90/40/508909040.db2.gz JSIGTDJJLQUMFU-WMZOPIPTSA-N 2 1 364.559 2.868 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CC1 ZINC000159903590 508909043 /nfs/dbraw/zinc/90/90/43/508909043.db2.gz JSIGTDJJLQUMFU-WMZOPIPTSA-N 2 1 364.559 2.868 20 70 FFIDMP CCn1nccc1C[NH2+]CCCCN1CC[NH+](Cc2ccccc2)CC1 ZINC000160037995 508929131 /nfs/dbraw/zinc/92/91/31/508929131.db2.gz GTCSKIDSOVHTBD-UHFFFAOYSA-N 2 1 355.530 2.591 20 70 FFIDMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000159480593 508847725 /nfs/dbraw/zinc/84/77/25/508847725.db2.gz XUUIQDAIVNQCLJ-NEWSRXKRSA-N 2 1 370.497 2.702 20 70 FFIDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000159480593 508847726 /nfs/dbraw/zinc/84/77/26/508847726.db2.gz XUUIQDAIVNQCLJ-NEWSRXKRSA-N 2 1 370.497 2.702 20 70 FFIDMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000159605405 508864269 /nfs/dbraw/zinc/86/42/69/508864269.db2.gz YPBRRMTUFSKINL-FUHIMQAGSA-N 2 1 369.513 2.647 20 70 FFIDMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159605405 508864270 /nfs/dbraw/zinc/86/42/70/508864270.db2.gz YPBRRMTUFSKINL-FUHIMQAGSA-N 2 1 369.513 2.647 20 70 FFIDMP C[C@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)[N@@H+](C)C1CC1 ZINC000159864757 508902740 /nfs/dbraw/zinc/90/27/40/508902740.db2.gz GBIIEJWRRVNKIN-QGZVFWFLSA-N 2 1 350.551 2.767 20 70 FFIDMP OC[C@H]1CCC[N@H+]1CCCC[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000160689146 509020181 /nfs/dbraw/zinc/02/01/81/509020181.db2.gz HOTLVUGSNLIETQ-JOCHJYFZSA-N 2 1 359.558 2.520 20 70 FFIDMP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000160689146 509020187 /nfs/dbraw/zinc/02/01/87/509020187.db2.gz HOTLVUGSNLIETQ-JOCHJYFZSA-N 3 1 359.558 2.520 20 70 FFIDMP OC[C@H]1CCC[N@H+]1CCCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000160689146 509020193 /nfs/dbraw/zinc/02/01/93/509020193.db2.gz HOTLVUGSNLIETQ-JOCHJYFZSA-N 3 1 359.558 2.520 20 70 FFIDMP C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)NC2CC[NH+](C)CC2)CC1 ZINC000160715147 509024516 /nfs/dbraw/zinc/02/45/16/509024516.db2.gz HHDIDEGYLFTAEJ-QGZVFWFLSA-N 2 1 350.551 2.767 20 70 FFIDMP CC(C)[N@@H+](CCc1nccs1)CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000159510297 508851556 /nfs/dbraw/zinc/85/15/56/508851556.db2.gz KKKDQGVPUWLSOJ-SFHVURJKSA-N 2 1 374.554 2.815 20 70 FFIDMP C[NH+](Cc1cccc(C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c1)C[C@@H]1CCC[C@@H]1O ZINC000159668870 508873372 /nfs/dbraw/zinc/87/33/72/508873372.db2.gz ZERNICYGASZJNW-CMOCDZPBSA-N 2 1 360.542 2.872 20 70 FFIDMP CCC[NH+]1CCC([NH2+]Cc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)CC1 ZINC000160924716 509048653 /nfs/dbraw/zinc/04/86/53/509048653.db2.gz ZJHBVKRYLXMMHC-QZTJIDSGSA-N 2 1 373.541 2.900 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)CC1 ZINC000159699933 508877093 /nfs/dbraw/zinc/87/70/93/508877093.db2.gz NXARWUWWSHVLDF-UHFFFAOYSA-N 2 1 362.493 2.527 20 70 FFIDMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000159725731 508880461 /nfs/dbraw/zinc/88/04/61/508880461.db2.gz AMHZYQJEDKBLBV-UGKGYDQZSA-N 3 1 359.558 2.988 20 70 FFIDMP C[C@H]1CN(C)CC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000159725731 508880464 /nfs/dbraw/zinc/88/04/64/508880464.db2.gz AMHZYQJEDKBLBV-UGKGYDQZSA-N 2 1 359.558 2.988 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N2CCC([NH+]3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000159946836 508915678 /nfs/dbraw/zinc/91/56/78/508915678.db2.gz LDSFFKBCMFMULP-QUCCMNQESA-N 2 1 370.541 2.919 20 70 FFIDMP Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000160158073 508947895 /nfs/dbraw/zinc/94/78/95/508947895.db2.gz HMYHCPSAVKLBLY-OALUTQOASA-N 2 1 369.513 2.583 20 70 FFIDMP Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000160158073 508947897 /nfs/dbraw/zinc/94/78/97/508947897.db2.gz HMYHCPSAVKLBLY-OALUTQOASA-N 2 1 369.513 2.583 20 70 FFIDMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1C[C@H](C)[NH+](Cc2ccccc2)C1 ZINC000160409337 508983209 /nfs/dbraw/zinc/98/32/09/508983209.db2.gz HCAFQMMWHLFIQT-KCLUMXDGSA-N 2 1 370.541 2.918 20 70 FFIDMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000160409337 508983212 /nfs/dbraw/zinc/98/32/12/508983212.db2.gz HCAFQMMWHLFIQT-KCLUMXDGSA-N 2 1 370.541 2.918 20 70 FFIDMP CC[NH+]1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000160409337 508983214 /nfs/dbraw/zinc/98/32/14/508983214.db2.gz HCAFQMMWHLFIQT-KCLUMXDGSA-N 2 1 370.541 2.918 20 70 FFIDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cccc(N2CCOC2=O)c1 ZINC000160705205 509022762 /nfs/dbraw/zinc/02/27/62/509022762.db2.gz HHFAJUZHCMBUIT-QFBILLFUSA-N 2 1 361.486 2.531 20 70 FFIDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cccc(N2CCOC2=O)c1 ZINC000160705340 509022888 /nfs/dbraw/zinc/02/28/88/509022888.db2.gz HHFAJUZHCMBUIT-VQIMIIECSA-N 2 1 361.486 2.531 20 70 FFIDMP CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000159650321 508871376 /nfs/dbraw/zinc/87/13/76/508871376.db2.gz ZCQUHPRHXNKLOB-UHFFFAOYSA-N 2 1 373.541 2.713 20 70 FFIDMP CC[NH+](CC)CC(=O)Nc1c(C)cnn1[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159761547 508886438 /nfs/dbraw/zinc/88/64/38/508886438.db2.gz QARBDGHSTYWFBA-LJQANCHMSA-N 2 1 369.513 2.919 20 70 FFIDMP CCN(C(=O)NCC[NH+](CC)C1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159952833 508916725 /nfs/dbraw/zinc/91/67/25/508916725.db2.gz YOQQNVAQIXCSIK-HXUWFJFHSA-N 2 1 358.530 2.777 20 70 FFIDMP CCN(C(=O)NCC[N@H+](CC)C1CC1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000159952833 508916726 /nfs/dbraw/zinc/91/67/26/508916726.db2.gz YOQQNVAQIXCSIK-HXUWFJFHSA-N 2 1 358.530 2.777 20 70 FFIDMP CCN(C(=O)NCC[N@@H+](CC)C1CC1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000159952833 508916729 /nfs/dbraw/zinc/91/67/29/508916729.db2.gz YOQQNVAQIXCSIK-HXUWFJFHSA-N 2 1 358.530 2.777 20 70 FFIDMP CC[NH+]1CCN([C@H]2CC[N@@H+](CCc3cccc(OC(F)(F)F)c3)C2)CC1 ZINC000160053297 508930608 /nfs/dbraw/zinc/93/06/08/508930608.db2.gz SJNBWRJQFRAGJR-KRWDZBQOSA-N 2 1 371.447 2.840 20 70 FFIDMP COc1cc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)cc1OC ZINC000160676785 509018469 /nfs/dbraw/zinc/01/84/69/509018469.db2.gz DLMANDAQJFHZBI-DLBZAZTESA-N 2 1 350.503 2.900 20 70 FFIDMP COc1cc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)cc1OC ZINC000160676670 509018639 /nfs/dbraw/zinc/01/86/39/509018639.db2.gz DLMANDAQJFHZBI-IAGOWNOFSA-N 2 1 350.503 2.900 20 70 FFIDMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)cc1NC(C)=O ZINC000160735543 509026646 /nfs/dbraw/zinc/02/66/46/509026646.db2.gz NTUBHZBYLHLDOC-MAUKXSAKSA-N 2 1 363.502 2.541 20 70 FFIDMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)cc1NC(C)=O ZINC000160735653 509026820 /nfs/dbraw/zinc/02/68/20/509026820.db2.gz NTUBHZBYLHLDOC-CRAIPNDOSA-N 2 1 363.502 2.541 20 70 FFIDMP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccnc1Cl ZINC000161231521 509089876 /nfs/dbraw/zinc/08/98/76/509089876.db2.gz VLAWDACNIASBDN-AWEZNQCLSA-N 2 1 360.889 2.877 20 70 FFIDMP CC(C)[N@H+]1CCCN(C(=O)N[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000160008950 508925091 /nfs/dbraw/zinc/92/50/91/508925091.db2.gz NPTHFBYXKRKKKH-ICSRJNTNSA-N 2 1 358.530 2.633 20 70 FFIDMP CC(C)[NH+]1CCCN(C(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000160008950 508925092 /nfs/dbraw/zinc/92/50/92/508925092.db2.gz NPTHFBYXKRKKKH-ICSRJNTNSA-N 2 1 358.530 2.633 20 70 FFIDMP CC(C)[NH+]1CCCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000160008950 508925097 /nfs/dbraw/zinc/92/50/97/508925097.db2.gz NPTHFBYXKRKKKH-ICSRJNTNSA-N 2 1 358.530 2.633 20 70 FFIDMP CCNC(=O)c1cccc(C[NH2+][C@H]2CC[N@H+](CCCOCC)C[C@@H]2C)c1 ZINC000160174634 508949982 /nfs/dbraw/zinc/94/99/82/508949982.db2.gz ZIBYIRKXZYQIBI-PXNSSMCTSA-N 2 1 361.530 2.663 20 70 FFIDMP CCNC(=O)c1cccc(C[NH2+][C@H]2CC[N@@H+](CCCOCC)C[C@@H]2C)c1 ZINC000160174634 508949983 /nfs/dbraw/zinc/94/99/83/508949983.db2.gz ZIBYIRKXZYQIBI-PXNSSMCTSA-N 2 1 361.530 2.663 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N2CC[C@H](C[NH+]3CCCC3)C2)C[N@H+]1Cc1ccccc1 ZINC000160333057 508971889 /nfs/dbraw/zinc/97/18/89/508971889.db2.gz JYDYHJJTHYIEGF-NRSPTQNISA-N 2 1 370.541 2.777 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N2CC[C@H]([NH+]3CCCC3)C2)C[N@H+]1Cc1ccccc1 ZINC000160362338 508975863 /nfs/dbraw/zinc/97/58/63/508975863.db2.gz WTDPZXBVIBWTQG-RLLQIKCJSA-N 2 1 356.514 2.529 20 70 FFIDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(N2CCCC2=O)cc1 ZINC000160744323 509027398 /nfs/dbraw/zinc/02/73/98/509027398.db2.gz UMSIDJMQDBVQQY-YLJYHZDGSA-N 2 1 359.514 2.701 20 70 FFIDMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)CC1 ZINC000161353027 509106196 /nfs/dbraw/zinc/10/61/96/509106196.db2.gz MKBDBMRDIGWHCG-ZWOKBUDYSA-N 2 1 373.545 2.589 20 70 FFIDMP C[NH+](C)Cc1ccc(C(=O)NCc2cccc(C[NH+]3CCOCC3)c2)cc1 ZINC000160549374 509001565 /nfs/dbraw/zinc/00/15/65/509001565.db2.gz XOGQYHGPLGHQLK-UHFFFAOYSA-N 2 1 367.493 2.510 20 70 FFIDMP CCC[C@H]1CCCN(C(=O)[C@@H](N)Cc2cn(Cc3ccccc3)cn2)C1 ZINC000161448882 509116724 /nfs/dbraw/zinc/11/67/24/509116724.db2.gz SYLVOVBSXWLELG-PXNSSMCTSA-N 2 1 354.498 2.840 20 70 FFIDMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(C(=O)OC(C)(C)C)cc3)C2)CC1 ZINC000160050960 508930652 /nfs/dbraw/zinc/93/06/52/508930652.db2.gz AKGUCUKYCMPEAO-FQEVSTJZSA-N 2 1 373.541 2.854 20 70 FFIDMP CN(C)c1cccc(C[N@H+](C)CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c1 ZINC000159392467 508835739 /nfs/dbraw/zinc/83/57/39/508835739.db2.gz STQLCAOIDIKVQM-OAQYLSRUSA-N 2 1 368.525 2.604 20 70 FFIDMP CN(C)c1cccc(C[N@@H+](C)CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c1 ZINC000159392467 508835741 /nfs/dbraw/zinc/83/57/41/508835741.db2.gz STQLCAOIDIKVQM-OAQYLSRUSA-N 2 1 368.525 2.604 20 70 FFIDMP CNS(=O)(=O)c1cccc([C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC000159618887 508866830 /nfs/dbraw/zinc/86/68/30/508866830.db2.gz IWTKFEYQRVVGPZ-CYBMUJFWSA-N 2 1 353.532 2.555 20 70 FFIDMP C[NH+](C)CCCC1CCN(C(=O)NC[C@H](c2ccco2)[NH+](C)C)CC1 ZINC000159782879 508890429 /nfs/dbraw/zinc/89/04/29/508890429.db2.gz GQGHHSSNVUVBDH-QGZVFWFLSA-N 2 1 350.507 2.646 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159948983 508916078 /nfs/dbraw/zinc/91/60/78/508916078.db2.gz BGRCTQNTJLOXIQ-AZUAARDMSA-N 2 1 358.530 2.634 20 70 FFIDMP CC[NH+]1CCCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159948983 508916082 /nfs/dbraw/zinc/91/60/82/508916082.db2.gz BGRCTQNTJLOXIQ-AZUAARDMSA-N 2 1 358.530 2.634 20 70 FFIDMP CC[NH+]1CCCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159948983 508916085 /nfs/dbraw/zinc/91/60/85/508916085.db2.gz BGRCTQNTJLOXIQ-AZUAARDMSA-N 2 1 358.530 2.634 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000159955358 508916899 /nfs/dbraw/zinc/91/68/99/508916899.db2.gz YVKOMWBZPHMTOB-UYAOXDASSA-N 2 1 358.530 2.777 20 70 FFIDMP CC[NH+]1CCCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000159955358 508916901 /nfs/dbraw/zinc/91/69/01/508916901.db2.gz YVKOMWBZPHMTOB-UYAOXDASSA-N 2 1 358.530 2.777 20 70 FFIDMP CC[NH+]1CCCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000159955358 508916904 /nfs/dbraw/zinc/91/69/04/508916904.db2.gz YVKOMWBZPHMTOB-UYAOXDASSA-N 2 1 358.530 2.777 20 70 FFIDMP CC(C)[N@H+]1CCCN(C(=O)N[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000160008819 508924907 /nfs/dbraw/zinc/92/49/07/508924907.db2.gz NPTHFBYXKRKKKH-QUCCMNQESA-N 2 1 358.530 2.633 20 70 FFIDMP CC(C)[NH+]1CCCN(C(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000160008819 508924909 /nfs/dbraw/zinc/92/49/09/508924909.db2.gz NPTHFBYXKRKKKH-QUCCMNQESA-N 2 1 358.530 2.633 20 70 FFIDMP CC(C)[NH+]1CCCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000160008819 508924912 /nfs/dbraw/zinc/92/49/12/508924912.db2.gz NPTHFBYXKRKKKH-QUCCMNQESA-N 2 1 358.530 2.633 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N(C)CC2CC[NH+](C)CC2)C[N@H+]1Cc1ccccc1 ZINC000160339143 508972582 /nfs/dbraw/zinc/97/25/82/508972582.db2.gz JKBWJKPIIOLXPW-YLJYHZDGSA-N 2 1 358.530 2.633 20 70 FFIDMP COC[C@H](Cc1ccccc1)[NH2+]Cc1ccccc1C[NH+]1CCOCC1 ZINC000160468661 508991392 /nfs/dbraw/zinc/99/13/92/508991392.db2.gz RDYJJBMEFRFXKL-QFIPXVFZSA-N 2 1 354.494 2.866 20 70 FFIDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cccc(N2CCCC2=O)c1 ZINC000160714612 509024140 /nfs/dbraw/zinc/02/41/40/509024140.db2.gz NSDFPJMZKIDFQI-FXAWDEMLSA-N 2 1 359.514 2.701 20 70 FFIDMP Cc1ccc(CN(CC[NH+](C)C)C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)o1 ZINC000160779171 509031993 /nfs/dbraw/zinc/03/19/93/509031993.db2.gz DYWLAQGQVUQBCH-KRWDZBQOSA-N 2 1 362.518 2.678 20 70 FFIDMP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N1CCC(CCC[NH+](C)C)CC1 ZINC000160882001 509043443 /nfs/dbraw/zinc/04/34/43/509043443.db2.gz NHKWMDYGODJNRW-ZWKOTPCHSA-N 2 1 352.567 2.870 20 70 FFIDMP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1 ZINC000161286624 509097232 /nfs/dbraw/zinc/09/72/32/509097232.db2.gz WSVGOWGYYIFJAW-ZWOKBUDYSA-N 2 1 373.545 2.731 20 70 FFIDMP C[C@H](NC1CC[NH+](C)CC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000161508924 509123190 /nfs/dbraw/zinc/12/31/90/509123190.db2.gz FIUPIHAFQSIJNO-INIZCTEOSA-N 2 1 365.543 2.606 20 70 FFIDMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000161508924 509123196 /nfs/dbraw/zinc/12/31/96/509123196.db2.gz FIUPIHAFQSIJNO-INIZCTEOSA-N 2 1 365.543 2.606 20 70 FFIDMP CCCC[N@H+]1CCCC[C@H]1CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000217037616 509266765 /nfs/dbraw/zinc/26/67/65/509266765.db2.gz ZZRAZKNPPYTZOQ-RBUKOAKNSA-N 2 1 350.551 2.911 20 70 FFIDMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000159369380 508831724 /nfs/dbraw/zinc/83/17/24/508831724.db2.gz QFNPZIZLXYTQGD-SOLBZPMBSA-N 2 1 367.559 2.850 20 70 FFIDMP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000159369380 508831727 /nfs/dbraw/zinc/83/17/27/508831727.db2.gz QFNPZIZLXYTQGD-SOLBZPMBSA-N 2 1 367.559 2.850 20 70 FFIDMP CC(C)[N@H+](CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)Cc1cccnc1 ZINC000159596323 508863666 /nfs/dbraw/zinc/86/36/66/508863666.db2.gz CEFYBAFKAOSHLV-HXUWFJFHSA-N 2 1 354.498 2.711 20 70 FFIDMP CC(C)[N@@H+](CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)Cc1cccnc1 ZINC000159596323 508863669 /nfs/dbraw/zinc/86/36/69/508863669.db2.gz CEFYBAFKAOSHLV-HXUWFJFHSA-N 2 1 354.498 2.711 20 70 FFIDMP CC[C@H](CNC(=O)N1CCC[N@@H+](CC)CC1)[NH+]1CCc2ccccc2C1 ZINC000159623138 508867385 /nfs/dbraw/zinc/86/73/85/508867385.db2.gz ADSMBOPHJJIJCV-HXUWFJFHSA-N 2 1 358.530 2.561 20 70 FFIDMP CC[C@H](CNC(=O)N1CCC[NH+](CC)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000159623138 508867390 /nfs/dbraw/zinc/86/73/90/508867390.db2.gz ADSMBOPHJJIJCV-HXUWFJFHSA-N 2 1 358.530 2.561 20 70 FFIDMP CC[C@H](CNC(=O)N1CCC[NH+](CC)CC1)[N@H+]1CCc2ccccc2C1 ZINC000159623138 508867392 /nfs/dbraw/zinc/86/73/92/508867392.db2.gz ADSMBOPHJJIJCV-HXUWFJFHSA-N 2 1 358.530 2.561 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)CC1 ZINC000159783566 508890514 /nfs/dbraw/zinc/89/05/14/508890514.db2.gz NTCDOBUWWAGHFK-KRWDZBQOSA-N 2 1 364.559 2.697 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000159783566 508890518 /nfs/dbraw/zinc/89/05/18/508890518.db2.gz NTCDOBUWWAGHFK-KRWDZBQOSA-N 2 1 364.559 2.697 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000159783566 508890523 /nfs/dbraw/zinc/89/05/23/508890523.db2.gz NTCDOBUWWAGHFK-KRWDZBQOSA-N 2 1 364.559 2.697 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159994922 508922711 /nfs/dbraw/zinc/92/27/11/508922711.db2.gz APCOFVWAUNEFKS-OALUTQOASA-N 2 1 372.557 2.880 20 70 FFIDMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000160281246 508964010 /nfs/dbraw/zinc/96/40/10/508964010.db2.gz JQATZOYKCPIFDL-CVEARBPZSA-N 2 1 353.532 2.510 20 70 FFIDMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000160281246 508964013 /nfs/dbraw/zinc/96/40/13/508964013.db2.gz JQATZOYKCPIFDL-CVEARBPZSA-N 2 1 353.532 2.510 20 70 FFIDMP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@@H]3C)cc2)CC1 ZINC000160316579 508969454 /nfs/dbraw/zinc/96/94/54/508969454.db2.gz OFVOONMPFUHXBX-CNNODRBYSA-N 3 1 358.574 2.642 20 70 FFIDMP CC[C@@H](CNC(=O)N1CCC[N@@H+](CC)CC1)[NH+]1CCc2ccccc2C1 ZINC000159623007 508866846 /nfs/dbraw/zinc/86/68/46/508866846.db2.gz ADSMBOPHJJIJCV-FQEVSTJZSA-N 2 1 358.530 2.561 20 70 FFIDMP CC[C@@H](CNC(=O)N1CCC[NH+](CC)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000159623007 508866849 /nfs/dbraw/zinc/86/68/49/508866849.db2.gz ADSMBOPHJJIJCV-FQEVSTJZSA-N 2 1 358.530 2.561 20 70 FFIDMP CC[C@@H](CNC(=O)N1CCC[NH+](CC)CC1)[N@H+]1CCc2ccccc2C1 ZINC000159623007 508866850 /nfs/dbraw/zinc/86/68/50/508866850.db2.gz ADSMBOPHJJIJCV-FQEVSTJZSA-N 2 1 358.530 2.561 20 70 FFIDMP C[C@H]1C[C@H](NC(=O)N2CCC([NH+]3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000159946927 508916148 /nfs/dbraw/zinc/91/61/48/508916148.db2.gz LDSFFKBCMFMULP-ICSRJNTNSA-N 2 1 370.541 2.919 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N2CCC[C@H]([NH+]3CCCC3)C2)C[N@H+]1Cc1ccccc1 ZINC000160154657 508946914 /nfs/dbraw/zinc/94/69/14/508946914.db2.gz PDZJEYQBVSDZRL-NRSPTQNISA-N 2 1 370.541 2.919 20 70 FFIDMP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCN(CC)CC1)c1cnn(C)c1 ZINC000160338199 508972662 /nfs/dbraw/zinc/97/26/62/508972662.db2.gz SNKZUSFRZUAQDR-NRFANRHFSA-N 2 1 355.530 2.799 20 70 FFIDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(N2CCCC2=O)cc1 ZINC000160744183 509027442 /nfs/dbraw/zinc/02/74/42/509027442.db2.gz UMSIDJMQDBVQQY-FXAWDEMLSA-N 2 1 359.514 2.701 20 70 FFIDMP C[NH+](C)CCN(Cc1ccccc1)C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000160805428 509034749 /nfs/dbraw/zinc/03/47/49/509034749.db2.gz GFEWRCHVWOXRHB-LJQANCHMSA-N 2 1 358.530 2.777 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@H]2CC[NH+](C)[C@@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC000160407930 508982616 /nfs/dbraw/zinc/98/26/16/508982616.db2.gz DOHKKAHERQSWDN-XEYPJELSSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000160407930 508982620 /nfs/dbraw/zinc/98/26/20/508982620.db2.gz DOHKKAHERQSWDN-XEYPJELSSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000160407930 508982623 /nfs/dbraw/zinc/98/26/23/508982623.db2.gz DOHKKAHERQSWDN-XEYPJELSSA-N 2 1 358.530 2.774 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)C[C@@H]2CCC[NH+](C)C2)C[N@H+]1Cc1ccccc1 ZINC000159884966 508905693 /nfs/dbraw/zinc/90/56/93/508905693.db2.gz SRYOLRFVOHHQDG-DFQSSKMNSA-N 2 1 358.530 2.633 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)C[C@@H]2CCC[N@H+](C)C2)C[NH+]1Cc1ccccc1 ZINC000159884966 508905694 /nfs/dbraw/zinc/90/56/94/508905694.db2.gz SRYOLRFVOHHQDG-DFQSSKMNSA-N 2 1 358.530 2.633 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)C[NH+]1Cc1ccccc1 ZINC000159884966 508905697 /nfs/dbraw/zinc/90/56/97/508905697.db2.gz SRYOLRFVOHHQDG-DFQSSKMNSA-N 2 1 358.530 2.633 20 70 FFIDMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000160281332 508964960 /nfs/dbraw/zinc/96/49/60/508964960.db2.gz JQATZOYKCPIFDL-HOTGVXAUSA-N 2 1 353.532 2.510 20 70 FFIDMP CNS(=O)(=O)c1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000160281332 508964964 /nfs/dbraw/zinc/96/49/64/508964964.db2.gz JQATZOYKCPIFDL-HOTGVXAUSA-N 2 1 353.532 2.510 20 70 FFIDMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)CC1 ZINC000160952471 509052652 /nfs/dbraw/zinc/05/26/52/509052652.db2.gz CMELFLITUZUDFB-QZTJIDSGSA-N 2 1 373.541 2.898 20 70 FFIDMP CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2C[C@H](C)[NH+](Cc3ccccc3)C2)C1 ZINC000160011783 508924986 /nfs/dbraw/zinc/92/49/86/508924986.db2.gz WLEVYAOKLILYMW-YSIASYRMSA-N 2 1 358.530 2.633 20 70 FFIDMP CC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)C1 ZINC000160011783 508924990 /nfs/dbraw/zinc/92/49/90/508924990.db2.gz WLEVYAOKLILYMW-YSIASYRMSA-N 2 1 358.530 2.633 20 70 FFIDMP CC[NH+](C)C[C@@H]1CCN(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000160011783 508924991 /nfs/dbraw/zinc/92/49/91/508924991.db2.gz WLEVYAOKLILYMW-YSIASYRMSA-N 2 1 358.530 2.633 20 70 FFIDMP O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000160690261 509021184 /nfs/dbraw/zinc/02/11/84/509021184.db2.gz MPGCBWBNMYFNNX-UXHICEINSA-N 2 1 362.562 2.768 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@H](c2ccccc2OC)[NH+]2CCCC2)CC1 ZINC000159533626 508854843 /nfs/dbraw/zinc/85/48/43/508854843.db2.gz UPKNVJUHCBLHMJ-LJQANCHMSA-N 2 1 374.529 2.569 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N(C)C[C@@H]2CCC[NH+](C)C2)C[N@H+]1Cc1ccccc1 ZINC000159884840 508905572 /nfs/dbraw/zinc/90/55/72/508905572.db2.gz SRYOLRFVOHHQDG-MISYRCLQSA-N 2 1 358.530 2.633 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N(C)C[C@@H]2CCC[N@H+](C)C2)C[NH+]1Cc1ccccc1 ZINC000159884840 508905573 /nfs/dbraw/zinc/90/55/73/508905573.db2.gz SRYOLRFVOHHQDG-MISYRCLQSA-N 2 1 358.530 2.633 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)C[NH+]1Cc1ccccc1 ZINC000159884840 508905575 /nfs/dbraw/zinc/90/55/75/508905575.db2.gz SRYOLRFVOHHQDG-MISYRCLQSA-N 2 1 358.530 2.633 20 70 FFIDMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H]2CC[N@@H+](C3CCCC3)C2)C1 ZINC000160824741 509037278 /nfs/dbraw/zinc/03/72/78/509037278.db2.gz DRGURMFUSQNBEL-FUHWJXTLSA-N 2 1 359.518 2.809 20 70 FFIDMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)C1 ZINC000160824741 509037282 /nfs/dbraw/zinc/03/72/82/509037282.db2.gz DRGURMFUSQNBEL-FUHWJXTLSA-N 2 1 359.518 2.809 20 70 FFIDMP COc1cc(C[NH+]2CCN(CCC[NH+]3CCCCC3)CC2)cc(OC)c1 ZINC000161381671 509109262 /nfs/dbraw/zinc/10/92/62/509109262.db2.gz DHMPKFXCAZHZQT-UHFFFAOYSA-N 2 1 361.530 2.697 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)CC1 ZINC000159562656 508859085 /nfs/dbraw/zinc/85/90/85/508859085.db2.gz CESMVYSLHGEMMC-UHFFFAOYSA-N 2 1 358.530 2.910 20 70 FFIDMP CN(C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000160683272 509019381 /nfs/dbraw/zinc/01/93/81/509019381.db2.gz QJOQREOPBHEQIG-FQEVSTJZSA-N 2 1 370.541 2.777 20 70 FFIDMP CCN1CC[NH+](Cc2ccc(C[NH2+]C3CCC4(CC3)OCCO4)cc2)CC1 ZINC000161302006 509099112 /nfs/dbraw/zinc/09/91/12/509099112.db2.gz AXQIVKFDNWMBDJ-UHFFFAOYSA-N 2 1 373.541 2.599 20 70 FFIDMP CC(C)[N@H+](CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)Cc1cccnc1 ZINC000159596222 508862764 /nfs/dbraw/zinc/86/27/64/508862764.db2.gz CEFYBAFKAOSHLV-FQEVSTJZSA-N 2 1 354.498 2.711 20 70 FFIDMP CC(C)[N@@H+](CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)Cc1cccnc1 ZINC000159596222 508862765 /nfs/dbraw/zinc/86/27/65/508862765.db2.gz CEFYBAFKAOSHLV-FQEVSTJZSA-N 2 1 354.498 2.711 20 70 FFIDMP C[C@H]1C[C@@H](NC(=O)N2CCC([NH+]3CCCC3)CC2)C[N@H+]1Cc1ccccc1 ZINC000159947104 508915858 /nfs/dbraw/zinc/91/58/58/508915858.db2.gz LDSFFKBCMFMULP-AZUAARDMSA-N 2 1 370.541 2.919 20 70 FFIDMP C[C@@H]1C[C@H](NC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C[N@H+]1C1CC1 ZINC000160002380 508923594 /nfs/dbraw/zinc/92/35/94/508923594.db2.gz FTDSPKQTNHVQLD-MJGOQNOKSA-N 2 1 362.562 2.909 20 70 FFIDMP CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000160986584 509057340 /nfs/dbraw/zinc/05/73/40/509057340.db2.gz WQSDNGBNXVTTCW-IBGZPJMESA-N 2 1 352.567 2.870 20 70 FFIDMP NC(=O)[C@H]1CCC[N@@H+]1C1CCN(CCCOc2cccc(Cl)c2)CC1 ZINC000159427454 508840878 /nfs/dbraw/zinc/84/08/78/508840878.db2.gz CGUXDCHQGSIKNC-GOSISDBHSA-N 2 1 365.905 2.523 20 70 FFIDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC[C@H]2C[NH+](C)CC[C@@H]21 ZINC000159945650 508915955 /nfs/dbraw/zinc/91/59/55/508915955.db2.gz DHCHUBAOPWSWAU-HZEGPAAWSA-N 2 1 370.541 2.633 20 70 FFIDMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@@H]21 ZINC000159945650 508915958 /nfs/dbraw/zinc/91/59/58/508915958.db2.gz DHCHUBAOPWSWAU-HZEGPAAWSA-N 2 1 370.541 2.633 20 70 FFIDMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21 ZINC000159945650 508915961 /nfs/dbraw/zinc/91/59/61/508915961.db2.gz DHCHUBAOPWSWAU-HZEGPAAWSA-N 2 1 370.541 2.633 20 70 FFIDMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@H]1CC[NH+](C)[C@H](C)C1 ZINC000159961948 508918186 /nfs/dbraw/zinc/91/81/86/508918186.db2.gz PFUVIBBFPJTURR-KVPLUYHFSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000159961948 508918187 /nfs/dbraw/zinc/91/81/87/508918187.db2.gz PFUVIBBFPJTURR-KVPLUYHFSA-N 2 1 358.530 2.631 20 70 FFIDMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H]1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000159961948 508918190 /nfs/dbraw/zinc/91/81/90/508918190.db2.gz PFUVIBBFPJTURR-KVPLUYHFSA-N 2 1 358.530 2.631 20 70 FFIDMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cc1 ZINC000160220807 508955799 /nfs/dbraw/zinc/95/57/99/508955799.db2.gz GTLHENTXMAMNLQ-KRWDZBQOSA-N 3 1 355.530 2.857 20 70 FFIDMP CC[N@@H+](Cc1ccc(C(=O)NCCCC[NH+]2CCOCC2)cc1)C(C)C ZINC000160294590 508966298 /nfs/dbraw/zinc/96/62/98/508966298.db2.gz KFLFAVRLLKZANP-UHFFFAOYSA-N 2 1 361.530 2.759 20 70 FFIDMP CC[C@@H]1CCCC[N@H+]1CCNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000160437159 508986511 /nfs/dbraw/zinc/98/65/11/508986511.db2.gz HQWDDOHCICDQAX-MOPGFXCFSA-N 2 1 350.551 2.911 20 70 FFIDMP O=C(NC[C@H]1CC[N@H+](C2CC2)C1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000159631240 508868799 /nfs/dbraw/zinc/86/87/99/508868799.db2.gz IQGZTEBPIBYMKY-LJQANCHMSA-N 2 1 362.562 2.768 20 70 FFIDMP Cc1cccc(CN(CC[NH+](C)C)C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)c1 ZINC000160684384 509020096 /nfs/dbraw/zinc/02/00/96/509020096.db2.gz DFIUUWIKWREPNM-FQEVSTJZSA-N 2 1 358.530 2.553 20 70 FFIDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cnn(Cc2ccccc2)c1 ZINC000160738673 509026535 /nfs/dbraw/zinc/02/65/35/509026535.db2.gz WANWWVYPXZLOTD-GHTZIAJQSA-N 2 1 356.514 2.819 20 70 FFIDMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N1CCC(CCC[NH+](C)C)CC1 ZINC000160881867 509043561 /nfs/dbraw/zinc/04/35/61/509043561.db2.gz NHKWMDYGODJNRW-QZTJIDSGSA-N 2 1 352.567 2.870 20 70 FFIDMP CC[NH2+]CC1CCN(C(=O)c2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000161066641 509066407 /nfs/dbraw/zinc/06/64/07/509066407.db2.gz SUVXFWCDTJIIET-HDICACEKSA-N 2 1 373.541 2.758 20 70 FFIDMP CC[NH2+]CC1CCN(C(=O)c2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000161066641 509066410 /nfs/dbraw/zinc/06/64/10/509066410.db2.gz SUVXFWCDTJIIET-HDICACEKSA-N 2 1 373.541 2.758 20 70 FFIDMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c(F)c1 ZINC000161209639 509086558 /nfs/dbraw/zinc/08/65/58/509086558.db2.gz TUCLOLRHUKXGIH-OAHLLOKOSA-N 2 1 373.472 2.977 20 70 FFIDMP CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000161246678 509091335 /nfs/dbraw/zinc/09/13/35/509091335.db2.gz OYOJROFTZZJGCM-FXAWDEMLSA-N 2 1 373.545 2.589 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)CC1 ZINC000159537843 508854816 /nfs/dbraw/zinc/85/48/16/508854816.db2.gz FGAZFYAAOYLBHG-MRXNPFEDSA-N 2 1 350.532 2.622 20 70 FFIDMP CC(C)[NH2+]C1CCN(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000160093255 508937264 /nfs/dbraw/zinc/93/72/64/508937264.db2.gz YXIIESKPGYYECW-YLJYHZDGSA-N 2 1 358.530 2.821 20 70 FFIDMP CC[C@H]1CCCC[N@H+]1CCNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000160437298 508986654 /nfs/dbraw/zinc/98/66/54/508986654.db2.gz HQWDDOHCICDQAX-OALUTQOASA-N 2 1 350.551 2.911 20 70 FFIDMP CCCC[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000217037576 509265659 /nfs/dbraw/zinc/26/56/59/509265659.db2.gz ZZRAZKNPPYTZOQ-RTBURBONSA-N 2 1 350.551 2.911 20 70 FFIDMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000159605705 508864669 /nfs/dbraw/zinc/86/46/69/508864669.db2.gz YPBRRMTUFSKINL-UWVAXJGDSA-N 2 1 369.513 2.647 20 70 FFIDMP Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159605705 508864673 /nfs/dbraw/zinc/86/46/73/508864673.db2.gz YPBRRMTUFSKINL-UWVAXJGDSA-N 2 1 369.513 2.647 20 70 FFIDMP C[N@@H+]1CCN(C(=O)N[C@@H]2CC[NH+](C3CCCC3)C2)[C@H](c2ccccc2)C1 ZINC000160788690 509033113 /nfs/dbraw/zinc/03/31/13/509033113.db2.gz NZTWKJQHCBYJKN-QUCCMNQESA-N 2 1 356.514 2.702 20 70 FFIDMP C[N@H+]1CCN(C(=O)N[C@@H]2CC[NH+](C3CCCC3)C2)[C@H](c2ccccc2)C1 ZINC000160788690 509033116 /nfs/dbraw/zinc/03/31/16/509033116.db2.gz NZTWKJQHCBYJKN-QUCCMNQESA-N 2 1 356.514 2.702 20 70 FFIDMP C[NH+]1CCN(C(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)[C@H](c2ccccc2)C1 ZINC000160788690 509033119 /nfs/dbraw/zinc/03/31/19/509033119.db2.gz NZTWKJQHCBYJKN-QUCCMNQESA-N 2 1 356.514 2.702 20 70 FFIDMP C[NH+]1CCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)[C@H](c2ccccc2)C1 ZINC000160788690 509033123 /nfs/dbraw/zinc/03/31/23/509033123.db2.gz NZTWKJQHCBYJKN-QUCCMNQESA-N 2 1 356.514 2.702 20 70 FFIDMP COc1cc([C@@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)ccc1S(C)(=O)=O ZINC000161069600 509067378 /nfs/dbraw/zinc/06/73/78/509067378.db2.gz OZSZQELTTUPSJD-BMFZPTHFSA-N 2 1 354.516 2.622 20 70 FFIDMP CC[NH+](CC)[C@@H](CNC(=O)N1CCC[N@@H+](CC)CC1)c1ccsc1 ZINC000159619992 508867217 /nfs/dbraw/zinc/86/72/17/508867217.db2.gz PFKOMXVYIJDOED-KRWDZBQOSA-N 2 1 352.548 2.868 20 70 FFIDMP C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)C[N@@H+](C)[C@@H]1CCSC1 ZINC000159625176 508868078 /nfs/dbraw/zinc/86/80/78/508868078.db2.gz DMNAWRURUOVPBL-QGZVFWFLSA-N 2 1 369.962 2.668 20 70 FFIDMP O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000159631131 508868733 /nfs/dbraw/zinc/86/87/33/508868733.db2.gz IQGZTEBPIBYMKY-IBGZPJMESA-N 2 1 362.562 2.768 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NCC(C)(C)[NH+]2CCc3ccccc3C2)CC1 ZINC000159670768 508873864 /nfs/dbraw/zinc/87/38/64/508873864.db2.gz MVJBYSRRVZXBJR-UHFFFAOYSA-N 2 1 358.530 2.561 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NCC(C)(C)[N@@H+]2CCc3ccccc3C2)CC1 ZINC000159670768 508873867 /nfs/dbraw/zinc/87/38/67/508873867.db2.gz MVJBYSRRVZXBJR-UHFFFAOYSA-N 2 1 358.530 2.561 20 70 FFIDMP CC[NH+]1CCCN(C(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)CC1 ZINC000159670768 508873872 /nfs/dbraw/zinc/87/38/72/508873872.db2.gz MVJBYSRRVZXBJR-UHFFFAOYSA-N 2 1 358.530 2.561 20 70 FFIDMP CCOCCC[N@H+]1CC[C@@H](Nc2nc(C(C)C)nc(N(C)C)n2)[C@H](C)C1 ZINC000159802553 508892540 /nfs/dbraw/zinc/89/25/40/508892540.db2.gz ICTWKINFZICFKJ-HZPDHXFCSA-N 2 1 364.538 2.610 20 70 FFIDMP C[C@@H]1C[C@@H](NC(=O)N2CC[C@H](C[NH+]3CCCC3)C2)C[N@H+]1Cc1ccccc1 ZINC000160333297 508971650 /nfs/dbraw/zinc/97/16/50/508971650.db2.gz JYDYHJJTHYIEGF-HMXCVIKNSA-N 2 1 370.541 2.777 20 70 FFIDMP C[C@H]1C[C@H](NC(=O)N(C)CC2CC[NH+](C)CC2)C[N@H+]1Cc1ccccc1 ZINC000160338995 508972644 /nfs/dbraw/zinc/97/26/44/508972644.db2.gz JKBWJKPIIOLXPW-PXNSSMCTSA-N 2 1 358.530 2.633 20 70 FFIDMP CCN(C(=O)N[C@@H]1C[C@H](C)[NH+](C2CC2)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160642558 509013293 /nfs/dbraw/zinc/01/32/93/509013293.db2.gz UCEFKVADVDJSGF-FBBABVLZSA-N 2 1 370.541 2.918 20 70 FFIDMP CCN(C(=O)N[C@@H]1C[C@H](C)[N@@H+](C2CC2)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000160642558 509013295 /nfs/dbraw/zinc/01/32/95/509013295.db2.gz UCEFKVADVDJSGF-FBBABVLZSA-N 2 1 370.541 2.918 20 70 FFIDMP CCN(C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000160642558 509013297 /nfs/dbraw/zinc/01/32/97/509013297.db2.gz UCEFKVADVDJSGF-FBBABVLZSA-N 2 1 370.541 2.918 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@@H](c2ccccc2OC)[NH+]2CCCC2)CC1 ZINC000159533494 508854739 /nfs/dbraw/zinc/85/47/39/508854739.db2.gz UPKNVJUHCBLHMJ-IBGZPJMESA-N 2 1 374.529 2.569 20 70 FFIDMP COC[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1C[NH+]1CCOCC1 ZINC000160468514 508991537 /nfs/dbraw/zinc/99/15/37/508991537.db2.gz RDYJJBMEFRFXKL-JOCHJYFZSA-N 2 1 354.494 2.866 20 70 FFIDMP Cc1ccc(C(=O)CC[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cc1 ZINC000161041532 509063776 /nfs/dbraw/zinc/06/37/76/509063776.db2.gz QVXRVOBSGALQLC-WCRBZPEASA-N 2 1 355.526 2.811 20 70 FFIDMP Cc1ccc(C(=O)CC[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cc1 ZINC000161041532 509063782 /nfs/dbraw/zinc/06/37/82/509063782.db2.gz QVXRVOBSGALQLC-WCRBZPEASA-N 2 1 355.526 2.811 20 70 FFIDMP CC[NH2+]CC1CCN(C(=O)c2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)CC1 ZINC000161066725 509066585 /nfs/dbraw/zinc/06/65/85/509066585.db2.gz SUVXFWCDTJIIET-QZTJIDSGSA-N 2 1 373.541 2.758 20 70 FFIDMP CCC[C@@H]1CCCN(C(=O)[C@@H](N)Cc2cn(Cc3ccccc3)cn2)C1 ZINC000161448747 509116101 /nfs/dbraw/zinc/11/61/01/509116101.db2.gz SYLVOVBSXWLELG-XLIONFOSSA-N 2 1 354.498 2.840 20 70 FFIDMP CC[N@H+]1CCCN(C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)CC1 ZINC000159537718 508854536 /nfs/dbraw/zinc/85/45/36/508854536.db2.gz FGAZFYAAOYLBHG-INIZCTEOSA-N 2 1 350.532 2.622 20 70 FFIDMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000160689305 509019923 /nfs/dbraw/zinc/01/99/23/509019923.db2.gz HOTLVUGSNLIETQ-QFIPXVFZSA-N 2 1 359.558 2.520 20 70 FFIDMP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000160689305 509019929 /nfs/dbraw/zinc/01/99/29/509019929.db2.gz HOTLVUGSNLIETQ-QFIPXVFZSA-N 3 1 359.558 2.520 20 70 FFIDMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000160689305 509019932 /nfs/dbraw/zinc/01/99/32/509019932.db2.gz HOTLVUGSNLIETQ-QFIPXVFZSA-N 3 1 359.558 2.520 20 70 FFIDMP C[NH+](C)CCN(Cc1ccccc1)C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000160805548 509034681 /nfs/dbraw/zinc/03/46/81/509034681.db2.gz GFEWRCHVWOXRHB-IBGZPJMESA-N 2 1 358.530 2.777 20 70 FFIDMP