smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)c1ccc(C[NH2+]Cc2cccc(Cl)c2Cl)cc1 ZINC000019995420 182175323 /nfs/dbraw/zinc/17/53/23/182175323.db2.gz IOYPASQOQFWCGT-UHFFFAOYSA-N 1 0 309.240 4.349 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](CCOC)c2ccco2)cc1 ZINC000272485728 130034606 /nfs/dbraw/zinc/03/46/06/130034606.db2.gz BPXNCJMGIKXYGV-QAPCUYQASA-N 1 0 316.445 4.164 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000273393937 130116085 /nfs/dbraw/zinc/11/60/85/130116085.db2.gz LMDNVFFNTQMFHS-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000273393940 130116240 /nfs/dbraw/zinc/11/62/40/130116240.db2.gz LMDNVFFNTQMFHS-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000273393944 130116318 /nfs/dbraw/zinc/11/63/18/130116318.db2.gz LMDNVFFNTQMFHS-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(OC(C)C)nc2)c(O)c1C ZINC000273444694 130121714 /nfs/dbraw/zinc/12/17/14/130121714.db2.gz ZNXANVAPRNECPL-HNNXBMFYSA-N 1 0 314.429 4.042 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)c(O)c1C ZINC000273485550 130127332 /nfs/dbraw/zinc/12/73/32/130127332.db2.gz NEUQFQHMQCAYCD-UXLLHSPISA-N 1 0 305.462 4.253 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCOC3(CCCCC3)C2)c1 ZINC000273489330 130128193 /nfs/dbraw/zinc/12/81/93/130128193.db2.gz NWXIOGZVJYTUQL-JKSUJKDBSA-N 1 0 303.446 4.233 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(C)c2)c1 ZINC000273493182 130128458 /nfs/dbraw/zinc/12/84/58/130128458.db2.gz OTDDEDGIVOPFCE-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO Cc1csc(C2([NH2+][C@H](C)c3cc(F)ccc3O)CCC2)n1 ZINC000273520464 130132202 /nfs/dbraw/zinc/13/22/02/130132202.db2.gz UBJDYNHRMCQSBC-LLVKDONJSA-N 1 0 306.406 4.026 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2nc3c(cccc3C)o2)c1 ZINC000273573529 130138067 /nfs/dbraw/zinc/13/80/67/130138067.db2.gz LEIXVQYHYJHFSB-CQSZACIVSA-N 1 0 310.397 4.044 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](CCCO)c2ccccc2)c(O)c1C ZINC000273598154 130142483 /nfs/dbraw/zinc/14/24/83/130142483.db2.gz REMBIKQXNKTZEH-QFBILLFUSA-N 1 0 313.441 4.173 20 10 DICDRO C[C@H]([NH2+]CC1(CCO)CCCC1)c1ccc2ccccc2c1O ZINC000273620028 130144926 /nfs/dbraw/zinc/14/49/26/130144926.db2.gz YTEQFEZUUFFZHL-HNNXBMFYSA-N 1 0 313.441 4.139 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000284966661 131127249 /nfs/dbraw/zinc/12/72/49/131127249.db2.gz FQWGCYMFKLQGSI-STQMWFEESA-N 1 0 302.418 4.068 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)c(O)c1 ZINC000285148851 131143110 /nfs/dbraw/zinc/14/31/10/131143110.db2.gz MCKNVQLNZGGAMQ-CJNGLKHVSA-N 1 0 315.388 4.323 20 10 DICDRO Cc1cnc([C@@H](C)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)s1 ZINC000285402810 131165426 /nfs/dbraw/zinc/16/54/26/131165426.db2.gz XIAKWGSIGDYKAP-GXTWGEPZSA-N 1 0 304.459 4.228 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(C)cc1O ZINC000285854644 131206630 /nfs/dbraw/zinc/20/66/30/131206630.db2.gz ZFUWQDOZEBQAKU-IAQYHMDHSA-N 1 0 306.356 4.176 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)c(O)c1 ZINC000286888158 131254429 /nfs/dbraw/zinc/25/44/29/131254429.db2.gz CWFDUMPWBRNQML-HOTGVXAUSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)c1 ZINC000287197471 131268274 /nfs/dbraw/zinc/26/82/74/131268274.db2.gz WCYUZJJNPZURLV-HZPDHXFCSA-N 1 0 321.424 4.298 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cccc(Cl)c1[O-] ZINC000287747137 131298872 /nfs/dbraw/zinc/29/88/72/131298872.db2.gz PZCVUSVLLFEZKV-HZPDHXFCSA-N 1 0 317.816 4.479 20 10 DICDRO Cc1ccoc1C[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC000293642173 131754073 /nfs/dbraw/zinc/75/40/73/131754073.db2.gz KVODMWHXSXBTBF-LLVKDONJSA-N 1 0 324.218 4.215 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)cnc2Cl)c(O)c1C ZINC000297309506 132008400 /nfs/dbraw/zinc/00/84/00/132008400.db2.gz MULYCRAUFYOYEM-NSHDSACASA-N 1 0 308.784 4.047 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)cnc2Cl)c(O)c1C ZINC000297309502 132008802 /nfs/dbraw/zinc/00/88/02/132008802.db2.gz MULYCRAUFYOYEM-LLVKDONJSA-N 1 0 308.784 4.047 20 10 DICDRO COC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(Cl)c1 ZINC000297472018 132016917 /nfs/dbraw/zinc/01/69/17/132016917.db2.gz YRBZUQHCIZTLAF-HZPDHXFCSA-N 1 0 317.816 4.010 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCOc3c(Cl)cccc31)CC2 ZINC000297576315 132023168 /nfs/dbraw/zinc/02/31/68/132023168.db2.gz GXTSIFZFXIHHQO-LSDHHAIUSA-N 1 0 315.800 4.146 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(N2CCCC2)c1 ZINC000297909135 132039707 /nfs/dbraw/zinc/03/97/07/132039707.db2.gz WNWKDLMTOQRLFM-DNVCBOLYSA-N 1 0 322.452 4.331 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1OC(F)F)c1ccccc1O ZINC000120502963 132144041 /nfs/dbraw/zinc/14/40/41/132144041.db2.gz OWDOSZHWDVWXRS-CQSZACIVSA-N 1 0 307.340 4.235 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(OCC(F)F)c1)c1ccccc1O ZINC000156493745 332792712 /nfs/dbraw/zinc/79/27/12/332792712.db2.gz GTKSOUZPZKGQNI-INIZCTEOSA-N 1 0 321.367 4.277 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)c1 ZINC000019999496 333296114 /nfs/dbraw/zinc/29/61/14/333296114.db2.gz VSTSFPMGENVLBU-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO CC(C)OCCCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000186529892 333374333 /nfs/dbraw/zinc/37/43/33/333374333.db2.gz DLTUKLYOYQKUNY-HNNXBMFYSA-N 1 0 301.430 4.401 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1O ZINC000273462729 334047121 /nfs/dbraw/zinc/04/71/21/334047121.db2.gz QSLRXCFTIQDKBP-IYJAJMOOSA-N 1 0 315.388 4.102 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1O ZINC000273462731 334047308 /nfs/dbraw/zinc/04/73/08/334047308.db2.gz QSLRXCFTIQDKBP-URKNILKWSA-N 1 0 315.388 4.102 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(C)cc1O ZINC000297401250 334241203 /nfs/dbraw/zinc/24/12/03/334241203.db2.gz SMQXKRPXMHBULQ-AWEZNQCLSA-N 1 0 308.784 4.129 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000192791325 336261889 /nfs/dbraw/zinc/26/18/89/336261889.db2.gz UGYPITVEXSZTAB-VBKZILBWSA-N 1 0 323.392 4.434 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCSc3ccccc32)c1 ZINC000192834929 336265185 /nfs/dbraw/zinc/26/51/85/336265185.db2.gz KGZOPCJDLYQYOR-WBMJQRKESA-N 1 0 315.438 4.289 20 10 DICDRO CCc1cc(NCc2cccc(OC)c2O)c2ccccc2[nH+]1 ZINC000301994104 336342020 /nfs/dbraw/zinc/34/20/20/336342020.db2.gz ROGCLDKIYMBQLM-UHFFFAOYSA-N 1 0 308.381 4.124 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(-c2cccnc2)cc1)c1cc(F)ccc1O ZINC000371840958 336914371 /nfs/dbraw/zinc/91/43/71/336914371.db2.gz NLRICPSLGDIBMN-AWEZNQCLSA-N 1 0 322.383 4.444 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccc(N(C)C)cc1 ZINC000375345270 337008476 /nfs/dbraw/zinc/00/84/76/337008476.db2.gz MYKFDLUTNVIZFX-SCLBCKFNSA-N 1 0 314.404 4.066 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](c2ccco2)c2ccccc2)cc1C ZINC000174249399 337139980 /nfs/dbraw/zinc/13/99/80/337139980.db2.gz RQLZQHGWDDAHKH-HXUWFJFHSA-N 1 0 307.393 4.481 20 10 DICDRO C[C@@H]([NH2+]C1CCN([C@@H](C)c2ccccc2)CC1)c1ccccc1O ZINC000183516848 337191983 /nfs/dbraw/zinc/19/19/83/337191983.db2.gz NMWBZLASDVNNLP-SJORKVTESA-N 1 0 324.468 4.268 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1ccccc1O ZINC000183716636 337193113 /nfs/dbraw/zinc/19/31/13/337193113.db2.gz VERSURXQKHGBJM-BLLLJJGKSA-N 1 0 301.361 4.096 20 10 DICDRO C[C@@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1ccccc1O ZINC000183634242 337193967 /nfs/dbraw/zinc/19/39/67/337193967.db2.gz LQUGNEGHXWYURB-JLTOFOAXSA-N 1 0 322.383 4.367 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1cc(F)ccc1O ZINC000185153074 337202322 /nfs/dbraw/zinc/20/23/22/337202322.db2.gz NSFBLJUVAJXLFM-XOBRGWDASA-N 1 0 322.383 4.367 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3ccccc3)CC2)cc1 ZINC000129473175 337429630 /nfs/dbraw/zinc/42/96/30/337429630.db2.gz VVIPXCBOBKWDEK-INIZCTEOSA-N 1 0 310.441 4.015 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cc(F)ccc1O ZINC000359974139 337441101 /nfs/dbraw/zinc/44/11/01/337441101.db2.gz NFAZUCYTXCJCGK-JLTOFOAXSA-N 1 0 322.383 4.367 20 10 DICDRO CCc1cccnc1[C@H](C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000479454429 339535770 /nfs/dbraw/zinc/53/57/70/339535770.db2.gz OLIXCKVHGTVMHO-HNNXBMFYSA-N 1 0 307.441 4.295 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1OC(F)F)c1ccccc1O ZINC000272816456 341630513 /nfs/dbraw/zinc/63/05/13/341630513.db2.gz DZZCQYSENHABMJ-VXGBXAGGSA-N 1 0 307.340 4.405 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCSc3ccc(F)cc31)CC2 ZINC000295816683 341715410 /nfs/dbraw/zinc/71/54/10/341715410.db2.gz DANGQBFQZCVEHO-HUUCEWRRSA-N 1 0 315.413 4.345 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc(N(C)C)cc1 ZINC000130448446 522759551 /nfs/dbraw/zinc/75/95/51/522759551.db2.gz UOEWRIBRQXTFDY-OALUTQOASA-N 1 0 310.441 4.186 20 10 DICDRO CC[C@@H]([NH2+]CCc1csc(C(C)C)n1)c1ccccc1O ZINC000155568641 522846110 /nfs/dbraw/zinc/84/61/10/522846110.db2.gz XTAMDMSMBYITGF-OAHLLOKOSA-N 1 0 304.459 4.256 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1-n1cccn1)c1ccccc1O ZINC000156350809 522914928 /nfs/dbraw/zinc/91/49/28/522914928.db2.gz XPHQVQGPEZVBIR-MAUKXSAKSA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1O ZINC000158133196 522926546 /nfs/dbraw/zinc/92/65/46/522926546.db2.gz PMLGLSNOURAFIC-POAQFYNOSA-N 1 0 311.425 4.353 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1O ZINC000156697237 522935248 /nfs/dbraw/zinc/93/52/48/522935248.db2.gz SVEXUPZZNGJBIW-CZUORRHYSA-N 1 0 314.385 4.411 20 10 DICDRO C[C@H](C[N@H+](C)Cc1c(O)ccc2ccccc21)c1nccs1 ZINC000182846458 524296370 /nfs/dbraw/zinc/29/63/70/524296370.db2.gz QFVILXLOIJFPSL-CYBMUJFWSA-N 1 0 312.438 4.237 20 10 DICDRO C[C@@H](CC1CC1)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000157729895 524429376 /nfs/dbraw/zinc/42/93/76/524429376.db2.gz OAOAZOUCMHVCDR-ZDUSSCGKSA-N 1 0 324.415 4.035 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000182414459 524766104 /nfs/dbraw/zinc/76/61/04/524766104.db2.gz KLLAUHXFQIUPBG-LLVKDONJSA-N 1 0 320.458 4.006 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)c1 ZINC000157988108 525363934 /nfs/dbraw/zinc/36/39/34/525363934.db2.gz LIKPQUUYSPJYBF-VPWXQRGCSA-N 1 0 311.425 4.272 20 10 DICDRO COc1cccc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)c1O ZINC000237363108 526012165 /nfs/dbraw/zinc/01/21/65/526012165.db2.gz HRKSUWTYSRNWJM-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000160533078 526679743 /nfs/dbraw/zinc/67/97/43/526679743.db2.gz COOUQDIPIIJSMS-ZDUSSCGKSA-N 1 0 317.502 4.492 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)o1 ZINC000293380546 535510961 /nfs/dbraw/zinc/51/09/61/535510961.db2.gz IGURUWPGCJGDQB-AWEZNQCLSA-N 1 0 315.461 4.242 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1cccc(C)c1 ZINC000286284025 535806018 /nfs/dbraw/zinc/80/60/18/535806018.db2.gz VXABPNFTWDWTJX-OAQYLSRUSA-N 1 0 324.468 4.073 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccc(C)o1 ZINC000273442532 536806878 /nfs/dbraw/zinc/80/68/78/536806878.db2.gz NBSUJYWBZDEFOD-SWLSCSKDSA-N 1 0 323.820 4.375 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccc(C)o1 ZINC000272706386 536809308 /nfs/dbraw/zinc/80/93/08/536809308.db2.gz ZUFKNTJFIHXVEE-CRAIPNDOSA-N 1 0 316.445 4.082 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(C)o1 ZINC000273389616 536810418 /nfs/dbraw/zinc/81/04/18/536810418.db2.gz DHKLZPVZPMQACE-GDBMZVCRSA-N 1 0 303.402 4.030 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cc1F ZINC000285462700 536897103 /nfs/dbraw/zinc/89/71/03/536897103.db2.gz ZYJWAEJBSQPOEC-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)cc1C ZINC000035257821 1035594067 /nfs/dbraw/zinc/59/40/67/1035594067.db2.gz UMXRQROOVHZURM-UONOGXRCSA-N 1 0 301.352 4.214 20 10 DICDRO Cc1noc(C)c1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000153903549 1035600292 /nfs/dbraw/zinc/60/02/92/1035600292.db2.gz QXPXNMLMHZHFHA-AWEZNQCLSA-N 1 0 313.445 4.133 20 10 DICDRO Cc1cc(O)c(CN2CCC[N@@H+](C(C)(C)C)CC2)cc1C(C)C ZINC000748084317 1035897273 /nfs/dbraw/zinc/89/72/73/1035897273.db2.gz ZNYJHQWYGMWCAS-UHFFFAOYSA-N 1 0 318.505 4.130 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(OC)c1O)c1ccc(Cl)cc1 ZINC000036979280 1035914816 /nfs/dbraw/zinc/91/48/16/1035914816.db2.gz YNDJEIIMOUFQGD-OAHLLOKOSA-N 1 0 305.805 4.295 20 10 DICDRO COc1ccc(N2CCC[N@H+](C[C@@H]3CCC[C@H](C)C3)CC2)cc1 ZINC001167107688 1036093190 /nfs/dbraw/zinc/09/31/90/1036093190.db2.gz GRUQKKJSWLZDIS-ZWKOTPCHSA-N 1 0 316.489 4.034 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](CC)Cc1cc(OC)c(C)cc1O ZINC000160282146 1036356662 /nfs/dbraw/zinc/35/66/62/1036356662.db2.gz AUAXFIMKGGSIPA-KRWDZBQOSA-N 1 0 314.429 4.077 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](c3ccc(OC)cc3)C2)cc1 ZINC001167287954 1036443358 /nfs/dbraw/zinc/44/33/58/1036443358.db2.gz WDFYUYLYFPNYQJ-IBGZPJMESA-N 1 0 324.468 4.141 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccc(Cl)s3)ccc21 ZINC000069629720 1036610722 /nfs/dbraw/zinc/61/07/22/1036610722.db2.gz MWRPZFOIRSOABE-UHFFFAOYSA-N 1 0 306.862 4.074 20 10 DICDRO CN(CC[N@H+](Cc1ccccc1O)C1CCCC1)c1ccccc1 ZINC001167353974 1036951445 /nfs/dbraw/zinc/95/14/45/1036951445.db2.gz UMAOSCRUTBKHKF-UHFFFAOYSA-N 1 0 324.468 4.273 20 10 DICDRO Cc1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1ccc(N(C)C)cc1 ZINC000160534620 1037186660 /nfs/dbraw/zinc/18/66/60/1037186660.db2.gz KHBRKXKPDNVMNY-LJQANCHMSA-N 1 0 310.441 4.065 20 10 DICDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)cc1 ZINC000175989480 1037496938 /nfs/dbraw/zinc/49/69/38/1037496938.db2.gz GCJPVEBQVLKAPZ-UHFFFAOYSA-N 1 0 304.384 4.056 20 10 DICDRO CC(C)c1nc(CC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cs1 ZINC000156963226 1037499092 /nfs/dbraw/zinc/49/90/92/1037499092.db2.gz GZDVGMWJRSTLLU-AWEZNQCLSA-N 1 0 317.502 4.226 20 10 DICDRO C[C@@H]1CC[C@H]([NH2+]Cc2c(O)cccc2Br)C[C@@H]1C ZINC000706843721 1037501830 /nfs/dbraw/zinc/50/18/30/1037501830.db2.gz 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ZINC001204585619 1038555839 /nfs/dbraw/zinc/55/58/39/1038555839.db2.gz VCTLEMUGGLKWEM-INIZCTEOSA-N 1 0 315.844 4.419 20 10 DICDRO CC[C@H](c1ccncc1)[N@H+](CC)Cc1cc2c(cc1O)CCC2 ZINC000172613620 1038621019 /nfs/dbraw/zinc/62/10/19/1038621019.db2.gz CLCUCXPBZFSXAZ-LJQANCHMSA-N 1 0 310.441 4.249 20 10 DICDRO Cc1ccc2c(C3=CCN(c4cc(C)nc(C)n4)CC3)c[nH]c2c1 ZINC000339014779 1038676082 /nfs/dbraw/zinc/67/60/82/1038676082.db2.gz WBERCAXPSWEBCY-UHFFFAOYSA-N 1 0 318.424 4.177 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000112536837 1038686212 /nfs/dbraw/zinc/68/62/12/1038686212.db2.gz OGXLDOLMQOIFGF-UTKZUKDTSA-N 1 0 324.468 4.325 20 10 DICDRO COc1ccc(N2C(C)(C)CC([NH3+])CC2(C)C)cc1C(C)C ZINC001167626775 1038980980 /nfs/dbraw/zinc/98/09/80/1038980980.db2.gz STESGUKSIOLKTJ-UHFFFAOYSA-N 1 0 304.478 4.303 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2c(O)ccc3ccccc32)cc1C ZINC000728559790 1039251602 /nfs/dbraw/zinc/25/16/02/1039251602.db2.gz JJVPVWPQIXUWQG-UHFFFAOYSA-N 1 0 321.420 4.494 20 10 DICDRO CC[C@](C)([NH2+]Cc1ccc(OC)c(C)c1)c1nc(C)cs1 ZINC000266172440 1039364502 /nfs/dbraw/zinc/36/45/02/1039364502.db2.gz RUCQVYXILCDVSH-KRWDZBQOSA-N 1 0 304.459 4.184 20 10 DICDRO C[C@H]1C[C@@H]1c1ccc(C[NH2+]CCCSc2nccs2)o1 ZINC000176797306 1039474252 /nfs/dbraw/zinc/47/42/52/1039474252.db2.gz JZLFHMHTYUACJS-AAEUAGOBSA-N 1 0 308.472 4.132 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOC[C@@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000278568630 1039555930 /nfs/dbraw/zinc/55/59/30/1039555930.db2.gz PJTWOPXJVWBSIG-ZWOKBUDYSA-N 1 0 316.489 4.143 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cccc(O)c2)cc1F ZINC000152186863 1039985618 /nfs/dbraw/zinc/98/56/18/1039985618.db2.gz KKVLDNPAHXJHID-AWEZNQCLSA-N 1 0 316.420 4.228 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1Cl ZINC000090468926 1040032897 /nfs/dbraw/zinc/03/28/97/1040032897.db2.gz KRSBDHYXLPIDDM-ZDUSSCGKSA-N 1 0 318.848 4.265 20 10 DICDRO Oc1ccc2ccccc2c1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000173414632 1040887927 /nfs/dbraw/zinc/88/79/27/1040887927.db2.gz YQZQUWYSAVCEGT-UHFFFAOYSA-N 1 0 309.331 4.320 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](CCO)CC(C)C)c1O ZINC000808700286 1041009165 /nfs/dbraw/zinc/00/91/65/1041009165.db2.gz KAAROGOCTDCMMR-ZIAGYGMSSA-N 1 0 313.869 4.049 20 10 DICDRO Cc1ccccc1[C@@H](CO)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808700734 1041011757 /nfs/dbraw/zinc/01/17/57/1041011757.db2.gz PKIIVTMIALSFKJ-SUMWQHHRSA-N 1 0 319.832 4.047 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1ccc(N(C)C)cc1 ZINC000808729199 1041017580 /nfs/dbraw/zinc/01/75/80/1041017580.db2.gz VVQOEWBVNGOVBF-MAODMQOUSA-N 1 0 324.468 4.324 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1cccc(Cl)c1 ZINC000808733584 1041018941 /nfs/dbraw/zinc/01/89/41/1041018941.db2.gz YHIGMABKROYCIB-DYVFJYSZSA-N 1 0 319.832 4.392 20 10 DICDRO CC[C@@H]([NH2+][C@H](COC)c1cccc(Cl)c1)c1ccccc1O ZINC000808733326 1041020398 /nfs/dbraw/zinc/02/03/98/1041020398.db2.gz UUQLCPLIVMSQIB-IAGOWNOFSA-N 1 0 319.832 4.474 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H](C(F)F)C2)ccc1N1CCCCC1 ZINC000828545633 1041074328 /nfs/dbraw/zinc/07/43/28/1041074328.db2.gz ZVLUQLUIXYCYLF-MRXNPFEDSA-N 1 0 308.416 4.072 20 10 DICDRO c1cc([C@H]2CCCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)n[nH]1 ZINC000809693148 1041214587 /nfs/dbraw/zinc/21/45/87/1041214587.db2.gz ORQYEFVVWHAYDT-HXUWFJFHSA-N 1 0 324.472 4.127 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CCC(c3ccncc3)CC2)cc1 ZINC000809730616 1041228135 /nfs/dbraw/zinc/22/81/35/1041228135.db2.gz VOIIXWQBXDMNMH-UHFFFAOYSA-N 1 0 323.484 4.307 20 10 DICDRO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(C)c1O ZINC000809768146 1041235604 /nfs/dbraw/zinc/23/56/04/1041235604.db2.gz DAPVXYHQQRBLKA-OAHLLOKOSA-N 1 0 319.836 4.031 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CCC(c3cccnc3)CC2)cc1 ZINC000809737318 1041237676 /nfs/dbraw/zinc/23/76/76/1041237676.db2.gz FZSQKCJVRQJLLR-UHFFFAOYSA-N 1 0 323.484 4.307 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCC[C@@H]2c2ccc(C)cc2)c1O ZINC000809740256 1041240306 /nfs/dbraw/zinc/24/03/06/1041240306.db2.gz RHWKUYDNGMRHHJ-MSOLQXFVSA-N 1 0 311.425 4.135 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCC[C@H]2c2ccc(C)cc2)c1O ZINC000809740258 1041241534 /nfs/dbraw/zinc/24/15/34/1041241534.db2.gz RHWKUYDNGMRHHJ-ROUUACIJSA-N 1 0 311.425 4.135 20 10 DICDRO C[N@H+](Cc1ccc(O)cc1)Cc1cc(-c2ccccc2)ccc1O ZINC000809753585 1041245809 /nfs/dbraw/zinc/24/58/09/1041245809.db2.gz LVOKHXLUVUGIFV-UHFFFAOYSA-N 1 0 319.404 4.397 20 10 DICDRO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@@H+]1Cc1cccc(C)c1O ZINC000809757965 1041248392 /nfs/dbraw/zinc/24/83/92/1041248392.db2.gz XXRSTQCPDQLLGG-QGZVFWFLSA-N 1 0 313.445 4.158 20 10 DICDRO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@@H+]1Cc1cc(C)ccc1O ZINC000809757314 1041248740 /nfs/dbraw/zinc/24/87/40/1041248740.db2.gz MGDZLCMDQLJGMQ-KRWDZBQOSA-N 1 0 313.445 4.158 20 10 DICDRO COc1cccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1O ZINC000809783148 1041252955 /nfs/dbraw/zinc/25/29/55/1041252955.db2.gz SGWILEYXEPHGIR-INIZCTEOSA-N 1 0 303.427 4.045 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)ccc1OC ZINC000255960680 1041258051 /nfs/dbraw/zinc/25/80/51/1041258051.db2.gz SPUSKLWFTXIYDZ-IIDMSEBBSA-N 1 0 305.462 4.146 20 10 DICDRO c1cc2c(o1)CCC[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000809792858 1041262049 /nfs/dbraw/zinc/26/20/49/1041262049.db2.gz JKRAQKZLSRLQSO-UHFFFAOYSA-N 1 0 310.441 4.218 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3ccc(C)cc3)CC2)cc1 ZINC000165902702 1041310551 /nfs/dbraw/zinc/31/05/51/1041310551.db2.gz LMJHXSZMUSUCMS-KRWDZBQOSA-N 1 0 324.468 4.323 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3ccc(C)cc3)CC2)cc1 ZINC000165902576 1041310692 /nfs/dbraw/zinc/31/06/92/1041310692.db2.gz LMJHXSZMUSUCMS-QGZVFWFLSA-N 1 0 324.468 4.323 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CCCC(F)(F)F)c1cc(F)cc(F)c1[O-] ZINC000756081848 1041329682 /nfs/dbraw/zinc/32/96/82/1041329682.db2.gz YTCKRWDLUQMOHI-DTWKUNHWSA-N 1 0 311.294 4.442 20 10 DICDRO CC[C@H]([NH2+]CCCCCOC)c1ccc(C(F)(F)F)cc1O ZINC000810214727 1041338682 /nfs/dbraw/zinc/33/86/82/1041338682.db2.gz HNRXTKOUAADGHM-AWEZNQCLSA-N 1 0 319.367 4.268 20 10 DICDRO CC[C@@H]([NH2+][C@H](COC)C(C)C)c1ccc(C(F)(F)F)cc1O ZINC000810218520 1041339518 /nfs/dbraw/zinc/33/95/18/1041339518.db2.gz AQZRAHATQTVZCL-ZIAGYGMSSA-N 1 0 319.367 4.123 20 10 DICDRO CC[C@H]([NH2+]CCOC(C)(C)C)c1ccc(C(F)(F)F)cc1O ZINC000810229979 1041343026 /nfs/dbraw/zinc/34/30/26/1041343026.db2.gz AKNDPEYZOHGZSH-ZDUSSCGKSA-N 1 0 319.367 4.267 20 10 DICDRO CC[C@H](C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)OC ZINC000810261065 1041348771 /nfs/dbraw/zinc/34/87/71/1041348771.db2.gz SVQSFIFBRIIMFC-QFBILLFUSA-N 1 0 304.478 4.143 20 10 DICDRO CO[C@@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000810257725 1041349496 /nfs/dbraw/zinc/34/94/96/1041349496.db2.gz UVNVINYQIHGRHP-ZACQAIPSSA-N 1 0 304.478 4.141 20 10 DICDRO CC[C@@H]([NH2+]CCc1cccnc1)c1ccc(C(F)(F)F)cc1O ZINC000810210320 1041349507 /nfs/dbraw/zinc/34/95/07/1041349507.db2.gz RLSURXMKYCNVFF-OAHLLOKOSA-N 1 0 324.346 4.089 20 10 DICDRO CC[C@@H]([NH2+][C@H]1C[C@@H]1C(F)F)c1ccc(C(F)(F)F)cc1O ZINC000810239968 1041353477 /nfs/dbraw/zinc/35/34/77/1041353477.db2.gz LAUVQUHCHBMAKO-AXFHLTTASA-N 1 0 309.278 4.105 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3sccc3c2)c1 ZINC000810242901 1041354994 /nfs/dbraw/zinc/35/49/94/1041354994.db2.gz IYQNWIKNDQMVDD-LBPRGKRZSA-N 1 0 313.422 4.466 20 10 DICDRO C[N@H+](Cc1cscc1C(F)(F)F)Cc1ccccc1O ZINC000811458647 1041519577 /nfs/dbraw/zinc/51/95/77/1041519577.db2.gz ZHOAVQYPFACYTQ-UHFFFAOYSA-N 1 0 301.333 4.105 20 10 DICDRO C[C@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(N2CCCCC2)cc1 ZINC000180258365 1041528153 /nfs/dbraw/zinc/52/81/53/1041528153.db2.gz RIDYYBFNYYIWDU-PXNSSMCTSA-N 1 0 316.489 4.287 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000811518287 1041530181 /nfs/dbraw/zinc/53/01/81/1041530181.db2.gz JAEFZVKYNHDBOI-PMACEKPBSA-N 1 0 323.436 4.079 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000811518290 1041530696 /nfs/dbraw/zinc/53/06/96/1041530696.db2.gz JAEFZVKYNHDBOI-WOJBJXKFSA-N 1 0 323.436 4.079 20 10 DICDRO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1cccc(C)c1O)CCC2 ZINC000180544528 1041533988 /nfs/dbraw/zinc/53/39/88/1041533988.db2.gz TZKGDOBQNMYXIA-OAHLLOKOSA-N 1 0 316.470 4.229 20 10 DICDRO C[C@@H]([NH2+]CCCCOc1ccc(F)cc1)c1ccccc1O ZINC000183411544 1041581867 /nfs/dbraw/zinc/58/18/67/1041581867.db2.gz DUUIDPWPTFATBM-CQSZACIVSA-N 1 0 303.377 4.041 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)CCC2 ZINC000363868991 1041587181 /nfs/dbraw/zinc/58/71/81/1041587181.db2.gz PPYBZEJSDGMHTB-FZMZJTMJSA-N 1 0 302.443 4.194 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1cc(Cl)ccc1O ZINC000363885534 1041589981 /nfs/dbraw/zinc/58/99/81/1041589981.db2.gz IJVMATBBFZJJPF-MEBBXXQBSA-N 1 0 321.779 4.359 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2ccccc2n1)c1cc(Cl)ccc1O ZINC000756455410 1041592137 /nfs/dbraw/zinc/59/21/37/1041592137.db2.gz JXBCRBIYLLQFDF-GFCCVEGCSA-N 1 0 312.800 4.445 20 10 DICDRO CCCCOc1ncccc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185143576 1041607404 /nfs/dbraw/zinc/60/74/04/1041607404.db2.gz WYZMAXGVKBQFGD-OAHLLOKOSA-N 1 0 314.429 4.125 20 10 DICDRO C[C@H]([NH2+]Cc1cc2c(s1)CCCC2)c1ccc(F)cc1[O-] ZINC000756484576 1041608904 /nfs/dbraw/zinc/60/89/04/1041608904.db2.gz YWXWEBQXDLVLAC-NSHDSACASA-N 1 0 305.418 4.322 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)c(O)c1 ZINC000185289245 1041611103 /nfs/dbraw/zinc/61/11/03/1041611103.db2.gz LASKVNRDXRKQQN-DOTOQJQBSA-N 1 0 317.429 4.358 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCCCC(=O)OC(C)(C)C)c(O)c1 ZINC000185597444 1041618235 /nfs/dbraw/zinc/61/82/35/1041618235.db2.gz UYQWNUNXTFCVAR-HNNXBMFYSA-N 1 0 321.461 4.253 20 10 DICDRO CCO[C@@H](CC[NH2+][C@H](C)c1cc(OC)ccc1O)C1CCCC1 ZINC000185635009 1041619436 /nfs/dbraw/zinc/61/94/36/1041619436.db2.gz GFCKZFPVDYTUBQ-KUHUBIRLSA-N 1 0 321.461 4.037 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1cc(Cl)ccc1O ZINC000186009115 1041623941 /nfs/dbraw/zinc/62/39/41/1041623941.db2.gz LXEVBYWFHJVBPL-ZUZCIYMTSA-N 1 0 321.779 4.359 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2sccc2OC)cc1 ZINC000186115299 1041625257 /nfs/dbraw/zinc/62/52/57/1041625257.db2.gz SXUVHACKNHIJRG-CQSZACIVSA-N 1 0 318.486 4.454 20 10 DICDRO Cc1cccc(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)c1O ZINC000812781505 1041646688 /nfs/dbraw/zinc/64/66/88/1041646688.db2.gz WZUXPRIOZQJARG-KGLIPLIRSA-N 1 0 301.352 4.254 20 10 DICDRO COc1cccc(C[NH2+]Cc2ccc(C3CCCC3)cc2)c1O ZINC000812766689 1041648587 /nfs/dbraw/zinc/64/85/87/1041648587.db2.gz MKHVKLSECDAMBI-UHFFFAOYSA-N 1 0 311.425 4.348 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)cc1 ZINC000812841630 1041655189 /nfs/dbraw/zinc/65/51/89/1041655189.db2.gz GBKBKHLOAISYQW-SOLBZPMBSA-N 1 0 316.489 4.078 20 10 DICDRO COc1ccc(N2CCC([NH2+]Cc3c(C)cccc3C)CC2)cc1 ZINC000812838613 1041655473 /nfs/dbraw/zinc/65/54/73/1041655473.db2.gz XRSLSTGKXWFWLQ-UHFFFAOYSA-N 1 0 324.468 4.071 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)cc1C(C)C ZINC000747833020 1041669423 /nfs/dbraw/zinc/66/94/23/1041669423.db2.gz SPVMQMUTONTGQO-IAGOWNOFSA-N 1 0 317.473 4.073 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)cc1C(C)C ZINC000747833018 1041669575 /nfs/dbraw/zinc/66/95/75/1041669575.db2.gz SPVMQMUTONTGQO-DLBZAZTESA-N 1 0 317.473 4.073 20 10 DICDRO C[C@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1ccc(F)cc1[O-] ZINC000756536464 1041695123 /nfs/dbraw/zinc/69/51/23/1041695123.db2.gz VZHYFDLJULKHHL-INIZCTEOSA-N 1 0 322.468 4.228 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3nc(C)ccc3c2)c1 ZINC000813331483 1041698597 /nfs/dbraw/zinc/69/85/97/1041698597.db2.gz PNPYNIGEMHVTDJ-AWEZNQCLSA-N 1 0 322.408 4.108 20 10 DICDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000189374138 1041702337 /nfs/dbraw/zinc/70/23/37/1041702337.db2.gz KFIGSVBOSOYPED-DNVCBOLYSA-N 1 0 310.441 4.235 20 10 DICDRO C[C@@H]([NH2+]CC1CC(F)(F)C1)c1ccc(N2CCCCC2)cc1 ZINC000813872364 1041739854 /nfs/dbraw/zinc/73/98/54/1041739854.db2.gz DHPRRLAQEGNCHR-CQSZACIVSA-N 1 0 308.416 4.373 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)c1cc(F)ccc1O ZINC000813872999 1041740615 /nfs/dbraw/zinc/74/06/15/1041740615.db2.gz MVGUDXAXTXLQGO-VXGBXAGGSA-N 1 0 301.352 4.398 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)COC)c1ccc(C(F)(F)F)cc1O ZINC000813882757 1041742596 /nfs/dbraw/zinc/74/25/96/1041742596.db2.gz JNZZOPJUTWVDNF-ZDUSSCGKSA-N 1 0 319.367 4.124 20 10 DICDRO CCc1nc(C)c(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000813887346 1041742648 /nfs/dbraw/zinc/74/26/48/1041742648.db2.gz GRTMOFGAHNJSLM-JTQLQIEISA-N 1 0 308.809 4.064 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)c1ccccc1O ZINC000364356980 1041761968 /nfs/dbraw/zinc/76/19/68/1041761968.db2.gz CEWDTPIWUCZVGZ-QRFRQXIXSA-N 1 0 311.425 4.211 20 10 DICDRO CC1(C)CN(Cc2cc(Cl)ccc2O)[C@@H]1c1cccnc1 ZINC000814171679 1041777779 /nfs/dbraw/zinc/77/77/79/1041777779.db2.gz UHZJZZLEOOPRDN-MRXNPFEDSA-N 1 0 302.805 4.024 20 10 DICDRO Cc1ccoc1C[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000814173343 1041778523 /nfs/dbraw/zinc/77/85/23/1041778523.db2.gz NOQMJQZTCVFHDV-UHFFFAOYSA-N 1 0 323.392 4.162 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCCc2sc(Cl)cc21 ZINC000814175173 1041779150 /nfs/dbraw/zinc/77/91/50/1041779150.db2.gz QJPWHEHUULJYKY-LBPRGKRZSA-N 1 0 311.809 4.413 20 10 DICDRO C=Cn1cc(C[NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)cn1 ZINC000194271301 1041785898 /nfs/dbraw/zinc/78/58/98/1041785898.db2.gz CBQJBLMUWYJKSZ-UHFFFAOYSA-N 1 0 324.472 4.042 20 10 DICDRO CC1(C)C[N@H+](Cc2cc3c(cc2O)CCCC3)[C@H]1c1ccncc1 ZINC000814227044 1041794746 /nfs/dbraw/zinc/79/47/46/1041794746.db2.gz AMNWIVDCNQTQJG-FQEVSTJZSA-N 1 0 322.452 4.249 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2OC)c1 ZINC000319628216 1041811495 /nfs/dbraw/zinc/81/14/95/1041811495.db2.gz BKYGZEJXOJJDGT-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO CCO[C@@H](CC[NH2+][C@@H](C)c1cc(C)ccc1O)C1CCCC1 ZINC000756634677 1041819851 /nfs/dbraw/zinc/81/98/51/1041819851.db2.gz CCYSBTHTRPVMAK-KXBFYZLASA-N 1 0 305.462 4.337 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCc4ccccc4C3)c2c1 ZINC000003554802 1041836391 /nfs/dbraw/zinc/83/63/91/1041836391.db2.gz QPOGZUMQOUVWON-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO Cc1cc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccnc2)ccc1N(C)C ZINC000815092928 1041909494 /nfs/dbraw/zinc/90/94/94/1041909494.db2.gz VXLAODYMHVMGBT-YWZLYKJASA-N 1 0 309.457 4.039 20 10 DICDRO Cc1cc(C[NH2+]C(C)(C)c2cccc(F)c2)ccc1N(C)C ZINC000815083318 1041912608 /nfs/dbraw/zinc/91/26/08/1041912608.db2.gz MJQUJQKFISERDK-UHFFFAOYSA-N 1 0 300.421 4.225 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(O)c2Cl)cc1 ZINC000815115979 1041914756 /nfs/dbraw/zinc/91/47/56/1041914756.db2.gz UOHJQJSXDTUZJZ-UHFFFAOYSA-N 1 0 318.848 4.182 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cc1 ZINC000815092156 1041917859 /nfs/dbraw/zinc/91/78/59/1041917859.db2.gz AYNOEBDHPJSYOM-OXJNMPFZSA-N 1 0 309.457 4.121 20 10 DICDRO CC(F)(F)c1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000815141833 1041924746 /nfs/dbraw/zinc/92/47/46/1041924746.db2.gz ISWADYDONLEHNR-UHFFFAOYSA-N 1 0 311.759 4.447 20 10 DICDRO COc1ccc(N2CCC([NH2+]C3CC(C(C)(C)C)C3)CC2)cc1 ZINC000815147835 1041926802 /nfs/dbraw/zinc/92/68/02/1041926802.db2.gz XFVVQEYPMORBHD-UHFFFAOYSA-N 1 0 316.489 4.078 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCOC2CCCCC2)c(O)c1 ZINC000815555444 1041961805 /nfs/dbraw/zinc/96/18/05/1041961805.db2.gz ZQRNORBDHTUVEL-MRXNPFEDSA-N 1 0 305.462 4.399 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](c2ccsc2)N(C)C)c(O)c1 ZINC000815556142 1041962567 /nfs/dbraw/zinc/96/25/67/1041962567.db2.gz OPUAXZUWQHNMSQ-HOCLYGCPSA-N 1 0 318.486 4.024 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccc(F)cc1C ZINC000815580906 1041965504 /nfs/dbraw/zinc/96/55/04/1041965504.db2.gz SWQMAGZHHUNEOU-HNNXBMFYSA-N 1 0 300.421 4.359 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccc(F)cc2F)c(O)c1 ZINC000815579967 1041965589 /nfs/dbraw/zinc/96/55/89/1041965589.db2.gz ZQSXIFVMBSAPLN-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cn1 ZINC000815578737 1041965643 /nfs/dbraw/zinc/96/56/43/1041965643.db2.gz VAUAZPHOZSXTLP-OAHLLOKOSA-N 1 0 314.429 4.044 20 10 DICDRO Cn1ccc(C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)c1 ZINC000815586061 1041968062 /nfs/dbraw/zinc/96/80/62/1041968062.db2.gz YHQKFALEAXKROF-HXUWFJFHSA-N 1 0 320.436 4.194 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2nc3c(cccc3C)o2)c(O)c1 ZINC000815585906 1041968327 /nfs/dbraw/zinc/96/83/27/1041968327.db2.gz VLYAGACQETXCTP-HNNXBMFYSA-N 1 0 324.424 4.352 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCCCF ZINC000815627575 1041977465 /nfs/dbraw/zinc/97/74/65/1041977465.db2.gz DJTCJDGEYDAKIV-GOSISDBHSA-N 1 0 301.405 4.405 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+][C@H]1C[C@@H]1C(F)F ZINC000815626081 1041977482 /nfs/dbraw/zinc/97/74/82/1041977482.db2.gz VFDBYYXOAPTHRL-ULQDDVLXSA-N 1 0 317.379 4.309 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c1 ZINC000815632313 1041978663 /nfs/dbraw/zinc/97/86/63/1041978663.db2.gz JVBPVNIQOFTEQK-NOLJZWGESA-N 1 0 315.388 4.137 20 10 DICDRO C[C@H](F)CC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815645362 1041983329 /nfs/dbraw/zinc/98/33/29/1041983329.db2.gz CQSVWCQGAHGVBD-YJBOKZPZSA-N 1 0 301.405 4.404 20 10 DICDRO C[N@H+](Cc1ccc2ccccc2c1O)Cc1ccccc1[N+](=O)[O-] ZINC000816487383 1042057751 /nfs/dbraw/zinc/05/77/51/1042057751.db2.gz LIBBTTBQSLXLGR-UHFFFAOYSA-N 1 0 322.364 4.086 20 10 DICDRO C[N@H+](CCOCc1ccccc1)Cc1ccc2ccccc2c1O ZINC000816520217 1042060663 /nfs/dbraw/zinc/06/06/63/1042060663.db2.gz ITZKJIGURHOLOM-UHFFFAOYSA-N 1 0 321.420 4.194 20 10 DICDRO CCCO[C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000816508825 1042061592 /nfs/dbraw/zinc/06/15/92/1042061592.db2.gz WADYTYOLTHMQEF-GOSISDBHSA-N 1 0 313.441 4.327 20 10 DICDRO COc1cc(C[NH2+]Cc2ccc3ccccc3c2O)ccc1C ZINC000816541650 1042063001 /nfs/dbraw/zinc/06/30/01/1042063001.db2.gz REDZGCKDIICPTK-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO CCCOc1ncccc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816543307 1042063562 /nfs/dbraw/zinc/06/35/62/1042063562.db2.gz WBRQINRLCQZQIL-UHFFFAOYSA-N 1 0 322.408 4.019 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc3ccccc3c2O)cc1F ZINC000816543743 1042063772 /nfs/dbraw/zinc/06/37/72/1042063772.db2.gz MPYVSHLZCWYTMO-UHFFFAOYSA-N 1 0 324.399 4.040 20 10 DICDRO CS[C@@H]1CCC[C@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816549955 1042064556 /nfs/dbraw/zinc/06/45/56/1042064556.db2.gz DBVBYKOMCYRIFO-JKSUJKDBSA-N 1 0 301.455 4.309 20 10 DICDRO COCCC1(C[NH2+]Cc2ccc3ccccc3c2O)CCCC1 ZINC000816556557 1042067301 /nfs/dbraw/zinc/06/73/01/1042067301.db2.gz MOECVPWETUHANH-UHFFFAOYSA-N 1 0 313.441 4.232 20 10 DICDRO OCCC[C@@H]([NH2+]Cc1ccc2ccccc2c1O)c1ccccc1 ZINC000816552160 1042067848 /nfs/dbraw/zinc/06/78/48/1042067848.db2.gz CMKHMPWWGLYJJY-HXUWFJFHSA-N 1 0 321.420 4.149 20 10 DICDRO Oc1c(C[NH2+]Cc2nc(C3CC3)cs2)ccc2ccccc21 ZINC000816558189 1042067989 /nfs/dbraw/zinc/06/79/89/1042067989.db2.gz PXVUSDBXNXBZKM-UHFFFAOYSA-N 1 0 310.422 4.169 20 10 DICDRO C[C@H](C[C@@H](O)c1ccccc1)[NH2+]Cc1ccc2ccccc2c1O ZINC000816559171 1042068022 /nfs/dbraw/zinc/06/80/22/1042068022.db2.gz ALAWLMFLVDSMPU-FOIQADDNSA-N 1 0 321.420 4.147 20 10 DICDRO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816559627 1042069051 /nfs/dbraw/zinc/06/90/51/1042069051.db2.gz PSHSQNGKIKDQLM-SJLPKXTDSA-N 1 0 313.441 4.229 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000816630851 1042070278 /nfs/dbraw/zinc/07/02/78/1042070278.db2.gz UWHHIHLGEKRCGW-IBGZPJMESA-N 1 0 309.409 4.128 20 10 DICDRO COCC(C)(C)CCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816612489 1042072775 /nfs/dbraw/zinc/07/27/75/1042072775.db2.gz QHKBPXZDOGVXFD-UHFFFAOYSA-N 1 0 301.430 4.088 20 10 DICDRO CSC[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816616993 1042073852 /nfs/dbraw/zinc/07/38/52/1042073852.db2.gz LNDIQBLCPMPRTR-AWEZNQCLSA-N 1 0 301.455 4.120 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]CCc1cc2ccccc2s1 ZINC000816643243 1042074782 /nfs/dbraw/zinc/07/47/82/1042074782.db2.gz YWBZPZQTHPNFGH-UHFFFAOYSA-N 1 0 301.386 4.078 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c1 ZINC000816630689 1042077469 /nfs/dbraw/zinc/07/74/69/1042077469.db2.gz ODPUVYVBKDXLCF-IBGZPJMESA-N 1 0 309.409 4.128 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cc1C ZINC000817365615 1042106455 /nfs/dbraw/zinc/10/64/55/1042106455.db2.gz QXMOIIRSOOGCKH-CYBMUJFWSA-N 1 0 301.352 4.173 20 10 DICDRO C[C@@H]([NH2+]CCCC1(O)CCC1)c1ccc(N2CCCCC2)cc1 ZINC000817587198 1042118601 /nfs/dbraw/zinc/11/86/01/1042118601.db2.gz VYLIVKHOMIOGCN-QGZVFWFLSA-N 1 0 316.489 4.023 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC23CCSCC3)c(O)c1C ZINC000817589942 1042119324 /nfs/dbraw/zinc/11/93/24/1042119324.db2.gz RIYCLYRFULWSCV-GJZGRUSLSA-N 1 0 305.487 4.193 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)nc(C)c1)c1cc(Cl)ccc1O ZINC000817589896 1042119620 /nfs/dbraw/zinc/11/96/20/1042119620.db2.gz RCMFVCIAGACAET-INIZCTEOSA-N 1 0 304.821 4.298 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CC12CCSCC2)c1ccc(C)cc1O ZINC000817588794 1042119638 /nfs/dbraw/zinc/11/96/38/1042119638.db2.gz KGKBUFCFOWKLKE-GOEBONIOSA-N 1 0 305.487 4.275 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC23CCSCC3)c(O)c1C ZINC000817589943 1042119774 /nfs/dbraw/zinc/11/97/74/1042119774.db2.gz RIYCLYRFULWSCV-HUUCEWRRSA-N 1 0 305.487 4.193 20 10 DICDRO CC[C@H]([NH2+]C1CCC([NH3+])CC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000817948126 1042130645 /nfs/dbraw/zinc/13/06/45/1042130645.db2.gz WIXKDUVRZUANFG-MGULZYLOSA-N 1 0 317.260 4.010 20 10 DICDRO CC(C)c1ccc([C@@H](N)C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000817954210 1042131291 /nfs/dbraw/zinc/13/12/91/1042131291.db2.gz WBYVMHOFUKMMJE-ACJLOTCBSA-N 1 0 316.420 4.005 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(N2CCCCC2)cc1 ZINC000817956002 1042131548 /nfs/dbraw/zinc/13/15/48/1042131548.db2.gz NHFSQRLZAGOINB-KRWDZBQOSA-N 1 0 323.484 4.152 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000817956728 1042131725 /nfs/dbraw/zinc/13/17/25/1042131725.db2.gz BFYZMTFXGGUGGX-LPHOPBHVSA-N 1 0 314.860 4.391 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](N)c2ccc(C(C)C)cc2)c(O)c1 ZINC000817954143 1042131770 /nfs/dbraw/zinc/13/17/70/1042131770.db2.gz VIEOPGSSGPYGHQ-KXBFYZLASA-N 1 0 312.457 4.175 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1cccc(Cl)c1[O-] ZINC000817963108 1042132916 /nfs/dbraw/zinc/13/29/16/1042132916.db2.gz NKXJSGJSNUHZFR-PXAZEXFGSA-N 1 0 318.848 4.306 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000817957162 1042132968 /nfs/dbraw/zinc/13/29/68/1042132968.db2.gz JRGGIRUBBACSHA-VQIMIIECSA-N 1 0 314.860 4.391 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccc(N(C)C)cc1 ZINC000817978065 1042136296 /nfs/dbraw/zinc/13/62/96/1042136296.db2.gz UZDSWTRHZJTUBQ-FQEVSTJZSA-N 1 0 323.484 4.352 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@@H]2CCCc3ccccc32)c1O ZINC000818259694 1042144703 /nfs/dbraw/zinc/14/47/03/1042144703.db2.gz JOYUWLBBPWRBDT-GOSISDBHSA-N 1 0 311.425 4.219 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3ccc(O)cc3)CC2)cc1C ZINC000818263530 1042144836 /nfs/dbraw/zinc/14/48/36/1042144836.db2.gz CSOINVDURUZZDO-UHFFFAOYSA-N 1 0 311.425 4.094 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(Cl)c2C1)c1ccccc1O ZINC001170901226 1042148767 /nfs/dbraw/zinc/14/87/67/1042148767.db2.gz CDPRSNDJKAUPPM-TZMCWYRMSA-N 1 0 301.817 4.254 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H]2CCc3cccc(Cl)c3C2)c(O)c1 ZINC001170906429 1042156836 /nfs/dbraw/zinc/15/68/36/1042156836.db2.gz FYOHTLMZLLNFFK-HNNXBMFYSA-N 1 0 315.844 4.310 20 10 DICDRO Fc1cccc2c1C[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CC2 ZINC001170948145 1042218632 /nfs/dbraw/zinc/21/86/32/1042218632.db2.gz DIAAYMORWKUAFP-GOSISDBHSA-N 1 0 324.443 4.073 20 10 DICDRO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1cccc(C)c1O ZINC000822502990 1042290192 /nfs/dbraw/zinc/29/01/92/1042290192.db2.gz BZWITFHIAYLKSA-UHFFFAOYSA-N 1 0 319.832 4.388 20 10 DICDRO c1ccc(CCC[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000319960976 1042299493 /nfs/dbraw/zinc/29/94/93/1042299493.db2.gz IRXBXPIUXJWIQK-UHFFFAOYSA-N 1 0 308.469 4.399 20 10 DICDRO Cc1cnccc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000823371531 1042322160 /nfs/dbraw/zinc/32/21/60/1042322160.db2.gz CLTJILFZTVOJAL-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1nc(C(F)(F)F)cs1 ZINC000279599316 1042324393 /nfs/dbraw/zinc/32/43/93/1042324393.db2.gz WBHGBGXGUIERAQ-DTWKUNHWSA-N 1 0 316.348 4.279 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1Br)c1cc(F)ccc1O ZINC000094617854 1042324896 /nfs/dbraw/zinc/32/48/96/1042324896.db2.gz JHNOFSREJUOFQU-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H]2CCc3c(Cl)cccc3C2)c(O)c1 ZINC001171022251 1042336637 /nfs/dbraw/zinc/33/66/37/1042336637.db2.gz LIGJOINVHHVDCN-HNNXBMFYSA-N 1 0 315.844 4.310 20 10 DICDRO COc1ccc(N2CCC[N@H+](Cc3cc(C)cc(C)c3)CC2)cc1 ZINC000108096384 1042353035 /nfs/dbraw/zinc/35/30/35/1042353035.db2.gz IJBWAKPVRLBVAP-UHFFFAOYSA-N 1 0 324.468 4.024 20 10 DICDRO CC[NH+](CC)Cc1cccc(NCc2ccc(N(C)C)cc2)c1 ZINC000236931754 1042414204 /nfs/dbraw/zinc/41/42/04/1042414204.db2.gz PLPAVCQXHZTISL-UHFFFAOYSA-N 1 0 311.473 4.207 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(F)c2F)cc1F ZINC000236928569 1042414287 /nfs/dbraw/zinc/41/42/87/1042414287.db2.gz VIOMYLYBMFPYAG-UHFFFAOYSA-N 1 0 322.374 4.240 20 10 DICDRO CC[C@@H]1CCC[C@H]([NH2+]C2CCN(c3ccc(OC)cc3)CC2)C1 ZINC000236967502 1042439045 /nfs/dbraw/zinc/43/90/45/1042439045.db2.gz GULRZCPFEFDLEP-AEFFLSMTSA-N 1 0 316.489 4.222 20 10 DICDRO CCc1ccc([C@@H]([NH2+]Cc2cc(OC)ccc2O)C(C)C)cc1 ZINC000236967758 1042439091 /nfs/dbraw/zinc/43/90/91/1042439091.db2.gz YYONQGGXSLJHNR-FQEVSTJZSA-N 1 0 313.441 4.450 20 10 DICDRO CCOc1ccccc1[C@H](CC)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000237000175 1042451944 /nfs/dbraw/zinc/45/19/44/1042451944.db2.gz CHAPORMHRTYJBZ-IBGZPJMESA-N 1 0 312.457 4.392 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)c1O ZINC000894146797 1042472547 /nfs/dbraw/zinc/47/25/47/1042472547.db2.gz XEPRVKCYAZNHTH-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](c2cccs2)C2CC2)c1O ZINC000894161215 1042476848 /nfs/dbraw/zinc/47/68/48/1042476848.db2.gz REZRZEWGRFPDCP-MRXNPFEDSA-N 1 0 303.427 4.012 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000237091128 1042523179 /nfs/dbraw/zinc/52/31/79/1042523179.db2.gz SFPRJBXUJJBJRQ-UHFFFAOYSA-N 1 0 322.374 4.370 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)cc(OC)c1)c1ccc(C)cc1O ZINC000280011084 1042560985 /nfs/dbraw/zinc/56/09/85/1042560985.db2.gz GRUJPFRKHCMKCD-QGZVFWFLSA-N 1 0 303.377 4.089 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccc(C)cc1O ZINC000280142384 1042565083 /nfs/dbraw/zinc/56/50/83/1042565083.db2.gz PSVJIEKWUBYYPJ-GOSISDBHSA-N 1 0 310.441 4.215 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2OC)c1 ZINC000319628222 1042578960 /nfs/dbraw/zinc/57/89/60/1042578960.db2.gz BKYGZEJXOJJDGT-ZIAGYGMSSA-N 1 0 315.413 4.130 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2OC)c1 ZINC000319628218 1042579034 /nfs/dbraw/zinc/57/90/34/1042579034.db2.gz BKYGZEJXOJJDGT-KGLIPLIRSA-N 1 0 315.413 4.130 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(N(C)C)cc1 ZINC000271847860 1042670044 /nfs/dbraw/zinc/67/00/44/1042670044.db2.gz WYQLNCNGORWSEP-KBPBESRZSA-N 1 0 313.401 4.073 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2cc(OC)ccc2O)cc1 ZINC000319705775 1042681224 /nfs/dbraw/zinc/68/12/24/1042681224.db2.gz NHFQYYUSRTVYRA-UONOGXRCSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2c(C)oc3ccccc32)c1O ZINC000894475409 1042961621 /nfs/dbraw/zinc/96/16/21/1042961621.db2.gz NOPYSOFIACJWNF-UHFFFAOYSA-N 1 0 311.381 4.054 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CCc1ccc(O)cc1)c1ccc(C)cc1O ZINC000794805420 1043049989 /nfs/dbraw/zinc/04/99/89/1043049989.db2.gz GNGYKDIZRUYKBF-DNVCBOLYSA-N 1 0 313.441 4.468 20 10 DICDRO CC[C@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccc(C)cc1O ZINC000794803164 1043050483 /nfs/dbraw/zinc/05/04/83/1043050483.db2.gz QSGBRGLOTQDAFA-HNNXBMFYSA-N 1 0 309.413 4.126 20 10 DICDRO CC[C@H]([NH2+]CCOc1ccc(F)c(F)c1)c1ccc(C)cc1O ZINC000794810099 1043055807 /nfs/dbraw/zinc/05/58/07/1043055807.db2.gz IYSKLSVYWBMRDF-KRWDZBQOSA-N 1 0 321.367 4.099 20 10 DICDRO CC[C@H]([NH2+]CCc1nc(C)c(C)s1)c1ccc(C)cc1O ZINC000794812680 1043059189 /nfs/dbraw/zinc/05/91/89/1043059189.db2.gz YQQBFOMNOLBLEH-HNNXBMFYSA-N 1 0 304.459 4.057 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](CC(C)C)C1)c1ccc(C)cc1O ZINC000794813893 1043059227 /nfs/dbraw/zinc/05/92/27/1043059227.db2.gz QLLCUAOLIMBBBW-NUJGCVRESA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1COc2c1ccc(C)c2C)c1ccc(C)cc1O ZINC000794812318 1043060277 /nfs/dbraw/zinc/06/02/77/1043060277.db2.gz VUIQMXIUEFXQFT-QZTJIDSGSA-N 1 0 311.425 4.492 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccc(C)cc1O ZINC000794812423 1043061136 /nfs/dbraw/zinc/06/11/36/1043061136.db2.gz WQOYGJQWJDQEPK-QUCCMNQESA-N 1 0 311.425 4.055 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1ccc(C)cc1O ZINC000794817089 1043062315 /nfs/dbraw/zinc/06/23/15/1043062315.db2.gz OVPNXYCDRRMGKP-QILLFSRXSA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@H]([NH2+]CCSCC(F)(F)F)c1ccc(C)cc1O ZINC000794817232 1043062325 /nfs/dbraw/zinc/06/23/25/1043062325.db2.gz NYTUKLANLCIKGE-LBPRGKRZSA-N 1 0 307.381 4.037 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCO)C1CCCCC1)c1ccc(C)cc1O ZINC000794811630 1043062491 /nfs/dbraw/zinc/06/24/91/1043062491.db2.gz SQHKKFSJIPPBQI-ROUUACIJSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C)cc1O ZINC000794818499 1043062859 /nfs/dbraw/zinc/06/28/59/1043062859.db2.gz SYIYJQJSBBDJIX-CZUORRHYSA-N 1 0 314.385 4.411 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCO[C@H]1C(C)C)c1ccc(C)cc1O ZINC000794820236 1043064174 /nfs/dbraw/zinc/06/41/74/1043064174.db2.gz ZKZOCGUKDNVRBG-AYBZRNKSSA-N 1 0 305.462 4.193 20 10 DICDRO CC[C@H]([NH2+]CCc1cccc(C)n1)c1cc(Cl)ccc1O ZINC000794826789 1043065979 /nfs/dbraw/zinc/06/59/79/1043065979.db2.gz DUFQJXSYWDXICV-INIZCTEOSA-N 1 0 304.821 4.032 20 10 DICDRO COCCC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccccc1O ZINC000794827501 1043066411 /nfs/dbraw/zinc/06/64/11/1043066411.db2.gz ZJYXGSWWWLUKGV-WMZOPIPTSA-N 1 0 313.441 4.081 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2cccc3ccccc32)c1 ZINC000120520896 1043092625 /nfs/dbraw/zinc/09/26/25/1043092625.db2.gz QMBJFCOOSWNTPI-AWEZNQCLSA-N 1 0 307.393 4.405 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C(F)F)nc2)cc1 ZINC000865419004 1043096185 /nfs/dbraw/zinc/09/61/85/1043096185.db2.gz RSXRUWQDWPKVGL-UHFFFAOYSA-N 1 0 319.399 4.155 20 10 DICDRO C[C@H]([NH2+]Cc1cccnc1F)c1ccc(N2CCCCC2)cc1 ZINC000794837017 1043097443 /nfs/dbraw/zinc/09/74/43/1043097443.db2.gz TXRYGFXNHVKROX-HNNXBMFYSA-N 1 0 313.420 4.062 20 10 DICDRO FC(F)(F)Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000865440307 1043097663 /nfs/dbraw/zinc/09/76/63/1043097663.db2.gz HLOWUSSDYWGDFJ-UHFFFAOYSA-N 1 0 321.342 4.016 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](CC(C)C)C1)c1ccc(N(C)C)cc1 ZINC000777311019 1043097540 /nfs/dbraw/zinc/09/75/40/1043097540.db2.gz ZEAWMHMNGPOQQT-IHPCNDPISA-N 1 0 318.505 4.387 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)cc1 ZINC000178545690 1043132747 /nfs/dbraw/zinc/13/27/47/1043132747.db2.gz PLPNCVDTUVBTRE-JKSUJKDBSA-N 1 0 312.457 4.047 20 10 DICDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cc2cnccc2o1 ZINC000865854563 1043141482 /nfs/dbraw/zinc/14/14/82/1043141482.db2.gz QEMZNOZTBAXGQW-XVWMLYKFSA-N 1 0 321.424 4.258 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(OC)c(F)c2)cc1C ZINC000237170070 1043146317 /nfs/dbraw/zinc/14/63/17/1043146317.db2.gz KJOMYQFKEVWIDX-CYBMUJFWSA-N 1 0 303.377 4.002 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOCC1)c1ccc(N2CCCCCC2)cc1 ZINC000183339141 1043160924 /nfs/dbraw/zinc/16/09/24/1043160924.db2.gz DHDDVMKXABJCLR-IEBWSBKVSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(OC(F)(F)F)cc1)c1ccccc1O ZINC000183393825 1043162438 /nfs/dbraw/zinc/16/24/38/1043162438.db2.gz LCONYPIMBCCPPD-NSHDSACASA-N 1 0 311.303 4.142 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(OC(F)(F)F)cc1)c1ccccc1O ZINC000183393843 1043162870 /nfs/dbraw/zinc/16/28/70/1043162870.db2.gz LCONYPIMBCCPPD-LLVKDONJSA-N 1 0 311.303 4.142 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(NC(=O)C2CC2)cc1 ZINC000183397144 1043162968 /nfs/dbraw/zinc/16/29/68/1043162968.db2.gz PGXJGZUYLPEUBB-KGLIPLIRSA-N 1 0 324.424 4.153 20 10 DICDRO CC(C)COC[C@H]([NH2+][C@H](C)c1ccccc1O)c1ccco1 ZINC000183478128 1043164702 /nfs/dbraw/zinc/16/47/02/1043164702.db2.gz SUMAFZPANPLDSR-ZBFHGGJFSA-N 1 0 303.402 4.050 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1O ZINC000183446675 1043164968 /nfs/dbraw/zinc/16/49/68/1043164968.db2.gz YOSLVCMMLXRJLR-WRWLIDTKSA-N 1 0 311.425 4.211 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cccc(N2CCCC2)c1)c1ccccc1O ZINC000183553194 1043166633 /nfs/dbraw/zinc/16/66/33/1043166633.db2.gz UJFGLDQFXIIXHY-JKSUJKDBSA-N 1 0 310.441 4.404 20 10 DICDRO C[C@@H]([NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1)c1ccccc1O ZINC000183628952 1043168428 /nfs/dbraw/zinc/16/84/28/1043168428.db2.gz WPJICCZRALJNBL-JTDSTZFVSA-N 1 0 311.425 4.211 20 10 DICDRO C[C@@H]([NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1)c1ccccc1O ZINC000183628924 1043168491 /nfs/dbraw/zinc/16/84/91/1043168491.db2.gz WPJICCZRALJNBL-GJYPPUQNSA-N 1 0 311.425 4.211 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(C)oc3ccccc32)c1 ZINC000184720759 1043188978 /nfs/dbraw/zinc/18/89/78/1043188978.db2.gz QYAMABKGGJDDLA-LBPRGKRZSA-N 1 0 311.381 4.306 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccnc1 ZINC000185004855 1043192282 /nfs/dbraw/zinc/19/22/82/1043192282.db2.gz YYYRTIWJDVRWBJ-HXUWFJFHSA-N 1 0 309.457 4.313 20 10 DICDRO COCc1ccccc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000184925778 1043192333 /nfs/dbraw/zinc/19/23/33/1043192333.db2.gz BBKOOSGUSNXKJJ-LBPRGKRZSA-N 1 0 305.805 4.043 20 10 DICDRO CCCOCc1ccccc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185062857 1043195046 /nfs/dbraw/zinc/19/50/46/1043195046.db2.gz QKUPFNGKLNERDD-MRXNPFEDSA-N 1 0 313.441 4.478 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1 ZINC000185215746 1043196946 /nfs/dbraw/zinc/19/69/46/1043196946.db2.gz DPGMSVONEIEFPN-APPDUMDISA-N 1 0 317.816 4.392 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000185230065 1043197264 /nfs/dbraw/zinc/19/72/64/1043197264.db2.gz VZNIHOMCKJCHCX-QWHCGFSZSA-N 1 0 303.377 4.342 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1)c1cc(F)ccc1O ZINC000185225578 1043197282 /nfs/dbraw/zinc/19/72/82/1043197282.db2.gz HSCHFRDMXFZESX-VMDGZTHMSA-N 1 0 315.388 4.102 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccsc1C(F)(F)F)CC2 ZINC000866405920 1043198345 /nfs/dbraw/zinc/19/83/45/1043198345.db2.gz MZPVVCVQBPXOKM-NSHDSACASA-N 1 0 313.344 4.250 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2csc(C(C)C)n2)c(O)c1 ZINC000185310285 1043199036 /nfs/dbraw/zinc/19/90/36/1043199036.db2.gz FHWFDDZBEOSPLW-ZDUSSCGKSA-N 1 0 304.459 4.174 20 10 DICDRO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cc(F)ccc1O ZINC000185374567 1043200586 /nfs/dbraw/zinc/20/05/86/1043200586.db2.gz MOQIZPARAFBVMS-SNVBAGLBSA-N 1 0 308.422 4.136 20 10 DICDRO Cc1csc(CCCC[NH2+][C@@H](C)c2ccc(C)cc2O)n1 ZINC000185318907 1043200717 /nfs/dbraw/zinc/20/07/17/1043200717.db2.gz BUUMRRAVFNTIQR-AWEZNQCLSA-N 1 0 304.459 4.139 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@H](C)c2cc(F)ccc2O)on1 ZINC000185562249 1043203962 /nfs/dbraw/zinc/20/39/62/1043203962.db2.gz MXNMYJKSBNUVTA-LLVKDONJSA-N 1 0 306.381 4.274 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000185611312 1043204419 /nfs/dbraw/zinc/20/44/19/1043204419.db2.gz FUUNHISLTIUMRX-HZPDHXFCSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000866455237 1043204823 /nfs/dbraw/zinc/20/48/23/1043204823.db2.gz KHBBRJLBFAWEMD-NEPJUHHUSA-N 1 0 316.470 4.448 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cnc(C)s1)c1ccc(N(C)C)cc1 ZINC000866454371 1043204864 /nfs/dbraw/zinc/20/48/64/1043204864.db2.gz ACJKKDSIHRBUPS-MLGOLLRUSA-N 1 0 303.475 4.319 20 10 DICDRO CC(C)[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1cccnc1 ZINC000185661328 1043206604 /nfs/dbraw/zinc/20/66/04/1043206604.db2.gz LCTVWFBEDQMJDW-DYVFJYSZSA-N 1 0 302.393 4.017 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC2([C@H]3CCCCO3)CCC2)c1 ZINC000866480811 1043209503 /nfs/dbraw/zinc/20/95/03/1043209503.db2.gz ISOHUCJTKRTRTL-CRAIPNDOSA-N 1 0 303.446 4.091 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1cc(Cl)ccc1O ZINC000186009136 1043210450 /nfs/dbraw/zinc/21/04/50/1043210450.db2.gz LXEVBYWFHJVBPL-MEBBXXQBSA-N 1 0 321.779 4.359 20 10 DICDRO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000186057969 1043212246 /nfs/dbraw/zinc/21/22/46/1043212246.db2.gz PAILAOQCHPHXRE-GJZGRUSLSA-N 1 0 323.440 4.482 20 10 DICDRO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000186057485 1043212930 /nfs/dbraw/zinc/21/29/30/1043212930.db2.gz LVPKTKMSXUZIRD-GJZGRUSLSA-N 1 0 323.440 4.482 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1cc(Cl)ccc1O ZINC000186128988 1043214421 /nfs/dbraw/zinc/21/44/21/1043214421.db2.gz PWICMWLACAJEQN-TZMCWYRMSA-N 1 0 309.837 4.188 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000186092624 1043214779 /nfs/dbraw/zinc/21/47/79/1043214779.db2.gz WOXHKRKFXJDYRN-UONOGXRCSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000186092643 1043215053 /nfs/dbraw/zinc/21/50/53/1043215053.db2.gz WOXHKRKFXJDYRN-KBPBESRZSA-N 1 0 314.385 4.329 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(F)c(F)c1 ZINC000186225579 1043217111 /nfs/dbraw/zinc/21/71/11/1043217111.db2.gz HAFNICKTGVWEPC-PXAZEXFGSA-N 1 0 321.367 4.017 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(F)c(F)c1 ZINC000186225600 1043217127 /nfs/dbraw/zinc/21/71/27/1043217127.db2.gz HAFNICKTGVWEPC-SJCJKPOMSA-N 1 0 321.367 4.017 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CC12CCCC2)c1ccc(Br)cc1O ZINC000760039204 1043219674 /nfs/dbraw/zinc/21/96/74/1043219674.db2.gz DERNIJWXSSKUIB-QMTHXVAHSA-N 1 0 310.235 4.138 20 10 DICDRO C[C@H]([NH2+][C@H]1CC12CCCC2)c1ccc(Br)cc1O ZINC000760039201 1043220004 /nfs/dbraw/zinc/22/00/04/1043220004.db2.gz DERNIJWXSSKUIB-HZMBPMFUSA-N 1 0 310.235 4.138 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1[N+](=O)[O-] ZINC000866541083 1043220043 /nfs/dbraw/zinc/22/00/43/1043220043.db2.gz VXPSHPJHWJLJIH-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)c1ccc(F)cc1O ZINC000186477344 1043225561 /nfs/dbraw/zinc/22/55/61/1043225561.db2.gz SRDNTVXMQVRENW-ZDUSSCGKSA-N 1 0 302.393 4.074 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1cc(F)ccc1O ZINC000186506969 1043227143 /nfs/dbraw/zinc/22/71/43/1043227143.db2.gz GRSLPIINCYNYGZ-BDJLRTHQSA-N 1 0 319.351 4.235 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(C)(C)C)o2)c1 ZINC000866573712 1043227363 /nfs/dbraw/zinc/22/73/63/1043227363.db2.gz LXPYJSHQQSKJAO-GFCCVEGCSA-N 1 0 303.402 4.142 20 10 DICDRO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)c2cc(Cl)ccc2O)s1 ZINC000186766083 1043233156 /nfs/dbraw/zinc/23/31/56/1043233156.db2.gz AKLPEFKDBTZGSE-ONGXEEELSA-N 1 0 310.850 4.265 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCn2nccc21)c1ccc(N2CCCCC2)cc1 ZINC000866632697 1043240591 /nfs/dbraw/zinc/24/05/91/1043240591.db2.gz OCDFDUYKHGFTFN-APWZRJJASA-N 1 0 324.472 4.059 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)c1 ZINC000237206376 1043240866 /nfs/dbraw/zinc/24/08/66/1043240866.db2.gz OOUSRQMIRHKYQM-GOSISDBHSA-N 1 0 317.404 4.417 20 10 DICDRO CCSc1cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)ccn1 ZINC000187787707 1043251303 /nfs/dbraw/zinc/25/13/03/1043251303.db2.gz RALSMSZWXZOUIJ-NSHDSACASA-N 1 0 322.861 4.403 20 10 DICDRO CCSc1cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)ccn1 ZINC000187789303 1043251570 /nfs/dbraw/zinc/25/15/70/1043251570.db2.gz LAPCQQQOJABZPL-CQSZACIVSA-N 1 0 315.486 4.110 20 10 DICDRO CCSc1cc(C[NH2+][C@H](CC)c2ccccc2O)ccn1 ZINC000187787766 1043252022 /nfs/dbraw/zinc/25/20/22/1043252022.db2.gz GTWLAKMMWHVPCG-OAHLLOKOSA-N 1 0 302.443 4.140 20 10 DICDRO Oc1ccc2ccccc2c1C[N@H+](Cc1cocn1)C1CCCC1 ZINC000191942144 1043264636 /nfs/dbraw/zinc/26/46/36/1043264636.db2.gz CPMYYIXJIBRMLK-UHFFFAOYSA-N 1 0 322.408 4.478 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000121907021 1043265677 /nfs/dbraw/zinc/26/56/77/1043265677.db2.gz JYOAGSLLDAGRAA-KUHUBIRLSA-N 1 0 310.441 4.099 20 10 DICDRO CCCNc1ccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000193366068 1043284708 /nfs/dbraw/zinc/28/47/08/1043284708.db2.gz SUQVGYICKYXQFK-AWEZNQCLSA-N 1 0 314.429 4.074 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccc(Cl)cc1 ZINC000194255665 1043291526 /nfs/dbraw/zinc/29/15/26/1043291526.db2.gz DNIJYXLIGUKSGL-MEDUHNTESA-N 1 0 323.795 4.223 20 10 DICDRO Oc1cccc2c(NCc3ccc(N4CCCC4)cc3)cc[nH+]c12 ZINC000795077605 1043314807 /nfs/dbraw/zinc/31/48/07/1043314807.db2.gz LZZNSXOLIJESIR-UHFFFAOYSA-N 1 0 319.408 4.153 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(Cl)nc1)c1ccc(N(C)C)cc1 ZINC000122762617 1043327789 /nfs/dbraw/zinc/32/77/89/1043327789.db2.gz OSERCNWTDTXIOE-QGZVFWFLSA-N 1 0 317.864 4.084 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc2c(c1)COC2 ZINC000268840498 1043336406 /nfs/dbraw/zinc/33/64/06/1043336406.db2.gz UCKSDFJDKAQIEU-INIZCTEOSA-N 1 0 322.452 4.168 20 10 DICDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(N(C)C)c(F)c2)s1 ZINC000123161053 1043350835 /nfs/dbraw/zinc/35/08/35/1043350835.db2.gz HJXZFLSBMVEAPS-LBPRGKRZSA-N 1 0 321.465 4.158 20 10 DICDRO CSc1ccc(CC[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000797877956 1043360648 /nfs/dbraw/zinc/36/06/48/1043360648.db2.gz HRJIDTTZKIZUQY-UHFFFAOYSA-N 1 0 307.846 4.100 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(C(F)(F)F)nc1 ZINC000872130432 1043473368 /nfs/dbraw/zinc/47/33/68/1043473368.db2.gz HTIRKNRFIXTSRT-QWRGUYRKSA-N 1 0 310.319 4.218 20 10 DICDRO Cc1nccnc1[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000872134639 1043474834 /nfs/dbraw/zinc/47/48/34/1043474834.db2.gz SWPPLQPOGBRYSL-JSGCOSHPSA-N 1 0 307.397 4.056 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2c(C)noc2C)cc1C ZINC000873049303 1043514638 /nfs/dbraw/zinc/51/46/38/1043514638.db2.gz FPMKBITVFICMAV-CYBMUJFWSA-N 1 0 302.418 4.239 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(N)cc(F)c1)c1cc(Cl)ccc1O ZINC000873288464 1043534202 /nfs/dbraw/zinc/53/42/02/1043534202.db2.gz GIAZAMVCHDBJTQ-OAHLLOKOSA-N 1 0 308.784 4.008 20 10 DICDRO CN(c1ccc(C[NH2+]Cc2ccn(C)c2)cc1)C1CCCCC1 ZINC000124529711 1043540543 /nfs/dbraw/zinc/54/05/43/1043540543.db2.gz MBOVHJLYHFYHFJ-UHFFFAOYSA-N 1 0 311.473 4.084 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1O ZINC000124935587 1043577207 /nfs/dbraw/zinc/57/72/07/1043577207.db2.gz ZANBEHHQOPAVQU-GFCCVEGCSA-N 1 0 321.367 4.262 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2C)c1O ZINC000926896732 1043650178 /nfs/dbraw/zinc/65/01/78/1043650178.db2.gz COLRFLKBUGRAIZ-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO CC[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc(C)cc1O ZINC000926919359 1043655491 /nfs/dbraw/zinc/65/54/91/1043655491.db2.gz NAMORZITCMLVMF-AWEZNQCLSA-N 1 0 316.470 4.277 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2[C@@H](c3ccccc3)C2(F)F)c1 ZINC000926971935 1043663287 /nfs/dbraw/zinc/66/32/87/1043663287.db2.gz AHMIRJFCZXFPSB-FDQGKXFDSA-N 1 0 317.379 4.400 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1ccc(Cl)cc1O ZINC000927064121 1043677351 /nfs/dbraw/zinc/67/73/51/1043677351.db2.gz PANAKLUUWULAPI-ABAIWWIYSA-N 1 0 302.805 4.169 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccc(Cl)cc1O ZINC000927062768 1043677363 /nfs/dbraw/zinc/67/73/63/1043677363.db2.gz PANAKLUUWULAPI-XHDPSFHLSA-N 1 0 302.805 4.169 20 10 DICDRO C[C@H]1C[C@H]([NH2+][C@H]2CCCc3cccnc32)c2c1c(F)ccc2O ZINC000927064018 1043678114 /nfs/dbraw/zinc/67/81/14/1043678114.db2.gz OAUCJDLOWKJBHR-CQDKDKBSSA-N 1 0 312.388 4.142 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc2c1OCC2)c1ccccc1O ZINC000927142679 1043699327 /nfs/dbraw/zinc/69/93/27/1043699327.db2.gz VLENRTNOTPAQTG-NEPJUHHUSA-N 1 0 317.816 4.392 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1Cl ZINC000825903288 1043709988 /nfs/dbraw/zinc/70/99/88/1043709988.db2.gz BWGWODJMEKBUSW-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1ccc(C[NH2+]C2CCN([C@@H](C)c3ccccc3)CC2)c(O)c1 ZINC000877038449 1043735426 /nfs/dbraw/zinc/73/54/26/1043735426.db2.gz PXBFGRKMRDZNDN-KRWDZBQOSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000877110585 1043744044 /nfs/dbraw/zinc/74/40/44/1043744044.db2.gz ZIWLVSPFVYTYOY-OAHLLOKOSA-N 1 0 321.424 4.046 20 10 DICDRO CC[N@H+](Cc1cc(Cl)c(C)cc1O)[C@@H](C)c1cccnc1 ZINC000825935519 1043744758 /nfs/dbraw/zinc/74/47/58/1043744758.db2.gz WRXGJJVCTXTXGU-ZDUSSCGKSA-N 1 0 304.821 4.332 20 10 DICDRO CC[N@H+](Cc1cc(Cl)c(C)cc1O)[C@H]1CCOC(C)(C)C1 ZINC000825943559 1043750214 /nfs/dbraw/zinc/75/02/14/1043750214.db2.gz HJHWKCXZIOENHI-AWEZNQCLSA-N 1 0 311.853 4.134 20 10 DICDRO Cc1cccc(O)c1C[NH2+]Cc1ccccc1CC(F)(F)F ZINC000877661216 1043786414 /nfs/dbraw/zinc/78/64/14/1043786414.db2.gz YCDSAJXSZCBXJI-UHFFFAOYSA-N 1 0 309.331 4.095 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1OCC ZINC000877756305 1043792107 /nfs/dbraw/zinc/79/21/07/1043792107.db2.gz FXNLDIJLTGUGTO-CQSZACIVSA-N 1 0 315.413 4.040 20 10 DICDRO Cc1nn(-c2cccc(C)c2)cc1C[NH2+][C@H](C)c1ccccc1O ZINC000877755658 1043793620 /nfs/dbraw/zinc/79/36/20/1043793620.db2.gz KFQSTJDNLRZSGM-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)cc(C(F)(F)F)c1)c1ccccc1O ZINC000877757044 1043793858 /nfs/dbraw/zinc/79/38/58/1043793858.db2.gz CINUGYLSUMTWOT-JTQLQIEISA-N 1 0 313.294 4.401 20 10 DICDRO Cc1cccc(O)c1C[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC000877807875 1043800453 /nfs/dbraw/zinc/80/04/53/1043800453.db2.gz YLMWZHITOVXGGM-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO COc1ccc(C[NH2+]CC[C@@]2(C)CC2(Cl)Cl)cc1C ZINC001308408755 1043823116 /nfs/dbraw/zinc/82/31/16/1043823116.db2.gz XQCMKIYUZFGAHK-AWEZNQCLSA-N 1 0 302.245 4.067 20 10 DICDRO Cc1cc(CC[NH2+]Cc2ccc3c(c2)CCCO3)ccc1Cl ZINC001202546804 1043854235 /nfs/dbraw/zinc/85/42/35/1043854235.db2.gz PRLSNDDVMXTSLC-UHFFFAOYSA-N 1 0 315.844 4.306 20 10 DICDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000127195175 1043902164 /nfs/dbraw/zinc/90/21/64/1043902164.db2.gz ICDXLHLZANXWLB-KRWDZBQOSA-N 1 0 309.457 4.231 20 10 DICDRO COc1ccc(O)c(C[NH2+]Cc2ccc(C(C)(C)C)s2)c1 ZINC000127310253 1043916281 /nfs/dbraw/zinc/91/62/81/1043916281.db2.gz SQZZTTMIKXLMCH-UHFFFAOYSA-N 1 0 305.443 4.050 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1O ZINC000896803532 1044011056 /nfs/dbraw/zinc/01/10/56/1044011056.db2.gz JJSAMTWYBHYEAP-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2cccnc2)c(C)n1-c1ccccc1 ZINC000320340268 1044025781 /nfs/dbraw/zinc/02/57/81/1044025781.db2.gz OGAFBEIYPVUGEM-MRXNPFEDSA-N 1 0 305.425 4.340 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2OCCc3sccc32)c(O)c1 ZINC000291953386 1044119464 /nfs/dbraw/zinc/11/94/64/1044119464.db2.gz RBRGXTNNZLXNFO-ZJNRKIDTSA-N 1 0 317.454 4.115 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(Cl)c(F)c1 ZINC000213539651 1044204868 /nfs/dbraw/zinc/20/48/68/1044204868.db2.gz PVESSUVVSVHVHQ-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)cc1 ZINC000281917040 1044213355 /nfs/dbraw/zinc/21/33/55/1044213355.db2.gz AHQWHXDTPXOGHY-CQSZACIVSA-N 1 0 317.864 4.350 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccc(Cl)cn1)C1CCCC1 ZINC000778214351 1044224846 /nfs/dbraw/zinc/22/48/46/1044224846.db2.gz JMJFBKFWTBVNJB-UHFFFAOYSA-N 1 0 316.832 4.385 20 10 DICDRO CCSc1ccc(C[NH2+][C@@H](C)c2cccc(OC)c2O)cc1 ZINC000883245372 1044243261 /nfs/dbraw/zinc/24/32/61/1044243261.db2.gz KJLNDKKGQBRFSI-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(C)nc2Cl)cc1 ZINC000883302014 1044262367 /nfs/dbraw/zinc/26/23/67/1044262367.db2.gz OGSJVQBRENHLLC-AWEZNQCLSA-N 1 0 317.864 4.350 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)[C@H]1CCCOC1 ZINC000883353402 1044281953 /nfs/dbraw/zinc/28/19/53/1044281953.db2.gz UDCDWYOMWYMJDH-QOKNQOGYSA-N 1 0 313.441 4.401 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)c1 ZINC000883376478 1044289559 /nfs/dbraw/zinc/28/95/59/1044289559.db2.gz LRVPTQSJTSIQQA-OYYNGEPBSA-N 1 0 315.388 4.077 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)c1O ZINC000883377849 1044293029 /nfs/dbraw/zinc/29/30/29/1044293029.db2.gz SADVDVGJNYXPOD-ULFGMLNVSA-N 1 0 315.388 4.077 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)c1 ZINC000192724495 1044306177 /nfs/dbraw/zinc/30/61/77/1044306177.db2.gz RTBXUXPUDDZATP-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1sccc1Cl ZINC000475190659 1044311645 /nfs/dbraw/zinc/31/16/45/1044311645.db2.gz AQPGXFORMLUZAP-UHFFFAOYSA-N 1 0 304.846 4.491 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)o1 ZINC000293901383 1044348788 /nfs/dbraw/zinc/34/87/88/1044348788.db2.gz ZPZYGBZZZXVBFW-KRWDZBQOSA-N 1 0 315.461 4.242 20 10 DICDRO CCN(CC)c1ccc(CNc2cc3c(c[nH+]2)CCCC3)cc1 ZINC001202561372 1044352360 /nfs/dbraw/zinc/35/23/60/1044352360.db2.gz URLINBZXJSADGU-UHFFFAOYSA-N 1 0 309.457 4.419 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c(O)c1 ZINC000293989652 1044363919 /nfs/dbraw/zinc/36/39/19/1044363919.db2.gz BWVUYJPFYHARHX-BBRMVZONSA-N 1 0 315.388 4.323 20 10 DICDRO COCC[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000840838640 1044368430 /nfs/dbraw/zinc/36/84/30/1044368430.db2.gz SASIETVGQGKZBL-SJORKVTESA-N 1 0 304.478 4.000 20 10 DICDRO CSCCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000133579754 1044420403 /nfs/dbraw/zinc/42/04/03/1044420403.db2.gz CHDJUARPKMSNRU-INIZCTEOSA-N 1 0 306.519 4.471 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000294827921 1044463712 /nfs/dbraw/zinc/46/37/12/1044463712.db2.gz QUSFVNZGFRZLNW-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCC23CCOCC3)c(O)c1C ZINC000282904383 1044479625 /nfs/dbraw/zinc/47/96/25/1044479625.db2.gz WYOXEDDSFZJUSQ-RDJZCZTQSA-N 1 0 303.446 4.009 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1ccc(SC(F)(F)F)cc1 ZINC000134236649 1044507242 /nfs/dbraw/zinc/50/72/42/1044507242.db2.gz RFHMURROCYBABH-UHFFFAOYSA-N 1 0 313.344 4.294 20 10 DICDRO CCOCc1cc(C[NH2+]CCC2=CCCCC2)ccc1OC ZINC000215919473 1044539829 /nfs/dbraw/zinc/53/98/29/1044539829.db2.gz ZLYQTTYNJALIEK-UHFFFAOYSA-N 1 0 303.446 4.212 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc(OC(F)F)cc1 ZINC000295861755 1044569808 /nfs/dbraw/zinc/56/98/08/1044569808.db2.gz GPVCJTSOFVTQIV-NHYWBVRUSA-N 1 0 319.351 4.332 20 10 DICDRO Cc1c[nH]nc1CN(Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000886098425 1044607283 /nfs/dbraw/zinc/60/72/83/1044607283.db2.gz MDTJPPYDBNQZBG-INIZCTEOSA-N 1 0 321.424 4.187 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)cc1 ZINC000136681659 1044609552 /nfs/dbraw/zinc/60/95/52/1044609552.db2.gz WIOKHLFXXVTKSW-GOSISDBHSA-N 1 0 316.489 4.114 20 10 DICDRO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297005464 1044655497 /nfs/dbraw/zinc/65/54/97/1044655497.db2.gz SWHZMMMSOYJBJX-XJKSGUPXSA-N 1 0 321.424 4.100 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2c(O)cccc2F)c1 ZINC000886579215 1044662996 /nfs/dbraw/zinc/66/29/96/1044662996.db2.gz DXPVJJWLNQTWCB-ZDUSSCGKSA-N 1 0 302.393 4.074 20 10 DICDRO CC(C)C[N@H+](Cc1ccccc1O)[C@@H]1CCCc2cccnc21 ZINC000155218639 1044685331 /nfs/dbraw/zinc/68/53/31/1044685331.db2.gz ZFFOWDCOTMMVTO-GOSISDBHSA-N 1 0 310.441 4.323 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)nc1 ZINC000155246768 1044691345 /nfs/dbraw/zinc/69/13/45/1044691345.db2.gz OKTVXYOMFCGGGN-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c(O)c1 ZINC000886774474 1044697142 /nfs/dbraw/zinc/69/71/42/1044697142.db2.gz ODHYYYQKMQEGKO-QAPCUYQASA-N 1 0 303.446 4.091 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c1 ZINC000886774795 1044697298 /nfs/dbraw/zinc/69/72/98/1044697298.db2.gz VVMUIGUQXVAEBG-QAPCUYQASA-N 1 0 303.446 4.091 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cn(C(C)(C)C)nc2C)cc1C ZINC000155408423 1044699642 /nfs/dbraw/zinc/69/96/42/1044699642.db2.gz RSFDCUNQRODLKL-CQSZACIVSA-N 1 0 315.461 4.114 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(-c2cccnc2)cc1)c1ccccc1O ZINC000367785397 1044752626 /nfs/dbraw/zinc/75/26/26/1044752626.db2.gz UEYGTZBBXKXZLC-OAHLLOKOSA-N 1 0 304.393 4.305 20 10 DICDRO CC(C)n1ncc2c1[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)CCC2 ZINC000368158794 1044767309 /nfs/dbraw/zinc/76/73/09/1044767309.db2.gz IWQAORCWDJBJMX-BLLLJJGKSA-N 1 0 317.408 4.037 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccccc2COC)cc1 ZINC000122035523 1044769228 /nfs/dbraw/zinc/76/92/28/1044769228.db2.gz CAQWBFRNYFHRGF-MRXNPFEDSA-N 1 0 312.457 4.140 20 10 DICDRO CCN(CC)c1ccc(CNc2ccc([C@H](C)[NH3+])cc2)cc1F ZINC000841029105 1044869467 /nfs/dbraw/zinc/86/94/67/1044869467.db2.gz SMKWDUJFOMCRAB-AWEZNQCLSA-N 1 0 315.436 4.304 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000134910181 1044970211 /nfs/dbraw/zinc/97/02/11/1044970211.db2.gz OSSKPCNRABXOPA-UONOGXRCSA-N 1 0 315.461 4.372 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000134925743 1044971521 /nfs/dbraw/zinc/97/15/21/1044971521.db2.gz PNLXNHDSCRGJNT-NWDGAFQWSA-N 1 0 319.424 4.203 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000134925761 1044972708 /nfs/dbraw/zinc/97/27/08/1044972708.db2.gz PNLXNHDSCRGJNT-RYUDHWBXSA-N 1 0 319.424 4.203 20 10 DICDRO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(Cl)c2[O-])o1 ZINC000137069723 1044991160 /nfs/dbraw/zinc/99/11/60/1044991160.db2.gz BPYVDTBDJIATRQ-HNNXBMFYSA-N 1 0 321.804 4.122 20 10 DICDRO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000153166176 1045053644 /nfs/dbraw/zinc/05/36/44/1045053644.db2.gz KCUYSCAJOGVVGZ-QZTJIDSGSA-N 1 0 324.468 4.243 20 10 DICDRO Cc1ccc(C(=O)C2CC[NH+](Cc3ccccc3O)CC2)c(C)c1 ZINC000779000389 1045115067 /nfs/dbraw/zinc/11/50/67/1045115067.db2.gz VFYIYBMRNNRDBP-UHFFFAOYSA-N 1 0 323.436 4.104 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(F)ccc1O ZINC000778995874 1045116002 /nfs/dbraw/zinc/11/60/02/1045116002.db2.gz DNPGXUUNXDWMIK-UHFFFAOYSA-N 1 0 316.420 4.008 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000779003248 1045119696 /nfs/dbraw/zinc/11/96/96/1045119696.db2.gz UHCYHGCHGQLSGO-UHFFFAOYSA-N 1 0 324.399 4.392 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)C2CCSCC2)cc1 ZINC000779002952 1045119987 /nfs/dbraw/zinc/11/99/87/1045119987.db2.gz IVHCMMRZQIGQFU-HNNXBMFYSA-N 1 0 306.519 4.154 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(-c2ccccc2)no1 ZINC000924575682 1045177864 /nfs/dbraw/zinc/17/78/64/1045177864.db2.gz ZXIAEMZSUMGELL-HNNXBMFYSA-N 1 0 321.424 4.258 20 10 DICDRO CC(C)C[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)N(C)C ZINC000320729515 1045185572 /nfs/dbraw/zinc/18/55/72/1045185572.db2.gz XBVUGKANPOEPBL-NVXWUHKLSA-N 1 0 314.473 4.172 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCSC1)c1ccc(N2CCCCC2)cc1 ZINC000159517033 1045200352 /nfs/dbraw/zinc/20/03/52/1045200352.db2.gz VUAFQJQHXXFFGJ-RDJZCZTQSA-N 1 0 304.503 4.223 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000779054031 1045218074 /nfs/dbraw/zinc/21/80/74/1045218074.db2.gz OTZNUQORVUITSW-YGRLFVJLSA-N 1 0 319.351 4.017 20 10 DICDRO CCOC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000779073551 1045248397 /nfs/dbraw/zinc/24/83/97/1045248397.db2.gz OSPGSBQZABTUBN-IRXDYDNUSA-N 1 0 304.478 4.143 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)cc1F ZINC000192795683 1045260380 /nfs/dbraw/zinc/26/03/80/1045260380.db2.gz XQHIRBLVWAULGG-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO COCCC1CC[NH+]([C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000527933122 1045286598 /nfs/dbraw/zinc/28/65/98/1045286598.db2.gz HQZNBXAIIFTXSX-HNNXBMFYSA-N 1 0 313.441 4.355 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCc3cc(Cl)ccc32)c1O ZINC000527991110 1045291408 /nfs/dbraw/zinc/29/14/08/1045291408.db2.gz HBRGEQICBLQMMC-BZNIZROVSA-N 1 0 317.816 4.392 20 10 DICDRO CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000779150862 1045322764 /nfs/dbraw/zinc/32/27/64/1045322764.db2.gz YFGRZAYWABQQEQ-UGSOOPFHSA-N 1 0 319.832 4.220 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](c1ccncc1)C1CC1 ZINC001120257846 1045535989 /nfs/dbraw/zinc/53/59/89/1045535989.db2.gz ANDVHKLDTCKOTA-OWDMVUQNSA-N 1 0 308.425 4.385 20 10 DICDRO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1cc(C)cc(OC)c1O ZINC000190400725 1045546201 /nfs/dbraw/zinc/54/62/01/1045546201.db2.gz NCJKTJJWKYYEBS-UHFFFAOYSA-N 1 0 324.424 4.213 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000113323539 1045561547 /nfs/dbraw/zinc/56/15/47/1045561547.db2.gz FZJAQXYPASAQAO-UHFFFAOYSA-N 1 0 305.805 4.124 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@H]2CC3CCC2CC3)c1 ZINC000381908438 1045585923 /nfs/dbraw/zinc/58/59/23/1045585923.db2.gz NDMNVOMUHFSJMS-BIPUWPRCSA-N 1 0 303.446 4.266 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000800238832 1045590573 /nfs/dbraw/zinc/59/05/73/1045590573.db2.gz JXFYWXGAFPMOHO-XLIONFOSSA-N 1 0 323.484 4.272 20 10 DICDRO CCOc1ccc(C[NH2+]C(C)(C)c2ccc(CC)cc2)c(O)c1 ZINC000751509557 1045609091 /nfs/dbraw/zinc/60/90/91/1045609091.db2.gz KWCJZGRWFCCKTF-UHFFFAOYSA-N 1 0 313.441 4.378 20 10 DICDRO COCC1(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CCC1 ZINC000800492408 1045630671 /nfs/dbraw/zinc/63/06/71/1045630671.db2.gz AEWCTCOIPCHJOO-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1cc(F)ccc1O ZINC000800496170 1045633773 /nfs/dbraw/zinc/63/37/73/1045633773.db2.gz SSNWJDYUGUJFRH-ZUZCIYMTSA-N 1 0 305.780 4.003 20 10 DICDRO C[C@@H]1CCCN(c2ccc(C[NH2+][C@H]3CCSC3)cc2Cl)C1 ZINC000800494649 1045633821 /nfs/dbraw/zinc/63/38/21/1045633821.db2.gz YEIKKPJPCFJFAW-HIFRSBDPSA-N 1 0 324.921 4.171 20 10 DICDRO C[C@H]([NH2+]CCCc1c[nH]c2ccc(F)cc12)c1ccccc1O ZINC000800501640 1045637002 /nfs/dbraw/zinc/63/70/02/1045637002.db2.gz WVVJRDPACAPVCZ-ZDUSSCGKSA-N 1 0 312.388 4.296 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cccc3[nH]ccc32)c(O)c1C ZINC000800501828 1045637324 /nfs/dbraw/zinc/63/73/24/1045637324.db2.gz ZVWIQQKRKWZQNY-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1C ZINC000752266446 1045669749 /nfs/dbraw/zinc/66/97/49/1045669749.db2.gz QMYLZGQRJUSVER-HIFRSBDPSA-N 1 0 315.379 4.467 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000752264313 1045669932 /nfs/dbraw/zinc/66/99/32/1045669932.db2.gz BGNNUZITVHGSIN-CABCVRRESA-N 1 0 314.395 4.211 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2cc(F)c(OC)cc21)c1ccccc1O ZINC000800994509 1045679185 /nfs/dbraw/zinc/67/91/85/1045679185.db2.gz VGBJADWFOICRRB-IAGOWNOFSA-N 1 0 315.388 4.268 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2cc(F)c(OC)cc21)c1ccccc1O ZINC000800994511 1045680459 /nfs/dbraw/zinc/68/04/59/1045680459.db2.gz VGBJADWFOICRRB-SJORKVTESA-N 1 0 315.388 4.268 20 10 DICDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000800994862 1045680492 /nfs/dbraw/zinc/68/04/92/1045680492.db2.gz YEMQWKPCQACEAH-SJCJKPOMSA-N 1 0 315.388 4.186 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@@H]1CCC[C@H](c2ccccc2)C1 ZINC000752986756 1045719152 /nfs/dbraw/zinc/71/91/52/1045719152.db2.gz MHAAFONWEUHBPH-DLBZAZTESA-N 1 0 311.425 4.217 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](C)c2ccsc2)c1O ZINC000801570737 1045744250 /nfs/dbraw/zinc/74/42/50/1045744250.db2.gz UTGWNEQPHICZIM-SECBINFHSA-N 1 0 309.818 4.161 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H](O)c1ccc(C)cc1 ZINC000801595113 1045749403 /nfs/dbraw/zinc/74/94/03/1045749403.db2.gz IGPCJYUWMDMBEQ-HXUWFJFHSA-N 1 0 313.441 4.036 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H](O)c1ccccc1C ZINC000801594903 1045749911 /nfs/dbraw/zinc/74/99/11/1045749911.db2.gz CTDREGBHDYLFKT-HXUWFJFHSA-N 1 0 313.441 4.036 20 10 DICDRO CCc1cnc(C[N@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000753543359 1045758864 /nfs/dbraw/zinc/75/88/64/1045758864.db2.gz OSIGCKCHGMUXSK-UHFFFAOYSA-N 1 0 316.470 4.356 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCOC(C)(C)C2)cc1 ZINC000754078955 1045845670 /nfs/dbraw/zinc/84/56/70/1045845670.db2.gz CMMFWMIYANLRMM-SFHVURJKSA-N 1 0 318.505 4.360 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2ncccc12 ZINC001137631871 1045912645 /nfs/dbraw/zinc/91/26/45/1045912645.db2.gz GEINPEVQTCQFPE-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC(C)(C)[C@H]2c2ccccc2)c1O ZINC000754723353 1045919131 /nfs/dbraw/zinc/91/91/31/1045919131.db2.gz QLTQCMCLSFXYLV-LJQANCHMSA-N 1 0 311.425 4.292 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCS[C@H](c3ccccc3)C2)c1 ZINC000754741922 1045923354 /nfs/dbraw/zinc/92/33/54/1045923354.db2.gz OQBAUPBRVVKIPO-SFHVURJKSA-N 1 0 313.466 4.299 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)cc1F ZINC000192796120 1045935261 /nfs/dbraw/zinc/93/52/61/1045935261.db2.gz PFJZKRHSMPQJHP-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO CC[C@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000802309006 1045950524 /nfs/dbraw/zinc/95/05/24/1045950524.db2.gz LPTIUSCTUPVOOD-CLWJZODNSA-N 1 0 318.505 4.387 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc(C3CCC3)cc2)c1 ZINC000755223479 1045964443 /nfs/dbraw/zinc/96/44/43/1045964443.db2.gz PMHNRXWOVLOXLX-UHFFFAOYSA-N 1 0 311.425 4.348 20 10 DICDRO Cc1cc(CN2Cc3cccnc3C2)c(C)n1-c1ccccc1 ZINC001137854134 1045984735 /nfs/dbraw/zinc/98/47/35/1045984735.db2.gz JQICKAMHNOKOAU-UHFFFAOYSA-N 1 0 303.409 4.005 20 10 DICDRO Cc1cc(C[NH+]2CCC3(CCCO3)CC2)c(C)n1-c1ccccc1 ZINC001137857396 1045987618 /nfs/dbraw/zinc/98/76/18/1045987618.db2.gz GCHMRLQWWOAHOA-UHFFFAOYSA-N 1 0 324.468 4.239 20 10 DICDRO CO[C@@H]1CC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)[C@@H](C)C1 ZINC001137859167 1045988485 /nfs/dbraw/zinc/98/84/85/1045988485.db2.gz LZICBKNXKIASCA-MGPUTAFESA-N 1 0 312.457 4.093 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)c(C)n1-c1ccccc1 ZINC001137856138 1045988555 /nfs/dbraw/zinc/98/85/55/1045988555.db2.gz RLUXLOSEJBICLZ-RXVVDRJESA-N 1 0 324.468 4.095 20 10 DICDRO CCCNc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000193360938 1045996085 /nfs/dbraw/zinc/99/60/85/1045996085.db2.gz KIHYLIAYTMSMDX-INIZCTEOSA-N 1 0 311.473 4.425 20 10 DICDRO CCCC[C@H](C)[N@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000829966947 1046027619 /nfs/dbraw/zinc/02/76/19/1046027619.db2.gz BNOQULHIKJGISU-KRWDZBQOSA-N 1 0 318.505 4.312 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@H]1CCCO1 ZINC000756047766 1046043644 /nfs/dbraw/zinc/04/36/44/1046043644.db2.gz VJCMUQKZUUURPZ-AZUAARDMSA-N 1 0 311.425 4.106 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)c1 ZINC000193703465 1046062670 /nfs/dbraw/zinc/06/26/70/1046062670.db2.gz FOWXMXZENZEUHK-AWEZNQCLSA-N 1 0 307.393 4.405 20 10 DICDRO Cc1ccccc1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000756317267 1046064393 /nfs/dbraw/zinc/06/43/93/1046064393.db2.gz IIJBXGZGWRDHBK-UHFFFAOYSA-N 1 0 307.393 4.496 20 10 DICDRO Oc1ccccc1C[N@H+](CCOc1ccccc1)Cc1ccco1 ZINC000756317026 1046064900 /nfs/dbraw/zinc/06/49/00/1046064900.db2.gz GETNXGIOFJNANI-UHFFFAOYSA-N 1 0 323.392 4.066 20 10 DICDRO C[C@H]([NH2+]CCCO[C@@H](C)c1ccccc1)c1cc(F)ccc1O ZINC000756359139 1046069755 /nfs/dbraw/zinc/06/97/55/1046069755.db2.gz NYEAMPPYEZBFNC-GJZGRUSLSA-N 1 0 317.404 4.350 20 10 DICDRO COCc1ccccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756373766 1046072743 /nfs/dbraw/zinc/07/27/43/1046072743.db2.gz YODMCIFXKMVYBE-WBMJQRKESA-N 1 0 315.388 4.016 20 10 DICDRO COCc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)cc1 ZINC000756384875 1046073365 /nfs/dbraw/zinc/07/33/65/1046073365.db2.gz PTCSQLZNWWLGNM-BLLLJJGKSA-N 1 0 315.388 4.016 20 10 DICDRO CC[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)N1CCCC1 ZINC000756399255 1046076330 /nfs/dbraw/zinc/07/63/30/1046076330.db2.gz AGRKYPKFOCRVCV-WBVHZDCISA-N 1 0 312.457 4.070 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCCOc2ccc(F)cc2)c(O)c1 ZINC000756400407 1046076537 /nfs/dbraw/zinc/07/65/37/1046076537.db2.gz KGUFLJMZNCWLOI-OAHLLOKOSA-N 1 0 317.404 4.350 20 10 DICDRO CC[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)N1CCCC1 ZINC000756399252 1046076873 /nfs/dbraw/zinc/07/68/73/1046076873.db2.gz AGRKYPKFOCRVCV-DOTOQJQBSA-N 1 0 312.457 4.070 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCO3)c(O)c1C ZINC000756396882 1046077362 /nfs/dbraw/zinc/07/73/62/1046077362.db2.gz MWKASRMDMFAJLC-ZIAGYGMSSA-N 1 0 313.397 4.150 20 10 DICDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1cc(F)ccc1O ZINC000756418747 1046077608 /nfs/dbraw/zinc/07/76/08/1046077608.db2.gz QITVFPNKHLSUKH-LBPRGKRZSA-N 1 0 303.352 4.053 20 10 DICDRO Cc1ccc(OCCCC[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756416017 1046079106 /nfs/dbraw/zinc/07/91/06/1046079106.db2.gz FZEFPZWIJIOVCD-OAHLLOKOSA-N 1 0 317.404 4.350 20 10 DICDRO C[C@@H]([NH2+][C@@H](Cn1ccnc1)C(C)(C)C)c1cc(Cl)ccc1O ZINC000756440760 1046081172 /nfs/dbraw/zinc/08/11/72/1046081172.db2.gz GTFVWINQHXGNLV-WBMJQRKESA-N 1 0 321.852 4.008 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCOCCc2ccccc2)c1 ZINC000756434265 1046081730 /nfs/dbraw/zinc/08/17/30/1046081730.db2.gz KMNUGRAZIWMOQV-QGZVFWFLSA-N 1 0 313.441 4.001 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756435231 1046083039 /nfs/dbraw/zinc/08/30/39/1046083039.db2.gz YDFIDUIJCKSLOI-BFQNTYOBSA-N 1 0 315.388 4.439 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3ccccc3n2)c(O)c1C ZINC000756458403 1046084951 /nfs/dbraw/zinc/08/49/51/1046084951.db2.gz VYBOHMCEQLZBFJ-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO COc1ccc(CCC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000756460700 1046085516 /nfs/dbraw/zinc/08/55/16/1046085516.db2.gz QZVXVFJFZJGEMU-INIZCTEOSA-N 1 0 313.441 4.301 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCOc2ccc(Cl)cc2)c(O)c1 ZINC000756471711 1046087452 /nfs/dbraw/zinc/08/74/52/1046087452.db2.gz WPRYGNQSSMOIPN-ZDUSSCGKSA-N 1 0 305.805 4.084 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CSCc3ccccc32)c1 ZINC000756491319 1046088271 /nfs/dbraw/zinc/08/82/71/1046088271.db2.gz ZNXIJSDDFVVXOG-YVEFUNNKSA-N 1 0 315.438 4.040 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc3ccccc3n2)c(O)c1C ZINC000756494008 1046088476 /nfs/dbraw/zinc/08/84/76/1046088476.db2.gz CPCMFDJEQJCYOQ-MRXNPFEDSA-N 1 0 320.436 4.451 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2cccc3cccnc32)c2c1c(F)ccc2O ZINC000756493914 1046088698 /nfs/dbraw/zinc/08/86/98/1046088698.db2.gz AZEOCNTUVPKIKW-LRDDRELGSA-N 1 0 322.383 4.418 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc3c(s2)CCCC3)c1 ZINC000756483340 1046090178 /nfs/dbraw/zinc/09/01/78/1046090178.db2.gz MOLABLRQVPWJSD-GFCCVEGCSA-N 1 0 317.454 4.192 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc3ccccc3n2)c1 ZINC000756493877 1046090492 /nfs/dbraw/zinc/09/04/92/1046090492.db2.gz ARBZETLYNPKUNV-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO C[C@@H](COc1ccccc1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756494882 1046090697 /nfs/dbraw/zinc/09/06/97/1046090697.db2.gz OXIAGLCNMOPXDN-STQMWFEESA-N 1 0 305.805 4.164 20 10 DICDRO C[C@@H]([NH2+]CCCOC1CCCC1)c1cc2c(cc1O)CCCC2 ZINC000756503523 1046091384 /nfs/dbraw/zinc/09/13/84/1046091384.db2.gz ODNVPCFMCDDNJD-OAHLLOKOSA-N 1 0 317.473 4.271 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(O)c1C ZINC000756497583 1046091636 /nfs/dbraw/zinc/09/16/36/1046091636.db2.gz QNXMEVKJBPFENE-CQSZACIVSA-N 1 0 316.420 4.065 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c(O)c1C ZINC000756497233 1046091982 /nfs/dbraw/zinc/09/19/82/1046091982.db2.gz MYESPXCKLZPESH-INIZCTEOSA-N 1 0 324.468 4.242 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c(O)c1C ZINC000756497256 1046092184 /nfs/dbraw/zinc/09/21/84/1046092184.db2.gz MYESPXCKLZPESH-MRXNPFEDSA-N 1 0 324.468 4.242 20 10 DICDRO Cc1ccc([C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C2CCC2)o1 ZINC000756496587 1046093001 /nfs/dbraw/zinc/09/30/01/1046093001.db2.gz PFHCKFWPFRZTLZ-LJQANCHMSA-N 1 0 316.420 4.424 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOc3c(C)cccc32)c(O)c1C ZINC000756518424 1046094148 /nfs/dbraw/zinc/09/41/48/1046094148.db2.gz WATBXVMIHHBJED-MAUKXSAKSA-N 1 0 311.425 4.492 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2c[nH]c3cc(C)ccc23)c1 ZINC000756516994 1046094305 /nfs/dbraw/zinc/09/43/05/1046094305.db2.gz MHQCGRYVBCNPKX-CQSZACIVSA-N 1 0 324.424 4.084 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)CCc2ccc(O)cc2)c(O)c1C ZINC000756532180 1046095972 /nfs/dbraw/zinc/09/59/72/1046095972.db2.gz FBTOXWYINRPHJC-GDBMZVCRSA-N 1 0 313.441 4.387 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1cc2c(cc1O)CCCC2 ZINC000756534488 1046096921 /nfs/dbraw/zinc/09/69/21/1046096921.db2.gz KXOYMLTWAYOGPS-HNNXBMFYSA-N 1 0 324.468 4.188 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3O)c2c1c(F)ccc2O ZINC000756549964 1046097717 /nfs/dbraw/zinc/09/77/17/1046097717.db2.gz PPEYBSDHOGLDGX-WKPIXPDZSA-N 1 0 313.372 4.062 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000756554733 1046100537 /nfs/dbraw/zinc/10/05/37/1046100537.db2.gz PRTXHDOMOMQJBL-INIZCTEOSA-N 1 0 312.457 4.316 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)cs1 ZINC000756568382 1046100792 /nfs/dbraw/zinc/10/07/92/1046100792.db2.gz DQSOVGFZHJTYIK-JBLDHEPKSA-N 1 0 320.433 4.449 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(F)cc2F)c(O)c1C ZINC000756578890 1046102888 /nfs/dbraw/zinc/10/28/88/1046102888.db2.gz XNZNETOAZGCRGM-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO CC(C)n1cc([C@@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)cn1 ZINC000756575863 1046102897 /nfs/dbraw/zinc/10/28/97/1046102897.db2.gz QSCXBSRKQFVWGS-JMSVASOKSA-N 1 0 317.408 4.208 20 10 DICDRO COc1ccc2[nH]cc(CC[NH2+][C@@H](C)c3ccc(C)cc3O)c2c1 ZINC000756575346 1046103246 /nfs/dbraw/zinc/10/32/46/1046103246.db2.gz PLUJVAJBYRSHGT-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2c[nH]c3ccc(F)cc23)c1 ZINC000756589960 1046104455 /nfs/dbraw/zinc/10/44/55/1046104455.db2.gz NLNXHOBJUGPVNJ-ZDUSSCGKSA-N 1 0 312.388 4.214 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCCNc2ccccc2)c2c1c(F)ccc2O ZINC000756589809 1046104872 /nfs/dbraw/zinc/10/48/72/1046104872.db2.gz NCUVFKMDDAQHOM-BBRMVZONSA-N 1 0 314.404 4.171 20 10 DICDRO Cc1cccc(F)c1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756608362 1046108902 /nfs/dbraw/zinc/10/89/02/1046108902.db2.gz KUDJSRXIBBEJED-XHDPSFHLSA-N 1 0 303.352 4.317 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(Cl)cc1 ZINC000756614708 1046109822 /nfs/dbraw/zinc/10/98/22/1046109822.db2.gz UXLYFEROBDYUPH-FZKQIMNGSA-N 1 0 319.832 4.392 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)C(C)C ZINC000756628365 1046111794 /nfs/dbraw/zinc/11/17/94/1046111794.db2.gz LSNYPQANMMDIPV-JGGQBBKZSA-N 1 0 309.425 4.120 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)C1CCOCC1 ZINC000756627310 1046111992 /nfs/dbraw/zinc/11/19/92/1046111992.db2.gz HEOLJYPHSLZNIN-IFXJQAMLSA-N 1 0 317.473 4.127 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)c2ccc(F)cc2F)c1 ZINC000756620904 1046112443 /nfs/dbraw/zinc/11/24/43/1046112443.db2.gz OHDIBXGMTDLJTA-QWHCGFSZSA-N 1 0 305.368 4.433 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)c2ccc(F)cc2F)c(O)c1 ZINC000756620518 1046112727 /nfs/dbraw/zinc/11/27/27/1046112727.db2.gz KKUHETDAJUZHQR-STQMWFEESA-N 1 0 305.368 4.433 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(F)ccc2SC)c1 ZINC000756628852 1046112834 /nfs/dbraw/zinc/11/28/34/1046112834.db2.gz YKSFLZNQXLNXCM-LLVKDONJSA-N 1 0 321.417 4.113 20 10 DICDRO CC[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)Oc1ccccc1F ZINC000756638216 1046113648 /nfs/dbraw/zinc/11/36/48/1046113648.db2.gz NPUSCXQLKTUCAA-OCCSQVGLSA-N 1 0 321.367 4.179 20 10 DICDRO C[C@H]([NH2+]CCc1cc(F)ccc1F)c1cc(Cl)ccc1O ZINC000756638020 1046113843 /nfs/dbraw/zinc/11/38/43/1046113843.db2.gz QKINVSPGUJCHRL-JTQLQIEISA-N 1 0 311.759 4.217 20 10 DICDRO C[C@@H](C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2)c1ccncc1 ZINC000756636291 1046114132 /nfs/dbraw/zinc/11/41/32/1046114132.db2.gz WMHAROZNFUDJDA-LSDHHAIUSA-N 1 0 310.441 4.120 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2SCCc3ccccc32)c(O)c1 ZINC000756634084 1046114271 /nfs/dbraw/zinc/11/42/71/1046114271.db2.gz LULWGJMOKXBCRW-LIRRHRJNSA-N 1 0 313.466 4.382 20 10 DICDRO CC[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)Oc1ccccc1F ZINC000756639407 1046114551 /nfs/dbraw/zinc/11/45/51/1046114551.db2.gz YIRIVKFGIVUULW-LSDHHAIUSA-N 1 0 317.404 4.348 20 10 DICDRO C[C@H](Cc1ccncc1)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756632983 1046114747 /nfs/dbraw/zinc/11/47/47/1046114747.db2.gz GJSQJJXJNLMZQC-CABCVRRESA-N 1 0 306.409 4.222 20 10 DICDRO C[C@H]([NH2+]CCNc1ccccc1)c1cc2c(cc1O)CCCC2 ZINC000756640446 1046116353 /nfs/dbraw/zinc/11/63/53/1046116353.db2.gz BGJJAEKDVUKDJL-HNNXBMFYSA-N 1 0 310.441 4.034 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CC2(CCO)CCCCC2)c2c1c(F)ccc2O ZINC000756647488 1046116413 /nfs/dbraw/zinc/11/64/13/1046116413.db2.gz GZMVNTHQSXPRBM-HIFRSBDPSA-N 1 0 321.436 4.002 20 10 DICDRO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CCO1 ZINC000756665987 1046118132 /nfs/dbraw/zinc/11/81/32/1046118132.db2.gz XYLHPJLFZOQLNC-NQYLQCIDSA-N 1 0 317.473 4.125 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756671356 1046118847 /nfs/dbraw/zinc/11/88/47/1046118847.db2.gz GWRMDJQABHYHLE-SWLSCSKDSA-N 1 0 315.388 4.186 20 10 DICDRO C[C@@]1(F)CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001138215675 1046119934 /nfs/dbraw/zinc/11/99/34/1046119934.db2.gz OCFABRUYNGYSBG-LJQANCHMSA-N 1 0 304.453 4.391 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1cc(C)ccc1O ZINC000756687393 1046120853 /nfs/dbraw/zinc/12/08/53/1046120853.db2.gz WBQZZJKPPOKZJI-RDTXWAMCSA-N 1 0 311.425 4.437 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)Oc1ccccc1 ZINC000756704130 1046122498 /nfs/dbraw/zinc/12/24/98/1046122498.db2.gz FQACZZDNLOOFSU-OLZOCXBDSA-N 1 0 305.805 4.164 20 10 DICDRO COC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccccc1 ZINC000756705225 1046122563 /nfs/dbraw/zinc/12/25/63/1046122563.db2.gz SGVQRWQZCRXHFH-KCXAZCMYSA-N 1 0 315.388 4.057 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccccc1O ZINC001138221001 1046122771 /nfs/dbraw/zinc/12/27/71/1046122771.db2.gz WRPXBIADWCXTBT-UHFFFAOYSA-N 1 0 324.468 4.405 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CC(c3ccccc3C)C2)c1 ZINC000756730630 1046123491 /nfs/dbraw/zinc/12/34/91/1046123491.db2.gz BHCPIZLCJCZLGK-FHERZECASA-N 1 0 311.425 4.306 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)Oc2ccccc2Cl)c(O)c1 ZINC000756732512 1046123684 /nfs/dbraw/zinc/12/36/84/1046123684.db2.gz MCOFHNFDPRNGHE-KGLIPLIRSA-N 1 0 319.832 4.472 20 10 DICDRO CC(C)[C@@H]1OCCC[C@H]1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756735818 1046123701 /nfs/dbraw/zinc/12/37/01/1046123701.db2.gz IXXUVVZNRVWTEH-CFLYGVGMSA-N 1 0 321.436 4.120 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1N(C)C)c1cc2c(cc1O)CCCC2 ZINC000756730880 1046124498 /nfs/dbraw/zinc/12/44/98/1046124498.db2.gz UDXVNNMTMRKSPS-OAHLLOKOSA-N 1 0 324.468 4.188 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1cccc(Cl)c1 ZINC000756731189 1046124657 /nfs/dbraw/zinc/12/46/57/1046124657.db2.gz FNJQKJKBXFZOOC-UGSOOPFHSA-N 1 0 319.832 4.392 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@H]2C)c(O)c1 ZINC000756744373 1046125507 /nfs/dbraw/zinc/12/55/07/1046125507.db2.gz AMCLLQXELMOCLT-ODCFSMADSA-N 1 0 311.425 4.304 20 10 DICDRO Cc1cccc(NCC[NH2+][C@@H](C)c2ccc3ccccc3c2O)n1 ZINC000756747499 1046125848 /nfs/dbraw/zinc/12/58/48/1046125848.db2.gz PQNIXQRCOOHFAL-HNNXBMFYSA-N 1 0 321.424 4.012 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)c(O)c1 ZINC000756744365 1046125892 /nfs/dbraw/zinc/12/58/92/1046125892.db2.gz AMCLLQXELMOCLT-IGMJJTELSA-N 1 0 311.425 4.304 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@H]1Oc2ccccc2[C@H]1C ZINC000756747887 1046126494 /nfs/dbraw/zinc/12/64/94/1046126494.db2.gz SEAJCSCWQQGJQM-VWQQLOEOSA-N 1 0 315.388 4.135 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2nc(C3CC3)cs2)c2c1c(F)ccc2O ZINC000756758424 1046127627 /nfs/dbraw/zinc/12/76/27/1046127627.db2.gz FMYFARYPAUQWFK-SKDRFNHKSA-N 1 0 318.417 4.203 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@@H](C)c3c1c(O)ccc3F)CO2 ZINC000756758278 1046127922 /nfs/dbraw/zinc/12/79/22/1046127922.db2.gz DDZSGZAXYDYJCZ-BYCMXARLSA-N 1 0 313.372 4.111 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(C3CCCC3)n2)c(O)c1C ZINC000756761609 1046128043 /nfs/dbraw/zinc/12/80/43/1046128043.db2.gz UHIBTJQHJRLUOH-OAHLLOKOSA-N 1 0 313.445 4.171 20 10 DICDRO C[C@H]([NH2+]CCC[C@H]1CCCC[C@H]1O)c1cc(Cl)ccc1O ZINC000756761743 1046128205 /nfs/dbraw/zinc/12/82/05/1046128205.db2.gz UZWHRCLTCXAMHS-WOSRLPQWSA-N 1 0 311.853 4.028 20 10 DICDRO Cc1ncc(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)s1 ZINC000756762080 1046128266 /nfs/dbraw/zinc/12/82/66/1046128266.db2.gz SQTVZTILTPNGQO-GFCCVEGCSA-N 1 0 312.438 4.204 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1Cl ZINC000756760147 1046128466 /nfs/dbraw/zinc/12/84/66/1046128466.db2.gz LZZQGTZKOXBIBW-ACJLOTCBSA-N 1 0 319.832 4.392 20 10 DICDRO Cc1cc([C@@H]2CCC[N@H+]2Cc2c(C)n(C)c3ccccc23)no1 ZINC001138252888 1046129482 /nfs/dbraw/zinc/12/94/82/1046129482.db2.gz XDICPNKCMIUEKZ-IBGZPJMESA-N 1 0 309.413 4.120 20 10 DICDRO Cc1cc([C@H]2CCC[N@H+]2Cc2c(C)n(C)c3ccccc23)no1 ZINC001138252891 1046129842 /nfs/dbraw/zinc/12/98/42/1046129842.db2.gz XDICPNKCMIUEKZ-LJQANCHMSA-N 1 0 309.413 4.120 20 10 DICDRO COc1cccc(C(C)(C)C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000756770384 1046130172 /nfs/dbraw/zinc/13/01/72/1046130172.db2.gz UXYREYHKLSFBOO-ZDUSSCGKSA-N 1 0 317.404 4.168 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCOC3(CCCC3)C2)c2c1c(F)ccc2O ZINC000756764394 1046130219 /nfs/dbraw/zinc/13/02/19/1046130219.db2.gz IJOUSZHYCPRPRL-NFAWXSAZSA-N 1 0 319.420 4.161 20 10 DICDRO CC[N@H+](Cc1c(C)n(C)c2ccccc12)Cc1ccccc1O ZINC001138258660 1046131413 /nfs/dbraw/zinc/13/14/13/1046131413.db2.gz XUYBQPWTSFGWPG-UHFFFAOYSA-N 1 0 308.425 4.214 20 10 DICDRO Cc1c(C[N@H+]2CCC(=O)[C@H](C)C23CCCC3)c2ccccc2n1C ZINC001138260180 1046131574 /nfs/dbraw/zinc/13/15/74/1046131574.db2.gz YCCFLPALQMWBER-HNNXBMFYSA-N 1 0 324.468 4.210 20 10 DICDRO COc1cccc2c1CC[N@H+](Cc1c(C)n(C)c3ccccc31)C2 ZINC001138260182 1046131687 /nfs/dbraw/zinc/13/16/87/1046131687.db2.gz YCJLHYGNHBPEEY-UHFFFAOYSA-N 1 0 320.436 4.054 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000756781598 1046132307 /nfs/dbraw/zinc/13/23/07/1046132307.db2.gz HIWAQZKUZXOPDI-LPMFXHHGSA-N 1 0 317.404 4.267 20 10 DICDRO Cc1c(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c2ccccc2n1C ZINC001138257100 1046132243 /nfs/dbraw/zinc/13/22/43/1046132243.db2.gz VZVGKNNTBNKYET-OAQYLSRUSA-N 1 0 320.436 4.060 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C)[C@@H]2c2ccccc2)c(O)c1C ZINC000756784019 1046133284 /nfs/dbraw/zinc/13/32/84/1046133284.db2.gz KBRAQCMAKBITRD-FFZOFVMBSA-N 1 0 324.468 4.105 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756785300 1046133324 /nfs/dbraw/zinc/13/33/24/1046133324.db2.gz CRDVMXUHJVFGIV-BFQNTYOBSA-N 1 0 314.404 4.388 20 10 DICDRO COc1ccc(C[C@@H](C)C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000756783650 1046133655 /nfs/dbraw/zinc/13/36/55/1046133655.db2.gz GUUOIMCQNWVQQO-CVEARBPZSA-N 1 0 313.441 4.239 20 10 DICDRO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1cc(Cl)ccc1O ZINC000756785053 1046133678 /nfs/dbraw/zinc/13/36/78/1046133678.db2.gz RWEBTLXDNGDBKW-APPDUMDISA-N 1 0 302.805 4.243 20 10 DICDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000756790687 1046135871 /nfs/dbraw/zinc/13/58/71/1046135871.db2.gz NYLAOWXMRCMXQM-KSMMKXTCSA-N 1 0 317.404 4.267 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CC(c3ccc(F)cc3)C2)c1 ZINC000756834992 1046142818 /nfs/dbraw/zinc/14/28/18/1046142818.db2.gz JVBPVNIQOFTEQK-YGONEPDPSA-N 1 0 315.388 4.137 20 10 DICDRO C[N@H+](CCOCc1ccccc1)Cc1c(O)ccc2ccccc21 ZINC000756875455 1046147683 /nfs/dbraw/zinc/14/76/83/1046147683.db2.gz ZCMCMVULMNBCEM-UHFFFAOYSA-N 1 0 321.420 4.194 20 10 DICDRO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc3c(c2)CCCN3C)cn1 ZINC001138356062 1046154838 /nfs/dbraw/zinc/15/48/38/1046154838.db2.gz GKGMRQIYWGENFN-OAQYLSRUSA-N 1 0 321.468 4.110 20 10 DICDRO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)CCCN3C)cn1 ZINC001138356060 1046155317 /nfs/dbraw/zinc/15/53/17/1046155317.db2.gz GKGMRQIYWGENFN-NRFANRHFSA-N 1 0 321.468 4.110 20 10 DICDRO CN1CCCc2cc(C[N@@H+]3CCCC[C@H]3c3cccnc3)ccc21 ZINC001138358105 1046155463 /nfs/dbraw/zinc/15/54/63/1046155463.db2.gz MKEWQKJONANEAP-NRFANRHFSA-N 1 0 321.468 4.191 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccccc2)c(OC)c1 ZINC001138387312 1046162108 /nfs/dbraw/zinc/16/21/08/1046162108.db2.gz AWBDMXUYJSEOFS-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCCCC23CC3)c(OC)c1 ZINC001138390420 1046162346 /nfs/dbraw/zinc/16/23/46/1046162346.db2.gz WHCNIFBVTHSGER-UHFFFAOYSA-N 1 0 302.462 4.060 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2nccc3c2CCCC3)c(O)c1C ZINC000903182986 1046184361 /nfs/dbraw/zinc/18/43/61/1046184361.db2.gz WQWAQJGUGIXXRX-OAHLLOKOSA-N 1 0 310.441 4.134 20 10 DICDRO C[C@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1cc(F)cc(F)c1O ZINC000757613674 1046192973 /nfs/dbraw/zinc/19/29/73/1046192973.db2.gz NMUKVEOJFDEEJK-JTQLQIEISA-N 1 0 324.346 4.044 20 10 DICDRO C[C@@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1cc(Cl)ccc1O ZINC000757615558 1046195389 /nfs/dbraw/zinc/19/53/89/1046195389.db2.gz VMWLQRMVECNLKS-LLVKDONJSA-N 1 0 322.811 4.419 20 10 DICDRO C[C@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1cc(Cl)ccc1O ZINC000757615559 1046196146 /nfs/dbraw/zinc/19/61/46/1046196146.db2.gz VMWLQRMVECNLKS-NSHDSACASA-N 1 0 322.811 4.419 20 10 DICDRO C[C@@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1ccc2ccccc2c1O ZINC000757654318 1046197586 /nfs/dbraw/zinc/19/75/86/1046197586.db2.gz ABUAPYAXUNAFNP-OAGGEKHMSA-N 1 0 313.441 4.401 20 10 DICDRO C[C@@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1ccc2ccccc2c1O ZINC000757654317 1046198146 /nfs/dbraw/zinc/19/81/46/1046198146.db2.gz ABUAPYAXUNAFNP-BZUAXINKSA-N 1 0 313.441 4.401 20 10 DICDRO CC[C@H]([NH2+]CCC1CCC(OC)CC1)c1ccc(N(C)C)cc1 ZINC000757678679 1046201286 /nfs/dbraw/zinc/20/12/86/1046201286.db2.gz DGOOZAMRZRNZIN-GQOXECLESA-N 1 0 318.505 4.389 20 10 DICDRO C[C@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1ccc2ccccc2c1O ZINC000903262317 1046210388 /nfs/dbraw/zinc/21/03/88/1046210388.db2.gz CQLGYBWIMKPMOY-QOKNQOGYSA-N 1 0 313.441 4.137 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)[C@H](C)c2ccncc2)cc1F ZINC000757883344 1046223212 /nfs/dbraw/zinc/22/32/12/1046223212.db2.gz ZXEGVTZWGFBVOU-OAHLLOKOSA-N 1 0 315.436 4.260 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000903334674 1046245444 /nfs/dbraw/zinc/24/54/44/1046245444.db2.gz FDVWXRKZEFGUTN-SPLOXXLWSA-N 1 0 322.452 4.468 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1cc(Cl)ccc1O ZINC000903335732 1046249210 /nfs/dbraw/zinc/24/92/10/1046249210.db2.gz STTXFNLKJLHWEC-DIFFPNOSSA-N 1 0 302.805 4.243 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1cc(Cl)ccc1O ZINC000903335733 1046249610 /nfs/dbraw/zinc/24/96/10/1046249610.db2.gz STTXFNLKJLHWEC-GTNSWQLSSA-N 1 0 302.805 4.243 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903338184 1046250621 /nfs/dbraw/zinc/25/06/21/1046250621.db2.gz GKNUHJUNBGONSX-ICSRJNTNSA-N 1 0 309.457 4.340 20 10 DICDRO CC(C)[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)cc1F ZINC000758507872 1046275363 /nfs/dbraw/zinc/27/53/63/1046275363.db2.gz MLALAUSCSDEESY-LJQANCHMSA-N 1 0 317.379 4.387 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000026237330 1046310635 /nfs/dbraw/zinc/31/06/35/1046310635.db2.gz ASAXJHTWQQSHPD-GOSISDBHSA-N 1 0 318.420 4.148 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(F)c(F)c1 ZINC000321530958 1046310877 /nfs/dbraw/zinc/31/08/77/1046310877.db2.gz YSHLZWNJGFDKDT-ZDUSSCGKSA-N 1 0 316.395 4.198 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(C)nc2)c(C)n1-c1ccccc1 ZINC000321599338 1046324647 /nfs/dbraw/zinc/32/46/47/1046324647.db2.gz KHILBORIAAKPQK-UHFFFAOYSA-N 1 0 305.425 4.087 20 10 DICDRO CCc1cccnc1[C@@H](C)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000780714340 1046400322 /nfs/dbraw/zinc/40/03/22/1046400322.db2.gz SNIIXFDXECIBAY-MRXNPFEDSA-N 1 0 311.473 4.341 20 10 DICDRO COC1(C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)CCC1 ZINC000780743941 1046401845 /nfs/dbraw/zinc/40/18/45/1046401845.db2.gz BVRMIFUJBDYATJ-OAHLLOKOSA-N 1 0 320.452 4.036 20 10 DICDRO Cc1cc(O)c(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)cc1C ZINC000780793881 1046406922 /nfs/dbraw/zinc/40/69/22/1046406922.db2.gz WHSZOTHAQLQAPY-TZMCWYRMSA-N 1 0 301.352 4.172 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000090886849 1046426874 /nfs/dbraw/zinc/42/68/74/1046426874.db2.gz IQRJUTOUPZUWSW-PXAZEXFGSA-N 1 0 301.434 4.159 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(C)(c3ccccc3)CC2)cc1 ZINC001168222555 1046432353 /nfs/dbraw/zinc/43/23/53/1046432353.db2.gz KJGRFGRKTDAXJD-UHFFFAOYSA-N 1 0 308.469 4.306 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1ccc(N(C)C)cc1 ZINC000090963525 1046432346 /nfs/dbraw/zinc/43/23/46/1046432346.db2.gz ICRCKRBBYVNIGW-CHWSQXEVSA-N 1 0 304.384 4.443 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(F)cc(OC)c2)cc1 ZINC000090972445 1046434207 /nfs/dbraw/zinc/43/42/07/1046434207.db2.gz XTZZIJZGCSNAFG-AWEZNQCLSA-N 1 0 316.420 4.141 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCCC23CCCCC3)c1O ZINC001168235177 1046435755 /nfs/dbraw/zinc/43/57/55/1046435755.db2.gz QSKBBUJQYSIWBN-UHFFFAOYSA-N 1 0 305.393 4.033 20 10 DICDRO COc1ccc2c(c1)CCCCN2C[C@@H]1CCCC[N@@H+]1C(C)C ZINC001168245208 1046448086 /nfs/dbraw/zinc/44/80/86/1046448086.db2.gz ZDFUONRKJXTRJR-SFHVURJKSA-N 1 0 316.489 4.101 20 10 DICDRO C[N@H+](Cc1ccc(-c2ccccc2)nc1)Cc1ccccc1O ZINC001139519094 1046459813 /nfs/dbraw/zinc/45/98/13/1046459813.db2.gz MQNVBIFZWMEBKR-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO C[N@H+](Cc1cnc(-c2cccs2)s1)Cc1ccccc1O ZINC000091974473 1046490285 /nfs/dbraw/zinc/49/02/85/1046490285.db2.gz QXDYAHJHNFFZGF-UHFFFAOYSA-N 1 0 316.451 4.209 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](CC)[C@H](C)c2cccc(O)c2)c1 ZINC000091975275 1046491295 /nfs/dbraw/zinc/49/12/95/1046491295.db2.gz IIRXBXDZQUEPLT-CQSZACIVSA-N 1 0 315.413 4.080 20 10 DICDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc(N(C)C)c(C)c3)C2)cc1 ZINC001139674173 1046497054 /nfs/dbraw/zinc/49/70/54/1046497054.db2.gz SSQNOQPBJOSDKQ-LJQANCHMSA-N 1 0 324.468 4.059 20 10 DICDRO CSCC1(CC[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000826937320 1046501251 /nfs/dbraw/zinc/50/12/51/1046501251.db2.gz LMLJOQUHHKEXDT-UHFFFAOYSA-N 1 0 301.455 4.168 20 10 DICDRO COc1ccc(C[NH2+]CC2CCC(C(F)(F)F)CC2)cc1C ZINC000237335276 1046517686 /nfs/dbraw/zinc/51/76/86/1046517686.db2.gz DSLYJHXJWBLAOS-UHFFFAOYSA-N 1 0 315.379 4.462 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccc(Cl)nc1 ZINC000179128849 1046524415 /nfs/dbraw/zinc/52/44/15/1046524415.db2.gz WEQORUISQVQYMH-SNVBAGLBSA-N 1 0 313.879 4.025 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)ccc1Cl)c1ccc(N(C)C)cc1 ZINC000782543242 1046535695 /nfs/dbraw/zinc/53/56/95/1046535695.db2.gz GSJIOWHXNOSZQI-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc(F)c3ccccc13)CC2 ZINC001139892734 1046546707 /nfs/dbraw/zinc/54/67/07/1046546707.db2.gz VAYKEMDOYHMQNL-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccc(F)c1 ZINC000783232742 1046565894 /nfs/dbraw/zinc/56/58/94/1046565894.db2.gz WLFYEGHMZGBHRK-KRWDZBQOSA-N 1 0 304.384 4.272 20 10 DICDRO Cc1ncc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)s1 ZINC000729681985 1046575996 /nfs/dbraw/zinc/57/59/96/1046575996.db2.gz DPOUJIYEVLPZBZ-UHFFFAOYSA-N 1 0 310.422 4.114 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(Cc2ccc(F)cc2)CC1 ZINC001140055000 1046576967 /nfs/dbraw/zinc/57/69/67/1046576967.db2.gz DDVQURXUSMEXBG-UHFFFAOYSA-N 1 0 317.379 4.125 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(Sc2ccccc2)CC1 ZINC001140058730 1046577917 /nfs/dbraw/zinc/57/79/17/1046577917.db2.gz JTPHDUQSXKCGPY-UHFFFAOYSA-N 1 0 317.429 4.288 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC2(C=Cc3ccccc32)CC1 ZINC001140062693 1046583402 /nfs/dbraw/zinc/58/34/02/1046583402.db2.gz DMBPPESQEJXRTF-UHFFFAOYSA-N 1 0 309.384 4.092 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2cnccc21 ZINC000783377927 1046586210 /nfs/dbraw/zinc/58/62/10/1046586210.db2.gz LAPZETYNGDVAHH-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)c2ccccc2O)ccc1OC(C)C ZINC000783500281 1046600382 /nfs/dbraw/zinc/60/03/82/1046600382.db2.gz UQBQEUYSUZMUCE-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO C[C@@H]([NH2+]Cc1ccnc(Oc2ccccc2)c1)c1ccccc1O ZINC000783500512 1046600465 /nfs/dbraw/zinc/60/04/65/1046600465.db2.gz WMMYKYJDFDYVSR-OAHLLOKOSA-N 1 0 320.392 4.430 20 10 DICDRO COc1ccccc1C[C@@H]([NH2+][C@H](C)c1ccccc1O)C(C)C ZINC000783517400 1046604011 /nfs/dbraw/zinc/60/40/11/1046604011.db2.gz JHTXSAUXFCYZLZ-CRAIPNDOSA-N 1 0 313.441 4.319 20 10 DICDRO COc1ccccc1C[C@@H]([NH2+][C@@H](C)c1ccccc1O)C(C)C ZINC000783517401 1046604161 /nfs/dbraw/zinc/60/41/61/1046604161.db2.gz JHTXSAUXFCYZLZ-MAUKXSAKSA-N 1 0 313.441 4.319 20 10 DICDRO CCOc1ccc(Cl)cc1CC[NH2+][C@H](C)c1ccccc1O ZINC000783526073 1046605088 /nfs/dbraw/zinc/60/50/88/1046605088.db2.gz RMCILQUTTUMDQU-CYBMUJFWSA-N 1 0 319.832 4.338 20 10 DICDRO C[N@H+](Cc1ccc(-c2ccncc2)cc1)Cc1ccccc1O ZINC001140171718 1046606239 /nfs/dbraw/zinc/60/62/39/1046606239.db2.gz VGJMQCIUVBBXCB-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO Cc1ccc(C)c(C[N@H+](C)Cc2ncccc2C(F)(F)F)c1O ZINC001140178356 1046609569 /nfs/dbraw/zinc/60/95/69/1046609569.db2.gz JIQGHNVAZUWLTH-UHFFFAOYSA-N 1 0 324.346 4.055 20 10 DICDRO Cc1ccc(C)c(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1O ZINC001140180564 1046609809 /nfs/dbraw/zinc/60/98/09/1046609809.db2.gz ZAZXXHOBOCPZMW-UHFFFAOYSA-N 1 0 324.468 4.241 20 10 DICDRO Cc1ccc(C)c(C[N@@H+]2CCc3c4ccccc4oc3C2)c1O ZINC001140184081 1046610395 /nfs/dbraw/zinc/61/03/95/1046610395.db2.gz MCCIBDLNUJQELM-UHFFFAOYSA-N 1 0 307.393 4.314 20 10 DICDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(Cl)ccc2O)s1 ZINC000093275193 1046619359 /nfs/dbraw/zinc/61/93/59/1046619359.db2.gz SEVHBUHGFALTGJ-SNVBAGLBSA-N 1 0 310.850 4.312 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1OC(F)(F)F)CC2 ZINC000834496587 1046622559 /nfs/dbraw/zinc/62/25/59/1046622559.db2.gz NIGUTBJEVNQKME-CYBMUJFWSA-N 1 0 323.314 4.068 20 10 DICDRO CC(C)OCc1ccccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834535004 1046626903 /nfs/dbraw/zinc/62/69/03/1046626903.db2.gz WVZFEFWAHQXEBG-SFHVURJKSA-N 1 0 311.425 4.094 20 10 DICDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)cs1 ZINC000834549114 1046629163 /nfs/dbraw/zinc/62/91/63/1046629163.db2.gz VNESBHULLQQEDX-CQSZACIVSA-N 1 0 300.471 4.290 20 10 DICDRO C[C@H](NC(C)(C)C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834584989 1046634130 /nfs/dbraw/zinc/63/41/30/1046634130.db2.gz BMSRWSQTPWTWLQ-YJBOKZPZSA-N 1 0 324.468 4.099 20 10 DICDRO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(C)ccc2O)s1 ZINC000093612587 1046634575 /nfs/dbraw/zinc/63/45/75/1046634575.db2.gz RPAKFHKQNGTYJT-ZDUSSCGKSA-N 1 0 304.459 4.221 20 10 DICDRO C[N@H+](Cc1cccc(-c2nccs2)c1)Cc1ccccc1O ZINC001140336854 1046665159 /nfs/dbraw/zinc/66/51/59/1046665159.db2.gz QEYSPHMTRLPFCW-UHFFFAOYSA-N 1 0 310.422 4.148 20 10 DICDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1c(O)cccc1Cl ZINC001140341212 1046666355 /nfs/dbraw/zinc/66/63/55/1046666355.db2.gz DJCNYJYMBGIQDH-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCSc2ccccc2C1 ZINC001140342183 1046667704 /nfs/dbraw/zinc/66/77/04/1046667704.db2.gz WFCCQXDNHQXUDG-UHFFFAOYSA-N 1 0 305.830 4.154 20 10 DICDRO CC[C@H]([NH2+]CCCC1CCOCC1)c1ccc(N(C)C)cc1 ZINC000834818063 1046675650 /nfs/dbraw/zinc/67/56/50/1046675650.db2.gz HEDPMLZXHGYHOT-IBGZPJMESA-N 1 0 304.478 4.000 20 10 DICDRO C[C@@H](CCO)CC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834832881 1046679949 /nfs/dbraw/zinc/67/99/49/1046679949.db2.gz SOTZELKDJADDIP-MSOLQXFVSA-N 1 0 318.505 4.126 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2cc(F)cnc2Cl)c2c1c(F)ccc2O ZINC000834836284 1046680098 /nfs/dbraw/zinc/68/00/98/1046680098.db2.gz LWIOJPWAZOIYSM-UFBFGSQYSA-N 1 0 324.758 4.057 20 10 DICDRO C[C@H]([NH2+][C@H]1CCn2ccnc21)c1ccc(N2CCCCCC2)cc1 ZINC000834834668 1046680162 /nfs/dbraw/zinc/68/01/62/1046680162.db2.gz DWVJRXWMDGQWID-LPHOPBHVSA-N 1 0 324.472 4.059 20 10 DICDRO C[C@@H]([NH2+]CC[C@H](C)CCO)c1ccc(N2CCCCCC2)cc1 ZINC000834832884 1046680869 /nfs/dbraw/zinc/68/08/69/1046680869.db2.gz SOTZELKDJADDIP-ZWKOTPCHSA-N 1 0 318.505 4.126 20 10 DICDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000834843804 1046684243 /nfs/dbraw/zinc/68/42/43/1046684243.db2.gz MCVKLMJTUPTRMH-OLZOCXBDSA-N 1 0 319.367 4.017 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)c1ccccn1)c1cc(Cl)ccc1O ZINC000834850801 1046686310 /nfs/dbraw/zinc/68/63/10/1046686310.db2.gz PJPJWBHZHXYXTL-LBPRGKRZSA-N 1 0 304.821 4.069 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000834881762 1046694732 /nfs/dbraw/zinc/69/47/32/1046694732.db2.gz ALMAZQGNHVEGLU-HOTGVXAUSA-N 1 0 303.446 4.009 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000834881760 1046695402 /nfs/dbraw/zinc/69/54/02/1046695402.db2.gz ALMAZQGNHVEGLU-CVEARBPZSA-N 1 0 303.446 4.009 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000834882266 1046697397 /nfs/dbraw/zinc/69/73/97/1046697397.db2.gz IFVYJXKNNGHSSV-CJNGLKHVSA-N 1 0 323.864 4.436 20 10 DICDRO CC[C@@H]([NH2+]CCCc1ncccc1C)c1ccc(N(C)C)cc1 ZINC000834884156 1046698383 /nfs/dbraw/zinc/69/83/83/1046698383.db2.gz WHQSHQHYGWNWTC-LJQANCHMSA-N 1 0 311.473 4.130 20 10 DICDRO CC[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1ccc(F)cc1[O-] ZINC000834885267 1046698418 /nfs/dbraw/zinc/69/84/18/1046698418.db2.gz UOZFPDYIHGYAIX-WCQYABFASA-N 1 0 306.208 4.156 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834885302 1046698445 /nfs/dbraw/zinc/69/84/45/1046698445.db2.gz VGYSPPUWJFDKHB-RISCZKNCSA-N 1 0 302.245 4.244 20 10 DICDRO COC[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000834885782 1046698862 /nfs/dbraw/zinc/69/88/62/1046698862.db2.gz YAWVBWMXBHKYQC-ZFWWWQNUSA-N 1 0 319.832 4.126 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCO[C@H](C(C)C)C1)c1ccc(C)cc1O ZINC000834885940 1046701222 /nfs/dbraw/zinc/70/12/22/1046701222.db2.gz NSMUOKXNCPIPLX-IEZWGBDMSA-N 1 0 305.462 4.193 20 10 DICDRO CC[C@@H]([NH2+]CCc1ncccc1C)c1cc(Cl)ccc1O ZINC000834886673 1046701524 /nfs/dbraw/zinc/70/15/24/1046701524.db2.gz VNAMVRAOAQAMDS-OAHLLOKOSA-N 1 0 304.821 4.032 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccc2ccccc2c1O ZINC000834892654 1046702346 /nfs/dbraw/zinc/70/23/46/1046702346.db2.gz CEEQGGHASXPYPX-IIYDPXPESA-N 1 0 307.397 4.099 20 10 DICDRO Cc1ccncc1C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000834889132 1046703507 /nfs/dbraw/zinc/70/35/07/1046703507.db2.gz UWBCGOVWRQBLKH-QGZVFWFLSA-N 1 0 309.457 4.231 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1nccn1CC)c1cc(Cl)ccc1O ZINC000834894918 1046704016 /nfs/dbraw/zinc/70/40/16/1046704016.db2.gz MZEIYJPMINWMEX-RISCZKNCSA-N 1 0 307.825 4.064 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc(N2CCCCC2)cc1 ZINC000834895718 1046705250 /nfs/dbraw/zinc/70/52/50/1046705250.db2.gz CVOGJVZYGSCACE-TXPKVOOTSA-N 1 0 324.472 4.230 20 10 DICDRO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000834897255 1046708061 /nfs/dbraw/zinc/70/80/61/1046708061.db2.gz ZBQYJMYQMABLNV-ZIAGYGMSSA-N 1 0 309.413 4.174 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCN(C)c3ccccc32)c1 ZINC000834903705 1046713421 /nfs/dbraw/zinc/71/34/21/1046713421.db2.gz LMAYWYXMLFVKPN-QAPCUYQASA-N 1 0 310.441 4.323 20 10 DICDRO CC[C@@H]([NH2+]C1CCC(OC(F)F)CC1)c1ccc(C)cc1O ZINC000834904043 1046716153 /nfs/dbraw/zinc/71/61/53/1046716153.db2.gz MJLASWIABDRIKL-SSDMNJCBSA-N 1 0 313.388 4.292 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1ccc(N(C)C)cc1 ZINC000834905205 1046716835 /nfs/dbraw/zinc/71/68/35/1046716835.db2.gz RIBGTWZVURBTHM-UZLBHIALSA-N 1 0 323.484 4.375 20 10 DICDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)nc1 ZINC000834909593 1046717388 /nfs/dbraw/zinc/71/73/88/1046717388.db2.gz PAPHMXJRTOUAQL-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO CC[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cc1[O-] ZINC000796694365 1046717674 /nfs/dbraw/zinc/71/76/74/1046717674.db2.gz IOXRLQVLRGBGGD-MAUKXSAKSA-N 1 0 322.468 4.227 20 10 DICDRO CC[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(F)cc1[O-] ZINC000796694368 1046717758 /nfs/dbraw/zinc/71/77/58/1046717758.db2.gz IOXRLQVLRGBGGD-QAPCUYQASA-N 1 0 322.468 4.227 20 10 DICDRO CCC[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccccn1 ZINC000835038223 1046742498 /nfs/dbraw/zinc/74/24/98/1046742498.db2.gz OUMGUASWXVGHLV-FUKPKEADSA-N 1 0 309.457 4.292 20 10 DICDRO CC[C@](C)([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1nccs1 ZINC000835040609 1046745979 /nfs/dbraw/zinc/74/59/79/1046745979.db2.gz QMHIQIXUUYNTCY-DKFQHHCZSA-N 1 0 315.486 4.137 20 10 DICDRO CC[C@@](C)([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1nccs1 ZINC000835040610 1046746886 /nfs/dbraw/zinc/74/68/86/1046746886.db2.gz QMHIQIXUUYNTCY-HPFMTEOYSA-N 1 0 315.486 4.137 20 10 DICDRO CC[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1nc(C)cs1 ZINC000835039115 1046746931 /nfs/dbraw/zinc/74/69/31/1046746931.db2.gz WNDUZFOBRLAEMI-JTGQJZMRSA-N 1 0 315.486 4.272 20 10 DICDRO CC[C@H](CC(F)(F)F)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835047327 1046748711 /nfs/dbraw/zinc/74/87/11/1046748711.db2.gz QTIDULUENSJYNW-VBROQKIQSA-N 1 0 300.368 4.086 20 10 DICDRO C[C@@H](CCCC(F)(F)F)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835048931 1046749044 /nfs/dbraw/zinc/74/90/44/1046749044.db2.gz NBBUOXWCISEMRH-VSKVDJIOSA-N 1 0 314.395 4.477 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cc1 ZINC000835048667 1046749692 /nfs/dbraw/zinc/74/96/92/1046749692.db2.gz KGDULVTZNXIHRU-JZIMQPMSSA-N 1 0 312.379 4.040 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C(C)(C)CC(F)(F)F)cc1 ZINC000835044574 1046749991 /nfs/dbraw/zinc/74/99/91/1046749991.db2.gz AKBQKMVZYUEECO-WAYWQWQTSA-N 1 0 300.368 4.086 20 10 DICDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)[C@@H](C)c1cccnc1 ZINC000835053895 1046750550 /nfs/dbraw/zinc/75/05/50/1046750550.db2.gz PZRCVHVVFDVSAQ-QWPQOLDESA-N 1 0 309.457 4.244 20 10 DICDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)[C@@H]1CCOC(C)(C)C1 ZINC000835055411 1046750591 /nfs/dbraw/zinc/75/05/91/1046750591.db2.gz IXUKXNRWSXVKMA-QULHZPMSSA-N 1 0 316.489 4.045 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH+]2CCC(c3ccncc3)CC2)cc1 ZINC000835053834 1046752183 /nfs/dbraw/zinc/75/21/83/1046752183.db2.gz PHPBCHGWCKMCOA-ARJAWSKDSA-N 1 0 321.468 4.040 20 10 DICDRO CCc1ccc([C@H](O)C[NH2+][C@@H](CC)c2ccc(C)cc2O)cc1 ZINC000797014674 1046771266 /nfs/dbraw/zinc/77/12/66/1046771266.db2.gz CCUSEDGHONXMGD-AZUAARDMSA-N 1 0 313.441 4.037 20 10 DICDRO CC[C@H]([NH2+]CCCc1cccc(C)n1)c1ccc(N(C)C)cc1 ZINC000797020541 1046772492 /nfs/dbraw/zinc/77/24/92/1046772492.db2.gz ZZERMRALODUVEB-FQEVSTJZSA-N 1 0 311.473 4.130 20 10 DICDRO Cc1cccc(CCC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000797015043 1046773497 /nfs/dbraw/zinc/77/34/97/1046773497.db2.gz GHMAVCMYWNGKCR-MLGOLLRUSA-N 1 0 314.404 4.005 20 10 DICDRO C[C@H]([NH2+]Cc1cnn2ccccc12)c1ccc2ccccc2c1O ZINC000797051847 1046780638 /nfs/dbraw/zinc/78/06/38/1046780638.db2.gz FGDIHHQCXMSVQF-AWEZNQCLSA-N 1 0 317.392 4.044 20 10 DICDRO CSCc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000797097921 1046790364 /nfs/dbraw/zinc/79/03/64/1046790364.db2.gz FJJIMNUPJBLPBA-AWEZNQCLSA-N 1 0 301.455 4.414 20 10 DICDRO CSCc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000797105186 1046791770 /nfs/dbraw/zinc/79/17/70/1046791770.db2.gz HTIQRBZHWIMCTL-HNNXBMFYSA-N 1 0 314.498 4.466 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1c(F)cncc1F ZINC000797125199 1046792954 /nfs/dbraw/zinc/79/29/54/1046792954.db2.gz IKDJNCGXHCXTAY-VYUIOLGVSA-N 1 0 322.330 4.104 20 10 DICDRO CCCN1CCC[C@H]1C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000797115826 1046793004 /nfs/dbraw/zinc/79/30/04/1046793004.db2.gz QWFAVIJFKBGCJC-RDJZCZTQSA-N 1 0 312.457 4.070 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1c(F)cncc1F ZINC000797125200 1046793447 /nfs/dbraw/zinc/79/34/47/1046793447.db2.gz IKDJNCGXHCXTAY-ZDMBXUJBSA-N 1 0 322.330 4.104 20 10 DICDRO Cc1cc2cc(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)ccc2[nH]1 ZINC000797131777 1046793878 /nfs/dbraw/zinc/79/38/78/1046793878.db2.gz CDBMIAHSPFTOJD-HNNXBMFYSA-N 1 0 307.441 4.393 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001140623933 1046817259 /nfs/dbraw/zinc/81/72/59/1046817259.db2.gz XSAJHBPLDFSELE-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)cc(C)c1O ZINC001140658835 1046840154 /nfs/dbraw/zinc/84/01/54/1046840154.db2.gz ZAIIPCDQQLKWJC-UHFFFAOYSA-N 1 0 324.468 4.241 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000797586629 1046856366 /nfs/dbraw/zinc/85/63/66/1046856366.db2.gz JDCQERABVSJRLL-CHWSQXEVSA-N 1 0 309.400 4.357 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1O ZINC001140747530 1046885302 /nfs/dbraw/zinc/88/53/02/1046885302.db2.gz DPOPSYCKFAAFBR-MRXNPFEDSA-N 1 0 319.351 4.022 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1cc(F)ccc1O ZINC000797998455 1046918050 /nfs/dbraw/zinc/91/80/50/1046918050.db2.gz HFMSRSJOYPNDOU-OBJOEFQTSA-N 1 0 303.352 4.267 20 10 DICDRO CSc1ccc(CC[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000797999417 1046918707 /nfs/dbraw/zinc/91/87/07/1046918707.db2.gz RGMQNWYYBNNTDN-AWEZNQCLSA-N 1 0 301.455 4.316 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCCc3ccccc3C2)c(O)c1 ZINC001140855943 1046931578 /nfs/dbraw/zinc/93/15/78/1046931578.db2.gz NNGNFSQKWDMGLB-UHFFFAOYSA-N 1 0 324.468 4.187 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCCC3(CCC3)C2)c(O)c1 ZINC001140857251 1046932478 /nfs/dbraw/zinc/93/24/78/1046932478.db2.gz NIKTVLVPYWHXID-UHFFFAOYSA-N 1 0 302.462 4.005 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c(Cl)c1 ZINC001140924132 1046950161 /nfs/dbraw/zinc/95/01/61/1046950161.db2.gz MKSRMLCMSZHNAB-SFHVURJKSA-N 1 0 315.848 4.138 20 10 DICDRO CN(C)c1ccc(CN2CCc3sccc3C2)c(Cl)c1 ZINC001140922494 1046950360 /nfs/dbraw/zinc/95/03/60/1046950360.db2.gz RNCRYBVSTJXTBN-UHFFFAOYSA-N 1 0 306.862 4.026 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(Cl)c1 ZINC001140924131 1046950517 /nfs/dbraw/zinc/95/05/17/1046950517.db2.gz MKSRMLCMSZHNAB-GOSISDBHSA-N 1 0 315.848 4.138 20 10 DICDRO Cc1cc(O)c(CNc2ccc(Cl)c(C[NH+](C)C)c2)cc1C ZINC000798504043 1046959493 /nfs/dbraw/zinc/95/94/93/1046959493.db2.gz XXMWFFWHTFOKAA-UHFFFAOYSA-N 1 0 318.848 4.336 20 10 DICDRO Cc1cc(O)c(C[NH2+]C(C)(C)COCc2ccccc2)cc1C ZINC000798503027 1046959713 /nfs/dbraw/zinc/95/97/13/1046959713.db2.gz BFNVRBSFSPYGEF-UHFFFAOYSA-N 1 0 313.441 4.094 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]C2CCC3(CC3(F)F)CC2)c1O ZINC000827388804 1046960170 /nfs/dbraw/zinc/96/01/70/1046960170.db2.gz IUCGROXRAAANMJ-UHFFFAOYSA-N 1 0 315.791 4.412 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@H](Sc3ccc(F)cc3)C2)c(O)c1 ZINC001140957493 1046962435 /nfs/dbraw/zinc/96/24/35/1046962435.db2.gz BHGPBKFWOVZYNG-KRWDZBQOSA-N 1 0 317.429 4.206 20 10 DICDRO CCCc1ccc(C[NH2+][C@H]2CCN(c3ccc(OC)cc3)C2)cc1 ZINC001203089492 1046991135 /nfs/dbraw/zinc/99/11/35/1046991135.db2.gz GQGJZNRYEJQIPK-IBGZPJMESA-N 1 0 324.468 4.016 20 10 DICDRO c1ccc([C@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)nc1 ZINC000798965233 1046995003 /nfs/dbraw/zinc/99/50/03/1046995003.db2.gz QEGJJYGDCYEBQU-IBGZPJMESA-N 1 0 321.468 4.061 20 10 DICDRO CC(C)([NH2+]Cc1ccccc1O)c1ccccc1Br ZINC000179329169 1047000702 /nfs/dbraw/zinc/00/07/02/1047000702.db2.gz WCDHEUFBLBILOW-UHFFFAOYSA-N 1 0 320.230 4.180 20 10 DICDRO C[N@H+](Cc1cccs1)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076382 1047000623 /nfs/dbraw/zinc/00/06/23/1047000623.db2.gz QHJWXNMLMMTWIS-UHFFFAOYSA-N 1 0 312.482 4.079 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1ccc(F)cc1 ZINC000096970791 1047005751 /nfs/dbraw/zinc/00/57/51/1047005751.db2.gz UPKKPZTUNFSYIE-UHFFFAOYSA-N 1 0 311.356 4.327 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000096970877 1047007251 /nfs/dbraw/zinc/00/72/51/1047007251.db2.gz NHSSMJBZPKCHLW-UHFFFAOYSA-N 1 0 307.393 4.496 20 10 DICDRO Oc1ccc(O)c(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)c1 ZINC001141156044 1047029076 /nfs/dbraw/zinc/02/90/76/1047029076.db2.gz DKYMZHJNZLHYFM-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2cc(O)ccc2O)cc1C ZINC001141161962 1047030461 /nfs/dbraw/zinc/03/04/61/1047030461.db2.gz INCDEUZRQBMSQD-IBGZPJMESA-N 1 0 311.425 4.442 20 10 DICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1ccc(N2CCCC2)cc1 ZINC001116437320 1047140250 /nfs/dbraw/zinc/14/02/50/1047140250.db2.gz YOUNDZRUGCDENZ-UHFFFAOYSA-N 1 0 324.468 4.318 20 10 DICDRO CCc1cccc(C[NH2+]C2(c3cccc(OC)c3)CCC2)c1O ZINC000827661952 1047149161 /nfs/dbraw/zinc/14/91/61/1047149161.db2.gz IPFOKNSXYTZDAN-UHFFFAOYSA-N 1 0 311.425 4.132 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc(Cl)nc1 ZINC001116565198 1047156273 /nfs/dbraw/zinc/15/62/73/1047156273.db2.gz KOUDCMXHWPRJSP-WCQYABFASA-N 1 0 302.805 4.087 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)cc1C ZINC000098172994 1047162094 /nfs/dbraw/zinc/16/20/94/1047162094.db2.gz RQTMGJHWHPGXJX-QGZVFWFLSA-N 1 0 315.388 4.146 20 10 DICDRO CC[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccc(C)cc1O ZINC001116889894 1047186645 /nfs/dbraw/zinc/18/66/45/1047186645.db2.gz JXPBMBMDQAFOFQ-GOSISDBHSA-N 1 0 317.473 4.481 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)COc1ccccc1F)c1ccc(C)cc1O ZINC001116889997 1047187400 /nfs/dbraw/zinc/18/74/00/1047187400.db2.gz MECXPZJIPIQZMB-YOEHRIQHSA-N 1 0 317.404 4.348 20 10 DICDRO FC(F)(F)CC1C[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000839138786 1047197049 /nfs/dbraw/zinc/19/70/49/1047197049.db2.gz TXMARGQNDWZTLL-UHFFFAOYSA-N 1 0 312.379 4.061 20 10 DICDRO CC1(CC(F)(F)F)C[NH+](Cc2ccc3ccccc3c2O)C1 ZINC000839143870 1047198408 /nfs/dbraw/zinc/19/84/08/1047198408.db2.gz DGOSTJVXGNSTDX-UHFFFAOYSA-N 1 0 309.331 4.320 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH+]2CC(C(F)F)C2)cc1 ZINC000839141645 1047198851 /nfs/dbraw/zinc/19/88/51/1047198851.db2.gz UVCPERMCOFOROA-UHFFFAOYSA-N 1 0 322.424 4.081 20 10 DICDRO Cc1cc(NCc2cccc(Cl)c2O)ccc1C[NH+](C)C ZINC000839190181 1047204798 /nfs/dbraw/zinc/20/47/98/1047204798.db2.gz XDWUBGHJEPDZOS-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c1O ZINC000388597012 1047287807 /nfs/dbraw/zinc/28/78/07/1047287807.db2.gz UTKSMQKPGXLBHI-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO CS[C@@H]1CC[N@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000840117256 1047287970 /nfs/dbraw/zinc/28/79/70/1047287970.db2.gz UCSQMQWDZUZSMA-CYBMUJFWSA-N 1 0 313.422 4.229 20 10 DICDRO C[C@H]1CC2(CC([NH2+]Cc3cc(-c4ccccc4)ccc3O)C2)CO1 ZINC000897781080 1047291004 /nfs/dbraw/zinc/29/10/04/1047291004.db2.gz OJMDDMUVQRFHFY-ULUNDTCASA-N 1 0 323.436 4.106 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)CCOCc2ccccc2)cc1C ZINC000389952116 1047293348 /nfs/dbraw/zinc/29/33/48/1047293348.db2.gz XNTVWKHDWBRQNO-QGZVFWFLSA-N 1 0 313.441 4.089 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)COCc2ccccc2)c(O)c1 ZINC000389898449 1047293645 /nfs/dbraw/zinc/29/36/45/1047293645.db2.gz ABMDTAIMNQOPTE-IRXDYDNUSA-N 1 0 313.441 4.204 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(F)cc1F ZINC000390871200 1047302538 /nfs/dbraw/zinc/30/25/38/1047302538.db2.gz PENVPXPXBGBHLK-CYBMUJFWSA-N 1 0 316.395 4.198 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](c2ccccc2)N2CCCC2)c1 ZINC000392231560 1047308113 /nfs/dbraw/zinc/30/81/13/1047308113.db2.gz XALCXZRZRHEDHF-FXAWDEMLSA-N 1 0 324.468 4.188 20 10 DICDRO C[C@H](Cc1ccco1)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725845275 1047318742 /nfs/dbraw/zinc/31/87/42/1047318742.db2.gz SBNXHAIRJTULJP-OAHLLOKOSA-N 1 0 307.393 4.373 20 10 DICDRO CCOc1cccc(C[NH2+]CCCc2ccc(C)cc2C)c1O ZINC000725842049 1047319007 /nfs/dbraw/zinc/31/90/07/1047319007.db2.gz YQFOKIFGDIMOLI-UHFFFAOYSA-N 1 0 313.441 4.130 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](c2cccs2)C2CC2)c(O)c1 ZINC000725844272 1047319386 /nfs/dbraw/zinc/31/93/86/1047319386.db2.gz QKWAROHPBRMRPL-QGZVFWFLSA-N 1 0 303.427 4.093 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)c1 ZINC000725844196 1047320096 /nfs/dbraw/zinc/32/00/96/1047320096.db2.gz KIXKXETYXYRMMH-IBGZPJMESA-N 1 0 317.404 4.417 20 10 DICDRO Cc1ccc(C[NH+]2CCC(c3nc4ccccc4o3)CC2)c(O)c1 ZINC001119295301 1047327810 /nfs/dbraw/zinc/32/78/10/1047327810.db2.gz HDIFBICILPOACH-UHFFFAOYSA-N 1 0 322.408 4.221 20 10 DICDRO CCC[C@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCOC1 ZINC000796489621 1047339509 /nfs/dbraw/zinc/33/95/09/1047339509.db2.gz BERGPXHJUVKOEZ-FQEVSTJZSA-N 1 0 311.425 4.108 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccnc(Cl)c2)cc1 ZINC000726230578 1047341748 /nfs/dbraw/zinc/34/17/48/1047341748.db2.gz JSNWKYOSFFCXRQ-UHFFFAOYSA-N 1 0 317.864 4.213 20 10 DICDRO COCC[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000840839467 1047342512 /nfs/dbraw/zinc/34/25/12/1047342512.db2.gz XBDYZXIYKVBSKB-HZPDHXFCSA-N 1 0 322.468 4.139 20 10 DICDRO COCC[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000840839468 1047342646 /nfs/dbraw/zinc/34/26/46/1047342646.db2.gz XBDYZXIYKVBSKB-JKSUJKDBSA-N 1 0 322.468 4.139 20 10 DICDRO Cc1ccc(Br)c(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000840874138 1047350777 /nfs/dbraw/zinc/35/07/77/1047350777.db2.gz XBFMNRMHRLHQDF-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc2ccccc2c1O ZINC000840874996 1047351702 /nfs/dbraw/zinc/35/17/02/1047351702.db2.gz BTBWEHJEUHBNIF-CQSZACIVSA-N 1 0 313.441 4.401 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)s1 ZINC000840892916 1047356593 /nfs/dbraw/zinc/35/65/93/1047356593.db2.gz DXCBUIHRBCIHQO-KGLIPLIRSA-N 1 0 317.502 4.108 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CCC(OC(C)C)CC2)c(Cl)c1 ZINC000840907819 1047359289 /nfs/dbraw/zinc/35/92/89/1047359289.db2.gz RACGCOVINBHHIR-UHFFFAOYSA-N 1 0 311.853 4.180 20 10 DICDRO Cc1cc(O)c(C[N@@H+](Cc2ccccn2)C(C)C)c(Cl)c1 ZINC000840911963 1047359748 /nfs/dbraw/zinc/35/97/48/1047359748.db2.gz WHRBCOQVRASYJZ-UHFFFAOYSA-N 1 0 304.821 4.160 20 10 DICDRO Cc1csc([C@H]([NH2+]Cc2ccc(N(C)C)cc2C)C2CC2)n1 ZINC000840935079 1047361413 /nfs/dbraw/zinc/36/14/13/1047361413.db2.gz DPJGTVRWYAIXKG-QGZVFWFLSA-N 1 0 315.486 4.067 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2cnccc2C(C)(C)C)c1O ZINC000840958913 1047363598 /nfs/dbraw/zinc/36/35/98/1047363598.db2.gz NJBJFUMXVFBYOK-UHFFFAOYSA-N 1 0 318.848 4.336 20 10 DICDRO CCOc1ccc(C[NH2+]C2(c3ccc(F)cc3)CCC2)c(O)c1 ZINC000726605393 1047368572 /nfs/dbraw/zinc/36/85/72/1047368572.db2.gz CVABZCJKSJJHEQ-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO [NH3+]C1CCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 ZINC000841004926 1047369220 /nfs/dbraw/zinc/36/92/20/1047369220.db2.gz SLGSHSRJKBVWOD-UHFFFAOYSA-N 1 0 323.400 4.057 20 10 DICDRO [NH3+][C@@H]1CCCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000841004884 1047369458 /nfs/dbraw/zinc/36/94/58/1047369458.db2.gz QZLMFWGBYCAYFT-CQSZACIVSA-N 1 0 323.400 4.057 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000841034649 1047373655 /nfs/dbraw/zinc/37/36/55/1047373655.db2.gz JBEIQJQUAOUHLW-RBUKOAKNSA-N 1 0 314.860 4.391 20 10 DICDRO CC[NH2+]Cc1cccc(NCc2ccc(N3CCCCC3)cc2)c1 ZINC000841044284 1047374441 /nfs/dbraw/zinc/37/44/41/1047374441.db2.gz YOKIHBSZFYSEDX-UHFFFAOYSA-N 1 0 323.484 4.399 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CC(C)(C)OC2(C)C)c2c1c(F)ccc2O ZINC000757632165 1047375379 /nfs/dbraw/zinc/37/53/79/1047375379.db2.gz VZJLRIXXBINEBC-SCDSUCTJSA-N 1 0 307.409 4.015 20 10 DICDRO C[C@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1ccc(Cl)cc1O ZINC000841744468 1047446792 /nfs/dbraw/zinc/44/67/92/1047446792.db2.gz OJKWJNHBNYGLOH-XHDPSFHLSA-N 1 0 324.877 4.061 20 10 DICDRO COCc1ccccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841743140 1047446863 /nfs/dbraw/zinc/44/68/63/1047446863.db2.gz CXNQONATDZPTBD-GFCCVEGCSA-N 1 0 305.805 4.043 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccc2c(c1)OCO2 ZINC000841745487 1047448691 /nfs/dbraw/zinc/44/86/91/1047448691.db2.gz YYPKYHQUYSYTJI-GHMZBOCLSA-N 1 0 319.788 4.186 20 10 DICDRO COCc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000841745276 1047448904 /nfs/dbraw/zinc/44/89/04/1047448904.db2.gz PHGJDPRBDAJIBN-GFCCVEGCSA-N 1 0 305.805 4.043 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)CO2 ZINC000841751125 1047449947 /nfs/dbraw/zinc/44/99/47/1047449947.db2.gz KVVQIWWRHBFGIO-XHDPSFHLSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)CO2 ZINC000841751120 1047450226 /nfs/dbraw/zinc/45/02/26/1047450226.db2.gz KVVQIWWRHBFGIO-ABAIWWIYSA-N 1 0 303.789 4.138 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccc(Cl)cc1O ZINC000841751522 1047450236 /nfs/dbraw/zinc/45/02/36/1047450236.db2.gz HQNBXLZQXIWDIO-GFCCVEGCSA-N 1 0 316.832 4.170 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccc(Cl)cc1O ZINC000841753751 1047451424 /nfs/dbraw/zinc/45/14/24/1047451424.db2.gz VPQZRFYZXIAAFY-MEBBXXQBSA-N 1 0 321.779 4.359 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1ccc(Cl)cc1O ZINC000841751786 1047451707 /nfs/dbraw/zinc/45/17/07/1047451707.db2.gz JSAOFJIHULFJBU-GFCCVEGCSA-N 1 0 319.832 4.124 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccc(C)o1 ZINC000841753833 1047452449 /nfs/dbraw/zinc/45/24/49/1047452449.db2.gz NQZUHZXAWPACLP-SWLSCSKDSA-N 1 0 323.820 4.375 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1COCc2ccccc21)c1cc(Cl)ccc1O ZINC000841758225 1047453528 /nfs/dbraw/zinc/45/35/28/1047453528.db2.gz ABMBTAMHNZWALI-IAGOWNOFSA-N 1 0 317.816 4.358 20 10 DICDRO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841757277 1047454020 /nfs/dbraw/zinc/45/40/20/1047454020.db2.gz NCLWZBAMKHKDKT-FHSNZYRGSA-N 1 0 319.832 4.127 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1F ZINC000841763693 1047455529 /nfs/dbraw/zinc/45/55/29/1047455529.db2.gz OKLNREXONRHIJC-LLVKDONJSA-N 1 0 323.795 4.434 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841765063 1047455570 /nfs/dbraw/zinc/45/55/70/1047455570.db2.gz UMBJVSIXYDPPBO-LBPRGKRZSA-N 1 0 320.820 4.080 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841765062 1047455682 /nfs/dbraw/zinc/45/56/82/1047455682.db2.gz UMBJVSIXYDPPBO-GFCCVEGCSA-N 1 0 320.820 4.080 20 10 DICDRO Cc1ccc(C[N@@H+](Cc2cc(C)c(C)cc2O)CC2CC2)cn1 ZINC000842629173 1047493050 /nfs/dbraw/zinc/49/30/50/1047493050.db2.gz KXZQOHKKJPKPBR-UHFFFAOYSA-N 1 0 310.441 4.125 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2[C@H]2CCCOC2)cc1C(C)C ZINC000842612844 1047493538 /nfs/dbraw/zinc/49/35/38/1047493538.db2.gz PFXDFUZGRPAVNC-LPHOPBHVSA-N 1 0 317.473 4.215 20 10 DICDRO C[C@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)CC(F)F ZINC000842727115 1047499354 /nfs/dbraw/zinc/49/93/54/1047499354.db2.gz CSUPHXIVGQMUHP-ZDUSSCGKSA-N 1 0 305.368 4.440 20 10 DICDRO C[C@@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)CC(F)F ZINC000842727114 1047499620 /nfs/dbraw/zinc/49/96/20/1047499620.db2.gz CSUPHXIVGQMUHP-CYBMUJFWSA-N 1 0 305.368 4.440 20 10 DICDRO CCOc1cccc(C[NH2+]C2(c3ccccc3Cl)CC2)c1O ZINC000842725288 1047499843 /nfs/dbraw/zinc/49/98/43/1047499843.db2.gz ZCEZPGBVEGHZCK-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO CCOc1ccc(C[NH2+]C2(c3ccc(C)cc3)CCC2)c(O)c1 ZINC000842773713 1047503159 /nfs/dbraw/zinc/50/31/59/1047503159.db2.gz KXRLZPCPEXMAMS-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](CC)c2csc(C)c2)c(O)c1 ZINC000842774798 1047504129 /nfs/dbraw/zinc/50/41/29/1047504129.db2.gz KEPGPMFXSYDNSZ-MRXNPFEDSA-N 1 0 305.443 4.402 20 10 DICDRO CC(C)C[C@@H]([NH2+]CCCSc1nccs1)c1ccncc1 ZINC000842843806 1047508107 /nfs/dbraw/zinc/50/81/07/1047508107.db2.gz DSDFXLROSXGPOG-OAHLLOKOSA-N 1 0 321.515 4.397 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C1CCC(F)(F)CC1 ZINC000842873603 1047510740 /nfs/dbraw/zinc/51/07/40/1047510740.db2.gz XOJDDZPVZLCUEO-AWEZNQCLSA-N 1 0 310.432 4.160 20 10 DICDRO COc1ccccc1C1([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000842900178 1047511719 /nfs/dbraw/zinc/51/17/19/1047511719.db2.gz FYGNQSAMYGYPPD-HNNXBMFYSA-N 1 0 310.441 4.101 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc(Br)ccc1O)CC(F)F ZINC000842890854 1047511955 /nfs/dbraw/zinc/51/19/55/1047511955.db2.gz UKUMYQHSZUSZRG-BDAKNGLRSA-N 1 0 322.193 4.097 20 10 DICDRO C[C@@H]([NH2+]C1(c2cccc(F)c2)CCC1)c1cc(F)ccc1O ZINC000842903405 1047512267 /nfs/dbraw/zinc/51/22/67/1047512267.db2.gz PJDIYRKBNUGVKX-GFCCVEGCSA-N 1 0 303.352 4.400 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2(c3cccc(C)c3)CCC2)c1 ZINC000842901374 1047512495 /nfs/dbraw/zinc/51/24/95/1047512495.db2.gz NKLLVZJSSCGBHZ-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2(c3cccc(F)c3)CCC2)c1 ZINC000842902860 1047513920 /nfs/dbraw/zinc/51/39/20/1047513920.db2.gz ONHWDMSTJUDKPS-ZDUSSCGKSA-N 1 0 315.388 4.270 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1O ZINC001143104047 1047531413 /nfs/dbraw/zinc/53/14/13/1047531413.db2.gz OOBBGAHOLQOWDF-GOSISDBHSA-N 1 0 310.441 4.422 20 10 DICDRO C[N@H+](Cc1ccccc1F)Cc1cccc(C(C)(C)C)c1O ZINC001143110448 1047531846 /nfs/dbraw/zinc/53/18/46/1047531846.db2.gz GJTMWUVUGNZZMG-UHFFFAOYSA-N 1 0 301.405 4.461 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC001143110586 1047532059 /nfs/dbraw/zinc/53/20/59/1047532059.db2.gz KHIMYYJKHDTXAJ-CYBMUJFWSA-N 1 0 315.379 4.464 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@H](c3cccnc3)C2)c1O ZINC001143111081 1047532474 /nfs/dbraw/zinc/53/24/74/1047532474.db2.gz WVHPZSRLWFXJTD-INIZCTEOSA-N 1 0 310.441 4.074 20 10 DICDRO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143110805 1047532666 /nfs/dbraw/zinc/53/26/66/1047532666.db2.gz PQWDCETVCHAUQT-MRXNPFEDSA-N 1 0 305.462 4.079 20 10 DICDRO [NH3+]Cc1ccc2c(c1)CCCN2Cc1cccc(C(F)F)c1 ZINC000843350854 1047543151 /nfs/dbraw/zinc/54/31/51/1047543151.db2.gz XCONUVQUSJCGOZ-UHFFFAOYSA-N 1 0 302.368 4.036 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2nc3c(s2)CCCC3)c(O)c1 ZINC000926920285 1047604776 /nfs/dbraw/zinc/60/47/76/1047604776.db2.gz RGYHWQUMPOTSKC-ZDUSSCGKSA-N 1 0 316.470 4.195 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2nc3c(s2)CCCC3)c(O)c1 ZINC000926920284 1047605160 /nfs/dbraw/zinc/60/51/60/1047605160.db2.gz RGYHWQUMPOTSKC-CYBMUJFWSA-N 1 0 316.470 4.195 20 10 DICDRO CCN(C)c1ccc(C[N@H+](C)[C@@H](C)c2ccccc2F)cc1 ZINC001307418667 1047820879 /nfs/dbraw/zinc/82/08/79/1047820879.db2.gz NYTAUKVPCBBYFB-HNNXBMFYSA-N 1 0 300.421 4.475 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(Oc3ccccc3)o2)c1 ZINC001182958585 1047867918 /nfs/dbraw/zinc/86/79/18/1047867918.db2.gz CAJRLHSTMYHVEU-UHFFFAOYSA-N 1 0 309.365 4.376 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000479439753 1047890598 /nfs/dbraw/zinc/89/05/98/1047890598.db2.gz QRZXLCJFJTWVJI-GOSISDBHSA-N 1 0 308.400 4.403 20 10 DICDRO CC(C)CCO[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001183095586 1047892502 /nfs/dbraw/zinc/89/25/02/1047892502.db2.gz RVCNGXXLRNWFPA-GOSISDBHSA-N 1 0 313.441 4.182 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccc2c(c1)COC2 ZINC000479452067 1047894496 /nfs/dbraw/zinc/89/44/96/1047894496.db2.gz HSBGPHZABHJDRV-OAHLLOKOSA-N 1 0 320.436 4.368 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@@H](Oc2ccccc2)C1(C)C)c1ccccc1O ZINC001183362881 1047919988 /nfs/dbraw/zinc/91/99/88/1047919988.db2.gz FLQGGBKUJMLRFJ-GDIGMMSISA-N 1 0 311.425 4.289 20 10 DICDRO CC[NH+](CC)Cc1ccc(F)c(Nc2ccc(NC)cc2)c1 ZINC001159829030 1047933447 /nfs/dbraw/zinc/93/34/47/1047933447.db2.gz OHCUJCQYJCUGPH-UHFFFAOYSA-N 1 0 301.409 4.453 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cccc3[nH]ccc32)cc1Cl ZINC001183481827 1047933537 /nfs/dbraw/zinc/93/35/37/1047933537.db2.gz IUFHLVGUPHXDPW-UHFFFAOYSA-N 1 0 300.789 4.125 20 10 DICDRO FC[C@H]1CC[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC001183520218 1047933743 /nfs/dbraw/zinc/93/37/43/1047933743.db2.gz IIXNSXRWKKZUFM-LJQANCHMSA-N 1 0 324.443 4.041 20 10 DICDRO CN(C)c1ccc(N=Nc2ccc(NC3=CC[NH2+]CC3)cc2)cc1 ZINC001159970202 1047960423 /nfs/dbraw/zinc/96/04/23/1047960423.db2.gz HXNUKITUDFAFHR-UHFFFAOYSA-N 1 0 321.428 4.457 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C(C)(C)c1ccc(F)cc1 ZINC001183831393 1047967815 /nfs/dbraw/zinc/96/78/15/1047967815.db2.gz BKZSJVFPJCOTJD-UHFFFAOYSA-N 1 0 300.421 4.225 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C[C@H](C)C(C)(C)C)c1O ZINC001183843806 1047970076 /nfs/dbraw/zinc/97/00/76/1047970076.db2.gz JTOZZAIQJBDWNF-NSHDSACASA-N 1 0 314.267 4.235 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@]3(C2)OCc2ccccc23)c1 ZINC000774699652 1047979630 /nfs/dbraw/zinc/97/96/30/1047979630.db2.gz AGVZOHCKKWMQNH-NRFANRHFSA-N 1 0 323.436 4.031 20 10 DICDRO Cc1cccc(OCCC[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC001199053311 1048029824 /nfs/dbraw/zinc/02/98/24/1048029824.db2.gz WHQBBXBSWBGVNN-YVMONPNESA-N 1 0 324.468 4.133 20 10 DICDRO Cc1cccc(OCCC[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC001199053310 1048030359 /nfs/dbraw/zinc/03/03/59/1048030359.db2.gz WHQBBXBSWBGVNN-VMPITWQZSA-N 1 0 324.468 4.133 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cnc(Cl)c(C)c2)cc1 ZINC001199403099 1048064218 /nfs/dbraw/zinc/06/42/18/1048064218.db2.gz FVAQIVDGVMCYJU-UHFFFAOYSA-N 1 0 317.864 4.179 20 10 DICDRO C[C@@H]([NH2+]Cc1ncccc1C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000776005415 1048083428 /nfs/dbraw/zinc/08/34/28/1048083428.db2.gz BESRYVWLZGEWIW-GFCCVEGCSA-N 1 0 323.362 4.017 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c1O ZINC000776023918 1048101098 /nfs/dbraw/zinc/10/10/98/1048101098.db2.gz LQIYZYORVIKRTM-BONVTDFDSA-N 1 0 305.805 4.360 20 10 DICDRO CCO[C@@H](CC[NH2+]Cc1ccc2c(c1)CCCO2)C1CCCC1 ZINC001200960693 1048162124 /nfs/dbraw/zinc/16/21/24/1048162124.db2.gz MTZBNNBETJGSQG-FQEVSTJZSA-N 1 0 317.473 4.087 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2CCC(OC)CC2)cc1C ZINC001200949879 1048169250 /nfs/dbraw/zinc/16/92/50/1048169250.db2.gz DBSFSCKFVLHQCK-UHFFFAOYSA-N 1 0 305.462 4.079 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CCC(C(F)F)CC2)c(Cl)c1 ZINC000842219766 1048237334 /nfs/dbraw/zinc/23/73/34/1048237334.db2.gz DDBIGRPZXRJKAZ-UHFFFAOYSA-N 1 0 303.780 4.268 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1)Cc1ccc(OC)cc1O ZINC001203629243 1048238791 /nfs/dbraw/zinc/23/87/91/1048238791.db2.gz UFXYPWMXJQYPMP-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@H]2CCCS2)cc1 ZINC001201441965 1048275664 /nfs/dbraw/zinc/27/56/64/1048275664.db2.gz FPPRZBACLCKSHH-GOSISDBHSA-N 1 0 306.519 4.298 20 10 DICDRO C[C@H]([NH2+][C@H]1CSC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000797065911 1048281004 /nfs/dbraw/zinc/28/10/04/1048281004.db2.gz NUKXYWURRCARFI-VKJFTORMSA-N 1 0 304.503 4.079 20 10 DICDRO CC(C)Nc1ccc(Nc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001201498278 1048287520 /nfs/dbraw/zinc/28/75/20/1048287520.db2.gz UZUCJSMLCSOBKA-UHFFFAOYSA-N 1 0 324.472 4.002 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Br)cc1)c1ccccc1O ZINC000042238815 1048361100 /nfs/dbraw/zinc/36/11/00/1048361100.db2.gz URTLYTAMESDOAD-NSHDSACASA-N 1 0 306.203 4.006 20 10 DICDRO CCC(CC)[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)CCO1 ZINC001201742292 1048362083 /nfs/dbraw/zinc/36/20/83/1048362083.db2.gz MOEUKYRHRMZGNU-AZUAARDMSA-N 1 0 317.473 4.085 20 10 DICDRO CCC(CC)[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)CCO1 ZINC001201742296 1048363618 /nfs/dbraw/zinc/36/36/18/1048363618.db2.gz MOEUKYRHRMZGNU-UYAOXDASSA-N 1 0 317.473 4.085 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Br)cc1F)c1ccccc1O ZINC000775131858 1048408001 /nfs/dbraw/zinc/40/80/01/1048408001.db2.gz XMJRFYOLMWROCI-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Br)cc1F)c1ccccc1O ZINC000775131856 1048408121 /nfs/dbraw/zinc/40/81/21/1048408121.db2.gz XMJRFYOLMWROCI-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO CCCN(Cc1cccc(OC(F)F)c1)c1ccc(C[NH3+])cc1 ZINC000775140100 1048432195 /nfs/dbraw/zinc/43/21/95/1048432195.db2.gz IHBCLOPVQPJHCJ-UHFFFAOYSA-N 1 0 320.383 4.163 20 10 DICDRO COc1cc[nH+]c(N[C@H]2c3c(c(C)cc(C)c3O)CC2(C)C)c1 ZINC001163488464 1048477943 /nfs/dbraw/zinc/47/79/43/1048477943.db2.gz ZUKYEAPHXBELCR-SFHVURJKSA-N 1 0 312.413 4.148 20 10 DICDRO Nc1ccc(Cc2ccc(Nc3ccc(C[NH3+])cc3)cc2)cc1 ZINC001175971143 1048512673 /nfs/dbraw/zinc/51/26/73/1048512673.db2.gz UFMHVGFHXCXTRD-UHFFFAOYSA-N 1 0 303.409 4.062 20 10 DICDRO C[C@@H](CN(C)C)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001202299717 1048515947 /nfs/dbraw/zinc/51/59/47/1048515947.db2.gz QGZZGCYTBYKUPG-AWEZNQCLSA-N 1 0 320.521 4.027 20 10 DICDRO Fc1ccc(CC2([NH2+]Cc3ccc4c(c3)CCCO4)CC2)cc1 ZINC001202409624 1048542531 /nfs/dbraw/zinc/54/25/31/1048542531.db2.gz YIAWSHCEDNDCGZ-UHFFFAOYSA-N 1 0 311.400 4.016 20 10 DICDRO C[C@@]1(CC[NH2+]Cc2ccc3c(c2)CCCO3)CC1(Cl)Cl ZINC001202417959 1048545055 /nfs/dbraw/zinc/54/50/55/1048545055.db2.gz PPUVSVNJCVUBLC-OAHLLOKOSA-N 1 0 314.256 4.075 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccc(F)c1F ZINC000776305168 1048562743 /nfs/dbraw/zinc/56/27/43/1048562743.db2.gz DBZFFNDOEQJHBE-ZDUSSCGKSA-N 1 0 316.395 4.198 20 10 DICDRO Cc1cccc2[nH]c(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)cc21 ZINC000850252141 1048629052 /nfs/dbraw/zinc/62/90/52/1048629052.db2.gz MUCUJSZFAHNZKX-HNNXBMFYSA-N 1 0 307.441 4.393 20 10 DICDRO COc1cc(C[NH2+]CCCC(C)(F)F)c(O)c(C(C)(C)C)c1 ZINC000850312689 1048632849 /nfs/dbraw/zinc/63/28/49/1048632849.db2.gz YAEUUCYAFJWESY-UHFFFAOYSA-N 1 0 315.404 4.223 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cccc(OC2CC2)c1F ZINC000850365697 1048640646 /nfs/dbraw/zinc/64/06/46/1048640646.db2.gz ZGYYIAJYFKQAIF-UHFFFAOYSA-N 1 0 321.779 4.016 20 10 DICDRO C[C@]1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1(F)F ZINC000850379749 1048643975 /nfs/dbraw/zinc/64/39/75/1048643975.db2.gz XCHCOLSDSWGZEN-QGZVFWFLSA-N 1 0 303.352 4.194 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2cc3cc(C)ccc3o2)c1O ZINC000850376366 1048644055 /nfs/dbraw/zinc/64/40/55/1048644055.db2.gz HJMZBWHYODTCAK-UHFFFAOYSA-N 1 0 311.381 4.135 20 10 DICDRO C[C@@]1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1(F)F ZINC000850379748 1048645082 /nfs/dbraw/zinc/64/50/82/1048645082.db2.gz XCHCOLSDSWGZEN-KRWDZBQOSA-N 1 0 303.352 4.194 20 10 DICDRO COc1cccc(C2([NH2+]Cc3cc(C)c(C)cc3O)CCC2)c1 ZINC000850404646 1048649425 /nfs/dbraw/zinc/64/94/25/1048649425.db2.gz BWDHXWATIXZZSM-UHFFFAOYSA-N 1 0 311.425 4.187 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)c1ccccn1 ZINC000850481325 1048669817 /nfs/dbraw/zinc/66/98/17/1048669817.db2.gz GKIGGLZMKUENJM-CABCVRRESA-N 1 0 306.409 4.395 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](C)c2ccccn2)c1O ZINC000850481425 1048670764 /nfs/dbraw/zinc/67/07/64/1048670764.db2.gz GWRPATOOQWJVRX-OLZOCXBDSA-N 1 0 304.821 4.203 20 10 DICDRO CC[C@@H]([NH2+]CCc1noc2ccccc12)c1ccc(C)cc1O ZINC000850483176 1048671180 /nfs/dbraw/zinc/67/11/80/1048671180.db2.gz OERQYDQHSUUFLH-MRXNPFEDSA-N 1 0 310.397 4.125 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)Cc2ccc(F)cc2C)c1O ZINC000850495194 1048671252 /nfs/dbraw/zinc/67/12/52/1048671252.db2.gz YEEFIZNXVMXQQX-KGLIPLIRSA-N 1 0 317.404 4.130 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccccn1 ZINC000850482966 1048671545 /nfs/dbraw/zinc/67/15/45/1048671545.db2.gz SZBFWHZRKFKMJA-GJZGRUSLSA-N 1 0 310.441 4.120 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1cscn1 ZINC000850512234 1048675318 /nfs/dbraw/zinc/67/53/18/1048675318.db2.gz YUQOPAVSJYISBH-NWDGAFQWSA-N 1 0 302.443 4.139 20 10 DICDRO C[C@@H]([NH2+][C@@H]1COC2(CCC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000850526778 1048680719 /nfs/dbraw/zinc/68/07/19/1048680719.db2.gz WKRFXSPUJJCLAN-AEFFLSMTSA-N 1 0 314.473 4.039 20 10 DICDRO C[C@@H]([NH2+][C@H]1COC2(CCC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000850526780 1048681487 /nfs/dbraw/zinc/68/14/87/1048681487.db2.gz WKRFXSPUJJCLAN-SJLPKXTDSA-N 1 0 314.473 4.039 20 10 DICDRO COCc1csc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000850532749 1048685264 /nfs/dbraw/zinc/68/52/64/1048685264.db2.gz ONRYHETWNCJPON-YGRLFVJLSA-N 1 0 321.417 4.077 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@]2(C)CC2(F)F)c1O ZINC000850535905 1048685591 /nfs/dbraw/zinc/68/55/91/1048685591.db2.gz DOLUGNASSMOIKU-QMTHXVAHSA-N 1 0 303.780 4.440 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cc(Cl)ccc1O ZINC000850543540 1048687575 /nfs/dbraw/zinc/68/75/75/1048687575.db2.gz LTNLZIWUMVUJAZ-MGPLVRAMSA-N 1 0 303.789 4.089 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2CCC3(CC3(F)F)CC2)c1O ZINC000850548990 1048689119 /nfs/dbraw/zinc/68/91/19/1048689119.db2.gz CDYDRAQEPOCARD-FZWSLVFFSA-N 1 0 311.372 4.019 20 10 DICDRO C[C@@H]([NH2+]C1CCC2(CC2(F)F)CC1)c1ccc(N(C)C)cc1 ZINC000850549621 1048689137 /nfs/dbraw/zinc/68/91/37/1048689137.db2.gz IESLCDZFXMNWNC-BZOOQXSSSA-N 1 0 308.416 4.371 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2nsc3ccccc23)c(O)c1 ZINC000850562757 1048693027 /nfs/dbraw/zinc/69/30/27/1048693027.db2.gz YAZDJMSPTVMGJU-ZDUSSCGKSA-N 1 0 312.438 4.204 20 10 DICDRO COc1ccccc1/C=C\C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000775365064 1048703733 /nfs/dbraw/zinc/70/37/33/1048703733.db2.gz RWVLCOFVZZPONF-GQSKFBFOSA-N 1 0 310.441 4.125 20 10 DICDRO COc1ccc2oc(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)cc2c1 ZINC000775363907 1048704395 /nfs/dbraw/zinc/70/43/95/1048704395.db2.gz NJXAFOOZEPPOOH-CQSZACIVSA-N 1 0 324.424 4.358 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1ccc(N(C)C)cc1 ZINC000775366069 1048708271 /nfs/dbraw/zinc/70/82/71/1048708271.db2.gz ZNCOFQOQPRCPRL-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO COCCC1(C[NH2+]Cc2ccc(OC)c(C)c2)CCCCC1 ZINC000775373858 1048714865 /nfs/dbraw/zinc/71/48/65/1048714865.db2.gz DGQLAQNFMNRKGH-UHFFFAOYSA-N 1 0 305.462 4.080 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2csc3ccccc23)c1 ZINC000775373409 1048716377 /nfs/dbraw/zinc/71/63/77/1048716377.db2.gz RXACBBDFBFMFCJ-LBPRGKRZSA-N 1 0 313.422 4.466 20 10 DICDRO CC[C@](C)([NH2+]Cc1cc(F)cc(C(C)=O)c1O)c1ccccc1 ZINC000775393876 1048749429 /nfs/dbraw/zinc/74/94/29/1048749429.db2.gz JHXXRLFGAQJORJ-IBGZPJMESA-N 1 0 315.388 4.149 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1O ZINC000775412785 1048785681 /nfs/dbraw/zinc/78/56/81/1048785681.db2.gz QLGBLNRVZNZABH-SWLSCSKDSA-N 1 0 300.358 4.102 20 10 DICDRO CC[C@H]([NH2+]CCCOCCc1ccccc1)c1ccccc1O ZINC000775412986 1048785757 /nfs/dbraw/zinc/78/57/57/1048785757.db2.gz SZCKLIRYSOLCNN-IBGZPJMESA-N 1 0 313.441 4.082 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H](C3CCCC3)C2)c1O ZINC001176932252 1048804926 /nfs/dbraw/zinc/80/49/26/1048804926.db2.gz GJIKXWWXRZATKG-OAHLLOKOSA-N 1 0 319.420 4.136 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1Cl ZINC000851949786 1048815667 /nfs/dbraw/zinc/81/56/67/1048815667.db2.gz JIAPSKQKLDOBPZ-CYBMUJFWSA-N 1 0 318.848 4.265 20 10 DICDRO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001177027477 1048816685 /nfs/dbraw/zinc/81/66/85/1048816685.db2.gz KZIMXUZWKDNSHU-UHFFFAOYSA-N 1 0 308.469 4.434 20 10 DICDRO CCC[N@H+](Cc1nc2c(s1)CCCC2)Cc1ccccc1O ZINC000776610121 1048851400 /nfs/dbraw/zinc/85/14/00/1048851400.db2.gz RXVBOULDISVEDH-UHFFFAOYSA-N 1 0 316.470 4.140 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](C)c2ccccc2C)ccc1OC ZINC001203276102 1048856360 /nfs/dbraw/zinc/85/63/60/1048856360.db2.gz IGVJTOUOLXCFRW-MRXNPFEDSA-N 1 0 313.441 4.391 20 10 DICDRO Cc1cc(C[N@H+](C)CC2=CCSC2)ccc1N1CCCCC1 ZINC000852747329 1048856422 /nfs/dbraw/zinc/85/64/22/1048856422.db2.gz DYPYVTVIYSEYJT-UHFFFAOYSA-N 1 0 316.514 4.090 20 10 DICDRO CC(C)c1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001177370733 1048874291 /nfs/dbraw/zinc/87/42/91/1048874291.db2.gz LNSPKOGYSOVFBH-UHFFFAOYSA-N 1 0 323.484 4.174 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)cc1C ZINC000853095315 1048882791 /nfs/dbraw/zinc/88/27/91/1048882791.db2.gz WACUVIATCNXLHA-OAHLLOKOSA-N 1 0 311.425 4.185 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000853239782 1048887542 /nfs/dbraw/zinc/88/75/42/1048887542.db2.gz DMWYKIMHKGNOEB-CABCVRRESA-N 1 0 311.425 4.437 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccc2c(c1)CCCO2 ZINC000853239487 1048888901 /nfs/dbraw/zinc/88/89/01/1048888901.db2.gz BWSMYYBWCAULHH-OLZOCXBDSA-N 1 0 315.388 4.268 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000853239910 1048891598 /nfs/dbraw/zinc/89/15/98/1048891598.db2.gz FDIXMQDJKUVWHF-LBPRGKRZSA-N 1 0 302.384 4.382 20 10 DICDRO CN(CCCC[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC001177446590 1048895481 /nfs/dbraw/zinc/89/54/81/1048895481.db2.gz URVATEXIPHLYNA-UHFFFAOYSA-N 1 0 318.848 4.052 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(CSC)cc1)c1ccccc1O ZINC000797100500 1048906007 /nfs/dbraw/zinc/90/60/07/1048906007.db2.gz RKDVCRYBIFOQON-QGZVFWFLSA-N 1 0 301.455 4.496 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3ccon3)CC2)cc1C(C)C ZINC000853593281 1048910461 /nfs/dbraw/zinc/91/04/61/1048910461.db2.gz LTMJQZLOUUZJLL-UHFFFAOYSA-N 1 0 314.429 4.192 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CC2(CO1)CCCCC2 ZINC001191288291 1048916070 /nfs/dbraw/zinc/91/60/70/1048916070.db2.gz FAUMQTLYIAFFQT-GOSISDBHSA-N 1 0 317.473 4.344 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)c(C)c1)[C@H](C)c1cccc(O)c1 ZINC001191297983 1048918997 /nfs/dbraw/zinc/91/89/97/1048918997.db2.gz UPUGFFKUTBYDCQ-MRXNPFEDSA-N 1 0 312.457 4.350 20 10 DICDRO CC(C)(C)c1ccc(N2CC[NH+](Cc3ccccc3O)CC2)cc1 ZINC001203558286 1048928318 /nfs/dbraw/zinc/92/83/18/1048928318.db2.gz BQDRKTYNLRHGLA-UHFFFAOYSA-N 1 0 324.468 4.012 20 10 DICDRO CC[N@H+](Cc1ccc(Br)cc1)Cc1ccccc1O ZINC001203558281 1048928767 /nfs/dbraw/zinc/92/87/67/1048928767.db2.gz BLACQZIHIAEKMG-UHFFFAOYSA-N 1 0 320.230 4.177 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccn1 ZINC001177688329 1048933141 /nfs/dbraw/zinc/93/31/41/1048933141.db2.gz TXAHVIKEECFTFW-IBGZPJMESA-N 1 0 309.457 4.313 20 10 DICDRO Cc1cccc2c1CC[C@H]2[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001177774184 1048937298 /nfs/dbraw/zinc/93/72/98/1048937298.db2.gz BIZNWPACYBWVNQ-JEUZPXFCSA-N 1 0 306.453 4.351 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2cccc(C)c2)c1O ZINC001203602219 1048938868 /nfs/dbraw/zinc/93/88/68/1048938868.db2.gz JLBFDHLYJVUQFD-SFHVURJKSA-N 1 0 311.425 4.436 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1O ZINC001203600203 1048939890 /nfs/dbraw/zinc/93/98/90/1048939890.db2.gz XAPFEMFLRINQOY-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c(O)c1 ZINC001203629351 1048943710 /nfs/dbraw/zinc/94/37/10/1048943710.db2.gz XNIDMGRXTXZZHH-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCOC2CCCCCC2)c(Cl)c1 ZINC001177875567 1048949460 /nfs/dbraw/zinc/94/94/60/1048949460.db2.gz MDISHHTWUHBOFG-UHFFFAOYSA-N 1 0 311.853 4.183 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)cc1 ZINC001203658510 1048951500 /nfs/dbraw/zinc/95/15/00/1048951500.db2.gz YQTQZEKYFOMENZ-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001203658530 1048951877 /nfs/dbraw/zinc/95/18/77/1048951877.db2.gz ZQRYXPXTRHNQTJ-MRXNPFEDSA-N 1 0 319.857 4.336 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(Cl)ccc1O ZINC001203664688 1048953323 /nfs/dbraw/zinc/95/33/23/1048953323.db2.gz PZNUXYAMPBASTH-UHFFFAOYSA-N 1 0 318.848 4.134 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(N)c1)c1ccc(N2CCCCC2)cc1 ZINC000854216752 1048954270 /nfs/dbraw/zinc/95/42/70/1048954270.db2.gz DFAJOCGPCCCIQF-MRXNPFEDSA-N 1 0 309.457 4.110 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)cc1 ZINC000854226118 1048954294 /nfs/dbraw/zinc/95/42/94/1048954294.db2.gz NZROFLNHVKGOSA-VLIAUNLRSA-N 1 0 309.457 4.063 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1cccc(Cl)c1[O-] ZINC000854227463 1048955545 /nfs/dbraw/zinc/95/55/45/1048955545.db2.gz STBIKAFVSJVOOD-SJORKVTESA-N 1 0 316.832 4.356 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)cc1 ZINC000854226117 1048955743 /nfs/dbraw/zinc/95/57/43/1048955743.db2.gz NZROFLNHVKGOSA-VBKZILBWSA-N 1 0 309.457 4.063 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)cc1)c1cc(Cl)ccc1O ZINC000775482796 1049002545 /nfs/dbraw/zinc/00/25/45/1049002545.db2.gz BFGDLCXUDWIDQC-MRXNPFEDSA-N 1 0 305.805 4.295 20 10 DICDRO Oc1cccc2c1CN(Cc1cc(Cl)cc(Cl)c1)CC2 ZINC001203811202 1049004973 /nfs/dbraw/zinc/00/49/73/1049004973.db2.gz PAEGUPFAMMWTFK-UHFFFAOYSA-N 1 0 308.208 4.257 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)COc1cccc(F)c1)c1ccccc1O ZINC000775491262 1049012453 /nfs/dbraw/zinc/01/24/53/1049012453.db2.gz HAGYLFRUYCNGRN-CXAGYDPISA-N 1 0 303.377 4.040 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@H]2CC(C)C)c1[O-] ZINC001191898614 1049015845 /nfs/dbraw/zinc/01/58/45/1049015845.db2.gz DUMQCFBSHANPOX-INIZCTEOSA-N 1 0 307.409 4.135 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1ccc(N(C)C)cc1 ZINC000776798998 1049017458 /nfs/dbraw/zinc/01/74/58/1049017458.db2.gz DKNRCSSLJSOSAH-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001178347405 1049019591 /nfs/dbraw/zinc/01/95/91/1049019591.db2.gz VNXQCYDUWNPPLV-QGZVFWFLSA-N 1 0 318.464 4.381 20 10 DICDRO Oc1ccc(C[NH+](Cc2ccccc2)Cc2ccccc2)cc1O ZINC001203882502 1049020373 /nfs/dbraw/zinc/02/03/73/1049020373.db2.gz JPPPYAFXBAYQCO-UHFFFAOYSA-N 1 0 319.404 4.300 20 10 DICDRO Oc1ccc(C[N@H+](Cc2ccccc2)C2CCCCC2)cc1O ZINC001203875517 1049020478 /nfs/dbraw/zinc/02/04/78/1049020478.db2.gz OJOCZSUARUQBLW-UHFFFAOYSA-N 1 0 311.425 4.433 20 10 DICDRO Oc1ccc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)cc1O ZINC001203875587 1049021683 /nfs/dbraw/zinc/02/16/83/1049021683.db2.gz QXDRVQSUZYRCAY-UHFFFAOYSA-N 1 0 315.800 4.041 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc3ncsc3c2)cc1C ZINC000776806637 1049026992 /nfs/dbraw/zinc/02/69/92/1049026992.db2.gz CZWGZVGAUDPUKK-CYBMUJFWSA-N 1 0 312.438 4.464 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1F ZINC000113312983 1049031367 /nfs/dbraw/zinc/03/13/67/1049031367.db2.gz WSZJXBKVIIPAFA-NSHDSACASA-N 1 0 308.347 4.021 20 10 DICDRO C[C@@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC001178436647 1049031236 /nfs/dbraw/zinc/03/12/36/1049031236.db2.gz ODMMNULWISUVCR-VFNWGFHPSA-N 1 0 307.437 4.425 20 10 DICDRO CCc1nc(CC[NH2+][C@@H](CC)c2cc(Cl)ccc2O)cs1 ZINC000775499915 1049033330 /nfs/dbraw/zinc/03/33/30/1049033330.db2.gz HBZRHSHWRBUBLE-AWEZNQCLSA-N 1 0 324.877 4.348 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](O)C1CCCCC1)c1cc(Cl)ccc1O ZINC000775497773 1049033840 /nfs/dbraw/zinc/03/38/40/1049033840.db2.gz FPRSLPONBYUFMO-NVXWUHKLSA-N 1 0 311.853 4.028 20 10 DICDRO Cc1cccc(OC2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)c1 ZINC001203936669 1049034405 /nfs/dbraw/zinc/03/44/05/1049034405.db2.gz GSXFLOIFIOEETL-UHFFFAOYSA-N 1 0 324.468 4.104 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(c3cccs3)CC2)cc1 ZINC001203934010 1049035184 /nfs/dbraw/zinc/03/51/84/1049035184.db2.gz JQSVGNVKUJJZSW-UHFFFAOYSA-N 1 0 300.471 4.194 20 10 DICDRO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001203937137 1049036060 /nfs/dbraw/zinc/03/60/60/1049036060.db2.gz MGUIMHIOOXCWEZ-HXUWFJFHSA-N 1 0 324.468 4.236 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc(O)cc1)c1cc(Cl)ccc1O ZINC000775498766 1049037736 /nfs/dbraw/zinc/03/77/36/1049037736.db2.gz NSTDNOYXLAITST-SJKOYZFVSA-N 1 0 319.832 4.423 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CN(C)Cc3ccccc32)cc1C ZINC001178425808 1049037914 /nfs/dbraw/zinc/03/79/14/1049037914.db2.gz IJQJWBGYEYYEMZ-FQEVSTJZSA-N 1 0 324.468 4.060 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2cccc(C(F)F)c2)cc1 ZINC001178493078 1049038600 /nfs/dbraw/zinc/03/86/00/1049038600.db2.gz SJEKRDGGORUXNC-GQCTYLIASA-N 1 0 316.395 4.493 20 10 DICDRO CC[C@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1ccccc1O ZINC000775500674 1049042900 /nfs/dbraw/zinc/04/29/00/1049042900.db2.gz WTUBOQTXSCLUPZ-KRWDZBQOSA-N 1 0 312.388 4.296 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)Oc1cccc(F)c1)c1ccccc1O ZINC000775508632 1049042984 /nfs/dbraw/zinc/04/29/84/1049042984.db2.gz KZFGEGBIOONWHX-SUMWQHHRSA-N 1 0 303.377 4.040 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000775507610 1049046723 /nfs/dbraw/zinc/04/67/23/1049046723.db2.gz NRASWIRTXKFATM-LPHOPBHVSA-N 1 0 310.441 4.102 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](OC)c1ccc(Cl)cc1)c1ccccc1O ZINC000775508017 1049047078 /nfs/dbraw/zinc/04/70/78/1049047078.db2.gz GTOGXABPZAPMEF-SJLPKXTDSA-N 1 0 319.832 4.474 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCCC(C)(C)C2)ccc1OC ZINC001178505078 1049047328 /nfs/dbraw/zinc/04/73/28/1049047328.db2.gz MGRMHHQDTIZNLT-QGZVFWFLSA-N 1 0 305.462 4.290 20 10 DICDRO CC[C@H]([NH2+]C[C@H](O)c1ccccc1C)c1cc(Cl)ccc1O ZINC000775503916 1049047470 /nfs/dbraw/zinc/04/74/70/1049047470.db2.gz PRQNUSZLJZQDOI-WMZOPIPTSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@@H]([NH2+]CCc1c[nH]c2c1cccc2C)c1ccccc1O ZINC000775509076 1049050302 /nfs/dbraw/zinc/05/03/02/1049050302.db2.gz HMDIZLQTSIFHSP-GOSISDBHSA-N 1 0 308.425 4.465 20 10 DICDRO C[C@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC001178523995 1049050615 /nfs/dbraw/zinc/05/06/15/1049050615.db2.gz DSKCALFYFBCVCS-NNTXTVRGSA-N 1 0 316.395 4.395 20 10 DICDRO C[C@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC001178523997 1049050785 /nfs/dbraw/zinc/05/07/85/1049050785.db2.gz DSKCALFYFBCVCS-WSNITJDQSA-N 1 0 316.395 4.395 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCCO[C@@H]2C1(C)C)c1cc(Cl)ccc1O ZINC000775509634 1049051899 /nfs/dbraw/zinc/05/18/99/1049051899.db2.gz SYCVNZQQPURUOT-UOJCXKCYSA-N 1 0 323.864 4.290 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)Cc1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775509406 1049052864 /nfs/dbraw/zinc/05/28/64/1049052864.db2.gz LREXEUVQOQVAPX-QLJPJBMISA-N 1 0 322.836 4.322 20 10 DICDRO CC[C@H]([NH2+][C@H](CCO)c1ccccc1)c1cc(Cl)ccc1O ZINC000775509633 1049053031 /nfs/dbraw/zinc/05/30/31/1049053031.db2.gz NYZFMNFLOWMECA-DLBZAZTESA-N 1 0 319.832 4.210 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1ccncc1)c1cc(Cl)ccc1O ZINC000775511820 1049054930 /nfs/dbraw/zinc/05/49/30/1049054930.db2.gz JYYNVBUCLISZMF-WBMJQRKESA-N 1 0 304.821 4.285 20 10 DICDRO CCO[C@H](CC[NH2+][C@H](CC)c1ccccc1O)C1CCCC1 ZINC000775513709 1049056707 /nfs/dbraw/zinc/05/67/07/1049056707.db2.gz SODVUOAKDDXUHS-IEBWSBKVSA-N 1 0 305.462 4.418 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)ccc1SC)c1ccccc1O ZINC000775512494 1049057193 /nfs/dbraw/zinc/05/71/93/1049057193.db2.gz LHPIKUSYGSRSRL-HNNXBMFYSA-N 1 0 305.418 4.494 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(Cl)ccc1O ZINC000775520887 1049071307 /nfs/dbraw/zinc/07/13/07/1049071307.db2.gz ZYCRRXISJBMATR-OAHLLOKOSA-N 1 0 320.776 4.195 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)[C@H](C)O ZINC001178710055 1049078378 /nfs/dbraw/zinc/07/83/78/1049078378.db2.gz QBYVPHRNZAWQIM-GUYCJALGSA-N 1 0 321.505 4.236 20 10 DICDRO CC[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccccc1O ZINC000775522156 1049080124 /nfs/dbraw/zinc/08/01/24/1049080124.db2.gz KQYDYOORMNAQJS-CABCVRRESA-N 1 0 303.789 4.220 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](OC)c1ccccc1Cl)c1ccccc1O ZINC000775522546 1049081278 /nfs/dbraw/zinc/08/12/78/1049081278.db2.gz SZDHPZHKAAUJTG-SJLPKXTDSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@@H]([NH2+]CCc1cnc(C)s1)c1cc(Cl)ccc1O ZINC000775522712 1049082992 /nfs/dbraw/zinc/08/29/92/1049082992.db2.gz YMPSNHJUQVNLHK-CQSZACIVSA-N 1 0 310.850 4.094 20 10 DICDRO CCCCCn1cc(C[NH2+][C@H](CC)c2ccccc2O)c(C)n1 ZINC000775523935 1049085333 /nfs/dbraw/zinc/08/53/33/1049085333.db2.gz BJAYFERFSQQBAN-GOSISDBHSA-N 1 0 315.461 4.328 20 10 DICDRO CC[C@H]([NH2+][C@H](COC)c1ccccc1)c1cc(Cl)ccc1O ZINC000775524960 1049088477 /nfs/dbraw/zinc/08/84/77/1049088477.db2.gz VGTTVLZKZWQXBB-DLBZAZTESA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)Cc1ccc(OC)cc1)c1ccccc1O ZINC000775524723 1049088978 /nfs/dbraw/zinc/08/89/78/1049088978.db2.gz HHUIBYOCOXNGOL-KXBFYZLASA-N 1 0 313.441 4.320 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)Cc1ccc(OC)cc1)c1ccccc1O ZINC000775524721 1049089063 /nfs/dbraw/zinc/08/90/63/1049089063.db2.gz HHUIBYOCOXNGOL-DNVCBOLYSA-N 1 0 313.441 4.320 20 10 DICDRO CC[C@@H]([NH2+][C@@H](COC)c1ccccc1)c1cc(Cl)ccc1O ZINC000775524970 1049089345 /nfs/dbraw/zinc/08/93/45/1049089345.db2.gz VGTTVLZKZWQXBB-SJORKVTESA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C)c1ccccc1O ZINC000775526066 1049090731 /nfs/dbraw/zinc/09/07/31/1049090731.db2.gz IQADRQMSXCXNEN-AMVBQIFNSA-N 1 0 311.425 4.386 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H]1Oc2ccccc2[C@H]1C)c1ccccc1O ZINC000775526070 1049091532 /nfs/dbraw/zinc/09/15/32/1049091532.db2.gz IQADRQMSXCXNEN-MJPMAJQWSA-N 1 0 311.425 4.386 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1cc(Cl)ccc1O ZINC000775527036 1049093069 /nfs/dbraw/zinc/09/30/69/1049093069.db2.gz VTLHXHMYZWVUQS-SDNTUTLCSA-N 1 0 321.848 4.044 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H](OC)c1ccc(F)cc1)c1ccccc1O ZINC000775526695 1049093803 /nfs/dbraw/zinc/09/38/03/1049093803.db2.gz TXWIJGUYXOWQRZ-FMEYXAORSA-N 1 0 317.404 4.348 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCCc2sccc2C1 ZINC001204172750 1049105504 /nfs/dbraw/zinc/10/55/04/1049105504.db2.gz YTWQISFATYIDGH-UHFFFAOYSA-N 1 0 300.471 4.071 20 10 DICDRO CC[C@@H](Cc1ccc(C)cc1)[N@H+](C)Cc1cc(F)ccc1O ZINC001204212508 1049110937 /nfs/dbraw/zinc/11/09/37/1049110937.db2.gz KKNJUELNSPSIQO-SFHVURJKSA-N 1 0 301.405 4.293 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)C1CCCCC1 ZINC001192585623 1049119793 /nfs/dbraw/zinc/11/97/93/1049119793.db2.gz XZCPCOULRLBYEK-KRWDZBQOSA-N 1 0 307.409 4.182 20 10 DICDRO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001178998955 1049121431 /nfs/dbraw/zinc/12/14/31/1049121431.db2.gz VBYRBCSUIXAPGI-PMACEKPBSA-N 1 0 310.416 4.014 20 10 DICDRO CC[C@@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(C(F)(F)F)cc1O ZINC000857059440 1049124292 /nfs/dbraw/zinc/12/42/92/1049124292.db2.gz PQSXPFZQLXSJHO-ZYHUDNBSSA-N 1 0 323.305 4.497 20 10 DICDRO CC[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(C(F)(F)F)cc1O ZINC000857059439 1049124707 /nfs/dbraw/zinc/12/47/07/1049124707.db2.gz PQSXPFZQLXSJHO-PWSUYJOCSA-N 1 0 323.305 4.497 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000857081684 1049125819 /nfs/dbraw/zinc/12/58/19/1049125819.db2.gz QDEVYFLGCGXMJK-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000857081392 1049125955 /nfs/dbraw/zinc/12/59/55/1049125955.db2.gz OGIQLTCOJNNUEY-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO CC[C@@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1ccc(C)cc1O ZINC000857082877 1049127760 /nfs/dbraw/zinc/12/77/60/1049127760.db2.gz RHZZQXHQRNMHJP-DGCLKSJQSA-N 1 0 302.245 4.325 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000857080061 1049126106 /nfs/dbraw/zinc/12/61/06/1049126106.db2.gz CKXXGFDIPPFSOS-ZUZCIYMTSA-N 1 0 319.351 4.017 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(OC)ccc1F)c1ccc(N(C)C)cc1 ZINC000857081397 1049126335 /nfs/dbraw/zinc/12/63/35/1049126335.db2.gz OGYHUQBEDFFVTN-IBGZPJMESA-N 1 0 316.420 4.141 20 10 DICDRO Oc1ccc(C[N@H+](Cc2ccccc2)C2CCCCC2)c(O)c1 ZINC001204276850 1049126518 /nfs/dbraw/zinc/12/65/18/1049126518.db2.gz SIYFCVFXCCEFMR-UHFFFAOYSA-N 1 0 311.425 4.433 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1O ZINC000775549709 1049139166 /nfs/dbraw/zinc/13/91/66/1049139166.db2.gz OZKWJQFYOBTHEL-LLVKDONJSA-N 1 0 319.351 4.032 20 10 DICDRO Cc1ccc(CC[N@@H+](C)Cc2ccc(N3CCCC3)cc2)cc1 ZINC001204322420 1049141832 /nfs/dbraw/zinc/14/18/32/1049141832.db2.gz RFRKYRRDGCCNNV-UHFFFAOYSA-N 1 0 308.469 4.270 20 10 DICDRO Fc1cccc([C@@H]2CC[N@H+](Cc3ccc(N4CCCC4)cc3)C2)c1 ZINC001204322203 1049142775 /nfs/dbraw/zinc/14/27/75/1049142775.db2.gz PITBVYQYXYCXMS-LJQANCHMSA-N 1 0 324.443 4.415 20 10 DICDRO CC[C@H]([NH2+]CCC[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000775554590 1049147460 /nfs/dbraw/zinc/14/74/60/1049147460.db2.gz BVDUYCNEGSGPAV-ZBFHGGJFSA-N 1 0 311.853 4.436 20 10 DICDRO CC[C@H]([NH2+]C[C@]1(C)CCO[C@@H]1C1CC1)c1cc(Cl)ccc1O ZINC000775553392 1049148248 /nfs/dbraw/zinc/14/82/48/1049148248.db2.gz BKILLFFXJOXXIF-JQHSSLGASA-N 1 0 323.864 4.292 20 10 DICDRO CC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC(F)(F)C1 ZINC001179463119 1049169101 /nfs/dbraw/zinc/16/91/01/1049169101.db2.gz HHRKUZSCYNIWKR-UHFFFAOYSA-N 1 0 308.416 4.202 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc(N(C)CC)cc2)c1 ZINC000773815206 1049169343 /nfs/dbraw/zinc/16/93/43/1049169343.db2.gz ZZMSXCARLBNRFW-MRXNPFEDSA-N 1 0 312.457 4.392 20 10 DICDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001179598080 1049182344 /nfs/dbraw/zinc/18/23/44/1049182344.db2.gz KLBURLWGTQYISQ-DGCLKSJQSA-N 1 0 300.368 4.050 20 10 DICDRO CC[C@@H]([NH2+]CC1(CCOC)CCCCC1)c1ccccc1O ZINC000775589111 1049193760 /nfs/dbraw/zinc/19/37/60/1049193760.db2.gz OPSIACYFNJRCDK-QGZVFWFLSA-N 1 0 305.462 4.420 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCCCC1 ZINC000775589047 1049193959 /nfs/dbraw/zinc/19/39/59/1049193959.db2.gz MGNGUUBMXGTHJS-QGZVFWFLSA-N 1 0 318.505 4.390 20 10 DICDRO CC[C@@H]([NH2+]C1(c2ccc(OC)cc2)CC1)c1ccc(N(C)C)cc1 ZINC000776959812 1049195623 /nfs/dbraw/zinc/19/56/23/1049195623.db2.gz CICYHYFXSVSRSX-HXUWFJFHSA-N 1 0 324.468 4.491 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCOCC23CCCC3)cc1C ZINC001179810203 1049208400 /nfs/dbraw/zinc/20/84/00/1049208400.db2.gz LWZSWGUPBULPPN-LJQANCHMSA-N 1 0 317.473 4.223 20 10 DICDRO CC[C@H](Cc1ccc(C)cc1)[N@H+](C)Cc1cc(OC)ccc1O ZINC001179881346 1049228213 /nfs/dbraw/zinc/22/82/13/1049228213.db2.gz BMBUCMMATKJPPH-GOSISDBHSA-N 1 0 313.441 4.162 20 10 DICDRO C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1cc(F)ccc1O ZINC001179937558 1049233429 /nfs/dbraw/zinc/23/34/29/1049233429.db2.gz MRPHETOGFBDHAH-LBPRGKRZSA-N 1 0 307.796 4.248 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccncc2F)c(C)n1-c1cccc(C)c1 ZINC000858293173 1049236847 /nfs/dbraw/zinc/23/68/47/1049236847.db2.gz KHJHNINFZJXVOW-UHFFFAOYSA-N 1 0 323.415 4.226 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccnn2C(C)C)c(C)n1-c1ccccc1 ZINC000858293341 1049237041 /nfs/dbraw/zinc/23/70/41/1049237041.db2.gz LMMAHFGTUIUOOQ-UHFFFAOYSA-N 1 0 322.456 4.161 20 10 DICDRO CC[N@H+](Cc1ccc(C)cc1)Cc1cc(F)c(N(C)C)cc1F ZINC001179909578 1049237924 /nfs/dbraw/zinc/23/79/24/1049237924.db2.gz OWTCSYRVSOBFJC-UHFFFAOYSA-N 1 0 318.411 4.361 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)c(O)c1 ZINC000858320643 1049241639 /nfs/dbraw/zinc/24/16/39/1049241639.db2.gz GHTJPWOHUHJWMM-KRWDZBQOSA-N 1 0 317.816 4.221 20 10 DICDRO COc1cc(C)c(C[N@@H+](Cc2ccccc2)CC(C)C)c(O)c1 ZINC001179993315 1049247292 /nfs/dbraw/zinc/24/72/92/1049247292.db2.gz JFIUPLNKBYCSJT-UHFFFAOYSA-N 1 0 313.441 4.367 20 10 DICDRO C[C@H]1C[NH+](Cc2ccc(OCc3ccccc3)cc2O)C[C@@H]1C ZINC001204769829 1049258484 /nfs/dbraw/zinc/25/84/84/1049258484.db2.gz WXEUXFWIWNSALG-HOTGVXAUSA-N 1 0 311.425 4.059 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(N(C)C)cc1 ZINC000858484272 1049264883 /nfs/dbraw/zinc/26/48/83/1049264883.db2.gz NBMLVOLIVVPABQ-MGPUTAFESA-N 1 0 309.457 4.340 20 10 DICDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001180141750 1049281696 /nfs/dbraw/zinc/28/16/96/1049281696.db2.gz ILBFVSRSHRAQBQ-MSOLQXFVSA-N 1 0 306.519 4.167 20 10 DICDRO C[C@@H]([NH2+]C1(c2c(F)cccc2F)CCC1)c1ccccc1O ZINC000858603008 1049283057 /nfs/dbraw/zinc/28/30/57/1049283057.db2.gz PAZVIDUOAFQSDR-GFCCVEGCSA-N 1 0 303.352 4.400 20 10 DICDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2cc(F)ccc2O)C12CCCCC2 ZINC001180099080 1049287408 /nfs/dbraw/zinc/28/74/08/1049287408.db2.gz SNEVWOXJNUFLGM-MSOLQXFVSA-N 1 0 321.436 4.091 20 10 DICDRO COc1ccc(C[N@@H+]2CCCC[C@@H]2CCC(C)C)c(O)c1OC ZINC001180116889 1049291129 /nfs/dbraw/zinc/29/11/29/1049291129.db2.gz NNHGTSHHNYFKSW-MRXNPFEDSA-N 1 0 321.461 4.200 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@H+](C)CCCc2ccccc2)cc1 ZINC001180121888 1049291919 /nfs/dbraw/zinc/29/19/19/1049291919.db2.gz XBQTUSVGCVBURJ-WQLSENKSSA-N 1 0 308.469 4.330 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1ccc(F)c(F)c1F ZINC001180188563 1049297934 /nfs/dbraw/zinc/29/79/34/1049297934.db2.gz GTGSFAITOXMMIW-UHFFFAOYSA-N 1 0 309.331 4.222 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@@H]2CCCN(c3ccccc3)C2)c1O ZINC001180202964 1049307916 /nfs/dbraw/zinc/30/79/16/1049307916.db2.gz GBLNMFTVUSMCOB-HXUWFJFHSA-N 1 0 324.468 4.055 20 10 DICDRO Cc1ccc(C[N@@H+](C)C/C=C/c2ccc(N(C)C)cc2)s1 ZINC001180212680 1049310815 /nfs/dbraw/zinc/31/08/15/1049310815.db2.gz FNTZCXOPICJYPP-AATRIKPKSA-N 1 0 300.471 4.268 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2c3ccccc3CC[C@H]2C)c1O ZINC001204974979 1049329292 /nfs/dbraw/zinc/32/92/92/1049329292.db2.gz FCRXKQIRLXQPJQ-AUUYWEPGSA-N 1 0 311.425 4.122 20 10 DICDRO C[C@@]1(C[N@H+](Cc2ccccc2O)C2CCCC2)CCCCO1 ZINC001180288071 1049335972 /nfs/dbraw/zinc/33/59/72/1049335972.db2.gz AQALUVQZYVMYAK-IBGZPJMESA-N 1 0 303.446 4.096 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC001180339641 1049338607 /nfs/dbraw/zinc/33/86/07/1049338607.db2.gz PWKFRNDYLQBNQL-UHFFFAOYSA-N 1 0 313.416 4.424 20 10 DICDRO Cc1cc(C[NH2+][C@@H](c2ccccn2)C2CCC2)ccc1N(C)C ZINC000859568076 1049339616 /nfs/dbraw/zinc/33/96/16/1049339616.db2.gz NGYMVTQDCWKXOD-HXUWFJFHSA-N 1 0 309.457 4.087 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H](CC(C)C)OC)cc1 ZINC001180359380 1049341123 /nfs/dbraw/zinc/34/11/23/1049341123.db2.gz KAHUBWSZDLLQAB-IBGZPJMESA-N 1 0 306.494 4.026 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](CC)Cc1cccs1 ZINC001205657056 1049347787 /nfs/dbraw/zinc/34/77/87/1049347787.db2.gz XMNFGTJHIDNWSH-INIZCTEOSA-N 1 0 302.487 4.445 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@H+](C)Cc2ccc(F)c(F)c2)cc1 ZINC001180394072 1049351595 /nfs/dbraw/zinc/35/15/95/1049351595.db2.gz RQGYSUDSMLIRMC-PLNGDYQASA-N 1 0 316.395 4.176 20 10 DICDRO COc1cc(C)c(C[N@H+](C)Cc2ccc(Cl)s2)c(O)c1 ZINC001180412726 1049359980 /nfs/dbraw/zinc/35/99/80/1049359980.db2.gz FOYKWJHQPMJGGO-UHFFFAOYSA-N 1 0 311.834 4.056 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@H]2c2cccc(OC)c2)c1O ZINC001180513680 1049368329 /nfs/dbraw/zinc/36/83/29/1049368329.db2.gz JYQIXKOYZDSLSJ-IBGZPJMESA-N 1 0 311.425 4.300 20 10 DICDRO Cc1cc(C[N@@H+]2CCCc3ccccc3CC2)ccc1N(C)C ZINC001194401277 1049368801 /nfs/dbraw/zinc/36/88/01/1049368801.db2.gz QWWMSEPEAPVWLT-UHFFFAOYSA-N 1 0 308.469 4.052 20 10 DICDRO COC1(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)CCCCC1 ZINC001180558742 1049382085 /nfs/dbraw/zinc/38/20/85/1049382085.db2.gz RTQFDVPGIAVOLN-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO [O-]c1c(F)cc(F)cc1C[N@@H+]1CCCC[C@H]1c1ccccc1 ZINC001180584814 1049386728 /nfs/dbraw/zinc/38/67/28/1049386728.db2.gz KMPLZDDMEPASJG-KRWDZBQOSA-N 1 0 303.352 4.398 20 10 DICDRO CCOc1ccc(C2=CC[N@H+](Cc3ccccc3O)CC2)cc1 ZINC000780767424 1049401017 /nfs/dbraw/zinc/40/10/17/1049401017.db2.gz MEXQXRRQVBNNIP-UHFFFAOYSA-N 1 0 309.409 4.080 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)c1O ZINC001205178041 1049404010 /nfs/dbraw/zinc/40/40/10/1049404010.db2.gz QDLIHTIONBZKQJ-LBPRGKRZSA-N 1 0 305.368 4.426 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)cc1F ZINC001205236557 1049414829 /nfs/dbraw/zinc/41/48/29/1049414829.db2.gz PGKWOUWAOKTMDD-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](CC(F)(F)F)C(C)C)cc1 ZINC000773889422 1049424507 /nfs/dbraw/zinc/42/45/07/1049424507.db2.gz VOYMUZLWULWFGQ-OAHLLOKOSA-N 1 0 302.384 4.209 20 10 DICDRO CC(C)[C@H](C[NH2+]Cc1cc(F)ccc1O)Cc1ccccc1 ZINC001180997791 1049426304 /nfs/dbraw/zinc/42/63/04/1049426304.db2.gz ZBTKQXJPFNARIJ-INIZCTEOSA-N 1 0 301.405 4.136 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CCc2cccc3[nH]ccc32)c1 ZINC001181195634 1049451347 /nfs/dbraw/zinc/45/13/47/1049451347.db2.gz BNMPOEXHNQXPEJ-UHFFFAOYSA-N 1 0 308.425 4.329 20 10 DICDRO COc1ccc(C[NH2+]CCc2ccc(C(C)(C)C)cc2)c(O)c1 ZINC001181196626 1049451875 /nfs/dbraw/zinc/45/18/75/1049451875.db2.gz TUVLSLZONUMETD-UHFFFAOYSA-N 1 0 313.441 4.031 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)c(O)c1 ZINC001181196694 1049451962 /nfs/dbraw/zinc/45/19/62/1049451962.db2.gz VUTQLVMEIRLSON-JCNLHEQBSA-N 1 0 301.817 4.390 20 10 DICDRO Cc1ccc(F)c(C[N@@H+](C)C/C=C\c2ccc(N(C)C)cc2)c1 ZINC001181276303 1049459735 /nfs/dbraw/zinc/45/97/35/1049459735.db2.gz LUGOVVACTADVMC-WAYWQWQTSA-N 1 0 312.432 4.345 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c(Cl)c1 ZINC001181350521 1049465921 /nfs/dbraw/zinc/46/59/21/1049465921.db2.gz SKXQOQGVZNWPSZ-KOLCDFICSA-N 1 0 307.743 4.127 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(c3ccsc3)CC2)cc1 ZINC000777223444 1049468394 /nfs/dbraw/zinc/46/83/94/1049468394.db2.gz WNCWQEJIUAOKPP-UHFFFAOYSA-N 1 0 300.471 4.194 20 10 DICDRO CCCN(Cc1ccc2c(c1)CCCC2)c1ccc(C[NH3+])cc1 ZINC001181445438 1049477164 /nfs/dbraw/zinc/47/71/64/1049477164.db2.gz OMVYCSGLZNFKSS-UHFFFAOYSA-N 1 0 308.469 4.441 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cnc(C2CC2)o1)C1CCCC1 ZINC000862243329 1049480858 /nfs/dbraw/zinc/48/08/58/1049480858.db2.gz YRNZAKKFQKEHEG-UHFFFAOYSA-N 1 0 312.413 4.202 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)c1O ZINC001181497302 1049484236 /nfs/dbraw/zinc/48/42/36/1049484236.db2.gz GJGJCXLPHJXAJE-GXFFZTMASA-N 1 0 321.467 4.178 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@](F)(c3ccccc3)C2)cc1 ZINC001205526552 1049491225 /nfs/dbraw/zinc/49/12/25/1049491225.db2.gz ACXGGOXQKZMYDU-IZRJCCQOSA-N 1 0 324.443 4.337 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000775652564 1049526012 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CCC1(C)C[NH+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001182226934 1049590271 /nfs/dbraw/zinc/59/02/71/1049590271.db2.gz MJHRCFKCHHUVIS-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO CCc1cccc(C[NH+]2CC(Cc3ccc(Cl)cc3)C2)c1O ZINC001182217062 1049592004 /nfs/dbraw/zinc/59/20/04/1049592004.db2.gz ZBFWZNYUXWDHAF-UHFFFAOYSA-N 1 0 315.844 4.283 20 10 DICDRO C[N@H+](Cc1cc(F)c(F)cc1[O-])[C@H]1CCC[C@H]1c1ccccc1 ZINC001182273014 1049599043 /nfs/dbraw/zinc/59/90/43/1049599043.db2.gz YUOKYJMHKAKDSD-YJBOKZPZSA-N 1 0 317.379 4.439 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@H](C)Cc1cccc(F)c1 ZINC001182272696 1049599792 /nfs/dbraw/zinc/59/97/92/1049599792.db2.gz VVYMELXPEAIGPL-MRXNPFEDSA-N 1 0 314.448 4.263 20 10 DICDRO CCCO[C@H]1CCC[N@H+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000775688964 1049624422 /nfs/dbraw/zinc/62/44/22/1049624422.db2.gz WCQYGPLVLAPOLU-INIZCTEOSA-N 1 0 311.853 4.135 20 10 DICDRO Cc1cccc(C[NH+]2CCC(OC3CCC(C)CC3)CC2)c1O ZINC000775689042 1049625282 /nfs/dbraw/zinc/62/52/82/1049625282.db2.gz XOHVWUIPMQEINC-UHFFFAOYSA-N 1 0 317.473 4.260 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)Cc3cccs3)cc2)[C@H]1C ZINC001206016226 1049629399 /nfs/dbraw/zinc/62/93/99/1049629399.db2.gz OYTOXYVSZDATLH-CABCVRRESA-N 1 0 300.471 4.225 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)c1 ZINC000775706356 1049636452 /nfs/dbraw/zinc/63/64/52/1049636452.db2.gz OVCWAKCEDXWENZ-SCLBCKFNSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@@H]1CCc2ccccc21 ZINC001182424401 1049644547 /nfs/dbraw/zinc/64/45/47/1049644547.db2.gz SQUWSAMWNFWPHT-PXNSSMCTSA-N 1 0 322.496 4.312 20 10 DICDRO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000794660065 1049653341 /nfs/dbraw/zinc/65/33/41/1049653341.db2.gz NDCMMRZNLCBBBW-NHYWBVRUSA-N 1 0 313.363 4.044 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2cccc(CC)c2O)c1 ZINC001206120681 1049659025 /nfs/dbraw/zinc/65/90/25/1049659025.db2.gz BFMVYYKXOZVGNJ-UHFFFAOYSA-N 1 0 301.455 4.356 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)c1 ZINC000775722827 1049666366 /nfs/dbraw/zinc/66/63/66/1049666366.db2.gz DMJDLPYGFGRSRA-GOSISDBHSA-N 1 0 315.388 4.267 20 10 DICDRO CC[C@H]([NH2+]C[C@H](c1ccccc1)N(C)C)c1ccc(C)cc1O ZINC000794794302 1049698200 /nfs/dbraw/zinc/69/82/00/1049698200.db2.gz LILGMNLCBVKKFH-RBUKOAKNSA-N 1 0 312.457 4.044 20 10 DICDRO CC[C@@H]([NH2+][C@H](CC)c1ccc(C)cc1O)c1c(C)nn(C)c1C ZINC000794802092 1049698749 /nfs/dbraw/zinc/69/87/49/1049698749.db2.gz MQQIFHJOJZLVND-IAGOWNOFSA-N 1 0 315.461 4.243 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)cc1 ZINC001197070113 1049718901 /nfs/dbraw/zinc/71/89/01/1049718901.db2.gz RYMCCMHYOTUCDX-FQEVSTJZSA-N 1 0 316.489 4.066 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](N(C)c3ccccc3)C2)c1 ZINC001206827704 1049808301 /nfs/dbraw/zinc/80/83/01/1049808301.db2.gz PRUNRYSRHNXRHZ-HXUWFJFHSA-N 1 0 324.468 4.226 20 10 DICDRO Cc1cc(CC[NH2+][C@H](C)[C@@H]2CC2(F)F)c(C)n1-c1ccccc1 ZINC001207017067 1049821488 /nfs/dbraw/zinc/82/14/88/1049821488.db2.gz IBUZZFLUJPHGSG-KDOFPFPSSA-N 1 0 318.411 4.270 20 10 DICDRO C[N@H+](Cc1ccc(F)c(F)c1)Cc1c(O)ccc2ccccc21 ZINC000913064146 1049834084 /nfs/dbraw/zinc/83/40/84/1049834084.db2.gz DFUURBQVMUCQGY-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO CSC1(C[NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)CC1 ZINC001207094073 1049834523 /nfs/dbraw/zinc/83/45/23/1049834523.db2.gz QLOATROMGKWBQN-UHFFFAOYSA-N 1 0 314.498 4.388 20 10 DICDRO CCc1cccc(C[NH+]2CCC(c3ccc(F)cc3)CC2)c1O ZINC001207166663 1049848172 /nfs/dbraw/zinc/84/81/72/1049848172.db2.gz FAGUVOXEATVKIR-UHFFFAOYSA-N 1 0 313.416 4.473 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc3cc[nH]c3c2)cc1Cl ZINC001207261512 1049870608 /nfs/dbraw/zinc/87/06/08/1049870608.db2.gz QXWRQVCXQOOASB-UHFFFAOYSA-N 1 0 314.816 4.467 20 10 DICDRO Cc1cc(C)c(O)c(C[NH+]2CCC(OC3CCCCC3)CC2)c1 ZINC000164232858 1049926514 /nfs/dbraw/zinc/92/65/14/1049926514.db2.gz VBECWMBIUKBHGW-UHFFFAOYSA-N 1 0 317.473 4.323 20 10 DICDRO CC[N@H+](CC[C@@H](C)CCCC(C)(C)O)Cc1ccccc1O ZINC001207678458 1049926549 /nfs/dbraw/zinc/92/65/49/1049926549.db2.gz MFRDAPOHCKKGPA-INIZCTEOSA-N 1 0 307.478 4.182 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)CC1(c2ccccc2)CC1 ZINC001207838351 1049943657 /nfs/dbraw/zinc/94/36/57/1049943657.db2.gz IDPYBBFLOZDFCZ-UHFFFAOYSA-N 1 0 320.480 4.450 20 10 DICDRO C[N@H+](CCCc1cccc(C(F)(F)F)c1)Cc1ccccc1O ZINC001207845539 1049945228 /nfs/dbraw/zinc/94/52/28/1049945228.db2.gz DLKHCGPMNOPBIY-UHFFFAOYSA-N 1 0 323.358 4.476 20 10 DICDRO CO[C@H]1CC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)[C@H](C)C1 ZINC001209519700 1050066176 /nfs/dbraw/zinc/06/61/76/1050066176.db2.gz FRULZFSNGDXZMP-XLIONFOSSA-N 1 0 312.457 4.093 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2c(Cl)cccc2C1)c1ccccc1O ZINC001171023181 1050146899 /nfs/dbraw/zinc/14/68/99/1050146899.db2.gz UIQARGYKJSOHNC-OCCSQVGLSA-N 1 0 301.817 4.254 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000770285135 1050148012 /nfs/dbraw/zinc/14/80/12/1050148012.db2.gz AOVPLZTXUGYRMZ-QUCCMNQESA-N 1 0 323.436 4.060 20 10 DICDRO Oc1cccc(Cl)c1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000770306909 1050149083 /nfs/dbraw/zinc/14/90/83/1050149083.db2.gz YGGJQDKWKZOMQK-UHFFFAOYSA-N 1 0 307.743 4.210 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2c(Cl)cccc2C1)c1ccccc1O ZINC001171027923 1050151964 /nfs/dbraw/zinc/15/19/64/1050151964.db2.gz UIQARGYKJSOHNC-GXTWGEPZSA-N 1 0 301.817 4.254 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000770509526 1050163880 /nfs/dbraw/zinc/16/38/80/1050163880.db2.gz CTWCVMUTQLYFJG-MRXNPFEDSA-N 1 0 319.857 4.336 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+]Cc2cc(Cl)cc(C)c2O)c1 ZINC000282582938 1050166095 /nfs/dbraw/zinc/16/60/95/1050166095.db2.gz UZDIIVQZLZYWOB-UHFFFAOYSA-N 1 0 311.212 4.001 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)[C@@H](OC)c2ccc(F)cc2)cc1C ZINC000770749675 1050191983 /nfs/dbraw/zinc/19/19/83/1050191983.db2.gz XGNPKNOPWOOKLG-AUUYWEPGSA-N 1 0 317.404 4.009 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000770747879 1050192478 /nfs/dbraw/zinc/19/24/78/1050192478.db2.gz RGZJIOSWNPILJY-KUHUBIRLSA-N 1 0 317.404 4.014 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000770744676 1050192779 /nfs/dbraw/zinc/19/27/79/1050192779.db2.gz BDISGDHAEHBPCB-GTNSWQLSSA-N 1 0 323.795 4.051 20 10 DICDRO CC[C@H]([NH2+]CCC(C)(F)F)c1ccc(C(F)(F)F)cc1O ZINC000824483247 1050213554 /nfs/dbraw/zinc/21/35/54/1050213554.db2.gz KFQYLINKZWJWDX-NSHDSACASA-N 1 0 311.294 4.497 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2cc(C3CC3)ccc2F)c1 ZINC000824548718 1050223443 /nfs/dbraw/zinc/22/34/43/1050223443.db2.gz MSHLRSZPCUAFBJ-UHFFFAOYSA-N 1 0 315.388 4.097 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2C[C@@H](C)Oc3ccccc32)c1O ZINC000824649599 1050230656 /nfs/dbraw/zinc/23/06/56/1050230656.db2.gz DHNSRURTKHRDEU-MLGOLLRUSA-N 1 0 317.816 4.356 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CCCCO)c1ccc(C(F)(F)F)cc1O ZINC000824653983 1050230844 /nfs/dbraw/zinc/23/08/44/1050230844.db2.gz KBFHDCZKEFLIRS-RISCZKNCSA-N 1 0 319.367 4.003 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CC(C)(C)O)c1ccc(C(F)(F)F)cc1O ZINC000824702538 1050234132 /nfs/dbraw/zinc/23/41/32/1050234132.db2.gz NEIQYFXXQFRFEI-MFKMUULPSA-N 1 0 319.367 4.001 20 10 DICDRO [O-]c1c(Cl)cccc1C[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000825104544 1050269367 /nfs/dbraw/zinc/26/93/67/1050269367.db2.gz ZPWJHOKWOQRREH-MRXNPFEDSA-N 1 0 303.789 4.366 20 10 DICDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000734476044 1050276512 /nfs/dbraw/zinc/27/65/12/1050276512.db2.gz BRVSOVLRPJSWPO-YJBOKZPZSA-N 1 0 318.420 4.318 20 10 DICDRO CC(C)(C)c1cc(O)c(O)c(C[NH+](CC2CC2)CC2CC2)c1 ZINC000734478352 1050277770 /nfs/dbraw/zinc/27/77/70/1050277770.db2.gz KTKSWMOFOFVORE-UHFFFAOYSA-N 1 0 303.446 4.017 20 10 DICDRO c1csc(SCCC[NH2+]C[C@H]2C[C@@H]2c2ccccc2)n1 ZINC000760956067 1050282220 /nfs/dbraw/zinc/28/22/20/1050282220.db2.gz UOGFRBYNNHNGHD-HUUCEWRRSA-N 1 0 304.484 4.019 20 10 DICDRO COc1cccc([C@H]2C[C@H]([N@H+](C)Cc3cccc(C)c3O)C2)c1 ZINC000825290356 1050290000 /nfs/dbraw/zinc/29/00/00/1050290000.db2.gz WCNFCGQPTUOXDE-IYARVYRRSA-N 1 0 311.425 4.087 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CCC(OC(C)C)CC2)cc1Cl ZINC000825370965 1050301264 /nfs/dbraw/zinc/30/12/64/1050301264.db2.gz SCXBFUCYIIIPDV-UHFFFAOYSA-N 1 0 311.853 4.180 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1Cl ZINC000825400490 1050302796 /nfs/dbraw/zinc/30/27/96/1050302796.db2.gz MCLHAHKIGRBAQI-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(C)ccc1OC ZINC000772447612 1050359029 /nfs/dbraw/zinc/35/90/29/1050359029.db2.gz ZLTCKCXZDJXNBN-LJQANCHMSA-N 1 0 312.457 4.311 20 10 DICDRO Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000766213320 1050394066 /nfs/dbraw/zinc/39/40/66/1050394066.db2.gz WYXZMWLBAZFNHD-HOCLYGCPSA-N 1 0 300.446 4.326 20 10 DICDRO Cc1ccccc1[C@H]([C@H](C)[NH2+][C@H](C)c1ccccc1O)N(C)C ZINC000785572728 1050397097 /nfs/dbraw/zinc/39/70/97/1050397097.db2.gz KUZNRBRSCFPPDR-GUXCAODWSA-N 1 0 312.457 4.043 20 10 DICDRO C[NH2+]Cc1ccc(N(c2ccccc2)c2ccc(N)cc2)cc1 ZINC001211131017 1050490239 /nfs/dbraw/zinc/49/02/39/1050490239.db2.gz JONDTMITUWWJHA-UHFFFAOYSA-N 1 0 303.409 4.458 20 10 DICDRO C[NH2+]Cc1cccc(Nc2ccccc2Cc2ccc(N)cc2)c1 ZINC001211139550 1050493430 /nfs/dbraw/zinc/49/34/30/1050493430.db2.gz LFSSJBBQTGNZRV-UHFFFAOYSA-N 1 0 317.436 4.323 20 10 DICDRO C[NH2+]Cc1cccc(N(c2ccccc2)c2ccc(N)cc2)c1 ZINC001211139150 1050493818 /nfs/dbraw/zinc/49/38/18/1050493818.db2.gz YIBXLKCKCYZLCJ-UHFFFAOYSA-N 1 0 303.409 4.458 20 10 DICDRO CO[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000786576470 1050498350 /nfs/dbraw/zinc/49/83/50/1050498350.db2.gz UVNVINYQIHGRHP-YESZJQIVSA-N 1 0 304.478 4.141 20 10 DICDRO CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000786792050 1050516839 /nfs/dbraw/zinc/51/68/39/1050516839.db2.gz HBQYKDRPJULOCT-UTKZUKDTSA-N 1 0 324.468 4.153 20 10 DICDRO CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000786792049 1050517443 /nfs/dbraw/zinc/51/74/43/1050517443.db2.gz HBQYKDRPJULOCT-LAUBAEHRSA-N 1 0 324.468 4.153 20 10 DICDRO CC[NH+](CC)Cc1ccc(NCc2c(O)cccc2Cl)cc1 ZINC000786831083 1050519960 /nfs/dbraw/zinc/51/99/60/1050519960.db2.gz MSNORANGJFDGLW-UHFFFAOYSA-N 1 0 318.848 4.500 20 10 DICDRO C[C@H]1CSCC[N@@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000738278545 1050526298 /nfs/dbraw/zinc/52/62/98/1050526298.db2.gz TZJQFNDXRIRKMW-LBPRGKRZSA-N 1 0 313.422 4.229 20 10 DICDRO c1ccc(C[C@@H]2CCC[C@H]2[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000738431714 1050534878 /nfs/dbraw/zinc/53/48/78/1050534878.db2.gz VUEIKNVSSYZJEE-AZUAARDMSA-N 1 0 307.437 4.123 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(F)nc2C)cc1 ZINC000787063220 1050552182 /nfs/dbraw/zinc/55/21/82/1050552182.db2.gz AKILEXVATHSFJU-UHFFFAOYSA-N 1 0 315.436 4.007 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC1 ZINC000766238087 1050585832 /nfs/dbraw/zinc/58/58/32/1050585832.db2.gz PEVCUJHFELWZEQ-PBHICJAKSA-N 1 0 324.415 4.035 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)[C@H]2CCC[C@@H](C)C2)c1O ZINC001171190438 1050597282 /nfs/dbraw/zinc/59/72/82/1050597282.db2.gz SICVIBUEAIVRLC-DYEKYZERSA-N 1 0 307.409 4.038 20 10 DICDRO CCOCc1cc(C[NH2+]C2C[C@@H](C)C[C@H](C)C2)ccc1OC ZINC000740017902 1050597464 /nfs/dbraw/zinc/59/74/64/1050597464.db2.gz FSNOJKSENFQPND-GJZGRUSLSA-N 1 0 305.462 4.146 20 10 DICDRO Fc1ccc2c(c1Cl)[C@H]([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC000845928246 1050637188 /nfs/dbraw/zinc/63/71/88/1050637188.db2.gz AVGYWWWZRDIPAI-OAHLLOKOSA-N 1 0 317.791 4.191 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ncc(C(C)(C)C)s2)c1 ZINC000845972546 1050639914 /nfs/dbraw/zinc/63/99/14/1050639914.db2.gz RQGXLNYSZGZEFT-LLVKDONJSA-N 1 0 320.458 4.006 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cnc(C2CCC2)s1 ZINC000846058199 1050648302 /nfs/dbraw/zinc/64/83/02/1050648302.db2.gz NQYMNMHCQPPWLP-UHFFFAOYSA-N 1 0 308.834 4.059 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccccc2OC(F)F)c(O)c1 ZINC000788258730 1050661299 /nfs/dbraw/zinc/66/12/99/1050661299.db2.gz IRUHTXDRDLWXLW-CYBMUJFWSA-N 1 0 321.367 4.195 20 10 DICDRO CS[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000227378120 1050665477 /nfs/dbraw/zinc/66/54/77/1050665477.db2.gz BKRBSQOTJVDHNJ-WMZOPIPTSA-N 1 0 304.503 4.051 20 10 DICDRO CS[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000227378107 1050665606 /nfs/dbraw/zinc/66/56/06/1050665606.db2.gz BKRBSQOTJVDHNJ-AEFFLSMTSA-N 1 0 304.503 4.051 20 10 DICDRO Cc1cccc([C@@H](C)C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000741254709 1050668803 /nfs/dbraw/zinc/66/88/03/1050668803.db2.gz CVPSMPWOXONGEE-HNNXBMFYSA-N 1 0 300.421 4.093 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CC[C@H](c2ccccc2)O1)c1ccccc1O ZINC000846102017 1050670231 /nfs/dbraw/zinc/67/02/31/1050670231.db2.gz JTMFXMJESIBILU-XKGZKEIXSA-N 1 0 311.425 4.353 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1 ZINC000846108022 1050671950 /nfs/dbraw/zinc/67/19/50/1050671950.db2.gz BHQOAHBPLUGOEV-GHMZBOCLSA-N 1 0 318.244 4.025 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)C2CC2)c1O ZINC000846156942 1050674214 /nfs/dbraw/zinc/67/42/14/1050674214.db2.gz ZQJWRUQUFVTGGK-KDOFPFPSSA-N 1 0 311.425 4.073 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC2(Cc3ccccc3)CC2)c1O ZINC000846157780 1050674244 /nfs/dbraw/zinc/67/42/44/1050674244.db2.gz XEZSTWOLNIBAEO-HNNXBMFYSA-N 1 0 311.425 4.074 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCc2cc3ccccc3o2)c1O ZINC000846154822 1050674661 /nfs/dbraw/zinc/67/46/61/1050674661.db2.gz NPCRAPIOTYXLEW-ZDUSSCGKSA-N 1 0 311.381 4.040 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CC(C)(C)c3ccccc32)c1O ZINC000846157741 1050675079 /nfs/dbraw/zinc/67/50/79/1050675079.db2.gz WNSZGURFUIAILI-DYVFJYSZSA-N 1 0 311.425 4.474 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2c(C)oc3ccccc32)c1O ZINC000846162835 1050676271 /nfs/dbraw/zinc/67/62/71/1050676271.db2.gz FVZDTKRCGVXMPO-LBPRGKRZSA-N 1 0 311.381 4.306 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(c3ccc(F)cc3)CCC2)c1O ZINC000846162598 1050676378 /nfs/dbraw/zinc/67/63/78/1050676378.db2.gz LLAPQVMAXPEGCB-ZDUSSCGKSA-N 1 0 315.388 4.270 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2cccc(OC)c2O)CCCCC1 ZINC000846164720 1050678133 /nfs/dbraw/zinc/67/81/33/1050678133.db2.gz QFICVWHTSAINRA-OAHLLOKOSA-N 1 0 321.461 4.038 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)CCCC(F)(F)F)c1O ZINC000846165383 1050678654 /nfs/dbraw/zinc/67/86/54/1050678654.db2.gz KYGMQGNGYSWICP-QWRGUYRKSA-N 1 0 305.340 4.173 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)CCCC(F)(F)F)c1O ZINC000846165382 1050678690 /nfs/dbraw/zinc/67/86/90/1050678690.db2.gz KYGMQGNGYSWICP-MNOVXSKESA-N 1 0 305.340 4.173 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCC2CC(OC(C)(C)C)C2)c1O ZINC000846167270 1050678733 /nfs/dbraw/zinc/67/87/33/1050678733.db2.gz VWMONXBJKOUGKI-NFOMZHRRSA-N 1 0 321.461 4.035 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2cccc(OC)c2O)CCCCC1 ZINC000846164716 1050678954 /nfs/dbraw/zinc/67/89/54/1050678954.db2.gz QFICVWHTSAINRA-HNNXBMFYSA-N 1 0 321.461 4.038 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCc3ccc(C)cc32)c1O ZINC000846170161 1050680646 /nfs/dbraw/zinc/68/06/46/1050680646.db2.gz JBNIUJCOJBQMIF-KSSFIOAISA-N 1 0 311.425 4.437 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCc2c[nH]c3cccc(C)c23)c1O ZINC000846144807 1050683782 /nfs/dbraw/zinc/68/37/82/1050683782.db2.gz KGHFOCQMZPATQV-CQSZACIVSA-N 1 0 324.424 4.084 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C[C@H](C)Sc2ccccc2)c1O ZINC000846143034 1050683969 /nfs/dbraw/zinc/68/39/69/1050683969.db2.gz AEJIJTDGCWSTGL-KBPBESRZSA-N 1 0 317.454 4.232 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@H](C)c2cccc(OC)c2O)on1 ZINC000846143430 1050684059 /nfs/dbraw/zinc/68/40/59/1050684059.db2.gz BSMDRJGVZBSOEQ-GFCCVEGCSA-N 1 0 318.417 4.143 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(F)c(Cl)c2)c1O ZINC000846144095 1050684103 /nfs/dbraw/zinc/68/41/03/1050684103.db2.gz HYIITLKAJPYKSH-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+][C@H](C)c2cccc(OC)c2O)c1 ZINC000846141973 1050684547 /nfs/dbraw/zinc/68/45/47/1050684547.db2.gz PHFQCPFBVIGKIA-ZIAGYGMSSA-N 1 0 315.413 4.211 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)COCC1CC1)c1ccc(N2CCCCC2)cc1 ZINC000846205433 1050686390 /nfs/dbraw/zinc/68/63/90/1050686390.db2.gz PMCBZBHKJFLURK-DLBZAZTESA-N 1 0 316.489 4.143 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)c(O)c1 ZINC000788500942 1050692815 /nfs/dbraw/zinc/69/28/15/1050692815.db2.gz FGNVUDGQJBAKLD-CYBMUJFWSA-N 1 0 321.367 4.461 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCn2cnc3ccccc32)c(O)c1 ZINC000788505119 1050693827 /nfs/dbraw/zinc/69/38/27/1050693827.db2.gz SQHHQNXPRGJHAM-MRXNPFEDSA-N 1 0 323.440 4.100 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](c2cccs2)N(C)C)c(O)c1 ZINC000788506789 1050694788 /nfs/dbraw/zinc/69/47/88/1050694788.db2.gz XXEPZMMSRFNOSP-LSDHHAIUSA-N 1 0 318.486 4.024 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](c2cccs2)N(C)C)c(O)c1 ZINC000788506785 1050695017 /nfs/dbraw/zinc/69/50/17/1050695017.db2.gz XXEPZMMSRFNOSP-HUUCEWRRSA-N 1 0 318.486 4.024 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCN(c3ccccc3)C2)c(O)c1 ZINC000788527591 1050704168 /nfs/dbraw/zinc/70/41/68/1050704168.db2.gz WZLHNAYBDAZMLC-QZTJIDSGSA-N 1 0 324.468 4.186 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000788533485 1050705199 /nfs/dbraw/zinc/70/51/99/1050705199.db2.gz ZNEAFRGIFAMRQS-UHFFFAOYSA-N 1 0 318.150 4.267 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(O)c1 ZINC000788584772 1050708980 /nfs/dbraw/zinc/70/89/80/1050708980.db2.gz QHZLRUSOAAMSBJ-CQSZACIVSA-N 1 0 316.420 4.065 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cc(F)cc(F)c2)c(O)c1 ZINC000788582588 1050709189 /nfs/dbraw/zinc/70/91/89/1050709189.db2.gz HRBMCABDCXHEQR-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2csc(C(C)C)n2)c(O)c1 ZINC000788589397 1050711249 /nfs/dbraw/zinc/71/12/49/1050711249.db2.gz QVCTZKCTNQGDTB-CQSZACIVSA-N 1 0 318.486 4.482 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000788613999 1050716226 /nfs/dbraw/zinc/71/62/26/1050716226.db2.gz PPMKBYTZVCDMHB-FXAWDEMLSA-N 1 0 324.468 4.350 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCOc2ccc(F)cc2F)c(O)c1 ZINC000788614810 1050716634 /nfs/dbraw/zinc/71/66/34/1050716634.db2.gz XDGUDIULTAFXIL-ZDUSSCGKSA-N 1 0 321.367 4.017 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](c2cccnc2)C(C)C)c(O)c1 ZINC000788629379 1050720815 /nfs/dbraw/zinc/72/08/15/1050720815.db2.gz UHFKHRGENUXOCI-WMZOPIPTSA-N 1 0 312.457 4.494 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C(C)C)[C@@H](O)c2ccccc2)c1 ZINC000788624698 1050721379 /nfs/dbraw/zinc/72/13/79/1050721379.db2.gz CMYLLKQWHWMJLP-YSSFQJQWSA-N 1 0 313.441 4.109 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(-n3ccnc3)cc2)c(O)c1 ZINC000788638017 1050722620 /nfs/dbraw/zinc/72/26/20/1050722620.db2.gz FOGTVIIHADCUCG-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(C)ccc2OC)cc1 ZINC000772950405 1050741207 /nfs/dbraw/zinc/74/12/07/1050741207.db2.gz HREXKTZDXADFKA-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)ccc1OC)c1ccc(N(C)C)cc1 ZINC000772952241 1050744062 /nfs/dbraw/zinc/74/40/62/1050744062.db2.gz QNAXIPWPONBMQA-IBGZPJMESA-N 1 0 312.457 4.311 20 10 DICDRO CCO[C@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)c1ccccc1 ZINC000788778893 1050753008 /nfs/dbraw/zinc/75/30/08/1050753008.db2.gz ZRRZGEJWWFMIFN-QFBILLFUSA-N 1 0 313.441 4.437 20 10 DICDRO CCO[C@@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)c1ccccc1 ZINC000788778890 1050753160 /nfs/dbraw/zinc/75/31/60/1050753160.db2.gz ZRRZGEJWWFMIFN-APWZRJJASA-N 1 0 313.441 4.437 20 10 DICDRO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000788982231 1050770505 /nfs/dbraw/zinc/77/05/05/1050770505.db2.gz WMYLRAHPHSEONH-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c1O ZINC000761198535 1050774371 /nfs/dbraw/zinc/77/43/71/1050774371.db2.gz QGLAXXHTIJXAPD-HZMBPMFUSA-N 1 0 321.804 4.060 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000772961416 1050808482 /nfs/dbraw/zinc/80/84/82/1050808482.db2.gz QKLCWYUJXOMWDP-YWZLYKJASA-N 1 0 324.468 4.489 20 10 DICDRO COc1ccccc1-c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000742368392 1050822057 /nfs/dbraw/zinc/82/20/57/1050822057.db2.gz GATJVKNMIQYMNS-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO C[C@@H]1CC[C@H]([NH2+][C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 ZINC000742384548 1050828302 /nfs/dbraw/zinc/82/83/02/1050828302.db2.gz HZHCYELDTWBTTM-ILXRZTDVSA-N 1 0 324.415 4.035 20 10 DICDRO COc1cccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000772977351 1050842214 /nfs/dbraw/zinc/84/22/14/1050842214.db2.gz MRKMBVRFXXPIPG-CVEARBPZSA-N 1 0 312.457 4.043 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000789514351 1050843361 /nfs/dbraw/zinc/84/33/61/1050843361.db2.gz PRSWTFYRMPNLRH-ROUUACIJSA-N 1 0 317.473 4.142 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2cc3ccccc3[nH]2)C2CC2)cc1 ZINC000789720791 1050876837 /nfs/dbraw/zinc/87/68/37/1050876837.db2.gz MLKPDNAUEHMTFY-UHFFFAOYSA-N 1 0 319.452 4.399 20 10 DICDRO CCCCO[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)CC)cc2)C1(C)C ZINC001170118105 1050883716 /nfs/dbraw/zinc/88/37/16/1050883716.db2.gz PBXWUQCNTXIEAQ-MOPGFXCFSA-N 1 0 318.505 4.216 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCSC1)c1ccc(N2CCCCC2)cc1 ZINC000790498827 1050964909 /nfs/dbraw/zinc/96/49/09/1050964909.db2.gz TYLSQYOPDLDAMC-HOTGVXAUSA-N 1 0 304.503 4.081 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC3(CCCCC3)O2)c(O)c1 ZINC000790716635 1050988432 /nfs/dbraw/zinc/98/84/32/1050988432.db2.gz WUJKTSXPPMRLSS-CVEARBPZSA-N 1 0 303.446 4.233 20 10 DICDRO CC(C)=CCC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000790683558 1050991417 /nfs/dbraw/zinc/99/14/17/1050991417.db2.gz PNUWMIPPXQZKQS-OAHLLOKOSA-N 1 0 322.880 4.184 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc(F)c(F)c2)ccc1N(C)C ZINC000772999573 1051012637 /nfs/dbraw/zinc/01/26/37/1051012637.db2.gz MRMSCHNORWPAEF-CYBMUJFWSA-N 1 0 304.384 4.190 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H]1CCC2(CCCCC2)O1 ZINC000790995385 1051015912 /nfs/dbraw/zinc/01/59/12/1051015912.db2.gz OEPMHZYOIVIPOC-ZDUSSCGKSA-N 1 0 309.837 4.017 20 10 DICDRO CC[C@@H](O)CCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000773014691 1051023135 /nfs/dbraw/zinc/02/31/35/1051023135.db2.gz KAZKTJHQWKWOEH-DOTOQJQBSA-N 1 0 322.468 4.018 20 10 DICDRO CC[C@H](O)CCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773015847 1051025513 /nfs/dbraw/zinc/02/55/13/1051025513.db2.gz OHQUIALWQGYBJY-XLIONFOSSA-N 1 0 318.505 4.269 20 10 DICDRO Cc1cc(C[N@@H+]2CCC3(C2)CCOCC3)c(O)c(C(C)(C)C)c1 ZINC000743408796 1051026101 /nfs/dbraw/zinc/02/61/01/1051026101.db2.gz NWRNDONTYMCREF-UHFFFAOYSA-N 1 0 317.473 4.001 20 10 DICDRO C[C@H]([NH2+][C@H]1CCSC1)c1ccc(N2CCCCCC2)cc1 ZINC000773030568 1051030328 /nfs/dbraw/zinc/03/03/28/1051030328.db2.gz TUZYSWUECKHNAO-RDJZCZTQSA-N 1 0 304.503 4.223 20 10 DICDRO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(N(C)C)cc1 ZINC000773039420 1051035846 /nfs/dbraw/zinc/03/58/46/1051035846.db2.gz GKZLQTDKDYXNBI-YVEFUNNKSA-N 1 0 316.832 4.190 20 10 DICDRO Cc1cc(C[NH2+]Cc2cccnc2)c(C)n1-c1cccc(C)c1 ZINC000743503689 1051036984 /nfs/dbraw/zinc/03/69/84/1051036984.db2.gz ZXWCZDRCRAYYLH-UHFFFAOYSA-N 1 0 305.425 4.087 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(-n3cccn3)cc2)cc1C ZINC000743498495 1051037452 /nfs/dbraw/zinc/03/74/52/1051037452.db2.gz PKWGPEJNQXRXST-MRXNPFEDSA-N 1 0 321.424 4.040 20 10 DICDRO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccc(N(C)C)cc1 ZINC000773058447 1051043454 /nfs/dbraw/zinc/04/34/54/1051043454.db2.gz HTECGEJKMGYHIA-SJCJKPOMSA-N 1 0 316.832 4.190 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1ccc(N2CCCCCC2)cc1 ZINC000773105516 1051062818 /nfs/dbraw/zinc/06/28/18/1051062818.db2.gz HQPLFOXYMFORKC-CVEARBPZSA-N 1 0 312.461 4.202 20 10 DICDRO CCC(CC)(CO)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000773101748 1051064960 /nfs/dbraw/zinc/06/49/60/1051064960.db2.gz JSZNNQWZTWSGIF-QGZVFWFLSA-N 1 0 318.505 4.126 20 10 DICDRO Cc1c2[nH+]c[nH]c2ccc1NCc1cc2ccccc2cc1O ZINC001171405310 1051092270 /nfs/dbraw/zinc/09/22/70/1051092270.db2.gz UMTRZCHFZQGLDY-UHFFFAOYSA-N 1 0 303.365 4.342 20 10 DICDRO CC(C)([NH3+])c1ccccc1NCc1cc2ccccc2cc1O ZINC001171407109 1051095960 /nfs/dbraw/zinc/09/59/60/1051095960.db2.gz KHDAEJPRXZQYRJ-UHFFFAOYSA-N 1 0 306.409 4.351 20 10 DICDRO Oc1cc2ccccc2cc1CNc1cc(OC(F)F)cc[nH+]1 ZINC001171407342 1051096292 /nfs/dbraw/zinc/09/62/92/1051096292.db2.gz ODBDNJAZXNDVQP-UHFFFAOYSA-N 1 0 316.307 4.154 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000037089958 1051109812 /nfs/dbraw/zinc/10/98/12/1051109812.db2.gz SNZQPMNPIJIHRF-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2CC(OCc3ccccc3)C2)c1 ZINC000716283574 1051129974 /nfs/dbraw/zinc/12/99/74/1051129974.db2.gz FPDAHFVEDPAYSP-FAEJEUNOSA-N 1 0 311.425 4.099 20 10 DICDRO FC(F)(F)C1CCC(C[NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000744450333 1051178412 /nfs/dbraw/zinc/17/84/12/1051178412.db2.gz YLOXLADNZMRYKH-UHFFFAOYSA-N 1 0 313.363 4.080 20 10 DICDRO C[C@@H](Cc1ccccc1Cl)[N@@H+]1CCc2cccc(O)c2C1 ZINC001170288601 1051183502 /nfs/dbraw/zinc/18/35/02/1051183502.db2.gz QYGOVAAVYRNZQT-ZDUSSCGKSA-N 1 0 301.817 4.035 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCOC2CCCCC2)cc1F ZINC001649138251 1051216947 /nfs/dbraw/zinc/21/69/47/1051216947.db2.gz DEGJTWFPAJEGFB-UHFFFAOYSA-N 1 0 322.468 4.111 20 10 DICDRO Cc1ccccc1C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792881772 1051223819 /nfs/dbraw/zinc/22/38/19/1051223819.db2.gz JTRHCUOVWXXJEQ-UHFFFAOYSA-N 1 0 322.374 4.370 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000792985113 1051234918 /nfs/dbraw/zinc/23/49/18/1051234918.db2.gz VKUMWEVGOYTHTL-CHWSQXEVSA-N 1 0 319.832 4.336 20 10 DICDRO C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1ccccc1O ZINC001171967841 1051248041 /nfs/dbraw/zinc/24/80/41/1051248041.db2.gz TUAPWURTTPSTBD-CYBMUJFWSA-N 1 0 323.358 4.474 20 10 DICDRO COc1ccc2c(c1)CCC[C@@H]2C[NH2+][C@@H](C)c1ccccc1O ZINC000766331227 1051256364 /nfs/dbraw/zinc/25/63/64/1051256364.db2.gz NDBOHVUDXRKADV-GOEBONIOSA-N 1 0 311.425 4.172 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000793309058 1051276997 /nfs/dbraw/zinc/27/69/97/1051276997.db2.gz JUHBXWSKZSTDIC-INIZCTEOSA-N 1 0 305.780 4.352 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000793385602 1051294064 /nfs/dbraw/zinc/29/40/64/1051294064.db2.gz COVWQCRUTZHQJZ-CTYIDZIISA-N 1 0 317.816 4.090 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CC[C@@](C)(c3ccccc3)C2)c(O)c1 ZINC000793391462 1051296044 /nfs/dbraw/zinc/29/60/44/1051296044.db2.gz YKUMWFJQQSYTQD-YLJYHZDGSA-N 1 0 311.425 4.001 20 10 DICDRO CC(C)[N@H+](Cc1ccccc1F)Cc1c(O)ccc2ccncc21 ZINC000746033326 1051309017 /nfs/dbraw/zinc/30/90/17/1051309017.db2.gz OIXGKJMWGZMJMQ-UHFFFAOYSA-N 1 0 324.399 4.490 20 10 DICDRO CC1(C)CC[C@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000793536698 1051310886 /nfs/dbraw/zinc/31/08/86/1051310886.db2.gz ULNHCZYBWRWNOP-XJKSGUPXSA-N 1 0 324.415 4.035 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000793607667 1051325477 /nfs/dbraw/zinc/32/54/77/1051325477.db2.gz BOEDXYIASGGSKY-FPOVZHCZSA-N 1 0 323.436 4.203 20 10 DICDRO CC[NH+](CC)Cc1ccc(F)c(N(C)c2ccc(N)cc2)c1 ZINC001215726995 1051326571 /nfs/dbraw/zinc/32/65/71/1051326571.db2.gz VQOSGLPUCYTETF-UHFFFAOYSA-N 1 0 301.409 4.018 20 10 DICDRO Cc1cccc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)c1O ZINC000793625973 1051328895 /nfs/dbraw/zinc/32/88/95/1051328895.db2.gz WZZTYXUKJVHPBD-UHFFFAOYSA-N 1 0 311.425 4.312 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000752267282 1051383954 /nfs/dbraw/zinc/38/39/54/1051383954.db2.gz WZKNIJYISIBIFZ-OCCSQVGLSA-N 1 0 301.352 4.159 20 10 DICDRO CCCCCC[C@H](CCC)[NH2+]CC(=O)c1ccc(O)c(O)c1 ZINC001172392699 1051394772 /nfs/dbraw/zinc/39/47/72/1051394772.db2.gz ZQFKAPXFPWIRRJ-HNNXBMFYSA-N 1 0 307.434 4.009 20 10 DICDRO Cc1cccc2oc(CC[NH2+][C@H](C)c3ccc(N(C)C)cc3)nc21 ZINC000766353609 1051403690 /nfs/dbraw/zinc/40/36/90/1051403690.db2.gz GNLCFQTWNCMOHQ-OAHLLOKOSA-N 1 0 323.440 4.096 20 10 DICDRO C[C@H](Cc1ccncc1)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766490350 1051432837 /nfs/dbraw/zinc/43/28/37/1051432837.db2.gz UEGAPYZHRBUHTG-QZTJIDSGSA-N 1 0 323.484 4.354 20 10 DICDRO CCCC[C@H](CC)C[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC001168802293 1051441857 /nfs/dbraw/zinc/44/18/57/1051441857.db2.gz XPEGSIWRGRRIOM-MSOLQXFVSA-N 1 0 318.505 4.390 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172722932 1051483940 /nfs/dbraw/zinc/48/39/40/1051483940.db2.gz CXTKGNYJEIZLON-QGZVFWFLSA-N 1 0 301.817 4.035 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2OC)cc1 ZINC000766576396 1051498136 /nfs/dbraw/zinc/49/81/36/1051498136.db2.gz NXYYBXIEXAZXIA-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO CCOc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000766574606 1051509757 /nfs/dbraw/zinc/50/97/57/1051509757.db2.gz YWZNWRFJXSRVJW-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO C[C@H](Cc1c(F)cccc1Cl)[NH2+][C@@H](C)c1ccccc1O ZINC001172839910 1051528139 /nfs/dbraw/zinc/52/81/39/1051528139.db2.gz ANOAAENNKLHIMM-NEPJUHHUSA-N 1 0 307.796 4.467 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](c3cccc(C)c3)C2)cc1 ZINC001169198289 1051544391 /nfs/dbraw/zinc/54/43/91/1051544391.db2.gz VPIFPCXVGLZCKJ-HXUWFJFHSA-N 1 0 308.469 4.441 20 10 DICDRO C[C@H](CSc1ccc(Cl)cc1)[NH2+]Cc1ccccc1O ZINC001172875169 1051557920 /nfs/dbraw/zinc/55/79/20/1051557920.db2.gz MCCDPDDCXNOSDL-GFCCVEGCSA-N 1 0 307.846 4.316 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)cc1 ZINC001169367245 1051590813 /nfs/dbraw/zinc/59/08/13/1051590813.db2.gz QKNFVQHIOBMCBX-PZJWPPBQSA-N 1 0 308.469 4.254 20 10 DICDRO CCO[C@H]1C[C@H]([NH2+]Cc2ccc(OC)c(C)c2)C1(CC)CC ZINC001169582006 1051655330 /nfs/dbraw/zinc/65/53/30/1051655330.db2.gz NPIUVJHMFPDFJY-ROUUACIJSA-N 1 0 305.462 4.077 20 10 DICDRO CC[C@H]1CC[C@@H]([N@@H+]2CCc3c(c4cc(OC)ccc4n3C)C2)C1 ZINC001173286018 1051690214 /nfs/dbraw/zinc/69/02/14/1051690214.db2.gz CEXLQWUSVGNPSE-LSDHHAIUSA-N 1 0 312.457 4.124 20 10 DICDRO CCCC[N@H+](CC(=O)c1ccccc1F)Cc1ccccc1O ZINC001169753907 1051692544 /nfs/dbraw/zinc/69/25/44/1051692544.db2.gz CZVVLAQIUCCROD-UHFFFAOYSA-N 1 0 315.388 4.016 20 10 DICDRO CNc1cc(N(c2ccc(N)cc2)c2ccc(OC)cc2)cc[nH+]1 ZINC001216338742 1051706880 /nfs/dbraw/zinc/70/68/80/1051706880.db2.gz UQTIJRYHDLVDQT-UHFFFAOYSA-N 1 0 320.396 4.184 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@@H]3C(C)(C)C)CC2)cc1 ZINC000806137855 1051738265 /nfs/dbraw/zinc/73/82/65/1051738265.db2.gz SQAPSQXFTFAZNH-RBUKOAKNSA-N 1 0 316.489 4.078 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@H](CC)C2)ccc1OC ZINC000740899071 1051745891 /nfs/dbraw/zinc/74/58/91/1051745891.db2.gz PFUMLJVSLDIALR-MAUKXSAKSA-N 1 0 305.462 4.290 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000806175480 1051748479 /nfs/dbraw/zinc/74/84/79/1051748479.db2.gz BTCKTQZQLGKXNP-OAHLLOKOSA-N 1 0 319.489 4.374 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000806176115 1051749133 /nfs/dbraw/zinc/74/91/33/1051749133.db2.gz LFQZIAGGAYJDGK-JSGCOSHPSA-N 1 0 309.425 4.122 20 10 DICDRO CC[C@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1cccc(Cl)c1[O-] ZINC000806157500 1051761096 /nfs/dbraw/zinc/76/10/96/1051761096.db2.gz GDUMEDGADRQVCE-YOEHRIQHSA-N 1 0 324.896 4.351 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cccc(Cl)c1[O-] ZINC000806160979 1051763056 /nfs/dbraw/zinc/76/30/56/1051763056.db2.gz HAFZNMXCEIMVGC-INIZCTEOSA-N 1 0 324.896 4.208 20 10 DICDRO CC(C)SCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000806167998 1051766001 /nfs/dbraw/zinc/76/60/01/1051766001.db2.gz QYANMDOBSYYNRZ-MRXNPFEDSA-N 1 0 306.519 4.469 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCSC1)c1cc2c(cc1O)CCCC2 ZINC000806179673 1051772121 /nfs/dbraw/zinc/77/21/21/1051772121.db2.gz UJBCUEMWDVPWNI-KBPBESRZSA-N 1 0 305.487 4.065 20 10 DICDRO Cc1nc(CC[N@H+](Cc2ccccc2O)C2CCCC2)cs1 ZINC000767398134 1051803334 /nfs/dbraw/zinc/80/33/34/1051803334.db2.gz KAEGPFLFBMJTFU-UHFFFAOYSA-N 1 0 316.470 4.144 20 10 DICDRO COc1ccc(C[NH2+]CCCSc2ccccc2)cc1C ZINC000806676777 1051840599 /nfs/dbraw/zinc/84/05/99/1051840599.db2.gz FJUXJXTYDLMDHE-UHFFFAOYSA-N 1 0 301.455 4.276 20 10 DICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]CCCF)cc1 ZINC000767927167 1051866613 /nfs/dbraw/zinc/86/66/13/1051866613.db2.gz QWGZGPAEHOVFRD-UHFFFAOYSA-N 1 0 300.421 4.162 20 10 DICDRO CC(C)Cc1ncc(C[N@H+](C)Cc2ccc(N(C)C)cc2)s1 ZINC000768130151 1051886899 /nfs/dbraw/zinc/88/68/99/1051886899.db2.gz ODNXBRSWQPYFBU-UHFFFAOYSA-N 1 0 317.502 4.040 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N2CCOCC2)cc1)C1CCCCC1 ZINC000768159695 1051889564 /nfs/dbraw/zinc/88/95/64/1051889564.db2.gz HDTPGPWCYMXNHN-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)c(O)c1 ZINC000768231049 1051906471 /nfs/dbraw/zinc/90/64/71/1051906471.db2.gz UDCNPVAWIXOOKU-LBPRGKRZSA-N 1 0 321.367 4.262 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000768236781 1051907906 /nfs/dbraw/zinc/90/79/06/1051907906.db2.gz LLCZIMMLWDTVDO-AWEZNQCLSA-N 1 0 316.420 4.093 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)c1O ZINC000768257551 1051909770 /nfs/dbraw/zinc/90/97/70/1051909770.db2.gz MGYZGFRUXGEJQC-UHFFFAOYSA-N 1 0 317.816 4.219 20 10 DICDRO CCc1ccc(C[N@H+](Cc2cccc(OC)c2O)C2CC2)cc1 ZINC000768253091 1051910435 /nfs/dbraw/zinc/91/04/35/1051910435.db2.gz YWXBADIKHPEDBI-UHFFFAOYSA-N 1 0 311.425 4.128 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2cccc(F)c2)C2CC2)c1O ZINC000768257169 1051910578 /nfs/dbraw/zinc/91/05/78/1051910578.db2.gz INCMOBMZLZCVLN-UHFFFAOYSA-N 1 0 315.388 4.095 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2cccs2)C2CC2)cc1F ZINC000768251990 1051910798 /nfs/dbraw/zinc/91/07/98/1051910798.db2.gz CVYLJCOWYGRSDQ-UHFFFAOYSA-N 1 0 304.434 4.118 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2cccc3ccccc32)c1O ZINC000768243293 1051913808 /nfs/dbraw/zinc/91/38/08/1051913808.db2.gz JZCVYHWRAZOHGI-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](Cc2cccs2)C(C)C)c1 ZINC000768335018 1051918529 /nfs/dbraw/zinc/91/85/29/1051918529.db2.gz TYVVMCMSELCEHX-UHFFFAOYSA-N 1 0 305.443 4.263 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2ccc(F)cc2)C(C)C)c1O ZINC000768329864 1051918742 /nfs/dbraw/zinc/91/87/42/1051918742.db2.gz IFCJVCSIFDLGNG-UHFFFAOYSA-N 1 0 317.404 4.341 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1 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Cc1nc(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)sc1C ZINC000808702705 1052067797 /nfs/dbraw/zinc/06/77/97/1052067797.db2.gz MDKOPPWNTHBLPI-LLVKDONJSA-N 1 0 324.877 4.321 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)C)C2)c1O ZINC000808702808 1052067815 /nfs/dbraw/zinc/06/78/15/1052067815.db2.gz BLCRPSFBFJDSNQ-NOLJZWGESA-N 1 0 311.853 4.208 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)C[C@H](O)c2ccco2)c1O ZINC000808703831 1052068482 /nfs/dbraw/zinc/06/84/82/1052068482.db2.gz XYMAZRJOVPQYGZ-XUJVJEKNSA-N 1 0 323.820 4.110 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)CO2 ZINC000808706677 1052068872 /nfs/dbraw/zinc/06/88/72/1052068872.db2.gz QTLAXGWQDPYUJV-MLGOLLRUSA-N 1 0 317.816 4.447 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccccc2N(C)C)c1O ZINC000808707152 1052070090 /nfs/dbraw/zinc/07/00/90/1052070090.db2.gz FONVSKKAGJXOFK-ZDUSSCGKSA-N 1 0 318.848 4.271 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808708253 1052070327 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DICDRO C[C@H]([NH2+][C@@H](C)[C@H](O)c1ccccc1)c1ccc2ccccc2c1O ZINC000808720364 1052077742 /nfs/dbraw/zinc/07/77/42/1052077742.db2.gz UDZLIBHRFCVCGW-AVYPCKFXSA-N 1 0 321.420 4.318 20 10 DICDRO Cc1cccc(CCC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)n1 ZINC000808717764 1052078472 /nfs/dbraw/zinc/07/84/72/1052078472.db2.gz HLGBMNRQNDLIGO-AWEZNQCLSA-N 1 0 318.848 4.341 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)[C@H](O)c2ccccc2)c1O ZINC000808720657 1052078499 /nfs/dbraw/zinc/07/84/99/1052078499.db2.gz BMKAKEYHBZMKEY-LXIYXOSZSA-N 1 0 319.832 4.127 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CCO[C@@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000769711612 1052097979 /nfs/dbraw/zinc/09/79/79/1052097979.db2.gz REUCPTVOBLEYSW-QFBILLFUSA-N 1 0 312.457 4.060 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2ccc(OC)c(C)c2)c1 ZINC000769909621 1052121011 /nfs/dbraw/zinc/12/10/11/1052121011.db2.gz CFAJNEBMPOPSRD-UHFFFAOYSA-N 1 0 301.455 4.405 20 10 DICDRO C[NH2+][C@H]1C[C@H](Oc2ccc(/N=N/c3ccc(N(C)C)cc3)cc2)C1 ZINC001217955341 1052178547 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323.396 4.469 20 10 DICDRO O=C1C=CC(=NNc2ccc(OC3CC4(CC[NH2+]4)C3)cc2)C=C1 ZINC001218246760 1052212059 /nfs/dbraw/zinc/21/20/59/1052212059.db2.gz UZQHXICUWCZIJI-UHFFFAOYSA-N 1 0 309.369 4.081 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3C[C@@H]4CC[NH2+][C@H]4C3)cc2)C=C1 ZINC001218250413 1052213462 /nfs/dbraw/zinc/21/34/62/1052213462.db2.gz MIPUTRGGAOBTSZ-BKTGTZMESA-N 1 0 323.396 4.327 20 10 DICDRO C[C@@H]1[NH2+]C[C@H]1Oc1ccc2ccccc2c1/N=N/c1ccccn1 ZINC001218388040 1052232977 /nfs/dbraw/zinc/23/29/77/1052232977.db2.gz QVGYOYXUVWAJGQ-NBTSSJLRSA-N 1 0 318.380 4.389 20 10 DICDRO C[C@H]1[NH2+]C[C@H]1Oc1ccc2ccccc2c1/N=N/c1ccccn1 ZINC001218388042 1052233355 /nfs/dbraw/zinc/23/33/55/1052233355.db2.gz QVGYOYXUVWAJGQ-XLJUVUDZSA-N 1 0 318.380 4.389 20 10 DICDRO C[C@@H]1[NH2+]C[C@@H]1Oc1ccc2ccccc2c1/N=N/c1ccccn1 ZINC001218388041 1052233420 /nfs/dbraw/zinc/23/34/20/1052233420.db2.gz QVGYOYXUVWAJGQ-UQRAVMFOSA-N 1 0 318.380 4.389 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CC[C@H]3C[NH2+]C[C@@H]32)=C1 ZINC001218460602 1052242412 /nfs/dbraw/zinc/24/24/12/1052242412.db2.gz NFUXWNLHWRYUKT-OFKMIJQQSA-N 1 0 323.396 4.184 20 10 DICDRO COc1ccc(C[NH2+]CCc2ccc(OC(C)C)cc2)cc1C ZINC000915224922 1052369449 /nfs/dbraw/zinc/36/94/49/1052369449.db2.gz YTMXBHQWJHJWJU-UHFFFAOYSA-N 1 0 313.441 4.123 20 10 DICDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000317361037 1052385081 /nfs/dbraw/zinc/38/50/81/1052385081.db2.gz ISJLRINVKMPKIY-CYBMUJFWSA-N 1 0 319.832 4.117 20 10 DICDRO Clc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCO3)CCC2 ZINC000762478029 1052388626 /nfs/dbraw/zinc/38/86/26/1052388626.db2.gz ZKWSMKHMZONVAO-GOSISDBHSA-N 1 0 313.828 4.442 20 10 DICDRO COc1cc(C[N@H+](C)Cc2ccc(C)o2)c(O)c(C(C)(C)C)c1 ZINC000915818230 1052487664 /nfs/dbraw/zinc/48/76/64/1052487664.db2.gz JXCSPWNRFKXZFF-UHFFFAOYSA-N 1 0 317.429 4.232 20 10 DICDRO CCOC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CCCC1 ZINC000320289610 1052498280 /nfs/dbraw/zinc/49/82/80/1052498280.db2.gz BGERBBVFELPMRM-GJZGRUSLSA-N 1 0 303.446 4.188 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c1 ZINC000154249709 1052681545 /nfs/dbraw/zinc/68/15/45/1052681545.db2.gz LYMSXIVCAITGRY-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(F)c1F ZINC000917074762 1052691006 /nfs/dbraw/zinc/69/10/06/1052691006.db2.gz FVFAIOAIJDHMMY-UHFFFAOYSA-N 1 0 318.411 4.441 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCOc3ccccc3C2)cc1C(C)C ZINC000917486759 1052731588 /nfs/dbraw/zinc/73/15/88/1052731588.db2.gz WTOMPRJKZMXUNQ-UHFFFAOYSA-N 1 0 311.425 4.219 20 10 DICDRO COc1ccc(CCC[N@H+](C)Cc2cc(C)c(C)cc2O)cc1 ZINC000918731450 1052828013 /nfs/dbraw/zinc/82/80/13/1052828013.db2.gz DAPAUBLZLCNNQL-UHFFFAOYSA-N 1 0 313.441 4.082 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C(C)C ZINC000920183670 1052926372 /nfs/dbraw/zinc/92/63/72/1052926372.db2.gz RSJVUWBLUKWBIR-INIZCTEOSA-N 1 0 319.449 4.109 20 10 DICDRO Cc1ccc(OCC[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000920957038 1052956768 /nfs/dbraw/zinc/95/67/68/1052956768.db2.gz ZACMZMVPWPBUOT-UHFFFAOYSA-N 1 0 324.468 4.154 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccc(N(C)C)cc1 ZINC000237612976 1053015470 /nfs/dbraw/zinc/01/54/70/1053015470.db2.gz SMYNCJZQFTWYRD-ZDUSSCGKSA-N 1 0 320.383 4.205 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c1O ZINC000179670228 1053020849 /nfs/dbraw/zinc/02/08/49/1053020849.db2.gz QGQOQALJQXNTBT-MRXNPFEDSA-N 1 0 322.408 4.221 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)c2cc3ccccc3o2)c1 ZINC000179665384 1053022364 /nfs/dbraw/zinc/02/23/64/1053022364.db2.gz RTPGRVYYBFKRSE-ZDUSSCGKSA-N 1 0 311.381 4.340 20 10 DICDRO C[C@@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccccc1O ZINC000179894346 1053033062 /nfs/dbraw/zinc/03/30/62/1053033062.db2.gz KJKOLMDDGLNNMF-CYBMUJFWSA-N 1 0 310.422 4.367 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)cc(Br)c1)c1ccccc1O ZINC000179896001 1053033119 /nfs/dbraw/zinc/03/31/19/1053033119.db2.gz CZPHNTWBYTZSOP-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO c1cc(N2CCCC2)ccc1C[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC001350898051 1053115686 /nfs/dbraw/zinc/11/56/86/1053115686.db2.gz BACJVGSSKLVDQJ-JLYLLQBASA-N 1 0 316.514 4.051 20 10 DICDRO c1ccc(CCCC[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001318366570 1053165421 /nfs/dbraw/zinc/16/54/21/1053165421.db2.gz BFWJFAMZLLACCH-UHFFFAOYSA-N 1 0 308.469 4.399 20 10 DICDRO COc1ccc(O)c(C[NH2+]C2(c3ccc(F)cc3)CCCC2)c1 ZINC000181379392 1053197867 /nfs/dbraw/zinc/19/78/67/1053197867.db2.gz OYLDVKUICISUFE-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(N3CCCC3)cc2)n1 ZINC001319712663 1053267116 /nfs/dbraw/zinc/26/71/16/1053267116.db2.gz RISXGFAQTNEUMO-NRFANRHFSA-N 1 0 321.468 4.327 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)cc1Cl ZINC001474744457 1053296099 /nfs/dbraw/zinc/29/60/99/1053296099.db2.gz KCVTVYFVQXMRJD-HNNXBMFYSA-N 1 0 322.235 4.264 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001320246807 1053318458 /nfs/dbraw/zinc/31/84/58/1053318458.db2.gz PROJJTVWBROXBC-HOCLYGCPSA-N 1 0 311.425 4.356 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc([C@@H](C)O)cc1 ZINC001320248646 1053318696 /nfs/dbraw/zinc/31/86/96/1053318696.db2.gz XCAWUZCLHZGTPU-CPUCHLNUSA-N 1 0 311.425 4.092 20 10 DICDRO COCCC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC001320411544 1053333487 /nfs/dbraw/zinc/33/34/87/1053333487.db2.gz PPFXZDHWTJARKE-HUUCEWRRSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCSCC(F)(F)F ZINC001320423826 1053334167 /nfs/dbraw/zinc/33/41/67/1053334167.db2.gz CGFIMCNXMDQOIS-MNOVXSKESA-N 1 0 319.392 4.134 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@]1(C)CCO[C@H]1C1CC1 ZINC001320570304 1053345559 /nfs/dbraw/zinc/34/55/59/1053345559.db2.gz SDQDUSOKTVTVOP-VGJAGTOYSA-N 1 0 315.457 4.044 20 10 DICDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001200067352 1053348212 /nfs/dbraw/zinc/34/82/12/1053348212.db2.gz FNPYPUCDFZDDCO-NRFANRHFSA-N 1 0 306.453 4.372 20 10 DICDRO CO[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC001320779321 1053361770 /nfs/dbraw/zinc/36/17/70/1053361770.db2.gz MPLGTEDRPAJMCB-IMFGXOCKSA-N 1 0 316.489 4.285 20 10 DICDRO COc1ccc(C2([NH2+]C/C=C/c3ccc(N(C)C)cc3)CC2)cc1 ZINC001200088046 1053370332 /nfs/dbraw/zinc/37/03/32/1053370332.db2.gz IDRLEIJVOXAZEN-SNAWJCMRSA-N 1 0 322.452 4.053 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCOc1ccccc1F ZINC001321024776 1053383015 /nfs/dbraw/zinc/38/30/15/1053383015.db2.gz VNKJLUDMNZMBLI-UKRRQHHQSA-N 1 0 315.388 4.057 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(Br)o1)c1ccc(C)cc1O ZINC001321072489 1053386487 /nfs/dbraw/zinc/38/64/87/1053386487.db2.gz JNOCCZAMHZIADX-ZDUSSCGKSA-N 1 0 324.218 4.297 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](OC)c1ccc(F)cc1)c1ccc(C)cc1O ZINC001321235817 1053402546 /nfs/dbraw/zinc/40/25/46/1053402546.db2.gz NDARSJIOHOETHS-PKOBYXMFSA-N 1 0 317.404 4.268 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccc(F)cc1 ZINC000182323367 1053412191 /nfs/dbraw/zinc/41/21/91/1053412191.db2.gz HWMNUJMBNSHNLR-PXAZEXFGSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1cccc(CCC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC001321859179 1053438487 /nfs/dbraw/zinc/43/84/87/1053438487.db2.gz VUYXGRCAVXBVBV-RHSMWYFYSA-N 1 0 310.441 4.175 20 10 DICDRO c1cn(-c2ccccc2)c(NCc2ccc(N3CCCC3)cc2)[nH+]1 ZINC001322427501 1053502634 /nfs/dbraw/zinc/50/26/34/1053502634.db2.gz JWVAOFHUWUGZNL-UHFFFAOYSA-N 1 0 318.424 4.085 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](C)c1c(F)cncc1F ZINC001322453027 1053507678 /nfs/dbraw/zinc/50/76/78/1053507678.db2.gz USQPVSRMPNGRCW-UHIISALHSA-N 1 0 318.367 4.273 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001322714999 1053539270 /nfs/dbraw/zinc/53/92/70/1053539270.db2.gz BIZDRTKMPUVTGK-HUUCEWRRSA-N 1 0 305.462 4.291 20 10 DICDRO Cc1ccccc1OCCC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001200323660 1053557738 /nfs/dbraw/zinc/55/77/38/1053557738.db2.gz SHOPLVBMVCDCND-TWGQIWQCSA-N 1 0 324.468 4.133 20 10 DICDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001323831361 1053603067 /nfs/dbraw/zinc/60/30/67/1053603067.db2.gz LVTJLUWLJZDZKD-HSMVNMDESA-N 1 0 314.429 4.075 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](c1cccnc1)C1CC1 ZINC001323828841 1053603088 /nfs/dbraw/zinc/60/30/88/1053603088.db2.gz DOLLRSYQADKRIY-JOTOCRJQSA-N 1 0 308.425 4.385 20 10 DICDRO Cc1csc(CCC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC001323828428 1053603571 /nfs/dbraw/zinc/60/35/71/1053603571.db2.gz AQHOTCCUGUZNCH-MFKMUULPSA-N 1 0 320.433 4.067 20 10 DICDRO CC(C)([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(F)cc1 ZINC001353548670 1053608309 /nfs/dbraw/zinc/60/83/09/1053608309.db2.gz VQWTVEPTQKLVKN-UHFFFAOYSA-N 1 0 312.432 4.451 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCC2)cc1)[C@H]1CCOC(C)(C)C1 ZINC001323937028 1053611240 /nfs/dbraw/zinc/61/12/40/1053611240.db2.gz ZQORAUBAGFETHF-IBGZPJMESA-N 1 0 316.489 4.066 20 10 DICDRO CC[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1O ZINC000183337564 1053635574 /nfs/dbraw/zinc/63/55/74/1053635574.db2.gz CHBOUWMWOAPWAB-QGZVFWFLSA-N 1 0 308.381 4.288 20 10 DICDRO CS[C@H]1CC[C@H]([N@H+](C)Cc2ccc3ccccc3c2O)C1 ZINC001324337990 1053646744 /nfs/dbraw/zinc/64/67/44/1053646744.db2.gz XTDABIRCPFSYAY-HOTGVXAUSA-N 1 0 301.455 4.261 20 10 DICDRO CC(C)[N@H+](CCc1ccccc1)Cc1c(O)ccc2ccncc21 ZINC001324684323 1053671313 /nfs/dbraw/zinc/67/13/13/1053671313.db2.gz PJMQWLZGQYPSEO-UHFFFAOYSA-N 1 0 320.436 4.394 20 10 DICDRO Oc1cccc(Br)c1C[NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC001200485332 1053694561 /nfs/dbraw/zinc/69/45/61/1053694561.db2.gz CTMKEGCDVZWGCD-RWMBFGLXSA-N 1 0 324.262 4.213 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc(C(F)F)c1 ZINC001325243138 1053707742 /nfs/dbraw/zinc/70/77/42/1053707742.db2.gz WVJAZEGFGDFTLV-UHFFFAOYSA-N 1 0 304.384 4.288 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CCOC(C)(C)C1 ZINC001325315726 1053712526 /nfs/dbraw/zinc/71/25/26/1053712526.db2.gz PDDHIUSBUDVIOS-ILXRZTDVSA-N 1 0 303.446 4.044 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCC3)c2c1c(F)ccc2O ZINC001325340130 1053714198 /nfs/dbraw/zinc/71/41/98/1053714198.db2.gz NNMMTHRBPJMNHW-SJCJKPOMSA-N 1 0 311.400 4.358 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCC3)c2c1c(F)ccc2O ZINC001325340127 1053714911 /nfs/dbraw/zinc/71/49/11/1053714911.db2.gz NNMMTHRBPJMNHW-PXAZEXFGSA-N 1 0 311.400 4.358 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCC3)c2c1c(F)ccc2O ZINC001325340138 1053715365 /nfs/dbraw/zinc/71/53/65/1053715365.db2.gz NNMMTHRBPJMNHW-YVEFUNNKSA-N 1 0 311.400 4.358 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC[C@H]1CCO[C@@H](C)C1 ZINC001325357207 1053716255 /nfs/dbraw/zinc/71/62/55/1053716255.db2.gz PZWNMZZFSFVOHY-UGUYLWEFSA-N 1 0 303.446 4.044 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccc(F)cc1 ZINC001325355853 1053716961 /nfs/dbraw/zinc/71/69/61/1053716961.db2.gz GNHVLXHYMIGAAW-APPDUMDISA-N 1 0 323.795 4.223 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CC(C)(C)OCC1CC1 ZINC001325573001 1053722417 /nfs/dbraw/zinc/72/24/17/1053722417.db2.gz DQUANUVQSAFOIP-ZFWWWQNUSA-N 1 0 303.446 4.044 20 10 DICDRO C[NH+]1CCC(Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)CC1 ZINC001231320000 1053726197 /nfs/dbraw/zinc/72/61/97/1053726197.db2.gz MKDCRZNDKBUWAZ-UHFFFAOYSA-N 1 0 311.385 4.281 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC001326035484 1053745415 /nfs/dbraw/zinc/74/54/15/1053745415.db2.gz JQULCIXUHXUSBD-JEBQAFNWSA-N 1 0 322.452 4.498 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H](C)Oc1ccccc1 ZINC001200553100 1053753881 /nfs/dbraw/zinc/75/38/81/1053753881.db2.gz ZUFSNORHAWNZDC-HNNXBMFYSA-N 1 0 308.425 4.044 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001231465929 1053757408 /nfs/dbraw/zinc/75/74/08/1053757408.db2.gz IAYPNTQSKGQTEO-QZTJIDSGSA-N 1 0 323.436 4.203 20 10 DICDRO CC[C@H]1CCC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001231469187 1053757999 /nfs/dbraw/zinc/75/79/99/1053757999.db2.gz SBVZZOKAEIEJEB-SFHVURJKSA-N 1 0 311.425 4.346 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c1O ZINC001231592022 1053792706 /nfs/dbraw/zinc/79/27/06/1053792706.db2.gz FLYLRSALIBIIMN-AWEZNQCLSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1O ZINC001231594285 1053792830 /nfs/dbraw/zinc/79/28/30/1053792830.db2.gz DCFCSMWYHRJXRT-INIZCTEOSA-N 1 0 303.352 4.316 20 10 DICDRO CCCN(Cc1ccc(N2CCCC2)cc1)c1ccc(C[NH3+])cc1 ZINC001326576689 1053793962 /nfs/dbraw/zinc/79/39/62/1053793962.db2.gz DVZLEEKPOBOOAM-UHFFFAOYSA-N 1 0 323.484 4.162 20 10 DICDRO Cc1cccc(C[N@H+](C)CCc2ccc(C(F)(F)F)cc2)c1O ZINC001231595132 1053795001 /nfs/dbraw/zinc/79/50/01/1053795001.db2.gz OLGIAJYUXLMEHV-UHFFFAOYSA-N 1 0 323.358 4.394 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCCc1ncccc1C ZINC001326622952 1053794992 /nfs/dbraw/zinc/79/49/92/1053794992.db2.gz NORDZYGPCNQYCA-DOTOQJQBSA-N 1 0 310.441 4.175 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCc1cc(C)cc(C)c1 ZINC001200611149 1053810809 /nfs/dbraw/zinc/81/08/09/1053810809.db2.gz BKYVINARLIZCAI-UHFFFAOYSA-N 1 0 306.453 4.436 20 10 DICDRO Cc1sc2ccccc2c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001231649977 1053817643 /nfs/dbraw/zinc/81/76/43/1053817643.db2.gz VJSAFMLOZGMZHY-UHFFFAOYSA-N 1 0 309.434 4.474 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccc(N2CCCCC2)cc1 ZINC001327607535 1053869122 /nfs/dbraw/zinc/86/91/22/1053869122.db2.gz PUPALXPEDMQGTB-PLYYQAHHSA-N 1 0 320.427 4.371 20 10 DICDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)c(O)c1 ZINC001231846054 1053889704 /nfs/dbraw/zinc/88/97/04/1053889704.db2.gz ZQUBKLSKUSDJJR-SFHVURJKSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cc(C)c(C[N@@H+](CC(=O)c2ccccc2)C(C)C)c(O)c1 ZINC001231848651 1053889845 /nfs/dbraw/zinc/88/98/45/1053889845.db2.gz JFVPETXKHJWTEO-UHFFFAOYSA-N 1 0 311.425 4.102 20 10 DICDRO Cc1cc(C)c(C[N@@H+]2CCc3cccc(Cl)c3C2)c(O)c1 ZINC001231847846 1053890274 /nfs/dbraw/zinc/89/02/74/1053890274.db2.gz DUHAWJXLAXGXPL-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1c(C)cc(C)cc1O ZINC001231850218 1053891130 /nfs/dbraw/zinc/89/11/30/1053891130.db2.gz MIDCQXGZXXRUFI-UHFFFAOYSA-N 1 0 312.457 4.097 20 10 DICDRO COc1cccc([C@@H]2CC[N@H+](Cc3c(C)cc(C)cc3O)C2)c1 ZINC001231850963 1053892105 /nfs/dbraw/zinc/89/21/05/1053892105.db2.gz XSHWGAYSZVXDAL-QGZVFWFLSA-N 1 0 311.425 4.007 20 10 DICDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(C)cc(C)cc2O)c1 ZINC001231847492 1053892348 /nfs/dbraw/zinc/89/23/48/1053892348.db2.gz ZHJSZCUHSRYANK-LJQANCHMSA-N 1 0 311.425 4.355 20 10 DICDRO C[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1cc2c(cc1O)CCCC2 ZINC000183991139 1053893428 /nfs/dbraw/zinc/89/34/28/1053893428.db2.gz UYBRLVRLYHATMC-YJBOKZPZSA-N 1 0 317.473 4.271 20 10 DICDRO Oc1c(CN2CCc3ncc(Cl)cc3C2)ccc2ccccc21 ZINC001231883559 1053906183 /nfs/dbraw/zinc/90/61/83/1053906183.db2.gz PESFQTAUNAVOHN-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO CCC(CC)[N@H+](CC)Cc1ccc(N2CCOCC2)c(Cl)c1 ZINC001232200097 1053986272 /nfs/dbraw/zinc/98/62/72/1053986272.db2.gz PWSFJRHBOKIEPS-UHFFFAOYSA-N 1 0 324.896 4.187 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCc2ccc(O)cc21 ZINC001329589913 1053999455 /nfs/dbraw/zinc/99/94/55/1053999455.db2.gz WICLFYJAQLZFPK-DQYPLSBCSA-N 1 0 309.409 4.232 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1Cl ZINC001232261221 1054005036 /nfs/dbraw/zinc/00/50/36/1054005036.db2.gz XGEMRJBEMDFUCI-MRXNPFEDSA-N 1 0 317.816 4.478 20 10 DICDRO CC[N@H+](Cc1ccc(C)cc1)Cc1cc(Cl)c(O)cc1O ZINC001232263356 1054006842 /nfs/dbraw/zinc/00/68/42/1054006842.db2.gz NREKSWWGZJKPBB-UHFFFAOYSA-N 1 0 305.805 4.082 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)cc1Cl ZINC001232262994 1054007056 /nfs/dbraw/zinc/00/70/56/1054007056.db2.gz ZJEQDXZKKHCYKW-CYBMUJFWSA-N 1 0 309.837 4.153 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@H]2c2ccccc2)cc1Cl ZINC001232269918 1054008897 /nfs/dbraw/zinc/00/88/97/1054008897.db2.gz NNVARGNOBHNLLC-HNNXBMFYSA-N 1 0 303.789 4.001 20 10 DICDRO CC[N@H+](Cc1cccs1)Cc1cc(Cl)c(OC)cc1O ZINC001232267399 1054009924 /nfs/dbraw/zinc/00/99/24/1054009924.db2.gz BHIOUEDZFVWBTN-UHFFFAOYSA-N 1 0 311.834 4.138 20 10 DICDRO CCc1cccc(C[NH2+]C2(c3ccccc3OC)CCC2)c1O ZINC001329985419 1054012645 /nfs/dbraw/zinc/01/26/45/1054012645.db2.gz WKBHMONIECNJJB-UHFFFAOYSA-N 1 0 311.425 4.132 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2cccc(Cl)c2F)cc1 ZINC001200831067 1054017356 /nfs/dbraw/zinc/01/73/56/1054017356.db2.gz TVMWUCYKVITCKI-PLNGDYQASA-N 1 0 318.823 4.348 20 10 DICDRO COc1cc(Cl)ccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001232501820 1054060353 /nfs/dbraw/zinc/06/03/53/1054060353.db2.gz FTQHJQKOGLKJNW-UHFFFAOYSA-N 1 0 318.848 4.047 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccn2C2CC2)cc1F ZINC001331257162 1054069021 /nfs/dbraw/zinc/06/90/21/1054069021.db2.gz GHSYLRAGIYVDRS-UHFFFAOYSA-N 1 0 315.436 4.098 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCSc3ccc(F)cc31)CC2 ZINC000295816676 1054083165 /nfs/dbraw/zinc/08/31/65/1054083165.db2.gz DANGQBFQZCVEHO-CABCVRRESA-N 1 0 315.413 4.345 20 10 DICDRO CCCC[N@H+](Cc1ccccc1)Cc1ccc(N(C)C)cc1O ZINC001232838931 1054126809 /nfs/dbraw/zinc/12/68/09/1054126809.db2.gz KIAKGASHRYGVGZ-UHFFFAOYSA-N 1 0 312.457 4.261 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1)Cc1ccc(N(C)C)cc1O ZINC001232840102 1054127315 /nfs/dbraw/zinc/12/73/15/1054127315.db2.gz MZBBFIWBTNPEPF-UHFFFAOYSA-N 1 0 318.848 4.134 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(C)(c3ccccc3)CC2)c(O)c1 ZINC001232841359 1054128403 /nfs/dbraw/zinc/12/84/03/1054128403.db2.gz DSTBHKMRMUSDQO-UHFFFAOYSA-N 1 0 324.468 4.012 20 10 DICDRO C[C@H]([NH2+][C@@H](C1CC1)[C@H]1CCCCO1)c1ccc(Cl)cc1O ZINC000848557800 1054148724 /nfs/dbraw/zinc/14/87/24/1054148724.db2.gz HOERGIOUSRIVDX-JECHBYEQSA-N 1 0 309.837 4.044 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)Cc2ccccn2)c1O ZINC000848565970 1054153572 /nfs/dbraw/zinc/15/35/72/1054153572.db2.gz VTEZZHCCGBKTNS-CHWSQXEVSA-N 1 0 304.821 4.031 20 10 DICDRO C[C@H](Cc1ccccn1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000848566054 1054153584 /nfs/dbraw/zinc/15/35/84/1054153584.db2.gz WLNAXEKRLQSHRJ-MSOLQXFVSA-N 1 0 323.484 4.354 20 10 DICDRO CCC[N@@H+](Cc1cc(Br)cc(C)c1O)CC1CC1 ZINC001233106812 1054185904 /nfs/dbraw/zinc/18/59/04/1054185904.db2.gz OSPNJVLFWHKCSP-UHFFFAOYSA-N 1 0 312.251 4.085 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c1O ZINC001233109392 1054187785 /nfs/dbraw/zinc/18/77/85/1054187785.db2.gz VEFLSHKEALUQTI-CHWSQXEVSA-N 1 0 324.262 4.085 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CCCC3(CCC3)C2)c1O ZINC001233111246 1054189551 /nfs/dbraw/zinc/18/95/51/1054189551.db2.gz MIMNJEJYFYOGES-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO CC[C@H]([NH2+]Cc1c(F)cccc1OC)c1ccc(C)cc1O ZINC001334727619 1054196337 /nfs/dbraw/zinc/19/63/37/1054196337.db2.gz BXUWGAGEEFPKTA-INIZCTEOSA-N 1 0 303.377 4.089 20 10 DICDRO COc1ccc(C[NH2+][C@@H](c2ncc(C)s2)C2CC2)cc1C ZINC001334679417 1054196448 /nfs/dbraw/zinc/19/64/48/1054196448.db2.gz FFZIAXLELWVFKC-MRXNPFEDSA-N 1 0 302.443 4.009 20 10 DICDRO Cc1cccc2nc(C3CC[NH+](Cc4ccc(N)cc4)CC3)oc21 ZINC001335288845 1054211749 /nfs/dbraw/zinc/21/17/49/1054211749.db2.gz IEBPVZNAQUESFL-UHFFFAOYSA-N 1 0 321.424 4.098 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N)cc1)c1cccc(OC(F)(F)F)c1 ZINC001335289560 1054212126 /nfs/dbraw/zinc/21/21/26/1054212126.db2.gz OTDZUYWPYLROJO-LLVKDONJSA-N 1 0 310.319 4.018 20 10 DICDRO Cc1ccc(Cl)cc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001233250667 1054216671 /nfs/dbraw/zinc/21/66/71/1054216671.db2.gz UDZFQIWPTJELTD-UHFFFAOYSA-N 1 0 317.816 4.008 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccccn2)c1 ZINC001233286078 1054221329 /nfs/dbraw/zinc/22/13/29/1054221329.db2.gz DMUOGWIRNMGOOO-SFHVURJKSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c1 ZINC001233284104 1054221631 /nfs/dbraw/zinc/22/16/31/1054221631.db2.gz ILXFYEOCRXIEGB-GASCZTMLSA-N 1 0 309.400 4.167 20 10 DICDRO C[N@H+](Cc1ccc(F)cc1)Cc1cc(C(C)(C)C)ccc1O ZINC001233283570 1054221890 /nfs/dbraw/zinc/22/18/90/1054221890.db2.gz MBSAVLKVHHLGIB-UHFFFAOYSA-N 1 0 301.405 4.461 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2cc(C(C)(C)C)ccc2O)cc1 ZINC001233284216 1054221957 /nfs/dbraw/zinc/22/19/57/1054221957.db2.gz MJISJSCMZBJIOD-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC(OC3CCC3)CC2)c1 ZINC001233284096 1054222585 /nfs/dbraw/zinc/22/25/85/1054222585.db2.gz IAPHLGDAYFIXPJ-UHFFFAOYSA-N 1 0 317.473 4.223 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC001233285917 1054222950 /nfs/dbraw/zinc/22/29/50/1054222950.db2.gz XNTWTEPSUXGPOH-CQSZACIVSA-N 1 0 315.379 4.464 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H]2Cc2ccccn2)c1 ZINC001233286559 1054224175 /nfs/dbraw/zinc/22/41/75/1054224175.db2.gz YWYMMCVHJYPIMR-IBGZPJMESA-N 1 0 324.468 4.292 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC3(CCOCC3)CC2)c1 ZINC001233286741 1054224636 /nfs/dbraw/zinc/22/46/36/1054224636.db2.gz HJGPOEDIFQMFGJ-UHFFFAOYSA-N 1 0 317.473 4.082 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c([O-])ccc(F)c1F ZINC001233334614 1054234581 /nfs/dbraw/zinc/23/45/81/1054234581.db2.gz NQGCQALJXONICU-HNNXBMFYSA-N 1 0 319.351 4.016 20 10 DICDRO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1c([O-])ccc(F)c1F ZINC001233332209 1054236588 /nfs/dbraw/zinc/23/65/88/1054236588.db2.gz CGSVGTSCTFFJDL-MRXNPFEDSA-N 1 0 303.352 4.316 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]CCCC(F)F ZINC001336842042 1054248809 /nfs/dbraw/zinc/24/88/09/1054248809.db2.gz GNEZPIXYKMWIJU-UHFFFAOYSA-N 1 0 321.367 4.106 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)c1 ZINC000184884189 1054249910 /nfs/dbraw/zinc/24/99/10/1054249910.db2.gz XABXJVGCVBABSQ-CQSZACIVSA-N 1 0 311.425 4.130 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCc2sccc2C1 ZINC001233451956 1054276208 /nfs/dbraw/zinc/27/62/08/1054276208.db2.gz GDJHOBZWPMMKTR-UHFFFAOYSA-N 1 0 313.344 4.031 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC001233454003 1054276535 /nfs/dbraw/zinc/27/65/35/1054276535.db2.gz CFTKJRRQQIHXLI-OAHLLOKOSA-N 1 0 322.330 4.143 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2O)cc1 ZINC001233454164 1054278025 /nfs/dbraw/zinc/27/80/25/1054278025.db2.gz IYWGVVXOXMAPNW-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CCc1cnc(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC001337785437 1054285887 /nfs/dbraw/zinc/28/58/87/1054285887.db2.gz MWFQMQVLMNLWBL-GXTWGEPZSA-N 1 0 316.470 4.100 20 10 DICDRO CO[C@H](C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)c1ccccc1 ZINC001337784356 1054286364 /nfs/dbraw/zinc/28/63/64/1054286364.db2.gz AUVULQIKEONQKI-YXJHDRRASA-N 1 0 311.425 4.226 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1COc2ccccc2C1 ZINC001337785301 1054286587 /nfs/dbraw/zinc/28/65/87/1054286587.db2.gz KJUGHVBPBJIIGM-BFYDXBDKSA-N 1 0 323.436 4.090 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccc(F)cc2CSC)c1O ZINC000848890648 1054286608 /nfs/dbraw/zinc/28/66/08/1054286608.db2.gz JNGWCGAKHHRLAW-UHFFFAOYSA-N 1 0 319.445 4.247 20 10 DICDRO CCc1cccc(C[NH2+][C@](C)(CC)c2nc(C)cs2)c1O ZINC000848897487 1054287797 /nfs/dbraw/zinc/28/77/97/1054287797.db2.gz PYTJNLJDPHKRAO-QGZVFWFLSA-N 1 0 304.459 4.135 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CCCOc3cc(F)ccc32)c1O ZINC000848900573 1054290311 /nfs/dbraw/zinc/29/03/11/1054290311.db2.gz NZLMEIUQXCKDOY-QGZVFWFLSA-N 1 0 315.388 4.097 20 10 DICDRO Cc1cccc(C[NH2+]Cc2cccc(Br)c2C)c1O ZINC000848924205 1054300576 /nfs/dbraw/zinc/30/05/76/1054300576.db2.gz XLCMGHPAQLHJOD-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO CCOc1ncccc1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000184985693 1054303443 /nfs/dbraw/zinc/30/34/43/1054303443.db2.gz JKJOQTCLGVVPPF-CQSZACIVSA-N 1 0 322.408 4.190 20 10 DICDRO C[C@@]1(F)CCCC[N@H+](Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233726793 1054345183 /nfs/dbraw/zinc/34/51/83/1054345183.db2.gz HWCDQIFPNWFQJW-CQSZACIVSA-N 1 0 321.314 4.005 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@H]2c2ccccc2)cccc1OC(F)(F)F ZINC001233760076 1054352657 /nfs/dbraw/zinc/35/26/57/1054352657.db2.gz BHQVFPFKRLXMPZ-CQSZACIVSA-N 1 0 323.314 4.238 20 10 DICDRO CCCC1CC[NH+](Cc2cccc(OC(F)(F)F)c2O)CC1 ZINC001233755561 1054354036 /nfs/dbraw/zinc/35/40/36/1054354036.db2.gz WCFSQAIDOIPXRI-UHFFFAOYSA-N 1 0 317.351 4.303 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@H]3C[C@@H](C)c4c3c(O)ccc4C)nc2c1 ZINC001342405745 1054421461 /nfs/dbraw/zinc/42/14/61/1054421461.db2.gz GEOOVLBTOBGXKS-CJNGLKHVSA-N 1 0 321.424 4.223 20 10 DICDRO CCOc1ccccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001342390453 1054421513 /nfs/dbraw/zinc/42/15/13/1054421513.db2.gz PWXBGNHOJKGZRS-GOEBONIOSA-N 1 0 311.425 4.437 20 10 DICDRO c1csc(SCCC[NH2+]Cc2cccc3ccoc32)n1 ZINC001344060448 1054462525 /nfs/dbraw/zinc/46/25/25/1054462525.db2.gz BGOLBMIVVGMGNQ-UHFFFAOYSA-N 1 0 304.440 4.161 20 10 DICDRO COc1ccc2ccc(O)c(C[NH+]3C[C@@H]4CCCC[C@H]4C3)c2c1 ZINC001234526071 1054543141 /nfs/dbraw/zinc/54/31/41/1054543141.db2.gz PTIKJZLILOCNQB-HOTGVXAUSA-N 1 0 311.425 4.176 20 10 DICDRO COc1ccc2ccc(O)c(CN3CC[C@@H](C)C(F)(F)C3)c2c1 ZINC001234526677 1054543229 /nfs/dbraw/zinc/54/32/29/1054543229.db2.gz XYOUPRBIHZXKHM-GFCCVEGCSA-N 1 0 321.367 4.031 20 10 DICDRO COc1ccc2ccc(O)c(C[NH+]3CC4(C3)CCCCC4)c2c1 ZINC001234562730 1054547012 /nfs/dbraw/zinc/54/70/12/1054547012.db2.gz SDFHLLYFZHBSDJ-UHFFFAOYSA-N 1 0 311.425 4.320 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@H]4CCC[C@@H]43)c2c1 ZINC001234562928 1054547771 /nfs/dbraw/zinc/54/77/71/1054547771.db2.gz XTINPRGPOAXDGR-BEFAXECRSA-N 1 0 311.425 4.319 20 10 DICDRO COc1ccc2ccc(O)c(C[NH+]3CC(c4ccccc4)C3)c2c1 ZINC001234561857 1054547928 /nfs/dbraw/zinc/54/79/28/1054547928.db2.gz DLLZLQUIWJNRNY-UHFFFAOYSA-N 1 0 319.404 4.153 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1OCC1CC1)c1cc(F)ccc1O ZINC000185516699 1054559510 /nfs/dbraw/zinc/55/95/10/1054559510.db2.gz RYIQXDLDMAIPPU-CYBMUJFWSA-N 1 0 315.388 4.171 20 10 DICDRO CCO[C@H](CC[NH2+][C@H](C)c1cc(OC)ccc1O)C1CCCC1 ZINC000185635022 1054604901 /nfs/dbraw/zinc/60/49/01/1054604901.db2.gz GFCKZFPVDYTUBQ-AUUYWEPGSA-N 1 0 321.461 4.037 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)cccc1-c1ccccc1 ZINC001234993692 1054637370 /nfs/dbraw/zinc/63/73/70/1054637370.db2.gz ALSCVXAROSTNEP-GOSISDBHSA-N 1 0 315.363 4.290 20 10 DICDRO CSC1CC[NH+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001234994027 1054637991 /nfs/dbraw/zinc/63/79/91/1054637991.db2.gz DOADCMODTGMPQT-UHFFFAOYSA-N 1 0 313.466 4.387 20 10 DICDRO Oc1c(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)cccc1-c1ccccc1 ZINC001234998132 1054642032 /nfs/dbraw/zinc/64/20/32/1054642032.db2.gz FYZNSSWZWXUQCO-WBVHZDCISA-N 1 0 315.363 4.146 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccc(F)cc2)c(O)c1 ZINC000185838625 1054733581 /nfs/dbraw/zinc/73/35/81/1054733581.db2.gz KJBPZMNJVAYOCC-DEYYWGMASA-N 1 0 317.404 4.003 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c(O)c1 ZINC001235686062 1054776615 /nfs/dbraw/zinc/77/66/15/1054776615.db2.gz XAZWXJORGXWIQQ-AWEZNQCLSA-N 1 0 315.379 4.464 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@H](c3ccccn3)C2)c(O)c1 ZINC001235686204 1054778169 /nfs/dbraw/zinc/77/81/69/1054778169.db2.gz YLMDSPWIEDNHHG-HNNXBMFYSA-N 1 0 310.441 4.074 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2OC2CCC2)c1 ZINC000186055525 1054871296 /nfs/dbraw/zinc/87/12/96/1054871296.db2.gz QTKGZZTVAFJDKC-HNNXBMFYSA-N 1 0 311.425 4.483 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2sccc2OC)cc1 ZINC000186115282 1054924338 /nfs/dbraw/zinc/92/43/38/1054924338.db2.gz SXUVHACKNHIJRG-AWEZNQCLSA-N 1 0 318.486 4.454 20 10 DICDRO Cc1ccn(-c2ccccc2C[NH2+][C@H](C)c2cc(C)ccc2O)n1 ZINC000186122839 1054929028 /nfs/dbraw/zinc/92/90/28/1054929028.db2.gz GBBCRDBIFVOEOK-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccc3ccccc3c2O)c1 ZINC000186124722 1054955707 /nfs/dbraw/zinc/95/57/07/1054955707.db2.gz UQAUXJJXZDBCFQ-QRWLVFNGSA-N 1 0 321.420 4.238 20 10 DICDRO C[NH+]1CCN(c2ccc(C3=CC[C@@H](C(F)(F)F)CC3)cc2)CC1 ZINC001236254721 1055037578 /nfs/dbraw/zinc/03/75/78/1055037578.db2.gz RFHHQHXZEHMUJO-MRXNPFEDSA-N 1 0 324.390 4.184 20 10 DICDRO CCOCCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000764434087 1055185780 /nfs/dbraw/zinc/18/57/80/1055185780.db2.gz WKHMZSABRGFJEQ-KRWDZBQOSA-N 1 0 304.478 4.144 20 10 DICDRO CCOCCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000764434088 1055186366 /nfs/dbraw/zinc/18/63/66/1055186366.db2.gz WKHMZSABRGFJEQ-QGZVFWFLSA-N 1 0 304.478 4.144 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@H](C)c3ccccc3)CC2)cc1 ZINC000764569322 1055211325 /nfs/dbraw/zinc/21/13/25/1055211325.db2.gz RQFUPRZCECHMFA-KRWDZBQOSA-N 1 0 324.468 4.057 20 10 DICDRO Cc1cc(Br)c([O-])c(C[N@H+]2[C@H](C)CCC[C@@H]2C)c1 ZINC001236672123 1055220965 /nfs/dbraw/zinc/22/09/65/1055220965.db2.gz BWZYRWGELGWTSD-TXEJJXNPSA-N 1 0 312.251 4.226 20 10 DICDRO COCCC[C@@H](C)[NH2+]CCc1cc(C)n(-c2ccccc2)c1C ZINC000764718249 1055237467 /nfs/dbraw/zinc/23/74/67/1055237467.db2.gz WIJJWWMYDJGFSL-MRXNPFEDSA-N 1 0 314.473 4.041 20 10 DICDRO COCCC[C@H](C)[NH2+]CCc1cc(C)n(-c2ccccc2)c1C ZINC000764718245 1055238808 /nfs/dbraw/zinc/23/88/08/1055238808.db2.gz WIJJWWMYDJGFSL-INIZCTEOSA-N 1 0 314.473 4.041 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[N@@H+]1CCCCC12CC2 ZINC001236788218 1055259334 /nfs/dbraw/zinc/25/93/34/1055259334.db2.gz HJFYHRGUPGJRJW-UHFFFAOYSA-N 1 0 323.436 4.490 20 10 DICDRO Oc1cc(Cl)c(Cl)cc1CN1CCc2sccc2C1 ZINC001236789105 1055259462 /nfs/dbraw/zinc/25/94/62/1055259462.db2.gz CHAQOQGIZXOMKP-UHFFFAOYSA-N 1 0 314.237 4.319 20 10 DICDRO CCc1ccc(C[N@H+](CC(=O)c2ccccc2)C(C)C)c(O)c1 ZINC001236791393 1055260574 /nfs/dbraw/zinc/26/05/74/1055260574.db2.gz HCICVSUKSVXGLC-UHFFFAOYSA-N 1 0 311.425 4.048 20 10 DICDRO CCc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(OC)cc2)c(O)c1 ZINC001236790314 1055260812 /nfs/dbraw/zinc/26/08/12/1055260812.db2.gz VVSWKXKZLPGDET-IBGZPJMESA-N 1 0 311.425 4.300 20 10 DICDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(OC)cc2)c(O)c1 ZINC001236790315 1055262823 /nfs/dbraw/zinc/26/28/23/1055262823.db2.gz VVSWKXKZLPGDET-LJQANCHMSA-N 1 0 311.425 4.300 20 10 DICDRO CCc1ccc(C[N@H+](C)[C@@H](C)Cc2ccccc2OC)c(O)c1 ZINC001236791239 1055263677 /nfs/dbraw/zinc/26/36/77/1055263677.db2.gz FNBUKIQBWSXZDH-HNNXBMFYSA-N 1 0 313.441 4.026 20 10 DICDRO CCc1ccc(C[NH+]2CCC(c3cccs3)CC2)c(O)c1 ZINC001236791035 1055264470 /nfs/dbraw/zinc/26/44/70/1055264470.db2.gz ZEXZSJJKPMLUEH-UHFFFAOYSA-N 1 0 301.455 4.396 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c([O-])c1Cl ZINC001236811463 1055271468 /nfs/dbraw/zinc/27/14/68/1055271468.db2.gz KIVUVRWTOKTOBS-GXTWGEPZSA-N 1 0 309.837 4.209 20 10 DICDRO COc1ccc(C[N@@H+]2CCCc3ccccc3C2)c([O-])c1Cl ZINC001236811301 1055271897 /nfs/dbraw/zinc/27/18/97/1055271897.db2.gz JARHJCXTBCQVFD-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC001236826497 1055278774 /nfs/dbraw/zinc/27/87/74/1055278774.db2.gz LIUOJXZYQDLAIT-IBGZPJMESA-N 1 0 304.393 4.278 20 10 DICDRO O=C1CCC2(CC1)CC[NH+](Cc1cc3ccccc3cc1O)CC2 ZINC001236834762 1055282438 /nfs/dbraw/zinc/28/24/38/1055282438.db2.gz CFMXWFDXJSXQRR-UHFFFAOYSA-N 1 0 323.436 4.271 20 10 DICDRO C[N@H+](CC/C=C/c1cccnc1)Cc1cc2ccccc2cc1O ZINC001236836432 1055283004 /nfs/dbraw/zinc/28/30/04/1055283004.db2.gz JDSOORZQYFGCBQ-QPJJXVBHSA-N 1 0 318.420 4.476 20 10 DICDRO C[N@@H+](Cc1cc2ccccc2cc1O)Cc1cccc(F)c1F ZINC001236836591 1055284463 /nfs/dbraw/zinc/28/44/63/1055284463.db2.gz LAJBEMHPFLFDST-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO COc1cccc2c1C[N@H+](Cc1cc3ccccc3cc1O)C2 ZINC001236836393 1055285794 /nfs/dbraw/zinc/28/57/94/1055285794.db2.gz HTPNPOJWYQWXGK-UHFFFAOYSA-N 1 0 305.377 4.070 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001236837109 1055288063 /nfs/dbraw/zinc/28/80/63/1055288063.db2.gz OBGJVYOBCZPQKK-OAQYLSRUSA-N 1 0 319.404 4.119 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC001236841649 1055289820 /nfs/dbraw/zinc/28/98/20/1055289820.db2.gz OBGJVYOBCZPQKK-NRFANRHFSA-N 1 0 319.404 4.119 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(C(F)F)cc2)cc1F ZINC000764979067 1055305358 /nfs/dbraw/zinc/30/53/58/1055305358.db2.gz CYDJZPJIZKQEGB-UHFFFAOYSA-N 1 0 308.347 4.119 20 10 DICDRO CC(C)(C)Oc1ccccc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001237029969 1055345501 /nfs/dbraw/zinc/34/55/01/1055345501.db2.gz VWEBSBWQBLLOCG-UHFFFAOYSA-N 1 0 311.425 4.128 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(O)c1 ZINC001237041394 1055345783 /nfs/dbraw/zinc/34/57/83/1055345783.db2.gz HYBZCCPLPFGPPE-GOSISDBHSA-N 1 0 315.388 4.267 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)Cc2nc3ccccc3o2)c(O)c1 ZINC001237050121 1055348511 /nfs/dbraw/zinc/34/85/11/1055348511.db2.gz YPJYXFWFCJOWJN-UHFFFAOYSA-N 1 0 310.397 4.289 20 10 DICDRO C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001237052458 1055349112 /nfs/dbraw/zinc/34/91/12/1055349112.db2.gz ZWCFJWSERNPQIM-RYUDHWBXSA-N 1 0 317.351 4.096 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCc3cccc(Cl)c3C2)c(O)c1 ZINC001237047135 1055349626 /nfs/dbraw/zinc/34/96/26/1055349626.db2.gz SHBIXHCQYPZRTL-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO COc1ccc(CCC[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000765257026 1055349654 /nfs/dbraw/zinc/34/96/54/1055349654.db2.gz GEFPNDSUVPAXEA-MRXNPFEDSA-N 1 0 312.457 4.045 20 10 DICDRO CCC[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)[C@@H](C)CC ZINC001237051361 1055349970 /nfs/dbraw/zinc/34/99/70/1055349970.db2.gz LBEYQGLWARZEMC-LBPRGKRZSA-N 1 0 319.367 4.344 20 10 DICDRO Cc1ccc(N2CC[NH+](Cc3ccc(C(C)C)cc3O)CC2)cc1 ZINC001237046590 1055350782 /nfs/dbraw/zinc/35/07/82/1055350782.db2.gz UDFDNAGKDNCZOT-UHFFFAOYSA-N 1 0 324.468 4.146 20 10 DICDRO COc1ccc2c(c1)CC[N@@H+](Cc1ccc(C(C)C)cc1O)C2 ZINC001237046531 1055351057 /nfs/dbraw/zinc/35/10/57/1055351057.db2.gz SZWISEVOOMKFEZ-UHFFFAOYSA-N 1 0 311.425 4.083 20 10 DICDRO CCOc1ccc(C[N@H+](CC)Cc2cccc(Cl)c2)c(O)c1 ZINC001237047116 1055351157 /nfs/dbraw/zinc/35/11/57/1055351157.db2.gz RRHVWLKMJLAMEM-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c(O)c1 ZINC001237045967 1055351301 /nfs/dbraw/zinc/35/13/01/1055351301.db2.gz NQXJMUZGNQZFHJ-OAHLLOKOSA-N 1 0 301.352 4.085 20 10 DICDRO CCOC[C@@]12CCC[C@@H]1C[N@H+](Cc1ccc(C(C)C)cc1O)C2 ZINC001237051523 1055352247 /nfs/dbraw/zinc/35/22/47/1055352247.db2.gz MOEHWRPMLMHKBR-QUCCMNQESA-N 1 0 317.473 4.154 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC(c3ccccn3)CC2)c(O)c1 ZINC001237053325 1055353096 /nfs/dbraw/zinc/35/30/96/1055353096.db2.gz JCZQOCUYXITBTG-UHFFFAOYSA-N 1 0 310.441 4.290 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC3(CCC(C)(C)O3)CC2)c(O)c1 ZINC001237055984 1055354775 /nfs/dbraw/zinc/35/47/75/1055354775.db2.gz STSPYDBVAUOIQJ-UHFFFAOYSA-N 1 0 317.473 4.439 20 10 DICDRO COC[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765328327 1055361976 /nfs/dbraw/zinc/36/19/76/1055361976.db2.gz DXVFPRQFDOSLAE-DLBZAZTESA-N 1 0 304.478 4.000 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cc(O)cc3ccccc32)cc1 ZINC001237077678 1055362734 /nfs/dbraw/zinc/36/27/34/1055362734.db2.gz XUDFEXYPZWBVKC-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO [O-]c1ccc(Cl)c(Cl)c1C[N@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001237080621 1055363375 /nfs/dbraw/zinc/36/33/75/1055363375.db2.gz UVGANMMFBHTOJP-SCZZXKLOSA-N 1 0 322.182 4.176 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1COc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000765333859 1055363886 /nfs/dbraw/zinc/36/38/86/1055363886.db2.gz LYTPGUZGXFLMLJ-JXFKEZNVSA-N 1 0 324.468 4.045 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2COc3ccccc3C2)cc1 ZINC000765334667 1055364525 /nfs/dbraw/zinc/36/45/25/1055364525.db2.gz QQTAAZLQYGSNDQ-SJORKVTESA-N 1 0 324.468 4.045 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1COc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000765333862 1055364609 /nfs/dbraw/zinc/36/46/09/1055364609.db2.gz LYTPGUZGXFLMLJ-OXQOHEQNSA-N 1 0 324.468 4.045 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@H]3CCCC[C@@H]3C)CC2)cc1 ZINC000765342421 1055366160 /nfs/dbraw/zinc/36/61/60/1055366160.db2.gz DDAPJWBWZNGIPV-DLBZAZTESA-N 1 0 316.489 4.080 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 ZINC000765342485 1055366727 /nfs/dbraw/zinc/36/67/27/1055366727.db2.gz FVVJMEBQRAWFAD-LNLFQRSKSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCCO1)c1ccc(N2CCCCCC2)cc1 ZINC000765341988 1055367389 /nfs/dbraw/zinc/36/73/89/1055367389.db2.gz BGENFAUBXMWCTP-FXAWDEMLSA-N 1 0 316.489 4.287 20 10 DICDRO CCCOc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000765379157 1055375214 /nfs/dbraw/zinc/37/52/14/1055375214.db2.gz DLGFETPFKPARMS-MRXNPFEDSA-N 1 0 312.457 4.392 20 10 DICDRO CCC[N@@H+](Cc1c(O)cccc1OC(F)(F)F)CC(C)C ZINC001237113880 1055376644 /nfs/dbraw/zinc/37/66/44/1055376644.db2.gz FYZAYRHOGIFOHN-UHFFFAOYSA-N 1 0 305.340 4.159 20 10 DICDRO CC[N@H+](Cc1cccc(OC)c1)Cc1c(O)ccc(F)c1Cl ZINC001237131212 1055378129 /nfs/dbraw/zinc/37/81/29/1055378129.db2.gz UZEHLDDFWTUOHT-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001237122711 1055378417 /nfs/dbraw/zinc/37/84/17/1055378417.db2.gz LAOSBBGSNYRFBD-DGCLKSJQSA-N 1 0 315.335 4.055 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[NH+]1CCc2ccccc2CC1 ZINC001237139863 1055382758 /nfs/dbraw/zinc/38/27/58/1055382758.db2.gz QIYKDOFELQNHPQ-UHFFFAOYSA-N 1 0 321.342 4.012 20 10 DICDRO C[C@H]([NH2+]CCOC1CCCC1)c1ccc(N2CCCCC2)cc1 ZINC000765416448 1055384166 /nfs/dbraw/zinc/38/41/66/1055384166.db2.gz HZVBKKLYNIBIII-KRWDZBQOSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@@H]([NH2+]Cc1cnc2ccccc2c1)c1ccc(N(C)C)cc1 ZINC000765450701 1055391099 /nfs/dbraw/zinc/39/10/99/1055391099.db2.gz RDJIJPPEEFKNMB-OAHLLOKOSA-N 1 0 305.425 4.152 20 10 DICDRO Cc1ccsc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765478669 1055398798 /nfs/dbraw/zinc/39/87/98/1055398798.db2.gz FBQRDLQQRDHQQO-CQSZACIVSA-N 1 0 300.471 4.290 20 10 DICDRO CCC(O)(CC)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765471365 1055400792 /nfs/dbraw/zinc/40/07/92/1055400792.db2.gz CGTNPMZWJIZOQB-HNNXBMFYSA-N 1 0 322.468 4.018 20 10 DICDRO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765480427 1055401877 /nfs/dbraw/zinc/40/18/77/1055401877.db2.gz MGFHRLVKEJZTIO-MRXNPFEDSA-N 1 0 324.468 4.237 20 10 DICDRO C[N@H+](Cc1ccc2nccc(Cl)c2c1)Cc1ccccc1O ZINC001237272636 1055412790 /nfs/dbraw/zinc/41/27/90/1055412790.db2.gz KAITWFPGGMUHRP-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO Cc1ccc(C[NH+]2CCC3(CCNc4ccccc43)CC2)c(O)c1 ZINC001237322963 1055426569 /nfs/dbraw/zinc/42/65/69/1055426569.db2.gz MNWFXBRJCHXSFJ-UHFFFAOYSA-N 1 0 322.452 4.050 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC2(CCNc3ccccc32)CC1 ZINC001237329823 1055428274 /nfs/dbraw/zinc/42/82/74/1055428274.db2.gz UDZSKYZYMMSTJB-UHFFFAOYSA-N 1 0 322.452 4.050 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001237487179 1055458332 /nfs/dbraw/zinc/45/83/32/1055458332.db2.gz GUVHNUORIHHBEQ-CQSZACIVSA-N 1 0 301.817 4.344 20 10 DICDRO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2c(C)cccc2O)cc1 ZINC001237488160 1055459289 /nfs/dbraw/zinc/45/92/89/1055459289.db2.gz SBLSHRIGNNLDEV-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO COc1cccc([C@H]2CCCC[N@@H+]2Cc2c(C)cccc2O)c1 ZINC001237488993 1055459783 /nfs/dbraw/zinc/45/97/83/1055459783.db2.gz BFDQMIPSVURXNZ-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO Cc1c2ccccc2n(C)c1CNc1cc(C[NH+](C)C)ccc1C ZINC001620846411 1055474998 /nfs/dbraw/zinc/47/49/98/1055474998.db2.gz NUCUDLSZGWIQTB-UHFFFAOYSA-N 1 0 321.468 4.469 20 10 DICDRO CCCC1(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC001620855801 1055484403 /nfs/dbraw/zinc/48/44/03/1055484403.db2.gz NQRMGCUTTLLKMW-UHFFFAOYSA-N 1 0 314.395 4.441 20 10 DICDRO C[N@H+](Cc1ccc(Cl)cc1)Cc1cc(Cl)cc(F)c1[O-] ZINC001237620844 1055484819 /nfs/dbraw/zinc/48/48/19/1055484819.db2.gz QVMNJTPTOLGSIE-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)cc1C ZINC001620859914 1055488388 /nfs/dbraw/zinc/48/83/88/1055488388.db2.gz GNFLYZRZCNBANW-GOSISDBHSA-N 1 0 317.473 4.365 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cccc2nccc(C)c12 ZINC001237630346 1055488776 /nfs/dbraw/zinc/48/87/76/1055488776.db2.gz LWJCPXUCCNCTJR-UHFFFAOYSA-N 1 0 306.409 4.271 20 10 DICDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001237642111 1055491410 /nfs/dbraw/zinc/49/14/10/1055491410.db2.gz ZLNPICUNJCDPKM-UGSOOPFHSA-N 1 0 317.379 4.378 20 10 DICDRO COC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccc1 ZINC001620864641 1055491992 /nfs/dbraw/zinc/49/19/92/1055491992.db2.gz IXDNRFSMCARTCC-OAQYLSRUSA-N 1 0 324.468 4.154 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC3(CCC(=O)CC3)CC2)c1O ZINC001237687447 1055502208 /nfs/dbraw/zinc/50/22/08/1055502208.db2.gz BMEDANPOZISXSC-UHFFFAOYSA-N 1 0 321.848 4.079 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC001237691159 1055504985 /nfs/dbraw/zinc/50/49/85/1055504985.db2.gz YIKBAZHXBCHJBK-QGZVFWFLSA-N 1 0 301.817 4.473 20 10 DICDRO CSc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1F ZINC000765608095 1055511346 /nfs/dbraw/zinc/51/13/46/1055511346.db2.gz IFGWCHMOXGZXIQ-GFCCVEGCSA-N 1 0 317.429 4.333 20 10 DICDRO [O-]c1c(Cl)cc(F)cc1C[NH+]1CCC2(CC[C@@H](F)C2)CC1 ZINC001237800765 1055533876 /nfs/dbraw/zinc/53/38/76/1055533876.db2.gz BCRIGBBPMCYRQD-GFCCVEGCSA-N 1 0 315.791 4.289 20 10 DICDRO CCCOc1ccc(C[NH2+]CC(C)(C)C(F)(F)F)cc1C ZINC001620911449 1055535622 /nfs/dbraw/zinc/53/56/22/1055535622.db2.gz JRXJWYHNVMKDMU-UHFFFAOYSA-N 1 0 303.368 4.462 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2c3ccccc3CCC[C@H]2C)c1 ZINC000765662963 1055538359 /nfs/dbraw/zinc/53/83/59/1055538359.db2.gz PNQCDXZOEJTAIN-JLTOFOAXSA-N 1 0 311.425 4.204 20 10 DICDRO c1ccc([C@@H]2CCC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001620926729 1055545729 /nfs/dbraw/zinc/54/57/29/1055545729.db2.gz CCOJLCLCLJLBRQ-QUCCMNQESA-N 1 0 307.437 4.438 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@@H]2CC)ccc1OC ZINC001620941224 1055556067 /nfs/dbraw/zinc/55/60/67/1055556067.db2.gz QJDJYLVNVUHFQN-IRXDYDNUSA-N 1 0 305.462 4.148 20 10 DICDRO C[N@H+](C/C=C/c1ccccc1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237950615 1055562335 /nfs/dbraw/zinc/56/23/35/1055562335.db2.gz YDDMEMVTAQXDRP-VMPITWQZSA-N 1 0 305.780 4.330 20 10 DICDRO CC(F)(F)c1ccc(C[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001620952334 1055570933 /nfs/dbraw/zinc/57/09/33/1055570933.db2.gz PJHHQYGZZZJTDQ-UHFFFAOYSA-N 1 0 317.379 4.413 20 10 DICDRO CC[C@H]1CCCC[C@H]1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001620953432 1055573378 /nfs/dbraw/zinc/57/33/78/1055573378.db2.gz LQARUYUGJXXNDN-KBPBESRZSA-N 1 0 310.432 4.337 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3c(F)cccc32)cc1F ZINC001620954169 1055575457 /nfs/dbraw/zinc/57/54/57/1055575457.db2.gz KQSNCNXGAFZTTL-GOSISDBHSA-N 1 0 316.395 4.198 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1O ZINC001238064765 1055596850 /nfs/dbraw/zinc/59/68/50/1055596850.db2.gz BFALIUJNTNNOGT-QGZVFWFLSA-N 1 0 321.342 4.455 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)cc(C)c2O)cc1 ZINC001238062816 1055598198 /nfs/dbraw/zinc/59/81/98/1055598198.db2.gz SBVJLOKNFUNYHR-SFHVURJKSA-N 1 0 315.388 4.185 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2cc(F)cc(C)c2O)cc1 ZINC001238071431 1055600276 /nfs/dbraw/zinc/60/02/76/1055600276.db2.gz XIDGGGQEKCDGAC-ZDUSSCGKSA-N 1 0 303.377 4.041 20 10 DICDRO CCOc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)ccc1C ZINC001238075571 1055601424 /nfs/dbraw/zinc/60/14/24/1055601424.db2.gz KSTKEOHVIWTCQK-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO CCO[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001620969083 1055732274 /nfs/dbraw/zinc/73/22/74/1055732274.db2.gz YPBOEFMDWHSQEW-WOJBJXKFSA-N 1 0 316.489 4.114 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccccc2SC)c1O ZINC000282160286 1055761112 /nfs/dbraw/zinc/76/11/12/1055761112.db2.gz XSMIROPBBHHGQE-CYBMUJFWSA-N 1 0 317.454 4.364 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2csc(C(C)(C)C)n2)c1 ZINC000186202010 1055935204 /nfs/dbraw/zinc/93/52/04/1055935204.db2.gz CHJULNUHSHQBMG-CYBMUJFWSA-N 1 0 318.486 4.348 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1Cl ZINC001620766345 1055936467 /nfs/dbraw/zinc/93/64/67/1055936467.db2.gz RAIGCQDJUJZISD-UHFFFAOYSA-N 1 0 315.844 4.342 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](COC)CC(C)(C)C)cc1 ZINC001620986114 1055958802 /nfs/dbraw/zinc/95/88/02/1055958802.db2.gz FWCWUWUNHZUWCH-QGZVFWFLSA-N 1 0 306.494 4.074 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C/C=C/c2ccc(F)cc2F)c1 ZINC001620989579 1055962832 /nfs/dbraw/zinc/96/28/32/1055962832.db2.gz HMUARQQAQSLZII-PCAWENJQSA-N 1 0 319.351 4.043 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@H](Sc3ccccc3)C2)cc1C ZINC001621023541 1055988992 /nfs/dbraw/zinc/98/89/92/1055988992.db2.gz PCKVVTVRVJWTQD-SAABIXHNSA-N 1 0 313.466 4.417 20 10 DICDRO Cc1cc(C[NH2+]C[C@H]2CCSC2)c(C)n1-c1cccc(C)c1 ZINC001621030051 1055992740 /nfs/dbraw/zinc/99/27/40/1055992740.db2.gz SIVMKMDNXIERPN-QGZVFWFLSA-N 1 0 314.498 4.245 20 10 DICDRO CCCOc1ccc(C[NH2+]CCCNc2ccccc2)cc1C ZINC001620809954 1056003399 /nfs/dbraw/zinc/00/33/99/1056003399.db2.gz XJVITHHJRNGCLD-UHFFFAOYSA-N 1 0 312.457 4.376 20 10 DICDRO C1=C[C@@H](C[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 ZINC001621047560 1056006324 /nfs/dbraw/zinc/00/63/24/1056006324.db2.gz WSOSRXSHDGZFKF-GOSISDBHSA-N 1 0 318.464 4.305 20 10 DICDRO CC1(C2([NH2+]Cc3ccc(OCc4ccccc4)cc3O)CC2)CC1 ZINC001621334325 1056038308 /nfs/dbraw/zinc/03/83/08/1056038308.db2.gz JRVJEVOYPXBPCQ-UHFFFAOYSA-N 1 0 323.436 4.394 20 10 DICDRO C[C@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000090965949 1056128005 /nfs/dbraw/zinc/12/80/05/1056128005.db2.gz YTSMWWLFASZMEK-ZACQAIPSSA-N 1 0 316.489 4.284 20 10 DICDRO CCO[C@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)C1(CC)CC ZINC001620819611 1056132995 /nfs/dbraw/zinc/13/29/95/1056132995.db2.gz XHGOIPRQVSPIDI-CVEARBPZSA-N 1 0 311.853 4.119 20 10 DICDRO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)CCC2 ZINC000765817513 1056178117 /nfs/dbraw/zinc/17/81/17/1056178117.db2.gz LWJKUBQABYKNFI-BLLLJJGKSA-N 1 0 317.408 4.037 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)c(O)c1 ZINC000765824676 1056274649 /nfs/dbraw/zinc/27/46/49/1056274649.db2.gz VVOCFCGBODEKCV-YOEHRIQHSA-N 1 0 313.445 4.206 20 10 DICDRO CCC[C@@](C)(O)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765939340 1056524676 /nfs/dbraw/zinc/52/46/76/1056524676.db2.gz AGUGSRAKOGMSHC-YLJYHZDGSA-N 1 0 318.505 4.269 20 10 DICDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765943224 1056536924 /nfs/dbraw/zinc/53/69/24/1056536924.db2.gz AEUNFCRJLMOSNL-SQGPQFPESA-N 1 0 318.505 4.125 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(C)ccc2O)CCO1 ZINC000186502043 1056558789 /nfs/dbraw/zinc/55/87/89/1056558789.db2.gz RGOLTODVSCZZHD-GMBSWORKSA-N 1 0 305.462 4.335 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1ccc(Cl)cc1OC ZINC001615686493 1056565359 /nfs/dbraw/zinc/56/53/59/1056565359.db2.gz PJPOBQNTEHBQOJ-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO C[C@H]([NH2+]CCc1ccsc1)c1cc2c(cc1O)CCCC2 ZINC000756379107 1056613520 /nfs/dbraw/zinc/61/35/20/1056613520.db2.gz LJUVGTIZLNNWBU-ZDUSSCGKSA-N 1 0 301.455 4.226 20 10 DICDRO C[C@@H]([NH2+]C[C@@]1(C)CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000765957909 1056649341 /nfs/dbraw/zinc/64/93/41/1056649341.db2.gz KVLLGPXQQUSIIU-YLJYHZDGSA-N 1 0 316.489 4.144 20 10 DICDRO c1ccc([C@@H]2C[C@H]([NH2+]Cc3ccc4c(c3)CCCO4)CCO2)cc1 ZINC000922000522 1056723653 /nfs/dbraw/zinc/72/36/53/1056723653.db2.gz MDGNCZHSXUFLBB-CTNGQTDRSA-N 1 0 323.436 4.022 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c1O ZINC001143104388 1056769769 /nfs/dbraw/zinc/76/97/69/1056769769.db2.gz SQCAZPMQVSRSIN-AWEZNQCLSA-N 1 0 315.379 4.259 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CC[C@@H](c2ccccc2)O1)c1ccc(N(C)C)cc1 ZINC001617339415 1056817699 /nfs/dbraw/zinc/81/76/99/1056817699.db2.gz VVQOEWBVNGOVBF-NDXORKPFSA-N 1 0 324.468 4.324 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@H](C2CCOCC2)C1)c1ccccc1O ZINC000922330514 1057010526 /nfs/dbraw/zinc/01/05/26/1057010526.db2.gz YLBSKYABIULNGF-BHYGNILZSA-N 1 0 303.446 4.028 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](C2CCOCC2)C1)c1ccccc1O ZINC000922330649 1057010552 /nfs/dbraw/zinc/01/05/52/1057010552.db2.gz YLBSKYABIULNGF-USXIJHARSA-N 1 0 303.446 4.028 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](c2ccccn2)C2CC2)cc1 ZINC000922585069 1057036053 /nfs/dbraw/zinc/03/60/53/1057036053.db2.gz HZPMDRAVCVTOTC-HXUWFJFHSA-N 1 0 309.457 4.169 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000766005414 1057076722 /nfs/dbraw/zinc/07/67/22/1057076722.db2.gz ITXKVJHPWLXDLH-IEBWSBKVSA-N 1 0 323.484 4.072 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000766005416 1057076729 /nfs/dbraw/zinc/07/67/29/1057076729.db2.gz ITXKVJHPWLXDLH-PKOBYXMFSA-N 1 0 323.484 4.072 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccc(F)cc1 ZINC000766028810 1057127949 /nfs/dbraw/zinc/12/79/49/1057127949.db2.gz GSWJGHPNRYYQDQ-LJQANCHMSA-N 1 0 300.421 4.441 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000766027933 1057128414 /nfs/dbraw/zinc/12/84/14/1057128414.db2.gz BFXFWGCMCGGEPI-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC(C)(C)Cc2occc21 ZINC000766031008 1057134760 /nfs/dbraw/zinc/13/47/60/1057134760.db2.gz YOJNKRPTOZTCIG-SFHVURJKSA-N 1 0 312.457 4.457 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@@H]2Cc3cccc(Cl)c3C2)cc1 ZINC001168744086 1057139887 /nfs/dbraw/zinc/13/98/87/1057139887.db2.gz OLNHURGOLDWYEV-QGZVFWFLSA-N 1 0 314.860 4.005 20 10 DICDRO C[C@H]([NH2+]CCCC(C)(C)CO)c1ccc(N2CCCCC2)cc1 ZINC000163160517 1057159961 /nfs/dbraw/zinc/15/99/61/1057159961.db2.gz SFOHSUBEBABTMY-KRWDZBQOSA-N 1 0 318.505 4.126 20 10 DICDRO CSCCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766070302 1057284520 /nfs/dbraw/zinc/28/45/20/1057284520.db2.gz BVGBLTIOJNXQDC-INIZCTEOSA-N 1 0 306.519 4.471 20 10 DICDRO CCOc1ccccc1[C@@H](C)[NH2+]CCCSc1nccs1 ZINC000766071081 1057285393 /nfs/dbraw/zinc/28/53/93/1057285393.db2.gz IVRSXVJJGWHGCU-CYBMUJFWSA-N 1 0 322.499 4.375 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+]CCCSc1nccs1 ZINC000766074169 1057285821 /nfs/dbraw/zinc/28/58/21/1057285821.db2.gz TTYZOGXHRUOTLC-CYBMUJFWSA-N 1 0 322.499 4.293 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+]CCCSc1nccs1 ZINC000766074170 1057286247 /nfs/dbraw/zinc/28/62/47/1057286247.db2.gz TTYZOGXHRUOTLC-ZDUSSCGKSA-N 1 0 322.499 4.293 20 10 DICDRO CSC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766082166 1057299285 /nfs/dbraw/zinc/29/92/85/1057299285.db2.gz BXNQYHLWZONDMR-JKSUJKDBSA-N 1 0 306.519 4.469 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1OCC1CC1)c1ccc(N(C)C)cc1 ZINC000766107671 1057345874 /nfs/dbraw/zinc/34/58/74/1057345874.db2.gz FTYSQXXWCCUSKF-MRXNPFEDSA-N 1 0 324.468 4.392 20 10 DICDRO CC(C)CCCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000766121495 1057358563 /nfs/dbraw/zinc/35/85/63/1057358563.db2.gz PBOWWHRCKLVUJR-KRWDZBQOSA-N 1 0 304.478 4.000 20 10 DICDRO Cc1ncc(-c2[nH+]ccc3c2ccn3Cc2ccccc2)cc1N ZINC001242408923 1057360227 /nfs/dbraw/zinc/36/02/27/1057360227.db2.gz HDWAHHLRLNZKCZ-UHFFFAOYSA-N 1 0 314.392 4.037 20 10 DICDRO C[C@H]([NH2+]Cc1cccnc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000020550973 1057637316 /nfs/dbraw/zinc/63/73/16/1057637316.db2.gz VUSSKOOBVHFPNF-HNNXBMFYSA-N 1 0 313.420 4.062 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3cccnc3c2)cc1 ZINC000727467007 1057655121 /nfs/dbraw/zinc/65/51/21/1057655121.db2.gz LJVFCGWPFZCOIN-UHFFFAOYSA-N 1 0 319.452 4.371 20 10 DICDRO CCC[N@H+](CCO[C@H]1CCCC[C@H]1C)Cc1ccccc1O ZINC000727830632 1057676854 /nfs/dbraw/zinc/67/68/54/1057676854.db2.gz FBRGVIPZRXBTLU-APWZRJJASA-N 1 0 305.462 4.200 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H](c3ccccc3F)C1)CCC2 ZINC000730453822 1057715433 /nfs/dbraw/zinc/71/54/33/1057715433.db2.gz CBBKXZHETGFVKK-INIZCTEOSA-N 1 0 311.400 4.010 20 10 DICDRO Cc1cc(C[NH+]2CCC(OC(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000730565095 1057718167 /nfs/dbraw/zinc/71/81/67/1057718167.db2.gz QHCNAZUFLZOYNI-UHFFFAOYSA-N 1 0 319.489 4.388 20 10 DICDRO CCOCC[N@H+](CC)Cc1cc2oc3ccccc3c2cc1O ZINC000730802476 1057725748 /nfs/dbraw/zinc/72/57/48/1057725748.db2.gz YVYXCAPQONHVBR-UHFFFAOYSA-N 1 0 313.397 4.150 20 10 DICDRO c1cncc([C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CCCCC2)c1 ZINC000731449904 1057743950 /nfs/dbraw/zinc/74/39/50/1057743950.db2.gz CMZOHCOBNSTJTC-NRFANRHFSA-N 1 0 322.452 4.428 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1CC(c2ccccc2F)C1 ZINC000731453873 1057744677 /nfs/dbraw/zinc/74/46/77/1057744677.db2.gz RKPFSVQOJVYOSN-UHFFFAOYSA-N 1 0 305.780 4.221 20 10 DICDRO CC1(C)CCc2cc(C[NH2+]Cc3ccc4c(c3)CCO4)ccc2O1 ZINC000731677885 1057751931 /nfs/dbraw/zinc/75/19/31/1057751931.db2.gz AVZOAFDSAPTZLC-UHFFFAOYSA-N 1 0 323.436 4.015 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2(c3ccc(OC)cc3)CC2)cc1 ZINC000731678608 1057752000 /nfs/dbraw/zinc/75/20/00/1057752000.db2.gz SHEIPBNVNKTQNI-UHFFFAOYSA-N 1 0 324.468 4.320 20 10 DICDRO Oc1ccccc1C[N@H+](CCc1cccs1)C1CCCC1 ZINC000731846149 1057756310 /nfs/dbraw/zinc/75/63/10/1057756310.db2.gz VMIZBOMQXCOSFM-UHFFFAOYSA-N 1 0 301.455 4.441 20 10 DICDRO CC[C@@H]([NH2+]C1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 ZINC000732919726 1057790804 /nfs/dbraw/zinc/79/08/04/1057790804.db2.gz SYCVLFIXQBFNQP-OAQYLSRUSA-N 1 0 324.468 4.405 20 10 DICDRO CCc1cc(C[N@@H+]2CCC[C@@H](COC)C2)c(O)c(C(C)(C)C)c1 ZINC000733185128 1057805979 /nfs/dbraw/zinc/80/59/79/1057805979.db2.gz QVEYQSICIPMCTE-MRXNPFEDSA-N 1 0 319.489 4.111 20 10 DICDRO CC(C)(C[NH2+]Cc1c(O)cccc1Cl)c1ccc(F)cc1 ZINC000733326863 1057812825 /nfs/dbraw/zinc/81/28/25/1057812825.db2.gz HITBRMYAKIZGRY-UHFFFAOYSA-N 1 0 307.796 4.252 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC1(c2ccccc2)CCC1 ZINC000733324316 1057812938 /nfs/dbraw/zinc/81/29/38/1057812938.db2.gz OYWSHYUXTPUNMA-UHFFFAOYSA-N 1 0 301.817 4.257 20 10 DICDRO Cc1nc(-c2ccc(C[NH2+]Cc3cc(C)ccc3O)cc2)cs1 ZINC000733325284 1057813198 /nfs/dbraw/zinc/81/31/98/1057813198.db2.gz BWFCOORCJKRKHH-UHFFFAOYSA-N 1 0 324.449 4.422 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1OC ZINC000733324208 1057813269 /nfs/dbraw/zinc/81/32/69/1057813269.db2.gz NVOSTKILNFFKKH-QGZVFWFLSA-N 1 0 316.420 4.141 20 10 DICDRO CC[C@@](C)([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1 ZINC000733327658 1057813682 /nfs/dbraw/zinc/81/36/82/1057813682.db2.gz ANQWYBSEIYYTGL-LJQANCHMSA-N 1 0 300.421 4.307 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccccc2O)C2CCCC2)c1 ZINC000733613778 1057827532 /nfs/dbraw/zinc/82/75/32/1057827532.db2.gz KYQJFKVDKHTSOZ-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO Cc1cc(C[N@@H+](C)[C@H](C)Cc2ccsc2)ccc1N(C)C ZINC001559583308 1059415621 /nfs/dbraw/zinc/41/56/21/1059415621.db2.gz CNQIMNHUFPPCTB-OAHLLOKOSA-N 1 0 302.487 4.186 20 10 DICDRO C[C@@H](C[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1)CC(C)(C)C ZINC001559709683 1059538030 /nfs/dbraw/zinc/53/80/30/1059538030.db2.gz NPQVMBHYIAUXKM-IAGOWNOFSA-N 1 0 318.505 4.246 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)cc1 ZINC001559741188 1059574685 /nfs/dbraw/zinc/57/46/85/1059574685.db2.gz JRGDKDMZFGKICK-ZFWWWQNUSA-N 1 0 314.395 4.306 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)cc1 ZINC001559741184 1059575499 /nfs/dbraw/zinc/57/54/99/1059575499.db2.gz JRGDKDMZFGKICK-DZGCQCFKSA-N 1 0 314.395 4.306 20 10 DICDRO CCCC[N@H+](Cc1ccc(F)c(F)c1)Cc1ccccc1O ZINC001559790136 1059625823 /nfs/dbraw/zinc/62/58/23/1059625823.db2.gz JVSASZDJOKMYMK-UHFFFAOYSA-N 1 0 305.368 4.473 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCC(C)(C)CO1 ZINC001559790162 1059626428 /nfs/dbraw/zinc/62/64/28/1059626428.db2.gz KTQMCQYRGSULQO-QGZVFWFLSA-N 1 0 305.462 4.200 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@@H](C)OC3(CCCCC3)C2)cc1 ZINC001559953799 1059764265 /nfs/dbraw/zinc/76/42/65/1059764265.db2.gz DBFSWDJLKIXASG-QGZVFWFLSA-N 1 0 316.489 4.066 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)c(Br)c1)c1ccccc1O ZINC001560074743 1059888413 /nfs/dbraw/zinc/88/84/13/1059888413.db2.gz CZSOGWYTVCXBJG-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO Cc1cc(C[N@H+](C)[C@H]2CCc3ccccc3C2)ccc1N(C)C ZINC001560220590 1059997489 /nfs/dbraw/zinc/99/74/89/1059997489.db2.gz RTCNUBTVADXNCU-FQEVSTJZSA-N 1 0 308.469 4.050 20 10 DICDRO CC(C)(C)c1cc(O)c(C[N@@H+]2CC[C@@]3(CCCO3)C2)cc1Cl ZINC001248881509 1060031743 /nfs/dbraw/zinc/03/17/43/1060031743.db2.gz YFBVJXUJDBLXGD-SFHVURJKSA-N 1 0 323.864 4.098 20 10 DICDRO CC(C)[C@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC001560296887 1060081793 /nfs/dbraw/zinc/08/17/93/1060081793.db2.gz NAXCTZJPAYZWFU-HKUYNNGSSA-N 1 0 300.490 4.373 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H](C)Oc2cccc(Cl)c2)cc1C ZINC001560350664 1060135616 /nfs/dbraw/zinc/13/56/16/1060135616.db2.gz BQCZCBKDJFZQOO-CQSZACIVSA-N 1 0 319.832 4.214 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CC(C)(C)c3ccccc32)cc1F ZINC001560384940 1060171901 /nfs/dbraw/zinc/17/19/01/1060171901.db2.gz CHIWKKBGHIGHDF-GOSISDBHSA-N 1 0 312.432 4.404 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCCC[C@](C)(F)C3)ccc2O1 ZINC001249223792 1060192622 /nfs/dbraw/zinc/19/26/22/1060192622.db2.gz MTZUHUDGVNSSKD-IBGZPJMESA-N 1 0 319.420 4.291 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCC[C@@H](C(F)F)C3)ccc2O1 ZINC001249252108 1060199784 /nfs/dbraw/zinc/19/97/84/1060199784.db2.gz GKEOVINNTKBSCX-CYBMUJFWSA-N 1 0 323.383 4.054 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCO[C@H](C(C)C)C2)cc1C ZINC001560415961 1060200269 /nfs/dbraw/zinc/20/02/69/1060200269.db2.gz GZGZNMGWALPTSF-MJGOQNOKSA-N 1 0 305.462 4.077 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCC4(CCCC4)C3)ccc2O1 ZINC001249244590 1060201049 /nfs/dbraw/zinc/20/10/49/1060201049.db2.gz JLPYHIHKFZNHEK-UHFFFAOYSA-N 1 0 313.441 4.343 20 10 DICDRO COC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CCC(C)CC1 ZINC001560461235 1060251969 /nfs/dbraw/zinc/25/19/69/1060251969.db2.gz LCSKBBLDBGGEAH-UHFFFAOYSA-N 1 0 311.853 4.039 20 10 DICDRO CCC[C@@H]([NH2+]C1CCN(c2ccc(OC)cc2)CC1)C(C)(C)C ZINC001560477101 1060265931 /nfs/dbraw/zinc/26/59/31/1060265931.db2.gz FLNBUICTBGIXGN-LJQANCHMSA-N 1 0 318.505 4.468 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@@H](C)Oc2ccccc21 ZINC001560480367 1060271576 /nfs/dbraw/zinc/27/15/76/1060271576.db2.gz YDKNIQWSNLNGJP-RDTXWAMCSA-N 1 0 320.436 4.489 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cn3cc(C)ccc3n2)cc1C ZINC001560494238 1060291079 /nfs/dbraw/zinc/29/10/79/1060291079.db2.gz DNXUAGMWOYSSHA-UHFFFAOYSA-N 1 0 323.440 4.030 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCCCO1 ZINC001560518117 1060316906 /nfs/dbraw/zinc/31/69/06/1060316906.db2.gz JBDFHXHUIFQZAQ-UXHICEINSA-N 1 0 316.489 4.114 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCCCO1 ZINC001560518116 1060317524 /nfs/dbraw/zinc/31/75/24/1060317524.db2.gz JBDFHXHUIFQZAQ-PMACEKPBSA-N 1 0 316.489 4.114 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C2CCC2)[C@@H]2CCCO2)cc1C ZINC001560547841 1060356799 /nfs/dbraw/zinc/35/67/99/1060356799.db2.gz STNUCPUCBSKVTE-PMACEKPBSA-N 1 0 317.473 4.221 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)cc1 ZINC001560568594 1060378654 /nfs/dbraw/zinc/37/86/54/1060378654.db2.gz UBUQZFBLGVZYKS-XWXQIQOZSA-N 1 0 324.443 4.381 20 10 DICDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)c1ccccc1O ZINC001560575548 1060386334 /nfs/dbraw/zinc/38/63/34/1060386334.db2.gz MSZYACUPBLLVKT-QLKUMGTLSA-N 1 0 312.369 4.055 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC23CCCCC3)cc1 ZINC001560607744 1060421717 /nfs/dbraw/zinc/42/17/17/1060421717.db2.gz NAULRDDDVPSAIU-LJQANCHMSA-N 1 0 316.489 4.114 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H]2CCCC(C)(C)O2)cc1C ZINC001560610182 1060424186 /nfs/dbraw/zinc/42/41/86/1060424186.db2.gz MFARVWSCYMGVKQ-KRWDZBQOSA-N 1 0 305.462 4.221 20 10 DICDRO COc1cc(C)cc(C[N@H+](CCC(C)C)C2CCCC2)c1O ZINC001560651413 1060475170 /nfs/dbraw/zinc/47/51/70/1060475170.db2.gz BSLSNBZMAWSYIY-UHFFFAOYSA-N 1 0 305.462 4.500 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001560665092 1060493937 /nfs/dbraw/zinc/49/39/37/1060493937.db2.gz MACGAEQYQDDNOU-ROUKRRSUSA-N 1 0 306.453 4.255 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)C1CCC1 ZINC001560677852 1060517486 /nfs/dbraw/zinc/51/74/86/1060517486.db2.gz NBRFIJDESJRESJ-UHFFFAOYSA-N 1 0 300.368 4.146 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)C[C@H](C)O2 ZINC001560724853 1060589950 /nfs/dbraw/zinc/58/99/50/1060589950.db2.gz YMBWCPSKWSHUMF-INIZCTEOSA-N 1 0 324.468 4.098 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@H](OC(C)C)C2(C)C)cc1Cl ZINC001560737116 1060606507 /nfs/dbraw/zinc/60/65/07/1060606507.db2.gz SQTWBPCLOVFDJR-CVEARBPZSA-N 1 0 311.853 4.036 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c(O)cc1Br ZINC001250120777 1060628072 /nfs/dbraw/zinc/62/80/72/1060628072.db2.gz QAVOSARCQRETSU-CHWSQXEVSA-N 1 0 324.262 4.085 20 10 DICDRO CCC(CC)[N@H+](C)Cc1cc(C)c(Br)cc1O ZINC001250134299 1060638220 /nfs/dbraw/zinc/63/82/20/1060638220.db2.gz YVGNIUKGTHAIIO-UHFFFAOYSA-N 1 0 300.240 4.084 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@H](C)[C@H]2C)c1O ZINC001560786827 1060649907 /nfs/dbraw/zinc/64/99/07/1060649907.db2.gz CFBUJOPDMVSYBS-XQQFMLRXSA-N 1 0 311.853 4.216 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(C)C[C@@H]2c2ccccc2)c1 ZINC001560814640 1060673840 /nfs/dbraw/zinc/67/38/40/1060673840.db2.gz DFFJSJUAZBPAOH-BOUXLOLZSA-N 1 0 311.425 4.245 20 10 DICDRO CSC(C)(C)CC[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001560815699 1060675030 /nfs/dbraw/zinc/67/50/30/1060675030.db2.gz KXQVEPSISBVEDM-UHFFFAOYSA-N 1 0 306.519 4.250 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2)c1O ZINC001560820404 1060678456 /nfs/dbraw/zinc/67/84/56/1060678456.db2.gz AUWFJMFSLFFVLZ-YJBOKZPZSA-N 1 0 311.425 4.292 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2)c1O ZINC001560820401 1060679461 /nfs/dbraw/zinc/67/94/61/1060679461.db2.gz AUWFJMFSLFFVLZ-CRAIPNDOSA-N 1 0 311.425 4.292 20 10 DICDRO C[C@@H](C1CC1)[N@H+](C)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560836592 1060693252 /nfs/dbraw/zinc/69/32/52/1060693252.db2.gz CKRHGIANEGZHHV-KRWDZBQOSA-N 1 0 320.480 4.480 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC3(CCCC3)[C@@H]2C(C)C)c1O ZINC001560884027 1060746526 /nfs/dbraw/zinc/74/65/26/1060746526.db2.gz MKJBQAACASREBN-SFHVURJKSA-N 1 0 303.446 4.110 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCC[C@H]2F)c(C(F)(F)F)c1 ZINC001560885148 1060746872 /nfs/dbraw/zinc/74/68/72/1060746872.db2.gz UCDMZBVZEIRDOY-HUUCEWRRSA-N 1 0 318.358 4.142 20 10 DICDRO Nc1ccc(N(Cc2ccccc2)c2ccc3c[nH+]cn3c2)cc1 ZINC001250332185 1060785159 /nfs/dbraw/zinc/78/51/59/1060785159.db2.gz WUKUJRQBOUKWSM-UHFFFAOYSA-N 1 0 314.392 4.255 20 10 DICDRO CCCC[C@H](C)[C@H](C)[NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001560927880 1060790422 /nfs/dbraw/zinc/79/04/22/1060790422.db2.gz DNDIKOICXYRIOI-YESZJQIVSA-N 1 0 304.478 4.078 20 10 DICDRO CCc1cccc(C[NH2+]C[C@]2(c3ccccc3)CC2(C)C)c1O ZINC001560943674 1060806170 /nfs/dbraw/zinc/80/61/70/1060806170.db2.gz XJTIGHIICBBGCE-NRFANRHFSA-N 1 0 309.453 4.412 20 10 DICDRO CCc1cccc(C[NH2+]C[C@@]2(c3ccccc3)CC2(C)C)c1O ZINC001560943675 1060807753 /nfs/dbraw/zinc/80/77/53/1060807753.db2.gz XJTIGHIICBBGCE-OAQYLSRUSA-N 1 0 309.453 4.412 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C(C)C)ccc1O)[C@H](O)c1ccccc1 ZINC001560998988 1060858238 /nfs/dbraw/zinc/85/82/38/1060858238.db2.gz LBNRABWAJPPBSL-AZUAARDMSA-N 1 0 313.441 4.117 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1C ZINC001561002651 1060862645 /nfs/dbraw/zinc/86/26/45/1060862645.db2.gz WHCDOMDYPQVDGG-INIZCTEOSA-N 1 0 312.457 4.229 20 10 DICDRO CSC1CCC(C[NH2+]Cc2ccc(N(C)C)cc2C)CC1 ZINC001561006690 1060865567 /nfs/dbraw/zinc/86/55/67/1060865567.db2.gz XVEJBEDFVMVJLM-UHFFFAOYSA-N 1 0 306.519 4.072 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)cc1 ZINC001561034945 1060888306 /nfs/dbraw/zinc/88/83/06/1060888306.db2.gz IDBUYAPIYBRMOJ-HZQHCPKGSA-N 1 0 310.416 4.352 20 10 DICDRO CCc1ccc2c(c1)CC[N@@H+](Cc1ccc(N(C)C)cc1C)C2 ZINC001561052680 1060902809 /nfs/dbraw/zinc/90/28/09/1060902809.db2.gz IQZIJYHZHLMZPA-UHFFFAOYSA-N 1 0 308.469 4.182 20 10 DICDRO CCC[N@H+](CCOC1CCCCCC1)Cc1ccccc1O ZINC001473196232 1060954083 /nfs/dbraw/zinc/95/40/83/1060954083.db2.gz VNNAJZFVJSGTOL-UHFFFAOYSA-N 1 0 305.462 4.344 20 10 DICDRO CCCC[N@H+](CCc1ccc(F)cc1)Cc1ccccc1O ZINC001462148245 1060969033 /nfs/dbraw/zinc/96/90/33/1060969033.db2.gz NEAVLECLGGWPGV-UHFFFAOYSA-N 1 0 301.405 4.376 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)c1O ZINC001462155988 1060979467 /nfs/dbraw/zinc/97/94/67/1060979467.db2.gz WKRMTECBURCOSP-SFHVURJKSA-N 1 0 317.404 4.335 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)c1O ZINC001462155983 1060979574 /nfs/dbraw/zinc/97/95/74/1060979574.db2.gz WKRMTECBURCOSP-GOSISDBHSA-N 1 0 317.404 4.335 20 10 DICDRO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001462172437 1060989762 /nfs/dbraw/zinc/98/97/62/1060989762.db2.gz BEUMFMJFFWULNJ-DUIDPNDXSA-N 1 0 312.379 4.039 20 10 DICDRO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001462172438 1060989895 /nfs/dbraw/zinc/98/98/95/1060989895.db2.gz BEUMFMJFFWULNJ-GNVQUDOXSA-N 1 0 312.379 4.039 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCC[C@@H](C(C)(C)C)CC2)c1O ZINC001462189553 1061013318 /nfs/dbraw/zinc/01/33/18/1061013318.db2.gz CENMTUITQTXLEM-CVEARBPZSA-N 1 0 305.462 4.485 20 10 DICDRO CCCN(Cc1cc2ccc(C)cc2[nH]1)c1ccc(C[NH3+])cc1 ZINC001462191643 1061016148 /nfs/dbraw/zinc/01/61/48/1061016148.db2.gz VBUSVCYXTNVMJA-UHFFFAOYSA-N 1 0 307.441 4.352 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c1O ZINC001462292938 1061083539 /nfs/dbraw/zinc/08/35/39/1061083539.db2.gz JRCHAMYSKIGNOU-FQEVSTJZSA-N 1 0 323.436 4.436 20 10 DICDRO COc1ccc(N2CC[C@@H](C[NH2+][C@H](C)CC3CCCC3)C2)cc1 ZINC001462374726 1061136022 /nfs/dbraw/zinc/13/60/22/1061136022.db2.gz NTHAWJFFMODNRM-AEFFLSMTSA-N 1 0 316.489 4.080 20 10 DICDRO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001473448375 1061164584 /nfs/dbraw/zinc/16/45/84/1061164584.db2.gz IVBRLGMVIHNNMX-FQEVSTJZSA-N 1 0 312.457 4.344 20 10 DICDRO Cc1cccc(CC2C[NH+](Cc3ccc(N(C)C)cc3C)C2)c1 ZINC001462455045 1061184059 /nfs/dbraw/zinc/18/40/59/1061184059.db2.gz PTJMFLOIQWPQEX-UHFFFAOYSA-N 1 0 308.469 4.044 20 10 DICDRO CCc1cccc(C[NH2+]CC2CCc3ccccc3CC2)c1O ZINC001462458379 1061186405 /nfs/dbraw/zinc/18/64/05/1061186405.db2.gz JSWZDSYEWGUTFV-UHFFFAOYSA-N 1 0 309.453 4.239 20 10 DICDRO C[C@@H](CCc1ccc(F)cc1F)[NH2+][C@@H](C)c1ccccc1O ZINC001462514281 1061222703 /nfs/dbraw/zinc/22/27/03/1061222703.db2.gz QWLZNJXLTCKTJP-STQMWFEESA-N 1 0 305.368 4.342 20 10 DICDRO COC1([C@H](C)[NH2+]Cc2ccc(N3CCCCC3)c(C)c2)CCC1 ZINC001473554432 1061242175 /nfs/dbraw/zinc/24/21/75/1061242175.db2.gz FIEHGONHRVGJPI-KRWDZBQOSA-N 1 0 316.489 4.033 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CC2C[C@H]3CC[C@@H](C2)S3)c1 ZINC001462582384 1061275248 /nfs/dbraw/zinc/27/52/48/1061275248.db2.gz DSNXMTYIRAJJMG-FUCXHRTASA-N 1 0 305.487 4.279 20 10 DICDRO Cc1cc(C[N@H+](C)CCC(F)(F)F)c(O)c(C(C)(C)C)c1 ZINC001251237196 1061281650 /nfs/dbraw/zinc/28/16/50/1061281650.db2.gz DWLAONVBHANAON-UHFFFAOYSA-N 1 0 303.368 4.382 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCCOc2ccccc2)c(Cl)c1 ZINC001473924436 1061473444 /nfs/dbraw/zinc/47/34/44/1061473444.db2.gz WDPNBLFNWHEDOZ-UHFFFAOYSA-N 1 0 319.832 4.303 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(SC)o2)cc1 ZINC001473939871 1061485083 /nfs/dbraw/zinc/48/50/83/1061485083.db2.gz DOYLQTGGUUHAHP-UHFFFAOYSA-N 1 0 304.459 4.138 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001473965011 1061508346 /nfs/dbraw/zinc/50/83/46/1061508346.db2.gz SBOYPJNOZXNELQ-SQRWCISFSA-N 1 0 310.441 4.125 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc3c(c2)CCCC3)cc1F ZINC001473966737 1061510519 /nfs/dbraw/zinc/51/05/19/1061510519.db2.gz VYHJTXYPKIKYOG-UHFFFAOYSA-N 1 0 312.432 4.060 20 10 DICDRO Cc1oc2ccccc2c1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC001473996061 1061540837 /nfs/dbraw/zinc/54/08/37/1061540837.db2.gz NFHSPBZILXWEDJ-UHFFFAOYSA-N 1 0 308.425 4.405 20 10 DICDRO Fc1c(Cl)cccc1C[NH2+]CCCSc1nccs1 ZINC001474018564 1061558473 /nfs/dbraw/zinc/55/84/73/1061558473.db2.gz VJSOEVYSNDKXGL-UHFFFAOYSA-N 1 0 316.854 4.208 20 10 DICDRO CCOc1cc(C)ccc1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001474066621 1061614325 /nfs/dbraw/zinc/61/43/25/1061614325.db2.gz COGDDTFBPFXLON-UHFFFAOYSA-N 1 0 319.832 4.351 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2(OC)CCCCC2)cc1C ZINC001474116793 1061666068 /nfs/dbraw/zinc/66/60/68/1061666068.db2.gz GYTUVULDPHHPKW-UHFFFAOYSA-N 1 0 305.462 4.223 20 10 DICDRO Fc1cc(Cl)ccc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001474120095 1061668588 /nfs/dbraw/zinc/66/85/88/1061668588.db2.gz GKYZMHIPDSDEGY-UHFFFAOYSA-N 1 0 305.780 4.094 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2cc3ccccc3[nH]2)cc1 ZINC001474144838 1061691168 /nfs/dbraw/zinc/69/11/68/1061691168.db2.gz DIXBCJJHEUEWJK-AATRIKPKSA-N 1 0 305.425 4.037 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3c(O)cccc3Cl)C2)c1 ZINC001474146889 1061693336 /nfs/dbraw/zinc/69/33/36/1061693336.db2.gz JGOBUPKPEKDXGJ-HDJSIYSDSA-N 1 0 317.816 4.090 20 10 DICDRO CC[C@@H](OCC[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC001474201526 1061754886 /nfs/dbraw/zinc/75/48/86/1061754886.db2.gz YMRADNZWUTVJHA-GOSISDBHSA-N 1 0 319.832 4.303 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]CC2CC=CC2)cc1 ZINC001474211112 1061765182 /nfs/dbraw/zinc/76/51/82/1061765182.db2.gz FLYLJQDXPVFNBZ-UHFFFAOYSA-N 1 0 312.482 4.440 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(OC)c2C)cc1 ZINC001474216327 1061771336 /nfs/dbraw/zinc/77/13/36/1061771336.db2.gz TURYDMCLAXKRPI-UHFFFAOYSA-N 1 0 312.457 4.140 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](OC)C2CCCCC2)cc1C ZINC001474222916 1061784307 /nfs/dbraw/zinc/78/43/07/1061784307.db2.gz MXVWEXHTZQRJBZ-HXUWFJFHSA-N 1 0 319.489 4.469 20 10 DICDRO CCSc1ccc(C[NH2+]Cc2ccc(OC)c(C)c2)cc1 ZINC001474248918 1061816906 /nfs/dbraw/zinc/81/69/06/1061816906.db2.gz XCOSUBUVOAHGFL-UHFFFAOYSA-N 1 0 301.455 4.405 20 10 DICDRO CC(C)n1c(C[NH2+][C@@H](C)c2ccccc2O)nc2ccccc21 ZINC001474253353 1061818412 /nfs/dbraw/zinc/81/84/12/1061818412.db2.gz PFHCLFHDMUCMPN-AWEZNQCLSA-N 1 0 309.413 4.174 20 10 DICDRO C[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)[C@@H]1C ZINC001474309488 1061879227 /nfs/dbraw/zinc/87/92/27/1061879227.db2.gz HPKWKHMTWUTTAD-CHWSQXEVSA-N 1 0 314.395 4.392 20 10 DICDRO CCC1(CC)[C@H](OC)C[C@H]1[N@H+](C)Cc1ccc(Cl)cc1O ZINC001474320960 1061897408 /nfs/dbraw/zinc/89/74/08/1061897408.db2.gz VJMIOMBRRYHKHE-HZPDHXFCSA-N 1 0 311.853 4.071 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001474325350 1061906356 /nfs/dbraw/zinc/90/63/56/1061906356.db2.gz ZACDYDQAZGSVGN-UHFFFAOYSA-N 1 0 320.839 4.486 20 10 DICDRO CO[C@@]1(C)C[C@@H]([N@H+](C)Cc2ccc3ccccc3c2O)C1(C)C ZINC001474327259 1061913660 /nfs/dbraw/zinc/91/36/60/1061913660.db2.gz QFAJYUCOWSDQTE-XLIONFOSSA-N 1 0 313.441 4.181 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccccc2F)CC(C)C)c(O)c1 ZINC001474333366 1061922196 /nfs/dbraw/zinc/92/21/96/1061922196.db2.gz JRGIQXHWENQKTO-UHFFFAOYSA-N 1 0 301.405 4.498 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(C)(C)CC2)c(C(F)(F)F)c1 ZINC001474343762 1061947672 /nfs/dbraw/zinc/94/76/72/1061947672.db2.gz UGMZHVYGGJGHKI-UHFFFAOYSA-N 1 0 314.395 4.393 20 10 DICDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001474360599 1061985014 /nfs/dbraw/zinc/98/50/14/1061985014.db2.gz BQQGEWVSQXHLMF-CXAGYDPISA-N 1 0 310.432 4.431 20 10 DICDRO c1ccc(CN2CCc3cc(C[NH+]4CCCCC4)ccc32)cc1 ZINC001474362732 1061988497 /nfs/dbraw/zinc/98/84/97/1061988497.db2.gz WGOZJKIQLZEACH-UHFFFAOYSA-N 1 0 306.453 4.235 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC001254010868 1062010815 /nfs/dbraw/zinc/01/08/15/1062010815.db2.gz OBVBFPAKQOXMJU-RXVVDRJESA-N 1 0 323.436 4.060 20 10 DICDRO CC[C@H]1CCC[C@@H](CN(C)c2ccc(OCC[NH+](C)C)cc2)C1 ZINC001474421999 1062094647 /nfs/dbraw/zinc/09/46/47/1062094647.db2.gz PNHRKVNEBFDVDH-ZWKOTPCHSA-N 1 0 318.505 4.280 20 10 DICDRO CCc1cccc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)c1O ZINC001474436519 1062112617 /nfs/dbraw/zinc/11/26/17/1062112617.db2.gz HRFYBTGKEDWICI-SMDDNHRTSA-N 1 0 301.352 4.117 20 10 DICDRO CCc1cccc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)c1O ZINC001474436516 1062112743 /nfs/dbraw/zinc/11/27/43/1062112743.db2.gz HRFYBTGKEDWICI-BXUZGUMPSA-N 1 0 301.352 4.117 20 10 DICDRO CCC[C@H](CCc1ccccc1)[NH2+]CCc1ccc(O)c(O)c1 ZINC001254486060 1062128807 /nfs/dbraw/zinc/12/88/07/1062128807.db2.gz QUZKFAPNJHYRHK-GOSISDBHSA-N 1 0 313.441 4.031 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)cc1Cl ZINC001474475015 1062153560 /nfs/dbraw/zinc/15/35/60/1062153560.db2.gz UVBRQMQOMNTNMP-SFHVURJKSA-N 1 0 319.807 4.425 20 10 DICDRO CCCC1CCC([N@H+](C)Cc2cc(C)cc(OC)c2O)CC1 ZINC001474492002 1062169701 /nfs/dbraw/zinc/16/97/01/1062169701.db2.gz OOECAVNCOVMNNB-UHFFFAOYSA-N 1 0 305.462 4.500 20 10 DICDRO CCC1CCC([N@H+](CCO)Cc2cc(C(C)C)ccc2O)CC1 ZINC001474494319 1062172662 /nfs/dbraw/zinc/17/26/62/1062172662.db2.gz RQLXATRVBBBKEQ-UHFFFAOYSA-N 1 0 319.489 4.279 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC001459518617 1062180185 /nfs/dbraw/zinc/18/01/85/1062180185.db2.gz VUIRYDRTTGZZNM-LJQANCHMSA-N 1 0 316.395 4.368 20 10 DICDRO COc1cccc(C[NH2+]C/C=C/c2cc(C)c(C)cc2C)c1O ZINC001474500177 1062180187 /nfs/dbraw/zinc/18/01/87/1062180187.db2.gz BWNIDKUTRSSTHQ-SOFGYWHQSA-N 1 0 311.425 4.129 20 10 DICDRO CC[C@@H](CCC(F)(F)F)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC001474505171 1062187364 /nfs/dbraw/zinc/18/73/64/1062187364.db2.gz OIYYAEZICBAPIW-MNOVXSKESA-N 1 0 305.340 4.173 20 10 DICDRO CN(C)c1ccc(C[N@H+](CCc2ccc(F)cc2)C2CC2)cc1 ZINC001459550596 1062204712 /nfs/dbraw/zinc/20/47/12/1062204712.db2.gz CBBPBIMWDHSECE-UHFFFAOYSA-N 1 0 312.432 4.099 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH+]1CC(c2ccc(Cl)cc2)C1 ZINC001474528477 1062211845 /nfs/dbraw/zinc/21/18/45/1062211845.db2.gz NWKNYZQGFDQAPB-UHFFFAOYSA-N 1 0 314.860 4.314 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@@]2(C)CC2(Cl)Cl)c1 ZINC001474531322 1062215908 /nfs/dbraw/zinc/21/59/08/1062215908.db2.gz BCIHBCBGOQPZPE-CQSZACIVSA-N 1 0 302.245 4.189 20 10 DICDRO C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001474544403 1062236158 /nfs/dbraw/zinc/23/61/58/1062236158.db2.gz GOSBLXJFHGJQNX-IIYDPXPESA-N 1 0 317.379 4.437 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2coc(-c3ccccc3)n2)c(O)c1 ZINC001254721120 1062239494 /nfs/dbraw/zinc/23/94/94/1062239494.db2.gz IZAMJBOOSPVAOZ-OAHLLOKOSA-N 1 0 322.408 4.249 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH+]2CC(c3ccc(F)cc3)C2)cc1 ZINC001474567448 1062271759 /nfs/dbraw/zinc/27/17/59/1062271759.db2.gz JQAZLZSGYOGLRT-ARJAWSKDSA-N 1 0 310.416 4.004 20 10 DICDRO COc1cc(C[N@@H+]2CC(C)(C)C[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001474582719 1062292794 /nfs/dbraw/zinc/29/27/94/1062292794.db2.gz NYTMEIHBLLXUAX-CYBMUJFWSA-N 1 0 305.462 4.319 20 10 DICDRO CCCC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001474592950 1062304435 /nfs/dbraw/zinc/30/44/35/1062304435.db2.gz YFVMUZDZCHLMJN-BZSNNMDCSA-N 1 0 318.505 4.326 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)cc1Cl ZINC001474622161 1062342680 /nfs/dbraw/zinc/34/26/80/1062342680.db2.gz QYOVNOCYUWZCEB-YVEFUNNKSA-N 1 0 301.817 4.172 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H](C)[C@H]3CCCC[C@H]3C)C2)cc1 ZINC001474624292 1062347616 /nfs/dbraw/zinc/34/76/16/1062347616.db2.gz PLPILGROAAIHDW-WWNBULGVSA-N 1 0 316.489 4.078 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+]CCC3CCCCCC3)C2)cc1 ZINC001474624081 1062348120 /nfs/dbraw/zinc/34/81/20/1062348120.db2.gz JVFXCFQUJJGJCC-GOSISDBHSA-N 1 0 316.489 4.224 20 10 DICDRO CCCC[C@H](CC)C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC001459745918 1062354961 /nfs/dbraw/zinc/35/49/61/1062354961.db2.gz BOUZRFODGSMEIU-INIZCTEOSA-N 1 0 322.468 4.173 20 10 DICDRO CC(C)CCO[C@@H]1CC[N@H+](Cc2cc(C(C)C)ccc2O)C1 ZINC001474648592 1062376198 /nfs/dbraw/zinc/37/61/98/1062376198.db2.gz HUUUWEADAOGQIP-GOSISDBHSA-N 1 0 305.462 4.153 20 10 DICDRO Cc1cc(CC[NH2+]Cc2ncccc2C)c(C)n1-c1ccccc1 ZINC001474653761 1062381744 /nfs/dbraw/zinc/38/17/44/1062381744.db2.gz GPQDCONVSQMKBI-UHFFFAOYSA-N 1 0 319.452 4.130 20 10 DICDRO Cc1cc(O)c(C[NH+]2CC(Cc3cccs3)C2)c(Cl)c1 ZINC001474655708 1062385482 /nfs/dbraw/zinc/38/54/82/1062385482.db2.gz UMOIXDSHVFKRNG-UHFFFAOYSA-N 1 0 307.846 4.090 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)COC(C)C)c(C)n1-c1cccc(C)c1 ZINC001474664688 1062395297 /nfs/dbraw/zinc/39/52/97/1062395297.db2.gz YELPJUZINPABGY-MRXNPFEDSA-N 1 0 314.473 4.306 20 10 DICDRO C[C@H]([NH2+]CCCc1c(F)cccc1Cl)c1ccccc1O ZINC001474670461 1062401604 /nfs/dbraw/zinc/40/16/04/1062401604.db2.gz ZRWCBTXFYADRQW-LBPRGKRZSA-N 1 0 307.796 4.468 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]Cc2noc3ccc(F)cc32)c1 ZINC001474673230 1062403385 /nfs/dbraw/zinc/40/33/85/1062403385.db2.gz WUQPMZJPADCPMJ-UHFFFAOYSA-N 1 0 314.360 4.086 20 10 DICDRO CCOc1ccc(N2CC[NH+]([C@@H](CC)c3ccccc3)CC2)cc1 ZINC001459798308 1062408450 /nfs/dbraw/zinc/40/84/50/1062408450.db2.gz QXZZXMRKBMREOB-NRFANRHFSA-N 1 0 324.468 4.359 20 10 DICDRO CC(C)(C)C1CCC([N@@H+]2CCCc3cc(O)c(O)cc3C2)CC1 ZINC001255505216 1062465139 /nfs/dbraw/zinc/46/51/39/1062465139.db2.gz CWQBWDBEYJQBIU-UHFFFAOYSA-N 1 0 317.473 4.451 20 10 DICDRO CCCN(Cc1ccccc1N1CCCC1)c1ccc(C[NH3+])cc1 ZINC001256047824 1062688767 /nfs/dbraw/zinc/68/87/67/1062688767.db2.gz GETNNCKQFDACGX-UHFFFAOYSA-N 1 0 323.484 4.162 20 10 DICDRO COc1cccc(C[C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001256144762 1062727258 /nfs/dbraw/zinc/72/72/58/1062727258.db2.gz SPGRVZSYVOSBOX-KRWDZBQOSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H](C)Cc1ccccn1 ZINC001256410520 1062811801 /nfs/dbraw/zinc/81/18/01/1062811801.db2.gz VDJYVSITNSLWPU-FOIQADDNSA-N 1 0 324.468 4.248 20 10 DICDRO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001460370940 1062818545 /nfs/dbraw/zinc/81/85/45/1062818545.db2.gz YRKWIYNHCXOESE-INIZCTEOSA-N 1 0 314.498 4.365 20 10 DICDRO C[C@H](CSc1ccccc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001460370945 1062819380 /nfs/dbraw/zinc/81/93/80/1062819380.db2.gz YRKWIYNHCXOESE-MRXNPFEDSA-N 1 0 314.498 4.365 20 10 DICDRO C[C@@H]([NH2+]CCCOc1cccc(Cl)c1)c1ccccc1O ZINC001460642332 1062957445 /nfs/dbraw/zinc/95/74/45/1062957445.db2.gz ZRSZEZWTRQIOAH-CYBMUJFWSA-N 1 0 305.805 4.165 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)cc1 ZINC001460750901 1063040108 /nfs/dbraw/zinc/04/01/08/1063040108.db2.gz RZEKPESMYRYXCL-OAHLLOKOSA-N 1 0 316.395 4.020 20 10 DICDRO COc1cc(C[NH2+]Cc2ccc(C)cc2)c(O)c(C(C)(C)C)c1 ZINC001460987813 1063168045 /nfs/dbraw/zinc/16/80/45/1063168045.db2.gz DZNLHLJNRNCKLQ-UHFFFAOYSA-N 1 0 313.441 4.297 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)CCc2ccco2)cc1F ZINC001461004255 1063181522 /nfs/dbraw/zinc/18/15/22/1063181522.db2.gz QCABJBSADUMPGJ-HNNXBMFYSA-N 1 0 318.436 4.376 20 10 DICDRO c1ccc(C2(C[NH2+]Cc3ccc4c(c3)CCO4)CCCC2)cc1 ZINC001461026618 1063199291 /nfs/dbraw/zinc/19/92/91/1063199291.db2.gz WMKNWNVSEDBQGC-UHFFFAOYSA-N 1 0 307.437 4.223 20 10 DICDRO CCCCCC[C@H](C)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001257356971 1063227519 /nfs/dbraw/zinc/22/75/19/1063227519.db2.gz DKDXPBBICBVSPB-KRWDZBQOSA-N 1 0 318.505 4.305 20 10 DICDRO CCCC[C@H](CC)[NH2+]Cc1ccc(Br)cc1O ZINC001257413368 1063261241 /nfs/dbraw/zinc/26/12/41/1063261241.db2.gz VDNNFBXSDMWZNO-ZDUSSCGKSA-N 1 0 300.240 4.213 20 10 DICDRO CCC[C@@H](C)CC[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001257463763 1063287461 /nfs/dbraw/zinc/28/74/61/1063287461.db2.gz PXIYGBJPHBPTQB-MSOLQXFVSA-N 1 0 318.505 4.218 20 10 DICDRO CCC[C@@H](C)CC[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001257463764 1063287633 /nfs/dbraw/zinc/28/76/33/1063287633.db2.gz PXIYGBJPHBPTQB-QZTJIDSGSA-N 1 0 318.505 4.218 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCOc2ccccc2C)c(Cl)c1 ZINC001461183226 1063318125 /nfs/dbraw/zinc/31/81/25/1063318125.db2.gz IMYAQXXCUWDFNI-UHFFFAOYSA-N 1 0 319.832 4.221 20 10 DICDRO CC[C@H]1CCCN(C(C)(C)C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC001461195587 1063323393 /nfs/dbraw/zinc/32/33/93/1063323393.db2.gz MTHABRUGKSVMOT-AWEZNQCLSA-N 1 0 324.896 4.036 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@H]2Cc2ccccc2)cc1 ZINC001461221822 1063342238 /nfs/dbraw/zinc/34/22/38/1063342238.db2.gz JYVIOKFLBGIQCB-TZIWHRDSSA-N 1 0 308.469 4.254 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@@H]2Cc2ccccc2)c(Cl)c1 ZINC001461219797 1063343790 /nfs/dbraw/zinc/34/37/90/1063343790.db2.gz CBKYUWOBAPUMAF-YOEHRIQHSA-N 1 0 301.817 4.075 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC2(c3cccc(F)c3)CC2)cc1 ZINC001461227512 1063349768 /nfs/dbraw/zinc/34/97/68/1063349768.db2.gz SLPMAOXDDVZZBB-PLNGDYQASA-N 1 0 324.443 4.226 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2C[C@@](C)(OC)C2(C)C)cc1C ZINC001461239092 1063357342 /nfs/dbraw/zinc/35/73/42/1063357342.db2.gz OBNQCVIZKCGRKR-PKOBYXMFSA-N 1 0 305.462 4.077 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H]1CCCSC1 ZINC001257669013 1063362482 /nfs/dbraw/zinc/36/24/82/1063362482.db2.gz YSWYYSWPMAFSDI-SUMWQHHRSA-N 1 0 305.487 4.118 20 10 DICDRO CC(C)OC1CCC([NH2+]Cc2cc3ccccc3cc2O)CC1 ZINC001257875493 1063417971 /nfs/dbraw/zinc/41/79/71/1063417971.db2.gz VSPIHXACQKFECK-UHFFFAOYSA-N 1 0 313.441 4.371 20 10 DICDRO CCOc1cc(C)ccc1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001461338486 1063428112 /nfs/dbraw/zinc/42/81/12/1063428112.db2.gz UWTYWFHZPQMRGH-UHFFFAOYSA-N 1 0 324.468 4.284 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](C)c2c(C)noc2C)cc1C ZINC001461369445 1063452598 /nfs/dbraw/zinc/45/25/98/1063452598.db2.gz FZNBSCIEBRXNTO-AWEZNQCLSA-N 1 0 316.445 4.282 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@H](OC)C2(CC)CC)cc1 ZINC001461372956 1063454053 /nfs/dbraw/zinc/45/40/53/1063454053.db2.gz HWTYZVPMTIXARL-OALUTQOASA-N 1 0 318.505 4.216 20 10 DICDRO Cc1ccccc1[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@H](C)CO1 ZINC001473174189 1063478972 /nfs/dbraw/zinc/47/89/72/1063478972.db2.gz VHKLOAHHVLFPBZ-DYESRHJHSA-N 1 0 324.468 4.023 20 10 DICDRO CC(C)C[C@@H](C)C[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001258052517 1063485945 /nfs/dbraw/zinc/48/59/45/1063485945.db2.gz QGCOOPDEQNOKJH-MSOLQXFVSA-N 1 0 318.505 4.074 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCC2CCC(OC)CC2)cc1 ZINC001461419573 1063489932 /nfs/dbraw/zinc/48/99/32/1063489932.db2.gz FENIKYCOKUTYFM-UHFFFAOYSA-N 1 0 318.505 4.218 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)cc1C ZINC001461427362 1063493985 /nfs/dbraw/zinc/49/39/85/1063493985.db2.gz VNALZHUVEUEOFZ-VQTJNVASSA-N 1 0 317.473 4.079 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](SC)C(C)(C)C)cc1 ZINC001461430229 1063496014 /nfs/dbraw/zinc/49/60/14/1063496014.db2.gz LJGORPHSLCAXSC-QGZVFWFLSA-N 1 0 308.535 4.400 20 10 DICDRO CS[C@@H](C[NH2+]Cc1c(C)c2ccccc2n1C)C(C)(C)C ZINC001461432080 1063498687 /nfs/dbraw/zinc/49/86/87/1063498687.db2.gz QVVVWPWSQZCJJY-KRWDZBQOSA-N 1 0 304.503 4.354 20 10 DICDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001461435273 1063502749 /nfs/dbraw/zinc/50/27/49/1063502749.db2.gz ADGKODOQLUCLAX-AWEZNQCLSA-N 1 0 301.352 4.078 20 10 DICDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC001461439259 1063505135 /nfs/dbraw/zinc/50/51/35/1063505135.db2.gz BHBRJZQINOYQGF-TUYSUELWSA-N 1 0 323.484 4.183 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCC1C[C@@H](C)O[C@H](C)C1 ZINC001461460317 1063520275 /nfs/dbraw/zinc/52/02/75/1063520275.db2.gz GSTYKUDRBFZITB-HUUCEWRRSA-N 1 0 314.473 4.170 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCCc2cccc(Cl)c2)cc1F ZINC001461459742 1063520368 /nfs/dbraw/zinc/52/03/68/1063520368.db2.gz IJCLOLNRXJFXNW-UHFFFAOYSA-N 1 0 320.839 4.268 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCC1C[C@H](C)O[C@@H](C)C1 ZINC001461460315 1063521198 /nfs/dbraw/zinc/52/11/98/1063521198.db2.gz GSTYKUDRBFZITB-GJZGRUSLSA-N 1 0 314.473 4.170 20 10 DICDRO C[C@H]1CC[C@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001461480984 1063530444 /nfs/dbraw/zinc/53/04/44/1063530444.db2.gz QBMXJULGDZAEBE-STQMWFEESA-N 1 0 314.395 4.297 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCCCC2(F)F)cc1 ZINC001461531837 1063564854 /nfs/dbraw/zinc/56/48/54/1063564854.db2.gz XUCFLGOSCZXNRL-JFDDCEBESA-N 1 0 308.416 4.181 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1c2ccccc2O[C@@H]1C ZINC001461553118 1063577704 /nfs/dbraw/zinc/57/77/04/1063577704.db2.gz MLSVAVFDWFSIPM-JLTOFOAXSA-N 1 0 306.409 4.099 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1c2ccccc2O[C@@H]1C ZINC001461553134 1063577780 /nfs/dbraw/zinc/57/77/80/1063577780.db2.gz MLSVAVFDWFSIPM-VLIAUNLRSA-N 1 0 306.409 4.099 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@@H]2C2CC2)ccc1OC ZINC001461577989 1063590390 /nfs/dbraw/zinc/59/03/90/1063590390.db2.gz FHJVJOGOLAYZFH-PKOBYXMFSA-N 1 0 317.473 4.148 20 10 DICDRO Fc1cccc(C2([NH2+]Cc3ccc4c(c3)CCCO4)CCC2)c1 ZINC001461592466 1063601984 /nfs/dbraw/zinc/60/19/84/1063601984.db2.gz OEYSNXRMSQDYHT-UHFFFAOYSA-N 1 0 311.400 4.320 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H](C)CC(C)(C)SC ZINC001258348298 1063621397 /nfs/dbraw/zinc/62/13/97/1063621397.db2.gz HJDXCOLNWBHVTC-OAHLLOKOSA-N 1 0 308.535 4.495 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(F)F)cc1 ZINC001461625911 1063622329 /nfs/dbraw/zinc/62/23/29/1063622329.db2.gz HXTDDHYSPIQMGJ-VBUUOAMHSA-N 1 0 322.443 4.446 20 10 DICDRO COc1cc(C[NH2+]CCCc2ccco2)c(O)c(C(C)(C)C)c1 ZINC001461656875 1063640595 /nfs/dbraw/zinc/64/05/95/1063640595.db2.gz NLCQKGOOAAFXKD-UHFFFAOYSA-N 1 0 317.429 4.014 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(C(C)(C)C)o2)cc1F ZINC001461698450 1063664265 /nfs/dbraw/zinc/66/42/65/1063664265.db2.gz RVFOUBRWWFMACF-UHFFFAOYSA-N 1 0 304.409 4.072 20 10 DICDRO CC(C)n1c2ccccc2nc1NCc1cc(F)cc(F)c1O ZINC001461724728 1063679546 /nfs/dbraw/zinc/67/95/46/1063679546.db2.gz QLGHZELYWDOPEG-UHFFFAOYSA-N 1 0 317.339 4.213 20 10 DICDRO CC(C)c1nc(C[NH2+][C@H](C)c2ccccc2O)c2ccccn21 ZINC001461731287 1063684601 /nfs/dbraw/zinc/68/46/01/1063684601.db2.gz YTNOXVYROUGZDG-CQSZACIVSA-N 1 0 309.413 4.014 20 10 DICDRO CN(C)c1ccc(CNc2nc3cc(Cl)ccc3[nH]2)cc1F ZINC001461734251 1063686011 /nfs/dbraw/zinc/68/60/11/1063686011.db2.gz YLSBWDXYUBWTPY-UHFFFAOYSA-N 1 0 318.783 4.034 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCCc3cccnc32)cc1C ZINC001461790422 1063717774 /nfs/dbraw/zinc/71/77/74/1063717774.db2.gz WYHUARNXEARNSC-GOSISDBHSA-N 1 0 310.441 4.346 20 10 DICDRO Cc1cccnc1[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001461813290 1063732593 /nfs/dbraw/zinc/73/25/93/1063732593.db2.gz ASMHORMYCXLMGF-KRWDZBQOSA-N 1 0 309.457 4.231 20 10 DICDRO C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]Cc1ccccc1O ZINC001258671651 1063740189 /nfs/dbraw/zinc/74/01/89/1063740189.db2.gz CAMMSZYLKRNFDR-LLVKDONJSA-N 1 0 310.224 4.420 20 10 DICDRO CCC[N@@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)CC1CC1 ZINC001461848040 1063747753 /nfs/dbraw/zinc/74/77/53/1063747753.db2.gz YQNGBEPPVRMPHT-UHFFFAOYSA-N 1 0 314.395 4.393 20 10 DICDRO CCCC[C@H](Cc1ccccc1)[NH2+]CCc1ccc(O)c(O)c1 ZINC001258705804 1063764660 /nfs/dbraw/zinc/76/46/60/1063764660.db2.gz LITJNHXUCHFEPX-GOSISDBHSA-N 1 0 313.441 4.031 20 10 DICDRO CC(C)C[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001461917030 1063797633 /nfs/dbraw/zinc/79/76/33/1063797633.db2.gz RQRVCGYJSBYXST-HNNXBMFYSA-N 1 0 310.432 4.431 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCCC[C@@H]2CCC(C)C)c(O)c1 ZINC001461930155 1063817344 /nfs/dbraw/zinc/81/73/44/1063817344.db2.gz STQYTTMXDMSNNT-MRXNPFEDSA-N 1 0 305.462 4.500 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCOc2ccccc2[C@@H]1C ZINC001461934308 1063820324 /nfs/dbraw/zinc/82/03/24/1063820324.db2.gz IXUZQZNJTGDIFJ-INIZCTEOSA-N 1 0 310.441 4.017 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC001461972905 1063851921 /nfs/dbraw/zinc/85/19/21/1063851921.db2.gz XZHDJVYTYQLPBH-SFHVURJKSA-N 1 0 317.816 4.009 20 10 DICDRO Cc1ccc(C[NH+]2CCC(Cc3ccc(F)cc3)CC2)c(O)c1 ZINC001461977097 1063853301 /nfs/dbraw/zinc/85/33/01/1063853301.db2.gz DITIIXRGOAKJHC-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO CCc1cccc(F)c1C[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001462027681 1063889092 /nfs/dbraw/zinc/88/90/92/1063889092.db2.gz VEFUFASBHDAQRL-UHFFFAOYSA-N 1 0 314.448 4.476 20 10 DICDRO Cc1cc(C)cc(C2=CC[N@H+](Cc3cc(F)ccc3O)CC2)c1 ZINC001462070574 1063914227 /nfs/dbraw/zinc/91/42/27/1063914227.db2.gz OZNDTRDRACKFRN-UHFFFAOYSA-N 1 0 311.400 4.437 20 10 DICDRO CO[C@@](C)([C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C)C1CC1 ZINC001261366007 1063921059 /nfs/dbraw/zinc/92/10/59/1063921059.db2.gz FLECSEGAIVCTQN-NGOJXBLDSA-N 1 0 303.446 4.042 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCC2(CCCCC2)O1 ZINC001462099671 1063929834 /nfs/dbraw/zinc/92/98/34/1063929834.db2.gz QQSXCFLMUPXQAP-LJQANCHMSA-N 1 0 316.489 4.033 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC(C)(C)[C@H]1CCCCO1 ZINC001261850074 1063949208 /nfs/dbraw/zinc/94/92/08/1063949208.db2.gz YNZWGDXGYMFMBH-BFYDXBDKSA-N 1 0 317.473 4.434 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC(C)(C)[C@H]1CCCCO1 ZINC001261850075 1063949866 /nfs/dbraw/zinc/94/98/66/1063949866.db2.gz YNZWGDXGYMFMBH-HLLBOEOZSA-N 1 0 317.473 4.434 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@H+](Cc2ccc(N)cc2)CC1 ZINC001262488324 1063966710 /nfs/dbraw/zinc/96/67/10/1063966710.db2.gz YOAATAMZCFMVKR-KRWDZBQOSA-N 1 0 310.441 4.047 20 10 DICDRO COc1ccccc1C[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000378950061 1063981062 /nfs/dbraw/zinc/98/10/62/1063981062.db2.gz GOYISZSVIXRUQS-QGZVFWFLSA-N 1 0 324.468 4.016 20 10 DICDRO c1cc(N2CCCCC2)ccc1C[NH2+]CCOC1CCCCC1 ZINC000378914350 1063981221 /nfs/dbraw/zinc/98/12/21/1063981221.db2.gz LBHDSGACXHQYEN-UHFFFAOYSA-N 1 0 316.489 4.116 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H]2CC3CCC2CC3)c1O ZINC000381984365 1063997302 /nfs/dbraw/zinc/99/73/02/1063997302.db2.gz WWJUNTPQFKILPF-PIISCBOPSA-N 1 0 323.864 4.359 20 10 DICDRO c1cc(N2CCCC2)ccc1C[NH2+]C12CC3CC(CC(C3)C1)C2 ZINC000390197664 1064150155 /nfs/dbraw/zinc/15/01/55/1064150155.db2.gz AEMDGPHRVZSEHT-UHFFFAOYSA-N 1 0 310.485 4.345 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC(C)(C)[C@H]3CCC[C@H]32)c1[O-] ZINC000393537365 1064284986 /nfs/dbraw/zinc/28/49/86/1064284986.db2.gz BAMZZTANBVZAGO-JKSUJKDBSA-N 1 0 321.848 4.259 20 10 DICDRO Oc1cccc(Cl)c1CNCc1coc(-c2cccs2)n1 ZINC000733325291 1064606227 /nfs/dbraw/zinc/60/62/27/1064606227.db2.gz CAJOQOMARVQXJF-UHFFFAOYSA-N 1 0 320.801 4.052 20 10 DICDRO CCC(C)(CC)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000734846373 1064689818 /nfs/dbraw/zinc/68/98/18/1064689818.db2.gz SZRHYOGWFXMDCA-UHFFFAOYSA-N 1 0 319.449 4.253 20 10 DICDRO Cc1cc(F)ccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001307424481 1065386557 /nfs/dbraw/zinc/38/65/57/1065386557.db2.gz RWANOEGYMOJYGM-UHFFFAOYSA-N 1 0 312.432 4.365 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](C)c1ccc(OC)cc1 ZINC001307502421 1065446959 /nfs/dbraw/zinc/44/69/59/1065446959.db2.gz WTJLNSPLMVHGAH-INIZCTEOSA-N 1 0 313.441 4.417 20 10 DICDRO CCOc1ccc(N2CC[NH+](C[C@H](C)CC(C)(C)C)CC2)cc1 ZINC001307600014 1065507910 /nfs/dbraw/zinc/50/79/10/1065507910.db2.gz RIEMZJCEVOJCDN-QGZVFWFLSA-N 1 0 318.505 4.280 20 10 DICDRO Cc1cc(C[NH2+][C@@]2(C)CCCc3ccccc32)ccc1N(C)C ZINC001307607251 1065511800 /nfs/dbraw/zinc/51/18/00/1065511800.db2.gz CHRNWDFRMFXZCA-NRFANRHFSA-N 1 0 308.469 4.402 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)ccc1N(C)C ZINC001307785163 1065619360 /nfs/dbraw/zinc/61/93/60/1065619360.db2.gz YUKSJZMFEKLVQD-FQEVSTJZSA-N 1 0 308.469 4.441 20 10 DICDRO COCCCCCN1C[C@H](C(C)C)Cc2cc(OC)ccc21 ZINC001307862209 1065657990 /nfs/dbraw/zinc/65/79/90/1065657990.db2.gz RVCPYHYVRPBIJJ-QGZVFWFLSA-N 1 0 305.462 4.147 20 10 DICDRO COc1ccc2c(c1)C[C@H](C(C)C)CN2CCCCCCCO ZINC001307864099 1065658086 /nfs/dbraw/zinc/65/80/86/1065658086.db2.gz OGUHOBDHPOETBE-SFHVURJKSA-N 1 0 319.489 4.273 20 10 DICDRO C[C@H]([NH2+]CCCOc1cccc(Cl)c1)c1ccccc1O ZINC001308010791 1065724101 /nfs/dbraw/zinc/72/41/01/1065724101.db2.gz ZRSZEZWTRQIOAH-ZDUSSCGKSA-N 1 0 305.805 4.165 20 10 DICDRO C[C@@H]([NH2+]CCSc1cccc(Cl)c1)c1ccccc1O ZINC001308010562 1065724688 /nfs/dbraw/zinc/72/46/88/1065724688.db2.gz RVNMHBQWPOGYRS-GFCCVEGCSA-N 1 0 307.846 4.489 20 10 DICDRO Cc1cc(C)c(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)c(C)c1 ZINC001308230242 1065836846 /nfs/dbraw/zinc/83/68/46/1065836846.db2.gz WMAZIFPDJZTGIB-SREVYHEPSA-N 1 0 308.469 4.481 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001308232831 1065838638 /nfs/dbraw/zinc/83/86/38/1065838638.db2.gz VSTXFPWGIQRPJO-HNNXBMFYSA-N 1 0 311.425 4.261 20 10 DICDRO C/C(=C/c1ccc(Cl)cc1)C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001308235671 1065843314 /nfs/dbraw/zinc/84/33/14/1065843314.db2.gz HTPJXHNNRPJGPW-UVTDQMKNSA-N 1 0 313.828 4.468 20 10 DICDRO c1ccc2c(c1)CSC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001308259079 1065860678 /nfs/dbraw/zinc/86/06/78/1065860678.db2.gz LECUUCKIRXLFPF-FQEVSTJZSA-N 1 0 324.493 4.365 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](CCCO)c1ccccc1 ZINC001308279794 1065878747 /nfs/dbraw/zinc/87/87/47/1065878747.db2.gz UYPYLHAZUOPGNS-LJQANCHMSA-N 1 0 322.452 4.090 20 10 DICDRO Cc1cc(C)cc(C[C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001308290936 1065886984 /nfs/dbraw/zinc/88/69/84/1065886984.db2.gz SDWSJHBKVMWRCI-QGZVFWFLSA-N 1 0 309.453 4.349 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC2(C)CCC2)c(C(F)(F)F)c1 ZINC001308295837 1065892638 /nfs/dbraw/zinc/89/26/38/1065892638.db2.gz WPIBQJYOVHCXNY-UHFFFAOYSA-N 1 0 300.368 4.051 20 10 DICDRO CC(C)C[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001308342833 1065928361 /nfs/dbraw/zinc/92/83/61/1065928361.db2.gz MMZAPTGEFGUGDW-LBPRGKRZSA-N 1 0 302.384 4.296 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@@H](C)CC2)ccc1OC ZINC001308375317 1065950229 /nfs/dbraw/zinc/95/02/29/1065950229.db2.gz WTVSCZPXTLJKMD-CRAIPNDOSA-N 1 0 305.462 4.290 20 10 DICDRO Cc1ccc2c(CC[NH2+]Cc3ccc4c(c3)CCCO4)c[nH]c2c1 ZINC001308377144 1065951257 /nfs/dbraw/zinc/95/12/57/1065951257.db2.gz WHDYQYNUVFDNLP-UHFFFAOYSA-N 1 0 320.436 4.134 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@]2(C)CC2(Cl)Cl)cc1 ZINC001308409919 1065970519 /nfs/dbraw/zinc/97/05/19/1065970519.db2.gz YCFYKPJAPYRETQ-HNNXBMFYSA-N 1 0 315.288 4.206 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](C)C2(OC)CCC2)cc1 ZINC001308439367 1065988918 /nfs/dbraw/zinc/98/89/18/1065988918.db2.gz MNVYNKAGTWCCCH-KRWDZBQOSA-N 1 0 318.505 4.360 20 10 DICDRO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001308444386 1065992497 /nfs/dbraw/zinc/99/24/97/1065992497.db2.gz YXHINEXQACNOJO-LEWJYISDSA-N 1 0 324.443 4.404 20 10 DICDRO Cc1cc[nH+]c(NCc2ccc(N3CCCC3)cc2)c1C1CC1 ZINC001308458995 1066001801 /nfs/dbraw/zinc/00/18/01/1066001801.db2.gz MCSFBMKNHZPBBD-UHFFFAOYSA-N 1 0 307.441 4.480 20 10 DICDRO CC(C)Cc1ccccc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001308473843 1066013901 /nfs/dbraw/zinc/01/39/01/1066013901.db2.gz RTAUGDWABAKBTK-UHFFFAOYSA-N 1 0 314.448 4.380 20 10 DICDRO COc1cc(C[NH2+]CC[C@@H]2C[C@H]2C2CC2)c(O)c(C(C)(C)C)c1 ZINC001308520463 1066042645 /nfs/dbraw/zinc/04/26/45/1066042645.db2.gz LOTMAOLWTARBCH-PBHICJAKSA-N 1 0 317.473 4.224 20 10 DICDRO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001308524761 1066045434 /nfs/dbraw/zinc/04/54/34/1066045434.db2.gz OQPXIUNYKXRCRZ-FQEVSTJZSA-N 1 0 310.416 4.203 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1Cl ZINC001308594814 1066106683 /nfs/dbraw/zinc/10/66/83/1066106683.db2.gz RPOUIBFOZCCBNG-GOEBONIOSA-N 1 0 311.878 4.214 20 10 DICDRO CCC[N@H+](Cc1cc(C(C)C)ccc1O)[C@@H](CC)C(=O)OCC ZINC001308685913 1066155140 /nfs/dbraw/zinc/15/51/40/1066155140.db2.gz KRYZNGUCELZARZ-KRWDZBQOSA-N 1 0 321.461 4.069 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC001308689257 1066181461 /nfs/dbraw/zinc/18/14/61/1066181461.db2.gz SBWPMOSXVAGEGY-UHFFFAOYSA-N 1 0 320.839 4.486 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1cccc(CC)c1O ZINC001308714659 1066195809 /nfs/dbraw/zinc/19/58/09/1066195809.db2.gz IGVUHFJWEIFBEO-UHFFFAOYSA-N 1 0 313.441 4.463 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)cc1Cl ZINC001308715985 1066195843 /nfs/dbraw/zinc/19/58/43/1066195843.db2.gz RPFHHCYBKQBVCI-STQMWFEESA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1C[C@H](c2cccc(F)c2)C1 ZINC001308721637 1066198675 /nfs/dbraw/zinc/19/86/75/1066198675.db2.gz QZEGLJCCGAAOOE-UAPYVXQJSA-N 1 0 312.432 4.236 20 10 DICDRO CC(C)[N@@H+](Cc1c(O)cccc1Br)CC1CCC1 ZINC001308722719 1066198844 /nfs/dbraw/zinc/19/88/44/1066198844.db2.gz BZOBEFHMBNWCRG-UHFFFAOYSA-N 1 0 312.251 4.165 20 10 DICDRO CCc1cccc(CNc2ccc(Cl)c(C[NH+](C)C)c2)c1O ZINC001308720242 1066198975 /nfs/dbraw/zinc/19/89/75/1066198975.db2.gz KJTHTMFJIAEGLF-UHFFFAOYSA-N 1 0 318.848 4.282 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc(Cl)cc1O)[C@H](O)c1ccccc1 ZINC001308736038 1066210765 /nfs/dbraw/zinc/21/07/65/1066210765.db2.gz NBLFNTPPPJUWSQ-SJLPKXTDSA-N 1 0 319.832 4.038 20 10 DICDRO CCCN(Cc1cc(C)nc2c1CCCC2)c1ccc(C[NH3+])cc1 ZINC001308741760 1066216240 /nfs/dbraw/zinc/21/62/40/1066216240.db2.gz YVVGAUSCBPHITI-UHFFFAOYSA-N 1 0 323.484 4.144 20 10 DICDRO COc1cc(C)c(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2)c(O)c1 ZINC001308753236 1066226678 /nfs/dbraw/zinc/22/66/78/1066226678.db2.gz MOBDIDUZNXQABI-KUHUBIRLSA-N 1 0 311.425 4.292 20 10 DICDRO CN(C)c1ccc(C[NH2+]C(C)(C)C2CCC2)c(C(F)(F)F)c1 ZINC001308773679 1066247943 /nfs/dbraw/zinc/24/79/43/1066247943.db2.gz IXBFYVTZNHRAKW-UHFFFAOYSA-N 1 0 314.395 4.440 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@@H](Oc3ccc(Cl)cc3)C2)c(O)c1 ZINC001308788125 1066261973 /nfs/dbraw/zinc/26/19/73/1066261973.db2.gz FHNHNFLYOTXOPE-QGZVFWFLSA-N 1 0 317.816 4.007 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c(O)c1 ZINC001308792860 1066269222 /nfs/dbraw/zinc/26/92/22/1066269222.db2.gz SDUVGPRLXRERRO-FQEVSTJZSA-N 1 0 323.436 4.436 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccccc2)c(O)c1 ZINC001308792861 1066269264 /nfs/dbraw/zinc/26/92/64/1066269264.db2.gz SDUVGPRLXRERRO-HXUWFJFHSA-N 1 0 323.436 4.436 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(C3CCC3)CC2)c(C(F)(F)F)c1 ZINC001308845194 1066320143 /nfs/dbraw/zinc/32/01/43/1066320143.db2.gz FTPQSZIKGIDMIM-UHFFFAOYSA-N 1 0 312.379 4.194 20 10 DICDRO CC(C)(F)CC[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC001308854173 1066332416 /nfs/dbraw/zinc/33/24/16/1066332416.db2.gz DULYBOWRQSMSJB-UHFFFAOYSA-N 1 0 317.404 4.199 20 10 DICDRO Oc1c(C[NH2+]CC[C@@H]2CCC3(CCC3)O2)ccc2ccccc21 ZINC001308952925 1066416909 /nfs/dbraw/zinc/41/69/09/1066416909.db2.gz PJQPOQQKMORKAZ-KRWDZBQOSA-N 1 0 311.425 4.127 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)c1O ZINC000076761619 185039620 /nfs/dbraw/zinc/03/96/20/185039620.db2.gz OGGVHNIIUSNCLA-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO C[C@@H](O)CC(C)(C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000090085982 185281183 /nfs/dbraw/zinc/28/11/83/185281183.db2.gz UQOJBBXKMITMFC-IAGOWNOFSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@H](O)CC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000090085975 185281213 /nfs/dbraw/zinc/28/12/13/185281213.db2.gz UQOJBBXKMITMFC-IRXDYDNUSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCSc2ccccc21)c1cc(F)ccc1O ZINC000094617492 193385060 /nfs/dbraw/zinc/38/50/60/193385060.db2.gz SMJBCDSBQRBYOZ-IAQYHMDHSA-N 1 0 303.402 4.419 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c1 ZINC000021502073 182274731 /nfs/dbraw/zinc/27/47/31/182274731.db2.gz GPGBAIAGNSQSPX-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2cccc(OC(F)F)c2)c1 ZINC000103855278 193961210 /nfs/dbraw/zinc/96/12/10/193961210.db2.gz SFDIRVSYNRHJGK-GFCCVEGCSA-N 1 0 307.340 4.153 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCOC)c1ccco1)c1ccc(N(C)C)cc1 ZINC000272626640 130048914 /nfs/dbraw/zinc/04/89/14/130048914.db2.gz ZNJMSBNLMAVIGZ-MSOLQXFVSA-N 1 0 316.445 4.164 20 10 DICDRO COc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000273430392 130120734 /nfs/dbraw/zinc/12/07/34/130120734.db2.gz VLHPDOJSFDSIII-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c(O)c1C ZINC000273470693 130125216 /nfs/dbraw/zinc/12/52/16/130125216.db2.gz JNWOVDUQTAQRHJ-DYVFJYSZSA-N 1 0 315.388 4.323 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCOC3(CCCCC3)C2)c1 ZINC000273489321 130127745 /nfs/dbraw/zinc/12/77/45/130127745.db2.gz NWXIOGZVJYTUQL-CVEARBPZSA-N 1 0 303.446 4.233 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273492599 130127752 /nfs/dbraw/zinc/12/77/52/130127752.db2.gz XBWXVZPLXJYGJD-BXUZGUMPSA-N 1 0 304.459 4.228 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000273505255 130129727 /nfs/dbraw/zinc/12/97/27/130129727.db2.gz QXOVAMYVYOHMQK-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc2ccccc2c1O ZINC000273516548 130131130 /nfs/dbraw/zinc/13/11/30/130131130.db2.gz SNYGZOFNQIZENX-GDBMZVCRSA-N 1 0 311.425 4.298 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1cc2c(cc1O)CCCC2 ZINC000273528130 130132263 /nfs/dbraw/zinc/13/22/63/130132263.db2.gz VVHLMRHAUXRBRD-PBHICJAKSA-N 1 0 315.457 4.023 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(O)c1C ZINC000273521629 130132870 /nfs/dbraw/zinc/13/28/70/130132870.db2.gz UNZIYUMWSHKMGC-ZIAGYGMSSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1csc(C2([NH2+][C@@H](C)c3cc(C)ccc3O)CCC2)n1 ZINC000273542900 130135054 /nfs/dbraw/zinc/13/50/54/130135054.db2.gz YQYKNKAUOVRCLM-ZDUSSCGKSA-N 1 0 302.443 4.196 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000275269755 130301728 /nfs/dbraw/zinc/30/17/28/130301728.db2.gz BQPABJCMMYZXNQ-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](CCCO)c2ccccc2)c(O)c1 ZINC000283912715 131033545 /nfs/dbraw/zinc/03/35/45/131033545.db2.gz DIEALVLXLNNHMT-AEFFLSMTSA-N 1 0 313.441 4.173 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)c1cn[nH]c1 ZINC000283979210 131037917 /nfs/dbraw/zinc/03/79/17/131037917.db2.gz GWKNUZQDXLRZMC-HNNXBMFYSA-N 1 0 312.461 4.029 20 10 DICDRO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CCC2 ZINC000284193680 131057962 /nfs/dbraw/zinc/05/79/62/131057962.db2.gz RUJUGCBQMTYGKN-NRFANRHFSA-N 1 0 322.452 4.160 20 10 DICDRO Cc1csc([C@@H](C)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)n1 ZINC000284946591 131125613 /nfs/dbraw/zinc/12/56/13/131125613.db2.gz DZLHDAVYSIERAM-GXTWGEPZSA-N 1 0 304.459 4.228 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)s1 ZINC000285402815 131165480 /nfs/dbraw/zinc/16/54/80/131165480.db2.gz XIAKWGSIGDYKAP-OCCSQVGLSA-N 1 0 304.459 4.228 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cncc2F)c(O)c1C ZINC000285540113 131178985 /nfs/dbraw/zinc/17/89/85/131178985.db2.gz DEPGWXNBLHGGKU-NEPJUHHUSA-N 1 0 306.356 4.094 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1cccc(Cl)c1 ZINC000290256177 131470320 /nfs/dbraw/zinc/47/03/20/131470320.db2.gz KFEGKHRKQAMRKE-BZNIZROVSA-N 1 0 323.795 4.223 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297144882 132001623 /nfs/dbraw/zinc/00/16/23/132001623.db2.gz ZRTPFEPZIVKPHI-DLBZAZTESA-N 1 0 309.409 4.055 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(N(C)C)cc1 ZINC000297340830 132011141 /nfs/dbraw/zinc/01/11/41/132011141.db2.gz OMPUMAAACMJYOE-INIZCTEOSA-N 1 0 321.827 4.181 20 10 DICDRO CC(F)(F)c1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000297361414 132011892 /nfs/dbraw/zinc/01/18/92/132011892.db2.gz PTFFVXXPQXSGSX-HNNXBMFYSA-N 1 0 303.352 4.281 20 10 DICDRO COC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccc(Cl)c1 ZINC000297472022 132017474 /nfs/dbraw/zinc/01/74/74/132017474.db2.gz YRBZUQHCIZTLAF-JKSUJKDBSA-N 1 0 317.816 4.010 20 10 DICDRO CCOCc1cc(C[NH2+]C(C)(C)c2ccccc2)ccc1OC ZINC000299469478 132106987 /nfs/dbraw/zinc/10/69/87/132106987.db2.gz NTUCELXWJAXYPD-UHFFFAOYSA-N 1 0 313.441 4.257 20 10 DICDRO C[C@H]([NH2+]Cc1cccc2cccnc21)c1ccc(N(C)C)cc1 ZINC000120501734 132144441 /nfs/dbraw/zinc/14/44/41/132144441.db2.gz NXZINXZTCRJSNZ-HNNXBMFYSA-N 1 0 305.425 4.152 20 10 DICDRO Cc1cccc(C[NH2+]C(C)(C)c2nc3ccccc3s2)c1O ZINC000529641276 331613662 /nfs/dbraw/zinc/61/36/62/331613662.db2.gz OXKTZXRTIMBEIJ-UHFFFAOYSA-N 1 0 312.438 4.335 20 10 DICDRO COCc1cccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)c1 ZINC000077289194 331673714 /nfs/dbraw/zinc/67/37/14/331673714.db2.gz HXBWBVSROBQZJY-UHFFFAOYSA-N 1 0 324.468 4.113 20 10 DICDRO Cc1cnc(CN(Cc2ccccc2O)[C@H](C)c2ccccc2)o1 ZINC000119287229 332368555 /nfs/dbraw/zinc/36/85/55/332368555.db2.gz ZVUPWGREWUFNJG-MRXNPFEDSA-N 1 0 322.408 4.452 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccccc1 ZINC000186034258 333216517 /nfs/dbraw/zinc/21/65/17/333216517.db2.gz YWMRGMLRZIWBLY-LRDDRELGSA-N 1 0 305.805 4.084 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000119558130 333255014 /nfs/dbraw/zinc/25/50/14/333255014.db2.gz OPFLNQLITUALPH-INIZCTEOSA-N 1 0 312.457 4.140 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccccc1O ZINC000120564956 333290509 /nfs/dbraw/zinc/29/05/09/333290509.db2.gz IHMDNZWNASPHKG-OAHLLOKOSA-N 1 0 307.340 4.235 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1O ZINC000297316786 335152904 /nfs/dbraw/zinc/15/29/04/335152904.db2.gz NBMASGUTBAWCOI-SUMWQHHRSA-N 1 0 314.385 4.411 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)cc1 ZINC000274946516 334067951 /nfs/dbraw/zinc/06/79/51/334067951.db2.gz UMRYKMWDUUJLGP-AWEZNQCLSA-N 1 0 317.864 4.432 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCSc3ccccc32)c1 ZINC000192834913 336265216 /nfs/dbraw/zinc/26/52/16/336265216.db2.gz KGZOPCJDLYQYOR-LRDDRELGSA-N 1 0 315.438 4.289 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3cnn(C(C)C)c32)c1 ZINC000375171310 337005135 /nfs/dbraw/zinc/00/51/35/337005135.db2.gz OCMLDNRTERCULZ-WMLDXEAASA-N 1 0 313.445 4.206 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)c(O)c1 ZINC000375243581 337006368 /nfs/dbraw/zinc/00/63/68/337006368.db2.gz ZEILGHORVLQRNX-XAUMDUMWSA-N 1 0 311.425 4.129 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)c(O)c1 ZINC000375243578 337006491 /nfs/dbraw/zinc/00/64/91/337006491.db2.gz ZEILGHORVLQRNX-KNBMTAEXSA-N 1 0 311.425 4.129 20 10 DICDRO C[C@@H]([NH2+]C1CCN([C@H](C)c2ccccc2)CC1)c1ccccc1O ZINC000183516870 337192044 /nfs/dbraw/zinc/19/20/44/337192044.db2.gz NMWBZLASDVNNLP-IAGOWNOFSA-N 1 0 324.468 4.268 20 10 DICDRO Cc1[nH]c2ccc(F)cc2c1CC[NH2+][C@@H](C)c1ccccc1O ZINC000527998332 337779117 /nfs/dbraw/zinc/77/91/17/337779117.db2.gz YILQWAKKTODVLO-LBPRGKRZSA-N 1 0 312.388 4.214 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](c1cncc(F)c1)C1CC1 ZINC000467366888 339234397 /nfs/dbraw/zinc/23/43/97/339234397.db2.gz BKGWPCWZLISALG-HXUWFJFHSA-N 1 0 323.415 4.262 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000475201669 339441447 /nfs/dbraw/zinc/44/14/47/339441447.db2.gz JJAMHTYYYGDLQV-SUMWQHHRSA-N 1 0 308.425 4.493 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](c1cccnc1)C(C)C ZINC000479433121 339534832 /nfs/dbraw/zinc/53/48/32/339534832.db2.gz YENNEXRYYQVMHC-FQEVSTJZSA-N 1 0 307.441 4.369 20 10 DICDRO CC(C)(C)OCc1cccc(C[NH2+]Cc2cc(F)ccc2O)c1 ZINC000180567985 518883134 /nfs/dbraw/zinc/88/31/34/518883134.db2.gz NKQGJUOWCVEYGC-UHFFFAOYSA-N 1 0 317.404 4.136 20 10 DICDRO CCCOCc1ccccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185063052 520260951 /nfs/dbraw/zinc/26/09/51/520260951.db2.gz GDROFTQLCZVFEI-AWEZNQCLSA-N 1 0 317.404 4.309 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc(COC)c2)cc1 ZINC000158522260 520284183 /nfs/dbraw/zinc/28/41/83/520284183.db2.gz NNXCMFKYQDTVSL-MRXNPFEDSA-N 1 0 312.457 4.140 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)c2nccs2)cc1 ZINC000186747080 520287475 /nfs/dbraw/zinc/28/74/75/520287475.db2.gz CGKLLUKDWOXKJZ-KGLIPLIRSA-N 1 0 303.475 4.054 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc(COC)c2)cc1 ZINC000158522398 520288246 /nfs/dbraw/zinc/28/82/46/520288246.db2.gz NNXCMFKYQDTVSL-INIZCTEOSA-N 1 0 312.457 4.140 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](CC)c2ccccc2O)cc1F ZINC000155726167 521007468 /nfs/dbraw/zinc/00/74/68/521007468.db2.gz HEPCWBCSHUKZQD-INIZCTEOSA-N 1 0 303.377 4.171 20 10 DICDRO CCOC1CC(CC[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000189266832 521645791 /nfs/dbraw/zinc/64/57/91/521645791.db2.gz HWYHCZIGMSSNLF-UQPPLGOBSA-N 1 0 313.441 4.401 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(Cl)cn1)c1ccc(N(C)C)cc1 ZINC000182121427 522644373 /nfs/dbraw/zinc/64/43/73/522644373.db2.gz ZBDVNHKAPYGOMH-KRWDZBQOSA-N 1 0 303.837 4.042 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)C[C@H](O)c1cccs1)c1ccccc1O ZINC000156420281 522692893 /nfs/dbraw/zinc/69/28/93/522692893.db2.gz OCYBNUOPJOGYDS-NOLJZWGESA-N 1 0 305.443 4.007 20 10 DICDRO CC[C@H]([NH2+][C@H](C)C[C@H](O)c1cccs1)c1ccccc1O ZINC000156420505 522734539 /nfs/dbraw/zinc/73/45/39/522734539.db2.gz OCYBNUOPJOGYDS-INWMFGNUSA-N 1 0 305.443 4.007 20 10 DICDRO CC[C@H]([NH2+][C@H](COC)c1ccc(F)c(F)c1)c1ccccc1O ZINC000157028285 522748727 /nfs/dbraw/zinc/74/87/27/522748727.db2.gz YHINSEFUNHQRTA-DLBZAZTESA-N 1 0 321.367 4.099 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3cccs3)CC2)cc1 ZINC000154493052 524403655 /nfs/dbraw/zinc/40/36/55/524403655.db2.gz REJURBUHIBHDDD-AWEZNQCLSA-N 1 0 316.470 4.076 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3ccc(F)cc32)c1 ZINC000182381173 524764973 /nfs/dbraw/zinc/76/49/73/524764973.db2.gz BWXDMOAIWPFLHC-KZULUSFZSA-N 1 0 315.388 4.268 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000182414440 524771439 /nfs/dbraw/zinc/77/14/39/524771439.db2.gz KLLAUHXFQIUPBG-NSHDSACASA-N 1 0 320.458 4.006 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1ccccn1 ZINC000159067413 525445005 /nfs/dbraw/zinc/44/50/05/525445005.db2.gz UEHFLYPQVQYJFM-KRWDZBQOSA-N 1 0 309.457 4.169 20 10 DICDRO C[C@@H]([NH2+]Cc1ccn(C)c1)c1ccc(N2CCCCC2)c(F)c1 ZINC000158461659 525543548 /nfs/dbraw/zinc/54/35/48/525543548.db2.gz XSJWKQVWYIYDOA-OAHLLOKOSA-N 1 0 315.436 4.005 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(N2CCCCC2)cc1 ZINC000158551425 525617570 /nfs/dbraw/zinc/61/75/70/525617570.db2.gz GAGJYJAOWWGIHD-SJORKVTESA-N 1 0 309.457 4.484 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000158129872 525624765 /nfs/dbraw/zinc/62/47/65/525624765.db2.gz YSPWOLNXFIPPTH-LRQRDZAKSA-N 1 0 324.468 4.324 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(OC(F)F)cc1 ZINC000179874590 525662248 /nfs/dbraw/zinc/66/22/48/525662248.db2.gz ZRJRMMISVSDDJB-VXGBXAGGSA-N 1 0 307.340 4.405 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1cc(F)ccc1O ZINC000186507009 525678039 /nfs/dbraw/zinc/67/80/39/525678039.db2.gz GRSLPIINCYNYGZ-BZNIZROVSA-N 1 0 319.351 4.235 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCO[C@H](C2CC2)C1)c1ccc2ccccc2c1O ZINC000157635229 525686575 /nfs/dbraw/zinc/68/65/75/525686575.db2.gz ZWVVJKVWGMBIFS-AZOIQLNYSA-N 1 0 311.425 4.154 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1nc(C)cs1 ZINC000294373462 535805845 /nfs/dbraw/zinc/80/58/45/535805845.db2.gz BCTYGOOBYSNEGL-OAHLLOKOSA-N 1 0 303.475 4.067 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1F ZINC000273437051 536896666 /nfs/dbraw/zinc/89/66/66/536896666.db2.gz XDSVZVAJRDXUEP-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCSC(F)(F)F)cc1 ZINC000765240875 1055341689 /nfs/dbraw/zinc/34/16/89/1055341689.db2.gz YQZXVSUJOWYRFU-LLVKDONJSA-N 1 0 306.397 4.046 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@@H]3C3CCC3)c2c1 ZINC000728199595 1035726042 /nfs/dbraw/zinc/72/60/42/1035726042.db2.gz NFNRVQWNRXQADT-LJQANCHMSA-N 1 0 311.425 4.319 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(O)c1)c1ccc(N2CCCCC2)cc1 ZINC000154391521 1035885608 /nfs/dbraw/zinc/88/56/08/1035885608.db2.gz VCXXNFIVRXWUMF-MRXNPFEDSA-N 1 0 310.441 4.233 20 10 DICDRO COc1ccc(N2CCC[N@H+](CCCC(C)(C)C)CC2)cc1 ZINC001167107377 1036089065 /nfs/dbraw/zinc/08/90/65/1036089065.db2.gz BZYPIPGTZWMFBV-UHFFFAOYSA-N 1 0 304.478 4.034 20 10 DICDRO Oc1ccccc1C[N@@H+](C[C@@H](O)CC1CCCC1)C1CCCC1 ZINC001167353938 1036952857 /nfs/dbraw/zinc/95/28/57/1036952857.db2.gz SQFQSTYRUZDWQM-IBGZPJMESA-N 1 0 317.473 4.078 20 10 DICDRO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000160555316 1037210335 /nfs/dbraw/zinc/21/03/35/1037210335.db2.gz HZEGDEVQWRGNPF-ZDUSSCGKSA-N 1 0 318.848 4.265 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001140341355 1037482704 /nfs/dbraw/zinc/48/27/04/1037482704.db2.gz JGLGIVCHKQFBCC-ZDUSSCGKSA-N 1 0 305.780 4.174 20 10 DICDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1c(O)cccc1Br ZINC000706854346 1037502239 /nfs/dbraw/zinc/50/22/39/1037502239.db2.gz ZGUKBTZHEZAVIA-SNVBAGLBSA-N 1 0 300.240 4.069 20 10 DICDRO C[C@H]([NH2+]Cc1c(O)cccc1Br)c1ccccc1 ZINC000706852049 1037503048 /nfs/dbraw/zinc/50/30/48/1037503048.db2.gz KDGCXYYCIHQVSP-NSHDSACASA-N 1 0 306.203 4.006 20 10 DICDRO CCCc1ncc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000834898206 1037727671 /nfs/dbraw/zinc/72/76/71/1037727671.db2.gz ACVJQEVBOBHCDD-NSHDSACASA-N 1 0 308.809 4.145 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)C/C(C)=C/c2ccccc2)c1O ZINC000754858118 1038174629 /nfs/dbraw/zinc/17/46/29/1038174629.db2.gz QVBMIJQZECSNBY-MHWRWJLKSA-N 1 0 311.425 4.245 20 10 DICDRO CCCN(Cc1nc(C(C)(C)C)co1)Cc1ccccc1O ZINC000891853207 1038236578 /nfs/dbraw/zinc/23/65/78/1038236578.db2.gz FASXFBULJLVVRO-UHFFFAOYSA-N 1 0 302.418 4.090 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2CCC(F)(F)CC2)cc1F ZINC000761337339 1038274827 /nfs/dbraw/zinc/27/48/27/1038274827.db2.gz SVEOVSMAXROOBJ-UHFFFAOYSA-N 1 0 314.395 4.339 20 10 DICDRO C[C@@H](Cc1ccsc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000048557000 1038667681 /nfs/dbraw/zinc/66/76/81/1038667681.db2.gz XQQBDGTZKQBQEV-HNNXBMFYSA-N 1 0 300.471 4.069 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccccc2Br)cc1C ZINC000048820119 1038670054 /nfs/dbraw/zinc/67/00/54/1038670054.db2.gz UHVVCDGJSQHCAU-UHFFFAOYSA-N 1 0 320.230 4.056 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000112536835 1038686348 /nfs/dbraw/zinc/68/63/48/1038686348.db2.gz OGXLDOLMQOIFGF-UWJYYQICSA-N 1 0 324.468 4.325 20 10 DICDRO CC[C@@H]([NH2+]Cc1sc(C)nc1C)c1ccc(N(C)C)cc1 ZINC000119847039 1038949837 /nfs/dbraw/zinc/94/98/37/1038949837.db2.gz UPRYYPMHAIICGU-MRXNPFEDSA-N 1 0 303.475 4.067 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2sc(C)nc2C)cc1 ZINC000119816996 1038950457 /nfs/dbraw/zinc/95/04/57/1038950457.db2.gz PRHKSSNSBFYBRR-GFCCVEGCSA-N 1 0 303.475 4.067 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)Cc2cccs2)cc1 ZINC000035253928 1039084525 /nfs/dbraw/zinc/08/45/25/1039084525.db2.gz MKQPACTWYTYXKY-OAHLLOKOSA-N 1 0 302.487 4.315 20 10 DICDRO CCC[C@@H]1CCC[N@H+](Cc2ccc(Br)cc2O)C1 ZINC000708481335 1039655609 /nfs/dbraw/zinc/65/56/09/1039655609.db2.gz CGKNXBPYXCOEIC-GFCCVEGCSA-N 1 0 312.251 4.167 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2c(C)noc2C)cc1F ZINC000152254763 1040006839 /nfs/dbraw/zinc/00/68/39/1040006839.db2.gz MWQDFRNGTOSQKT-GFCCVEGCSA-N 1 0 319.424 4.128 20 10 DICDRO COc1ccc(C[NH2+]CC(C)(C)c2ccc(F)cc2)cc1C ZINC000728595260 1040045011 /nfs/dbraw/zinc/04/50/11/1040045011.db2.gz VXXFHFRPPHGZDI-UHFFFAOYSA-N 1 0 301.405 4.210 20 10 DICDRO Cc1cccc(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)n1 ZINC000280062089 1040129673 /nfs/dbraw/zinc/12/96/73/1040129673.db2.gz KJVFKOHROLKCEL-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1O ZINC000309943566 1040354987 /nfs/dbraw/zinc/35/49/87/1040354987.db2.gz PEXDVUFPRVSJDN-AZUAARDMSA-N 1 0 324.468 4.098 20 10 DICDRO Cc1cc(CC[NH2+]Cc2ccccc2O)c(C)n1-c1ccccc1 ZINC000725844274 1040617756 /nfs/dbraw/zinc/61/77/56/1040617756.db2.gz QMQDLNLULOOPFX-UHFFFAOYSA-N 1 0 320.436 4.132 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cc(F)cc(F)c1 ZINC000177974780 1040847573 /nfs/dbraw/zinc/84/75/73/1040847573.db2.gz NGUOGSYBAFSPCX-AWEZNQCLSA-N 1 0 316.395 4.416 20 10 DICDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808697698 1041007812 /nfs/dbraw/zinc/00/78/12/1041007812.db2.gz RRKBATHKLOQXSZ-GHMZBOCLSA-N 1 0 322.836 4.241 20 10 DICDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808697700 1041007950 /nfs/dbraw/zinc/00/79/50/1041007950.db2.gz RRKBATHKLOQXSZ-QWRGUYRKSA-N 1 0 322.836 4.241 20 10 DICDRO CCc1cnc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808699550 1041009333 /nfs/dbraw/zinc/00/93/33/1041009333.db2.gz JTFLMRKSJUBOFH-SNVBAGLBSA-N 1 0 310.850 4.224 20 10 DICDRO COC1CCC(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000808700672 1041009577 /nfs/dbraw/zinc/00/95/77/1041009577.db2.gz JRBQCGBLFMVMQB-DNOWBOINSA-N 1 0 311.853 4.210 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808701819 1041010000 /nfs/dbraw/zinc/01/00/00/1041010000.db2.gz JVYBAFCRBDGEPZ-LLVKDONJSA-N 1 0 322.836 4.318 20 10 DICDRO CCC(CC)(CCO)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808701137 1041011148 /nfs/dbraw/zinc/01/11/48/1041011148.db2.gz XATJBRGLFKEXSK-ZDUSSCGKSA-N 1 0 313.869 4.193 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1cccc(Cl)c1 ZINC000808732364 1041018497 /nfs/dbraw/zinc/01/84/97/1041018497.db2.gz JYUBMZYOACSUEH-SUMWQHHRSA-N 1 0 319.832 4.392 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1cccc(Cl)c1 ZINC000808733582 1041020072 /nfs/dbraw/zinc/02/00/72/1041020072.db2.gz YHIGMABKROYCIB-CXAGYDPISA-N 1 0 319.832 4.392 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c1O ZINC000809694766 1041213804 /nfs/dbraw/zinc/21/38/04/1041213804.db2.gz STVPDAGMRCCPBI-GUDVDZBRSA-N 1 0 323.436 4.169 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)c1O ZINC000809694769 1041216414 /nfs/dbraw/zinc/21/64/14/1041216414.db2.gz STVPDAGMRCCPBI-QRVBRYPASA-N 1 0 323.436 4.169 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1 ZINC000809729186 1041223067 /nfs/dbraw/zinc/22/30/67/1041223067.db2.gz QZBPODKGYOWOSP-FQEVSTJZSA-N 1 0 309.457 4.265 20 10 DICDRO C/C(=C/c1ccccc1OC(F)F)C[NH2+]Cc1ccccc1O ZINC000810141664 1041319351 /nfs/dbraw/zinc/31/93/51/1041319351.db2.gz GPCBAOUCDBFCDN-RAXLEYEMSA-N 1 0 319.351 4.187 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CC[C@@H](c3ccccc3)O2)cc1C ZINC000810168790 1041322063 /nfs/dbraw/zinc/32/20/63/1041322063.db2.gz DVMPAVKOLJSSDM-QUCCMNQESA-N 1 0 311.425 4.019 20 10 DICDRO CC[C@@H]([NH2+]CC(O)(CC)CC)c1ccc(C(F)(F)F)cc1O ZINC000810215234 1041338455 /nfs/dbraw/zinc/33/84/55/1041338455.db2.gz UHUFTUAQSNUCHV-CYBMUJFWSA-N 1 0 319.367 4.003 20 10 DICDRO CC[C@H]([NH2+]CCCSC)c1ccc(C(F)(F)F)cc1O ZINC000810217700 1041338485 /nfs/dbraw/zinc/33/84/85/1041338485.db2.gz AETRAQLLUWIRBM-LBPRGKRZSA-N 1 0 307.381 4.205 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCSC1)c1ccc(C(F)(F)F)cc1O ZINC000810221151 1041340347 /nfs/dbraw/zinc/34/03/47/1041340347.db2.gz LQSHGXXNCPBAND-YPMHNXCESA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCOCC1)c1ccc(C(F)(F)F)cc1O ZINC000810229995 1041343120 /nfs/dbraw/zinc/34/31/20/1041343120.db2.gz PVZDPYQEOPLYHF-OCCSQVGLSA-N 1 0 317.351 4.021 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000168203368 1041345855 /nfs/dbraw/zinc/34/58/55/1041345855.db2.gz GFJSLUDEBWVTMB-SJCJKPOMSA-N 1 0 301.434 4.159 20 10 DICDRO CC[C@H]([NH2+]CC1(OC)CCC1)c1ccc(C(F)(F)F)cc1O ZINC000810234270 1041346004 /nfs/dbraw/zinc/34/60/04/1041346004.db2.gz BEWJEVHQWZQMBE-ZDUSSCGKSA-N 1 0 317.351 4.021 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCC=CO1)c1ccc(C(F)(F)F)cc1O ZINC000810239058 1041353964 /nfs/dbraw/zinc/35/39/64/1041353964.db2.gz RCRYCBXDVUMROT-TZMCWYRMSA-N 1 0 315.335 4.144 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1ccccc1O ZINC000810250268 1041356849 /nfs/dbraw/zinc/35/68/49/1041356849.db2.gz JTMFXMJESIBILU-KPFFTGBYSA-N 1 0 311.425 4.353 20 10 DICDRO CC(C)N(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000810254935 1041357781 /nfs/dbraw/zinc/35/77/81/1041357781.db2.gz SIXHGAJQQZUZIT-MSOLQXFVSA-N 1 0 317.521 4.056 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc(N(C)C)cc1 ZINC000810251242 1041357946 /nfs/dbraw/zinc/35/79/46/1041357946.db2.gz VVQOEWBVNGOVBF-DQLDELGASA-N 1 0 324.468 4.324 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(C(C)C)no2)cc1 ZINC000169221481 1041361446 /nfs/dbraw/zinc/36/14/46/1041361446.db2.gz KZPQVPYOQPOHAU-AWEZNQCLSA-N 1 0 301.434 4.105 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1ccc(N(C)C)cc1 ZINC000053149069 1041443066 /nfs/dbraw/zinc/44/30/66/1041443066.db2.gz QCUSDHXIEIGNIT-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1ccc(N(C)C)cc1 ZINC000053149072 1041443082 /nfs/dbraw/zinc/44/30/82/1041443082.db2.gz QCUSDHXIEIGNIT-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO C[C@@H](Cc1cccs1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000037284857 1041470135 /nfs/dbraw/zinc/47/01/35/1041470135.db2.gz BUAZLMLOAZRGGU-HNNXBMFYSA-N 1 0 300.471 4.069 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@H](C)c1ccc(N(C)C)cc1 ZINC000179991947 1041522200 /nfs/dbraw/zinc/52/22/00/1041522200.db2.gz GTIYDIQOYVNAMH-MRXNPFEDSA-N 1 0 311.473 4.296 20 10 DICDRO CCCN(Cc1ccnc(Cl)c1Cl)c1ccc(C[NH3+])cc1 ZINC000811496174 1041524079 /nfs/dbraw/zinc/52/40/79/1041524079.db2.gz RWTOZMIRTAYSOD-UHFFFAOYSA-N 1 0 324.255 4.264 20 10 DICDRO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1cc(C)c(C)cc1O)C2 ZINC000811519001 1041531096 /nfs/dbraw/zinc/53/10/96/1041531096.db2.gz RNNMSXWLTSBYNL-UHFFFAOYSA-N 1 0 323.436 4.065 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCC1(F)F ZINC000811512776 1041534287 /nfs/dbraw/zinc/53/42/87/1041534287.db2.gz SBNQQWUXATTZKB-OAHLLOKOSA-N 1 0 308.416 4.154 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCSc2c(F)cccc21)c1ccccc1O ZINC000183413964 1041582518 /nfs/dbraw/zinc/58/25/18/1041582518.db2.gz YBCJHCCHINTTAD-IAQYHMDHSA-N 1 0 303.402 4.419 20 10 DICDRO C[C@@H](NC(C)(C)C[NH2+][C@H](C)c1ccccc1O)c1ccccc1 ZINC000183512407 1041583625 /nfs/dbraw/zinc/58/36/25/1041583625.db2.gz AHMJLVAKHDFGOM-HZPDHXFCSA-N 1 0 312.457 4.172 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2cccc(C)c2C)c1O ZINC000183738896 1041586687 /nfs/dbraw/zinc/58/66/87/1041586687.db2.gz GOOJPKNJFNOUNW-CYBMUJFWSA-N 1 0 315.388 4.202 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccccc1OC(C)C ZINC000236677620 1041587039 /nfs/dbraw/zinc/58/70/39/1041587039.db2.gz CFCVIOAUPFHYTN-UHFFFAOYSA-N 1 0 312.457 4.138 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2ccccc2n1)c1cc(Cl)ccc1O ZINC000756455411 1041592882 /nfs/dbraw/zinc/59/28/82/1041592882.db2.gz JXBCRBIYLLQFDF-LBPRGKRZSA-N 1 0 312.800 4.445 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCc3sccc3C2)cc1C(C)C ZINC000014309327 1041594318 /nfs/dbraw/zinc/59/43/18/1041594318.db2.gz CVQWTSRXEGSPSF-UHFFFAOYSA-N 1 0 301.455 4.444 20 10 DICDRO C[C@H](O)c1ccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cc1 ZINC000185119892 1041607326 /nfs/dbraw/zinc/60/73/26/1041607326.db2.gz KZSUPTOAARDZII-GJZGRUSLSA-N 1 0 321.420 4.450 20 10 DICDRO C[C@@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1ccc2ccccc2c1O ZINC000185454158 1041614099 /nfs/dbraw/zinc/61/40/99/1041614099.db2.gz OFVWZVBMHARBBF-QVKFZJNVSA-N 1 0 321.420 4.104 20 10 DICDRO CC[N@@H+](Cc1cc2oc3ccccc3c2cc1O)C[C@H](C)OC ZINC000812303159 1041615181 /nfs/dbraw/zinc/61/51/81/1041615181.db2.gz MJJYWYLVEXYJJF-ZDUSSCGKSA-N 1 0 313.397 4.148 20 10 DICDRO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1cc(F)cc(F)c1[O-] ZINC000756498666 1041624044 /nfs/dbraw/zinc/62/40/44/1041624044.db2.gz YMNXWLQSOMQAFR-QMMMGPOBSA-N 1 0 315.722 4.314 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000186092663 1041625442 /nfs/dbraw/zinc/62/54/42/1041625442.db2.gz WOXHKRKFXJDYRN-ZIAGYGMSSA-N 1 0 314.385 4.329 20 10 DICDRO C[C@@H](Nc1cc2c(c[nH+]1)CCCC2)c1cc(F)cc(F)c1O ZINC000812739388 1041643867 /nfs/dbraw/zinc/64/38/67/1041643867.db2.gz PUEFIIQCGRZZEY-SNVBAGLBSA-N 1 0 304.340 4.117 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H]3C[C@H](C)C[C@H](C)C3)CC2)cc1 ZINC000812835020 1041654240 /nfs/dbraw/zinc/65/42/40/1041654240.db2.gz ZIRIFZKDGPQMBZ-VQFNDLOPSA-N 1 0 316.489 4.078 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@H]3CCOC3)C2)cc1C(C)C ZINC000747833022 1041669369 /nfs/dbraw/zinc/66/93/69/1041669369.db2.gz SPVMQMUTONTGQO-IRXDYDNUSA-N 1 0 317.473 4.073 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2[C@H](C)CCC[C@@H]2C)ccc1OC ZINC000747854132 1041700760 /nfs/dbraw/zinc/70/07/60/1041700760.db2.gz MGMAPKRMJYUPHN-QWHZDKJVSA-N 1 0 305.462 4.146 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H]2CCCc3ccc(C)cc32)c(O)c1 ZINC000813790480 1041732345 /nfs/dbraw/zinc/73/23/45/1041732345.db2.gz SOLJOEUUXOICFP-LJQANCHMSA-N 1 0 311.425 4.267 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)o1 ZINC000813885654 1041742201 /nfs/dbraw/zinc/74/22/01/1041742201.db2.gz PWTFIBOXCSRJRV-GWCFXTLKSA-N 1 0 318.392 4.118 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)o1 ZINC000813885655 1041742502 /nfs/dbraw/zinc/74/25/02/1041742502.db2.gz PWTFIBOXCSRJRV-GXFFZTMASA-N 1 0 318.392 4.118 20 10 DICDRO COCC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000813883769 1041742592 /nfs/dbraw/zinc/74/25/92/1041742592.db2.gz WWUTZFMLZMRRPE-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO CC[C@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccccc1O ZINC000192874098 1041755638 /nfs/dbraw/zinc/75/56/38/1041755638.db2.gz BSDSSKGKOPDANY-FQEVSTJZSA-N 1 0 324.468 4.098 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CCN(Cc3ccccc3)CC2)c(O)c1 ZINC000192902812 1041756882 /nfs/dbraw/zinc/75/68/82/1041756882.db2.gz PETBQTKTQDGOCR-KRWDZBQOSA-N 1 0 324.468 4.016 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccccc1O ZINC000364356978 1041761816 /nfs/dbraw/zinc/76/18/16/1041761816.db2.gz CEWDTPIWUCZVGZ-KPFFTGBYSA-N 1 0 311.425 4.211 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1ccccc1O ZINC000364356981 1041762165 /nfs/dbraw/zinc/76/21/65/1041762165.db2.gz CEWDTPIWUCZVGZ-XKGZKEIXSA-N 1 0 311.425 4.211 20 10 DICDRO CSC[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000814178976 1041780818 /nfs/dbraw/zinc/78/08/18/1041780818.db2.gz LGQFXYXTGICYFY-GOSISDBHSA-N 1 0 318.530 4.252 20 10 DICDRO CC(C)[N@H+](Cc1cc2c(cc1O)OCO2)[C@@H](C)c1ccccc1 ZINC000814169057 1041781415 /nfs/dbraw/zinc/78/14/15/1041781415.db2.gz CQFSEKOFSXXVER-AWEZNQCLSA-N 1 0 313.397 4.093 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(Cl)cc1 ZINC000194254951 1041785842 /nfs/dbraw/zinc/78/58/42/1041785842.db2.gz LEMWHOMLVIHOTD-GUYCJALGSA-N 1 0 319.832 4.392 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)s1)Cc1cccc(OC)c1O ZINC000162748199 1041791896 /nfs/dbraw/zinc/79/18/96/1041791896.db2.gz JETXVZAMMHNGHS-UHFFFAOYSA-N 1 0 311.834 4.138 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1F)c1cc(Cl)ccc1O ZINC000756609738 1041792771 /nfs/dbraw/zinc/79/27/71/1041792771.db2.gz NGIFLBQEDUPTQT-NWDGAFQWSA-N 1 0 323.795 4.303 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000814224313 1041794674 /nfs/dbraw/zinc/79/46/74/1041794674.db2.gz FMIDAIVHOLLGPB-GOSISDBHSA-N 1 0 318.420 4.320 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccsc3Cl)ccc21 ZINC000312760503 1041800888 /nfs/dbraw/zinc/80/08/88/1041800888.db2.gz HICMQEYXTYHWGG-UHFFFAOYSA-N 1 0 306.862 4.074 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2ncccc2c1)c1cc(Cl)ccc1O ZINC000195147018 1041803001 /nfs/dbraw/zinc/80/30/01/1041803001.db2.gz VHQQRMUCZCXCTQ-GFCCVEGCSA-N 1 0 312.800 4.445 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2ccccc2c1O ZINC000194619434 1041828654 /nfs/dbraw/zinc/82/86/54/1041828654.db2.gz RKEOHMGUBROPMH-ZDUSSCGKSA-N 1 0 322.364 4.304 20 10 DICDRO Cc1cc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)ccc1N(C)C ZINC000815009929 1041902955 /nfs/dbraw/zinc/90/29/55/1041902955.db2.gz MRMZAXCMQJKTIW-UHFFFAOYSA-N 1 0 322.452 4.056 20 10 DICDRO Cc1cc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)ccc1N(C)C ZINC000815036228 1041909163 /nfs/dbraw/zinc/90/91/63/1041909163.db2.gz TZGZJLXUKYRVEV-OAQYLSRUSA-N 1 0 324.468 4.025 20 10 DICDRO COc1cc(CC[NH2+]Cc2cc(C)c(C)cc2O)ccc1Cl ZINC000815162098 1041922036 /nfs/dbraw/zinc/92/20/36/1041922036.db2.gz BPXTWCUFEIJJBF-UHFFFAOYSA-N 1 0 319.832 4.003 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)c1cccc(Cl)c1 ZINC000756734777 1041950505 /nfs/dbraw/zinc/95/05/05/1041950505.db2.gz ZOJSZGADQMZIKK-UGSOOPFHSA-N 1 0 319.832 4.392 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCCc2nc3ccccc3[nH]2)c(O)c1 ZINC000815565903 1041964014 /nfs/dbraw/zinc/96/40/14/1041964014.db2.gz DHFUVTLQCPLYIK-HNNXBMFYSA-N 1 0 323.440 4.169 20 10 DICDRO CSCCC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815581468 1041966183 /nfs/dbraw/zinc/96/61/83/1041966183.db2.gz HFASVQXWJGBKMI-SFHVURJKSA-N 1 0 315.482 4.409 20 10 DICDRO CSC[C@@H](C)[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815581999 1041966953 /nfs/dbraw/zinc/96/69/53/1041966953.db2.gz VHGIPCFIWIHRPK-CRAIPNDOSA-N 1 0 315.482 4.407 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)C[C@@H](O)c2ccccc2)c(O)c1 ZINC000815589636 1041968934 /nfs/dbraw/zinc/96/89/34/1041968934.db2.gz YVLFSOBGUDGVNB-SOLBZPMBSA-N 1 0 313.441 4.172 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](O)c2ccccc2Cl)c(O)c1 ZINC000815594054 1041969378 /nfs/dbraw/zinc/96/93/78/1041969378.db2.gz DTIWOOPAVSGDTI-GUYCJALGSA-N 1 0 319.832 4.047 20 10 DICDRO CO[C@H](C)CC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815573180 1041973118 /nfs/dbraw/zinc/97/31/18/1041973118.db2.gz ALGJVEKPPKRHHC-VQIMIIECSA-N 1 0 313.441 4.081 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c(O)c1 ZINC000815619375 1041975621 /nfs/dbraw/zinc/97/56/21/1041975621.db2.gz MCKNVQLNZGGAMQ-CZUORRHYSA-N 1 0 315.388 4.323 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CC2(c3ccccn3)CCC2)c(O)c1 ZINC000815625654 1041977006 /nfs/dbraw/zinc/97/70/06/1041977006.db2.gz JMNDFPJFMUKHMQ-MRXNPFEDSA-N 1 0 310.441 4.177 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CC2(c3ccccn3)CCC2)c(O)c1 ZINC000815625653 1041977653 /nfs/dbraw/zinc/97/76/53/1041977653.db2.gz JMNDFPJFMUKHMQ-INIZCTEOSA-N 1 0 310.441 4.177 20 10 DICDRO C[C@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(N2CCOCC2)cc1 ZINC000815657380 1041980462 /nfs/dbraw/zinc/98/04/62/1041980462.db2.gz XPBFFTOJBLBPBU-INIZCTEOSA-N 1 0 316.489 4.000 20 10 DICDRO COc1cc(CC[NH2+][C@H](C)c2cc(C)ccc2O)ccc1Cl ZINC000815658098 1041981219 /nfs/dbraw/zinc/98/12/19/1041981219.db2.gz SLFAMYCPDQYZQK-CYBMUJFWSA-N 1 0 319.832 4.256 20 10 DICDRO CCc1noc(C)c1C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000815641457 1041981592 /nfs/dbraw/zinc/98/15/92/1041981592.db2.gz YIAHIPDDDAVTPS-CQSZACIVSA-N 1 0 308.809 4.145 20 10 DICDRO CCc1noc(C)c1C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000815641456 1041982054 /nfs/dbraw/zinc/98/20/54/1041982054.db2.gz YIAHIPDDDAVTPS-AWEZNQCLSA-N 1 0 308.809 4.145 20 10 DICDRO COCC1(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CCC1 ZINC000815642362 1041983510 /nfs/dbraw/zinc/98/35/10/1041983510.db2.gz ZZSSSFXXXUZTPT-CYBMUJFWSA-N 1 0 311.853 4.211 20 10 DICDRO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(Cl)ccc1O ZINC000815649610 1041984044 /nfs/dbraw/zinc/98/40/44/1041984044.db2.gz UXRJOEYFWNCOKK-MRVPVSSYSA-N 1 0 315.722 4.314 20 10 DICDRO CC[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cccc(Cl)c1[O-] ZINC000815647369 1041984438 /nfs/dbraw/zinc/98/44/38/1041984438.db2.gz IHCDPGZRERYUQD-KRWDZBQOSA-N 1 0 324.896 4.352 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2c(F)cc(F)cc2F)c(O)c1C ZINC000815650121 1041985250 /nfs/dbraw/zinc/98/52/50/1041985250.db2.gz JAZOULSDJNSFSU-NSHDSACASA-N 1 0 309.331 4.277 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)c1O ZINC000748051444 1042030758 /nfs/dbraw/zinc/03/07/58/1042030758.db2.gz XJYIMJBHGFNTJV-NSHDSACASA-N 1 0 319.351 4.066 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](c2ccccc2)C(C)C)c1O ZINC000748050425 1042032905 /nfs/dbraw/zinc/03/29/05/1042032905.db2.gz ASTNBBMTVVSBML-SFHVURJKSA-N 1 0 315.388 4.221 20 10 DICDRO Oc1c(C[NH+]2CCC(c3ccccn3)CC2)ccc2ccccc21 ZINC000816496343 1042057682 /nfs/dbraw/zinc/05/76/82/1042057682.db2.gz GELVTSKXIHTIPU-UHFFFAOYSA-N 1 0 318.420 4.320 20 10 DICDRO Oc1c(C[NH2+]CCCOC2CCCCC2)ccc2ccccc21 ZINC000816530644 1042062114 /nfs/dbraw/zinc/06/21/14/1042062114.db2.gz PKNOMCQHZONYOO-UHFFFAOYSA-N 1 0 313.441 4.374 20 10 DICDRO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816508305 1042062305 /nfs/dbraw/zinc/06/23/05/1042062305.db2.gz IPYGCKNLKBONPX-HNNXBMFYSA-N 1 0 321.420 4.314 20 10 DICDRO Oc1c(C[NH2+]CC2Cc3ccccc3C2)ccc2ccccc21 ZINC000816550658 1042065153 /nfs/dbraw/zinc/06/51/53/1042065153.db2.gz XSSVNWNCWIYDQI-UHFFFAOYSA-N 1 0 303.405 4.050 20 10 DICDRO CC(C)Oc1ncccc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816528135 1042065634 /nfs/dbraw/zinc/06/56/34/1042065634.db2.gz NWVIRCDPUALJOE-UHFFFAOYSA-N 1 0 322.408 4.017 20 10 DICDRO Oc1c(C[NH2+][C@@H]2CCOc3c(F)cccc32)ccc2ccccc21 ZINC000816586129 1042066396 /nfs/dbraw/zinc/06/63/96/1042066396.db2.gz ASSNCPZLHUMMLV-GOSISDBHSA-N 1 0 323.367 4.298 20 10 DICDRO CCO[C@@H](CC[NH2+]Cc1ccc2ccccc2c1O)C(C)C ZINC000816555799 1042067360 /nfs/dbraw/zinc/06/73/60/1042067360.db2.gz QDSLAEYFYOQSBU-SFHVURJKSA-N 1 0 301.430 4.086 20 10 DICDRO CCO[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)c1ccccc1 ZINC000816593429 1042067921 /nfs/dbraw/zinc/06/79/21/1042067921.db2.gz RRGKMDVLACKHET-FQEVSTJZSA-N 1 0 321.420 4.413 20 10 DICDRO CCSc1cc(C[NH2+]Cc2ccc3ccccc3c2O)ccn1 ZINC000816574815 1042070192 /nfs/dbraw/zinc/07/01/92/1042070192.db2.gz SQWXITYCNBJGDC-UHFFFAOYSA-N 1 0 324.449 4.342 20 10 DICDRO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816594977 1042070477 /nfs/dbraw/zinc/07/04/77/1042070477.db2.gz VBIBDROTVYFHEQ-XHDPSFHLSA-N 1 0 309.331 4.318 20 10 DICDRO COCC[C@H]1CCCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816571169 1042070552 /nfs/dbraw/zinc/07/05/52/1042070552.db2.gz UWDTZSCBIJNCQH-MRXNPFEDSA-N 1 0 313.441 4.184 20 10 DICDRO COCC[C@@H]1CCCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816571168 1042070882 /nfs/dbraw/zinc/07/08/82/1042070882.db2.gz UWDTZSCBIJNCQH-INIZCTEOSA-N 1 0 313.441 4.184 20 10 DICDRO Oc1c(C[NH2+]CC2(c3ccccn3)CCC2)ccc2ccccc21 ZINC000816608514 1042071183 /nfs/dbraw/zinc/07/11/83/1042071183.db2.gz BHADPXGAZNSZOW-UHFFFAOYSA-N 1 0 318.420 4.152 20 10 DICDRO C[C@@H]1CC(CC[NH2+]Cc2ccc3ccccc3c2O)C[C@@H](C)O1 ZINC000816601019 1042071722 /nfs/dbraw/zinc/07/17/22/1042071722.db2.gz ORAIEUIJSPVSSG-HUUCEWRRSA-N 1 0 313.441 4.229 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@H]2c2cccnc2)ccc2ccccc21 ZINC000816610576 1042073394 /nfs/dbraw/zinc/07/33/94/1042073394.db2.gz PPBTYUQFAHTICK-LJQANCHMSA-N 1 0 304.393 4.278 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)c1O ZINC000816666616 1042077980 /nfs/dbraw/zinc/07/79/80/1042077980.db2.gz RSAKAZWFAAUZCO-SHTZXODSSA-N 1 0 301.817 4.390 20 10 DICDRO CCc1nc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cs1 ZINC000185397152 1042098219 /nfs/dbraw/zinc/09/82/19/1042098219.db2.gz VOXHGDQAIFXAPO-LBPRGKRZSA-N 1 0 312.438 4.415 20 10 DICDRO CC[C@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000817415480 1042108379 /nfs/dbraw/zinc/10/83/79/1042108379.db2.gz UCXMTTYMGAJHBP-MOPGFXCFSA-N 1 0 311.425 4.106 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)cc(C)n1 ZINC000817590475 1042119435 /nfs/dbraw/zinc/11/94/35/1042119435.db2.gz XSUIKOYSQFVBGA-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CC12CCSCC2)c1cc(Cl)ccc1O ZINC000817588069 1042119483 /nfs/dbraw/zinc/11/94/83/1042119483.db2.gz BRXNSOBWQCQDFQ-NEPJUHHUSA-N 1 0 311.878 4.230 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cc(C)n1 ZINC000817590474 1042120032 /nfs/dbraw/zinc/12/00/32/1042120032.db2.gz XSUIKOYSQFVBGA-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](N)c2ccc(C(C)C)cc2)c(O)c1 ZINC000817954138 1042131554 /nfs/dbraw/zinc/13/15/54/1042131554.db2.gz VIEOPGSSGPYGHQ-BEFAXECRSA-N 1 0 312.457 4.175 20 10 DICDRO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955764 1042131593 /nfs/dbraw/zinc/13/15/93/1042131593.db2.gz HHUHIENEVIMWRA-GFCCVEGCSA-N 1 0 303.475 4.050 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000817955987 1042131728 /nfs/dbraw/zinc/13/17/28/1042131728.db2.gz MYIPAMNFNHZSAQ-LBPRGKRZSA-N 1 0 324.346 4.061 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCc2ccc(N)cc2)c2ccsc2S1 ZINC000817955434 1042131828 /nfs/dbraw/zinc/13/18/28/1042131828.db2.gz AQDMJDWRHQUBOH-XHDPSFHLSA-N 1 0 304.484 4.088 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CCc1ccc(N)cc1 ZINC000817957995 1042132310 /nfs/dbraw/zinc/13/23/10/1042132310.db2.gz RWRZQLLJODTCNZ-FQEVSTJZSA-N 1 0 319.452 4.268 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc3c2CCCN3)c(O)c1 ZINC000817976321 1042134513 /nfs/dbraw/zinc/13/45/13/1042134513.db2.gz XRNHZAZWZUXXKH-OAHLLOKOSA-N 1 0 310.441 4.218 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc2c1CCCN2)c1ccc(C)cc1O ZINC000817974876 1042134639 /nfs/dbraw/zinc/13/46/39/1042134639.db2.gz GXYKSCCVKXNHQG-SFHVURJKSA-N 1 0 310.441 4.300 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(Cl)cc(Cl)c1[O-] ZINC000817976085 1042134888 /nfs/dbraw/zinc/13/48/88/1042134888.db2.gz FNJKQOCZDGBKTL-YGRLFVJLSA-N 1 0 319.276 4.257 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817969486 1042134955 /nfs/dbraw/zinc/13/49/55/1042134955.db2.gz DPYMRGCYTUIXRB-NRUUGDAUSA-N 1 0 317.260 4.010 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000817968613 1042134990 /nfs/dbraw/zinc/13/49/90/1042134990.db2.gz UUEBLDBIHLOTTC-VBKZILBWSA-N 1 0 309.457 4.063 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1cc(Cl)ccc1O ZINC000817978278 1042135664 /nfs/dbraw/zinc/13/56/64/1042135664.db2.gz ZYPOPGMHZVYZNX-GFCCVEGCSA-N 1 0 316.832 4.255 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1cc(Cl)ccc1O ZINC000817978279 1042136264 /nfs/dbraw/zinc/13/62/64/1042136264.db2.gz ZYPOPGMHZVYZNX-LBPRGKRZSA-N 1 0 316.832 4.255 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)cc1 ZINC000817977387 1042136291 /nfs/dbraw/zinc/13/62/91/1042136291.db2.gz JDRKVDXSPZPWAZ-INIZCTEOSA-N 1 0 323.484 4.352 20 10 DICDRO CC[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1[O-] ZINC000817983358 1042136328 /nfs/dbraw/zinc/13/63/28/1042136328.db2.gz MQNWUTMNGMFYDD-ZWKOTPCHSA-N 1 0 316.420 4.052 20 10 DICDRO Cc1cccc(C[NH2+][C@@H]2CCc3cccc(Cl)c3C2)c1O ZINC001170908514 1042154081 /nfs/dbraw/zinc/15/40/81/1042154081.db2.gz NWMUTRNXSMDOTD-OAHLLOKOSA-N 1 0 301.817 4.001 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H]2CCc3cccc(Cl)c3C2)c(O)c1 ZINC001170906430 1042156920 /nfs/dbraw/zinc/15/69/20/1042156920.db2.gz FYOHTLMZLLNFFK-OAHLLOKOSA-N 1 0 315.844 4.310 20 10 DICDRO Fc1cccc2c1C[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CC2 ZINC001170948146 1042218456 /nfs/dbraw/zinc/21/84/56/1042218456.db2.gz DIAAYMORWKUAFP-SFHVURJKSA-N 1 0 324.443 4.073 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C23CC4CC(CC(C4)C2)C3)c1O ZINC000317354184 1042224945 /nfs/dbraw/zinc/22/49/45/1042224945.db2.gz HXEAGEGTALEJEJ-UHFFFAOYSA-N 1 0 321.848 4.113 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cccc(F)c2C1)c1ccc(N(C)C)cc1 ZINC001170963351 1042249413 /nfs/dbraw/zinc/24/94/13/1042249413.db2.gz WJBGRJGTVLUOFO-WMLDXEAASA-N 1 0 312.432 4.100 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(Br)c1)c1cc(F)ccc1O ZINC000094617851 1042325195 /nfs/dbraw/zinc/32/51/95/1042325195.db2.gz BNWOIWNCALJMIA-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO CCc1ccc([C@H]([NH2+]Cc2cccc(OC)c2O)C(C)C)cc1 ZINC000236986898 1042447780 /nfs/dbraw/zinc/44/77/80/1042447780.db2.gz LMUSDPUEFAUGJU-LJQANCHMSA-N 1 0 313.441 4.450 20 10 DICDRO CC[C@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccc(C)cc1O ZINC000279961638 1042466298 /nfs/dbraw/zinc/46/62/98/1042466298.db2.gz CHKGTUMFEYRJKL-RBUKOAKNSA-N 1 0 313.441 4.255 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2CCSc3ccccc32)c1O ZINC000894144004 1042471313 /nfs/dbraw/zinc/47/13/13/1042471313.db2.gz YXRXBQJUISAZJQ-OAHLLOKOSA-N 1 0 315.438 4.036 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccccc2Cl)c1O ZINC000894145391 1042471897 /nfs/dbraw/zinc/47/18/97/1042471897.db2.gz CCNOYNYITXOOBW-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)o1 ZINC000137064611 1042484029 /nfs/dbraw/zinc/48/40/29/1042484029.db2.gz BVPUFSQRNHUMEN-OAHLLOKOSA-N 1 0 321.804 4.122 20 10 DICDRO Cc1ncoc1C[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000894208131 1042513284 /nfs/dbraw/zinc/51/32/84/1042513284.db2.gz DJBOZMZXXSODEK-UHFFFAOYSA-N 1 0 313.445 4.042 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccc(Cl)cc1)c1ccccc1O ZINC000760014617 1042532420 /nfs/dbraw/zinc/53/24/20/1042532420.db2.gz BRJDBXWYDCNVCN-QWHCGFSZSA-N 1 0 305.805 4.164 20 10 DICDRO CCSc1cc(C[NH2+][C@H](CC)c2ccc(C)cc2O)ccn1 ZINC000279985165 1042560668 /nfs/dbraw/zinc/56/06/68/1042560668.db2.gz DWHOUAUBBMOUKS-MRXNPFEDSA-N 1 0 316.470 4.449 20 10 DICDRO c1cncc([C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C2CCC2)c1 ZINC000280185209 1042567527 /nfs/dbraw/zinc/56/75/27/1042567527.db2.gz COZJQBFTBUVVFQ-OAQYLSRUSA-N 1 0 321.468 4.313 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(C)cc1O ZINC000280272593 1042569297 /nfs/dbraw/zinc/56/92/97/1042569297.db2.gz YAKYTMNENCXERN-BLLLJJGKSA-N 1 0 302.418 4.150 20 10 DICDRO Cc1csc(C2([NH2+][C@@H](C)c3ccc(N(C)C)cc3)CCC2)n1 ZINC000271963168 1042673775 /nfs/dbraw/zinc/67/37/75/1042673775.db2.gz LNXSANYOSCYJLF-AWEZNQCLSA-N 1 0 315.486 4.248 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)cc1 ZINC000237129010 1042686598 /nfs/dbraw/zinc/68/65/98/1042686598.db2.gz ZDKDDFDFMCWVML-UHFFFAOYSA-N 1 0 306.409 4.302 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)c1O ZINC000894614392 1042970330 /nfs/dbraw/zinc/97/03/30/1042970330.db2.gz QOOAXZVDXFVYOU-QGZVFWFLSA-N 1 0 315.388 4.016 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000729468317 1042974779 /nfs/dbraw/zinc/97/47/79/1042974779.db2.gz CDJKRIQREKXAKV-MRXNPFEDSA-N 1 0 322.383 4.069 20 10 DICDRO CC[C@@H]([NH2+]CCc1cccc(F)c1F)c1ccc(C)cc1O ZINC000794808428 1043053231 /nfs/dbraw/zinc/05/32/31/1043053231.db2.gz BJJUMOYYPLLSSZ-MRXNPFEDSA-N 1 0 305.368 4.262 20 10 DICDRO CC[C@@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1ccc(C)cc1O ZINC000794805788 1043054363 /nfs/dbraw/zinc/05/43/63/1043054363.db2.gz YGZVNNMFZLNOOG-MRXNPFEDSA-N 1 0 323.440 4.250 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)C[C@@H](O)c1ccccc1)c1ccc(C)cc1O ZINC000794809631 1043055958 /nfs/dbraw/zinc/05/59/58/1043055958.db2.gz HAHHVQBXIKWPNM-ZYSHUDEJSA-N 1 0 313.441 4.254 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(C)cc1O ZINC000794811517 1043056731 /nfs/dbraw/zinc/05/67/31/1043056731.db2.gz FHDBTINHDFYWSR-DKKFBQAASA-N 1 0 315.457 4.089 20 10 DICDRO CC[C@H]([NH2+]CCC[C@H]1CCCC[C@@H]1O)c1ccc(C)cc1O ZINC000794815346 1043059177 /nfs/dbraw/zinc/05/91/77/1043059177.db2.gz KCJJRHCCCOQTEZ-NJAFHUGGSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@H](O)c1cccc(F)c1)c1ccc(C)cc1O ZINC000794816614 1043062936 /nfs/dbraw/zinc/06/29/36/1043062936.db2.gz NYZPYXBHMPTMJV-SOVGHPHASA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)C)c1ccc(C)cc1O ZINC000794820237 1043064864 /nfs/dbraw/zinc/06/48/64/1043064864.db2.gz ZKZOCGUKDNVRBG-HHXXYDBFSA-N 1 0 305.462 4.193 20 10 DICDRO CCC[C@H]([NH2+][C@H](CC)c1ccccc1O)[C@H](O)c1ccccc1 ZINC000794828542 1043065365 /nfs/dbraw/zinc/06/53/65/1043065365.db2.gz BVUKKCALJLIPTR-WSTZPKSXSA-N 1 0 313.441 4.335 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](CC)c2ccc(C)cc2O)CCC1 ZINC000794819819 1043065585 /nfs/dbraw/zinc/06/55/85/1043065585.db2.gz XXPBEMVTUFIZRZ-KRWDZBQOSA-N 1 0 305.462 4.338 20 10 DICDRO CCC[C@H]([NH2+][C@@H](CC)c1ccccc1O)[C@@H](O)c1ccccc1 ZINC000794828538 1043065706 /nfs/dbraw/zinc/06/57/06/1043065706.db2.gz BVUKKCALJLIPTR-BJLQDIEVSA-N 1 0 313.441 4.335 20 10 DICDRO CCN(CC)[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000794834962 1043081875 /nfs/dbraw/zinc/08/18/75/1043081875.db2.gz YHPHADXWOXLXJU-QZTJIDSGSA-N 1 0 317.521 4.058 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cccnc2Cl)cc1 ZINC000178228448 1043123961 /nfs/dbraw/zinc/12/39/61/1043123961.db2.gz OQXLHXQGNSJQHB-CQSZACIVSA-N 1 0 317.864 4.432 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccc(N(C)C)cc1 ZINC000178550309 1043133132 /nfs/dbraw/zinc/13/31/32/1043133132.db2.gz LSVRFZBCFQGNBM-YWZLYKJASA-N 1 0 312.457 4.047 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc([C@@H](C)O)cc1)c1ccc(N(C)C)cc1 ZINC000178550297 1043133256 /nfs/dbraw/zinc/13/32/56/1043133256.db2.gz LSVRFZBCFQGNBM-FOIQADDNSA-N 1 0 312.457 4.047 20 10 DICDRO CC(C)[C@@H]([NH2+][C@H](C)c1ccccc1O)c1nc2ccccc2[nH]1 ZINC000183448071 1043165003 /nfs/dbraw/zinc/16/50/03/1043165003.db2.gz BHMDJJXPZRWJQU-FZKQIMNGSA-N 1 0 309.413 4.316 20 10 DICDRO Cc1cncc([C@H](C)[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c1 ZINC000184351085 1043182346 /nfs/dbraw/zinc/18/23/46/1043182346.db2.gz BSRZMFGOQSEPFW-SFHVURJKSA-N 1 0 323.484 4.477 20 10 DICDRO COc1ccc([C@@H]([NH2+][C@@H](C)c2cc(F)ccc2O)C2CC2)cc1 ZINC000184911006 1043190757 /nfs/dbraw/zinc/19/07/57/1043190757.db2.gz WBVDAUVOJHJZSG-BUXKBTBVSA-N 1 0 315.388 4.342 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c(O)c1 ZINC000185006139 1043192716 /nfs/dbraw/zinc/19/27/16/1043192716.db2.gz LMQLAOIEBCASKY-INIZCTEOSA-N 1 0 310.441 4.152 20 10 DICDRO CCCOCc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185063067 1043194407 /nfs/dbraw/zinc/19/44/07/1043194407.db2.gz GDROFTQLCZVFEI-CQSZACIVSA-N 1 0 317.404 4.309 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1 ZINC000185215764 1043196554 /nfs/dbraw/zinc/19/65/54/1043196554.db2.gz DPGMSVONEIEFPN-PIGZYNQJSA-N 1 0 317.816 4.392 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2csc(C(C)C)n2)c(O)c1 ZINC000185310268 1043199432 /nfs/dbraw/zinc/19/94/32/1043199432.db2.gz FHWFDDZBEOSPLW-CYBMUJFWSA-N 1 0 304.459 4.174 20 10 DICDRO Cc1cccnc1[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)C(C)C ZINC000185458466 1043201998 /nfs/dbraw/zinc/20/19/98/1043201998.db2.gz FCELNLYHSCIJLC-SUMWQHHRSA-N 1 0 302.393 4.283 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ncccc2C)C(C)C)c1 ZINC000185457853 1043203147 /nfs/dbraw/zinc/20/31/47/1043203147.db2.gz HIOQMSRVRUXVDN-RDTXWAMCSA-N 1 0 314.429 4.152 20 10 DICDRO CC(C)(C)OC1CCC([NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000866450413 1043203784 /nfs/dbraw/zinc/20/37/84/1043203784.db2.gz GUIYTHBDNOHWNM-UYSNPLJNSA-N 1 0 303.446 4.095 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@@H](C)c2ccc(C)cc2O)on1 ZINC000185562028 1043204089 /nfs/dbraw/zinc/20/40/89/1043204089.db2.gz PVBVUKOVFJDEFF-ZDUSSCGKSA-N 1 0 302.418 4.443 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)c2cnc(C)s2)cc1 ZINC000866454568 1043204302 /nfs/dbraw/zinc/20/43/02/1043204302.db2.gz CWQYIUVPQXONQU-QWHCGFSZSA-N 1 0 303.475 4.319 20 10 DICDRO COc1cc(C[NH2+][C@H](C)c2ccc(C)cc2O)c2ccccc2n1 ZINC000185573944 1043205207 /nfs/dbraw/zinc/20/52/07/1043205207.db2.gz UHLLULNILZPDNO-CQSZACIVSA-N 1 0 322.408 4.108 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)s1 ZINC000866454618 1043205751 /nfs/dbraw/zinc/20/57/51/1043205751.db2.gz FILBYDIEJHEEOH-VDDIYKPWSA-N 1 0 306.406 4.195 20 10 DICDRO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000186057986 1043213285 /nfs/dbraw/zinc/21/32/85/1043213285.db2.gz PAILAOQCHPHXRE-HUUCEWRRSA-N 1 0 323.440 4.482 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2noc3ccc(F)cc32)c(O)c1 ZINC000866512299 1043215212 /nfs/dbraw/zinc/21/52/12/1043215212.db2.gz XGWCZEBKRGWERW-GFCCVEGCSA-N 1 0 314.360 4.140 20 10 DICDRO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(Cl)ccc1O ZINC000186117284 1043215400 /nfs/dbraw/zinc/21/54/00/1043215400.db2.gz RTGYXONBPQBCBK-SECBINFHSA-N 1 0 308.834 4.230 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCOc3cc(F)ccc32)c1 ZINC000186374074 1043223352 /nfs/dbraw/zinc/22/33/52/1043223352.db2.gz BVJHSCHAVYABJD-DYVFJYSZSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1cnc([C@@H](C)C[NH2+][C@H](C)c2cc(Cl)ccc2O)s1 ZINC000186766114 1043233011 /nfs/dbraw/zinc/23/30/11/1043233011.db2.gz AKLPEFKDBTZGSE-GXSJLCMTSA-N 1 0 310.850 4.265 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)c1O ZINC000777440640 1043253193 /nfs/dbraw/zinc/25/31/93/1043253193.db2.gz OQUYDGPKIXTLHU-CVEARBPZSA-N 1 0 311.853 4.037 20 10 DICDRO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000121877548 1043263127 /nfs/dbraw/zinc/26/31/27/1043263127.db2.gz LJQRPKYTTCFWIX-MRXNPFEDSA-N 1 0 312.457 4.391 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000121906551 1043265252 /nfs/dbraw/zinc/26/52/52/1043265252.db2.gz JYOAGSLLDAGRAA-IFXJQAMLSA-N 1 0 310.441 4.099 20 10 DICDRO CCCNc1ccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)cc1 ZINC000193366083 1043284808 /nfs/dbraw/zinc/28/48/08/1043284808.db2.gz SUQVGYICKYXQFK-CQSZACIVSA-N 1 0 314.429 4.074 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000194257072 1043290313 /nfs/dbraw/zinc/29/03/13/1043290313.db2.gz XJPOKOZLBGRYAJ-WBMJQRKESA-N 1 0 305.805 4.084 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000122424968 1043303949 /nfs/dbraw/zinc/30/39/49/1043303949.db2.gz SSIWXQKHGAIZNS-KGLIPLIRSA-N 1 0 316.420 4.312 20 10 DICDRO CC(C)C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccn1 ZINC000122918025 1043336986 /nfs/dbraw/zinc/33/69/86/1043336986.db2.gz OGTBDKCNVJCZHP-FQEVSTJZSA-N 1 0 323.484 4.341 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000268984790 1043349060 /nfs/dbraw/zinc/34/90/60/1043349060.db2.gz SNQSAKIBJKNRGE-IBGZPJMESA-N 1 0 323.436 4.251 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cnccc2C)cc1F ZINC000271572967 1043438619 /nfs/dbraw/zinc/43/86/19/1043438619.db2.gz XKQDCAQLNGGNTI-HNNXBMFYSA-N 1 0 315.436 4.226 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCO[C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000271585335 1043442345 /nfs/dbraw/zinc/44/23/45/1043442345.db2.gz XMKYUQUHUVYKEY-INMHGKMJSA-N 1 0 320.452 4.034 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(OC(C)C)cc2)c1 ZINC000271671356 1043446212 /nfs/dbraw/zinc/44/62/12/1043446212.db2.gz GOFLCBFFDUHOGO-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO CC[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cc(Cl)ccc1O ZINC000872116990 1043465268 /nfs/dbraw/zinc/46/52/68/1043465268.db2.gz WJYALRXHKGZZJA-SNVBAGLBSA-N 1 0 317.241 4.396 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(C(F)(F)F)nc1 ZINC000873185795 1043524194 /nfs/dbraw/zinc/52/41/94/1043524194.db2.gz ULCDBPAPMDFJJO-GFCCVEGCSA-N 1 0 323.362 4.017 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)on1 ZINC000125604254 1043642103 /nfs/dbraw/zinc/64/21/03/1043642103.db2.gz ZKYJOXMNHDAUMK-MRXNPFEDSA-N 1 0 313.445 4.214 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(OC)c2O)cc1C ZINC000926903778 1043651541 /nfs/dbraw/zinc/65/15/41/1043651541.db2.gz ZTNSXRVCSUMNID-UONOGXRCSA-N 1 0 315.413 4.130 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(OC)c(C)c2)c1 ZINC000926903434 1043652982 /nfs/dbraw/zinc/65/29/82/1043652982.db2.gz VOGLBQHYJYMMMZ-UONOGXRCSA-N 1 0 315.413 4.130 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(OC)c2O)cc1C ZINC000926903777 1043653026 /nfs/dbraw/zinc/65/30/26/1043653026.db2.gz ZTNSXRVCSUMNID-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO COc1ccc(N2CCC([NH2+]Cc3ccc(C)cc3C)CC2)cc1 ZINC000237261188 1043659684 /nfs/dbraw/zinc/65/96/84/1043659684.db2.gz PAXQYIDMACXPTP-UHFFFAOYSA-N 1 0 324.468 4.071 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCCc3cccnc32)c1O ZINC000927064255 1043679584 /nfs/dbraw/zinc/67/95/84/1043679584.db2.gz RDNQVUAKKMVOPX-WBMJQRKESA-N 1 0 316.832 4.477 20 10 DICDRO Cc1cccc(O)c1C[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000876912650 1043724575 /nfs/dbraw/zinc/72/45/75/1043724575.db2.gz XIJSYSVICHRTAU-HNNXBMFYSA-N 1 0 303.402 4.166 20 10 DICDRO C[C@H]([NH2+]Cc1cn(C)nc1C1CCCCC1)c1ccccc1O ZINC000877757399 1043791461 /nfs/dbraw/zinc/79/14/61/1043791461.db2.gz XNCBKGZCUAJCIT-AWEZNQCLSA-N 1 0 313.445 4.024 20 10 DICDRO Cc1cccnc1[C@H]1CCC[C@H]([NH2+][C@H](C)c2ccccc2O)C1 ZINC000877755475 1043791497 /nfs/dbraw/zinc/79/14/97/1043791497.db2.gz CEJKFMLRQJVIGA-IKGGRYGDSA-N 1 0 310.441 4.473 20 10 DICDRO CCCOc1cc(C[NH2+][C@H](C)c2ccccc2O)ccc1OC ZINC000877756483 1043791800 /nfs/dbraw/zinc/79/18/00/1043791800.db2.gz LSPUEQGAOYKUAN-CQSZACIVSA-N 1 0 315.413 4.040 20 10 DICDRO CCOc1cc(C[NH2+][C@H](C)c2ccccc2O)cc(Cl)c1O ZINC000877755602 1043792389 /nfs/dbraw/zinc/79/23/89/1043792389.db2.gz HSRZRZOPWSPTDH-LLVKDONJSA-N 1 0 321.804 4.001 20 10 DICDRO Cc1cccnc1[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccccc2O)C1 ZINC000877757994 1043792786 /nfs/dbraw/zinc/79/27/86/1043792786.db2.gz CEJKFMLRQJVIGA-BBWFWOEESA-N 1 0 310.441 4.473 20 10 DICDRO CCOc1cc(C[NH2+][C@@H](C)c2ccccc2O)cc(Cl)c1O ZINC000877758069 1043792961 /nfs/dbraw/zinc/79/29/61/1043792961.db2.gz HSRZRZOPWSPTDH-NSHDSACASA-N 1 0 321.804 4.001 20 10 DICDRO C[C@H]([NH2+]Cc1cnc(C2CCCC2)s1)c1ccccc1O ZINC000877757132 1043793773 /nfs/dbraw/zinc/79/37/73/1043793773.db2.gz IKTGGIBXNZAKGZ-LBPRGKRZSA-N 1 0 302.443 4.357 20 10 DICDRO C[C@H]([NH2+][C@@H]1c2ccccc2CC12CCOCC2)c1ccccc1O ZINC000290104813 1043918264 /nfs/dbraw/zinc/91/82/64/1043918264.db2.gz IGMQRLMBOPUVST-MGPUTAFESA-N 1 0 323.436 4.137 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000127421424 1043929334 /nfs/dbraw/zinc/92/93/34/1043929334.db2.gz WAXGCWJPPYXPDA-FUHWJXTLSA-N 1 0 316.489 4.285 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c1 ZINC000127851109 1043973285 /nfs/dbraw/zinc/97/32/85/1043973285.db2.gz OADISBSURGEUGX-HNNXBMFYSA-N 1 0 322.408 4.221 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccccn2)c(C)n1-c1ccccc1 ZINC000320344376 1044025129 /nfs/dbraw/zinc/02/51/29/1044025129.db2.gz OUWVCMCVZSPLML-INIZCTEOSA-N 1 0 305.425 4.340 20 10 DICDRO C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccccc1O ZINC000798925693 1044072909 /nfs/dbraw/zinc/07/29/09/1044072909.db2.gz CIQPJMHFXNIZEX-GFCCVEGCSA-N 1 0 309.331 4.132 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2cccc(SCC)c2)c1O ZINC000291671759 1044093248 /nfs/dbraw/zinc/09/32/48/1044093248.db2.gz GQOHZHLGDBHQHO-UHFFFAOYSA-N 1 0 317.454 4.193 20 10 DICDRO C[C@@]12CC[N@H+](Cc3c(O)ccc4ccccc43)C[C@@H]1C2(F)F ZINC000291819451 1044105289 /nfs/dbraw/zinc/10/52/89/1044105289.db2.gz DRZBMUXIXBPCOW-DLBZAZTESA-N 1 0 303.352 4.023 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccc1O ZINC000281233960 1044108321 /nfs/dbraw/zinc/10/83/21/1044108321.db2.gz VYAXHRRDYHKMLC-CYBMUJFWSA-N 1 0 313.294 4.190 20 10 DICDRO CC(C)Oc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000128980841 1044115057 /nfs/dbraw/zinc/11/50/57/1044115057.db2.gz FOGXGOUGOUYXRA-MRXNPFEDSA-N 1 0 312.457 4.391 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@H]1OCCc2sccc21)c1ccccc1O ZINC000291974898 1044121548 /nfs/dbraw/zinc/12/15/48/1044121548.db2.gz UMQAPURIGBHPCK-XLWVJDPXSA-N 1 0 317.454 4.197 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000778119712 1044158806 /nfs/dbraw/zinc/15/88/06/1044158806.db2.gz XWBGVTRLWVCJIU-GUYCJALGSA-N 1 0 311.853 4.119 20 10 DICDRO COc1cccc(C[NH2+]CCCCCc2ccc(F)cc2)c1O ZINC000778207209 1044219004 /nfs/dbraw/zinc/21/90/04/1044219004.db2.gz XEIGAVZUCVUGAW-UHFFFAOYSA-N 1 0 317.404 4.043 20 10 DICDRO COCc1c(C)cc(C)c(C[NH2+][C@@H](C)c2ccccc2O)c1C ZINC000883225478 1044239753 /nfs/dbraw/zinc/23/97/53/1044239753.db2.gz IBKLFKKFARSEGG-INIZCTEOSA-N 1 0 313.441 4.315 20 10 DICDRO C[C@@H]([NH2+]CCc1ccns1)c1ccc(N2CCCCC2)cc1 ZINC000883249153 1044243169 /nfs/dbraw/zinc/24/31/69/1044243169.db2.gz VIEVALNBXSFYDL-OAHLLOKOSA-N 1 0 315.486 4.027 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000293219330 1044262548 /nfs/dbraw/zinc/26/25/48/1044262548.db2.gz AGBQFNYREGQEOH-INIZCTEOSA-N 1 0 313.441 4.396 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(C)nc1Cl)c1ccc(C)cc1O ZINC000883302482 1044263199 /nfs/dbraw/zinc/26/31/99/1044263199.db2.gz ZHJFXUHAMVQDJG-HNNXBMFYSA-N 1 0 304.821 4.298 20 10 DICDRO Oc1c(C[NH2+][C@H]2CCCc3cccnc32)ccc2ccccc21 ZINC000897072639 1044290539 /nfs/dbraw/zinc/29/05/39/1044290539.db2.gz XJJFNYNZNVVTKW-SFHVURJKSA-N 1 0 304.393 4.108 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2c3ccccc3CC[C@@H]2F)c1O ZINC000883377848 1044292660 /nfs/dbraw/zinc/29/26/60/1044292660.db2.gz SADVDVGJNYXPOD-IWEFOYFVSA-N 1 0 315.388 4.077 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)c1 ZINC000293607839 1044304674 /nfs/dbraw/zinc/30/46/74/1044304674.db2.gz DWJZNSKYVRZNNE-GFCCVEGCSA-N 1 0 321.367 4.363 20 10 DICDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000192744873 1044306971 /nfs/dbraw/zinc/30/69/71/1044306971.db2.gz JEDPQZDWGAQRAN-ZIAGYGMSSA-N 1 0 312.413 4.071 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2nsc3ccccc23)c(O)c1 ZINC000883403016 1044306899 /nfs/dbraw/zinc/30/68/99/1044306899.db2.gz HYAHJCIRKKFUQD-CYBMUJFWSA-N 1 0 312.438 4.470 20 10 DICDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000192789233 1044309407 /nfs/dbraw/zinc/30/94/07/1044309407.db2.gz AQBAFERIOOVAIE-UONOGXRCSA-N 1 0 315.413 4.130 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1OC)c1ccccc1O ZINC000192789537 1044309417 /nfs/dbraw/zinc/30/94/17/1044309417.db2.gz AHJKLJQRJXEBJO-DYVFJYSZSA-N 1 0 315.413 4.211 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc(Cl)cs1 ZINC000475191910 1044311680 /nfs/dbraw/zinc/31/16/80/1044311680.db2.gz FQIMGQLEQGAPHE-UHFFFAOYSA-N 1 0 304.846 4.491 20 10 DICDRO C[C@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 ZINC000132744597 1044332290 /nfs/dbraw/zinc/33/22/90/1044332290.db2.gz XXSQTPGVMCOKIG-KRWDZBQOSA-N 1 0 323.484 4.072 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000361066274 1044355310 /nfs/dbraw/zinc/35/53/10/1044355310.db2.gz KBOTXANPAWNBHB-MRXNPFEDSA-N 1 0 308.381 4.261 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c(O)c1 ZINC000293989666 1044363226 /nfs/dbraw/zinc/36/32/26/1044363226.db2.gz BWVUYJPFYHARHX-XJKSGUPXSA-N 1 0 315.388 4.323 20 10 DICDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000192948148 1044407378 /nfs/dbraw/zinc/40/73/78/1044407378.db2.gz KBLBDGYHHUSZTA-ZIAGYGMSSA-N 1 0 312.413 4.071 20 10 DICDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000192948160 1044407593 /nfs/dbraw/zinc/40/75/93/1044407593.db2.gz KBLBDGYHHUSZTA-KGLIPLIRSA-N 1 0 312.413 4.071 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1c(Cl)cccc1Cl)CC2 ZINC000696908418 1044410847 /nfs/dbraw/zinc/41/08/47/1044410847.db2.gz YSMSBGVZKPAJGR-CQSZACIVSA-N 1 0 308.208 4.476 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000121301488 1044418193 /nfs/dbraw/zinc/41/81/93/1044418193.db2.gz GZFJAHVNLDOMIO-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(O)c1 ZINC000294870492 1044467560 /nfs/dbraw/zinc/46/75/60/1044467560.db2.gz UGWRXNQDAUTEIQ-CYBMUJFWSA-N 1 0 304.459 4.440 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(Cl)cc1 ZINC001202691467 1044472202 /nfs/dbraw/zinc/47/22/02/1044472202.db2.gz KOPHQADZSODGHD-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)ccc1OC ZINC000215919620 1044540515 /nfs/dbraw/zinc/54/05/15/1044540515.db2.gz SPUSKLWFTXIYDZ-RLFYNMQTSA-N 1 0 305.462 4.146 20 10 DICDRO CC(C)[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1nc2ccccc2[nH]1 ZINC000295787940 1044559798 /nfs/dbraw/zinc/55/97/98/1044559798.db2.gz BJDMDBASNNTURR-VQIMIIECSA-N 1 0 321.424 4.243 20 10 DICDRO c1cc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)cs1 ZINC000042374061 1044591840 /nfs/dbraw/zinc/59/18/40/1044591840.db2.gz SJHOUEMEYOBRIN-UHFFFAOYSA-N 1 0 300.471 4.071 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C(F)(F)F)n2)c(O)c1C ZINC000296337304 1044610328 /nfs/dbraw/zinc/61/03/28/1044610328.db2.gz HRJYULXNXJVRBI-GFCCVEGCSA-N 1 0 324.346 4.274 20 10 DICDRO C[N@H+](Cc1ccc2cccc(Cl)c2n1)Cc1ccccc1O ZINC001137228867 1044640385 /nfs/dbraw/zinc/64/03/85/1044640385.db2.gz VEHKTJPDQZSVKP-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2c(O)cccc2F)c1 ZINC000886579214 1044662610 /nfs/dbraw/zinc/66/26/10/1044662610.db2.gz DXPVJJWLNQTWCB-CYBMUJFWSA-N 1 0 302.393 4.074 20 10 DICDRO c1coc([C@H](NCc2ccc3c(c2)CCO3)c2ccccc2)c1 ZINC000043288583 1044683521 /nfs/dbraw/zinc/68/35/21/1044683521.db2.gz HRLQRMBCMUYEOL-HXUWFJFHSA-N 1 0 305.377 4.094 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cn(C(C)(C)C)nc2C)cc1C ZINC000155408317 1044698943 /nfs/dbraw/zinc/69/89/43/1044698943.db2.gz RSFDCUNQRODLKL-AWEZNQCLSA-N 1 0 315.461 4.114 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](c1ccco1)N(CC)CC)c1ccccc1O ZINC000155455460 1044699901 /nfs/dbraw/zinc/69/99/01/1044699901.db2.gz HERCDQLZKJDHFS-SJORKVTESA-N 1 0 316.445 4.109 20 10 DICDRO Cc1ccc([C@H]([NH2+]Cc2cccc(C)c2O)c2ccccn2)cc1 ZINC000366269487 1044716951 /nfs/dbraw/zinc/71/69/51/1044716951.db2.gz MODKFVOCXWJCIG-FQEVSTJZSA-N 1 0 318.420 4.283 20 10 DICDRO CC(C)n1ncc2c1[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)CCC2 ZINC000368158796 1044768456 /nfs/dbraw/zinc/76/84/56/1044768456.db2.gz IWQAORCWDJBJMX-MLGOLLRUSA-N 1 0 317.408 4.037 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccccc2COC)cc1 ZINC000122035762 1044769986 /nfs/dbraw/zinc/76/99/86/1044769986.db2.gz CAQWBFRNYFHRGF-INIZCTEOSA-N 1 0 312.457 4.140 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000373164911 1044946755 /nfs/dbraw/zinc/94/67/55/1044946755.db2.gz ORCCXKNIPAUHSD-SCWSEQNSSA-N 1 0 324.468 4.181 20 10 DICDRO CSc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC000302740115 1044996686 /nfs/dbraw/zinc/99/66/86/1044996686.db2.gz OIZRUDXJZRCQEG-UHFFFAOYSA-N 1 0 300.471 4.107 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c1 ZINC000373696662 1045004130 /nfs/dbraw/zinc/00/41/30/1045004130.db2.gz WCEASWWNQPGVOA-BLLLJJGKSA-N 1 0 301.361 4.014 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccn1)c1ccc(N2CCCCC2)cc1 ZINC000152401708 1045042398 /nfs/dbraw/zinc/04/23/98/1045042398.db2.gz OWOHQNNOIFVZAW-IAGOWNOFSA-N 1 0 309.457 4.484 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccn1)c1ccc(N2CCCCC2)cc1 ZINC000152401431 1045042572 /nfs/dbraw/zinc/04/25/72/1045042572.db2.gz OWOHQNNOIFVZAW-IRXDYDNUSA-N 1 0 309.457 4.484 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000778999239 1045114988 /nfs/dbraw/zinc/11/49/88/1045114988.db2.gz BIEBXWMCAVTBHZ-INIZCTEOSA-N 1 0 306.409 4.253 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(OCC2CCCCC2)CC1 ZINC000779003019 1045119677 /nfs/dbraw/zinc/11/96/77/1045119677.db2.gz IMPGVPGIQRJTCB-UHFFFAOYSA-N 1 0 321.436 4.093 20 10 DICDRO Cc1cc(Br)cc([C@@H](C)[NH2+]C2(C3CC3)CC2)c1O ZINC000779045674 1045201248 /nfs/dbraw/zinc/20/12/48/1045201248.db2.gz NAYDSKZOHNSOHV-SNVBAGLBSA-N 1 0 310.235 4.056 20 10 DICDRO COc1ccc(C(C)(C)[NH2+]Cc2cc(Cl)ccc2O)cc1F ZINC000527782491 1045259685 /nfs/dbraw/zinc/25/96/85/1045259685.db2.gz XAIHDCSYIIBEQD-UHFFFAOYSA-N 1 0 323.795 4.218 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cc(Cl)ccc1O ZINC000528035652 1045296048 /nfs/dbraw/zinc/29/60/48/1045296048.db2.gz JGKVJQWSXOSSKN-HZMBPMFUSA-N 1 0 308.784 4.382 20 10 DICDRO CCOC(C)(C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000188690304 1045338758 /nfs/dbraw/zinc/33/87/58/1045338758.db2.gz JPGPGKRYMOMPSV-MRXNPFEDSA-N 1 0 304.478 4.143 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(CSC)c2)c1 ZINC000188725561 1045339336 /nfs/dbraw/zinc/33/93/36/1045339336.db2.gz BAMFLFPUEKZRFZ-ZDUSSCGKSA-N 1 0 317.454 4.115 20 10 DICDRO CSCc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000188722231 1045339679 /nfs/dbraw/zinc/33/96/79/1045339679.db2.gz ZDUDOBKHXNFQCT-HNNXBMFYSA-N 1 0 314.498 4.466 20 10 DICDRO COc1cccc(C[NH2+]C(c2ccccc2)c2ccccc2)c1O ZINC000076272134 1045345624 /nfs/dbraw/zinc/34/56/24/1045345624.db2.gz KYWZZINICAKVNR-UHFFFAOYSA-N 1 0 319.404 4.280 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)[C@H](C)c2ccccc2)c1O ZINC000779197444 1045368494 /nfs/dbraw/zinc/36/84/94/1045368494.db2.gz APJNUCWIONQAKS-STQMWFEESA-N 1 0 315.388 4.016 20 10 DICDRO CCOc1cccc(C[N@H+](CC)[C@H](C)Cc2ccsc2)c1O ZINC000779216262 1045372012 /nfs/dbraw/zinc/37/20/12/1045372012.db2.gz QWSVQZVZFJYTHH-CQSZACIVSA-N 1 0 319.470 4.306 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](CC)[C@H](C)Cc2ccsc2)c1 ZINC000779215665 1045372429 /nfs/dbraw/zinc/37/24/29/1045372429.db2.gz NTRFSZHUQTXZGX-CQSZACIVSA-N 1 0 319.470 4.306 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC([C@H]3CCCO3)CC2)cc1C(C)C ZINC000190186601 1045386390 /nfs/dbraw/zinc/38/63/90/1045386390.db2.gz YOTRFSBUOVASKL-HXUWFJFHSA-N 1 0 317.473 4.215 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CCc3ccc(C(C)C)cc32)c1 ZINC000190235910 1045515650 /nfs/dbraw/zinc/51/56/50/1045515650.db2.gz RWENXDIOPZEEKO-IBGZPJMESA-N 1 0 311.425 4.301 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(F)ccc1F ZINC000077454628 1045521497 /nfs/dbraw/zinc/52/14/97/1045521497.db2.gz VJXZKWHGWAQJCV-GOSISDBHSA-N 1 0 304.384 4.272 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccccc1OC1CCC1 ZINC000118454671 1045575372 /nfs/dbraw/zinc/57/53/72/1045575372.db2.gz XIQNBQFBAWPXOB-UHFFFAOYSA-N 1 0 317.816 4.267 20 10 DICDRO C[C@@H]1CCCN(c2ccc(C[NH2+]Cc3cc[nH]c3)cc2Cl)C1 ZINC000800276251 1045601580 /nfs/dbraw/zinc/60/15/80/1045601580.db2.gz LOQFUPBAZNOBOM-CQSZACIVSA-N 1 0 317.864 4.194 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCSC2CCCCC2)c1 ZINC000800368920 1045611862 /nfs/dbraw/zinc/61/18/62/1045611862.db2.gz FNAXVMXYUPTEKE-CYBMUJFWSA-N 1 0 309.475 4.117 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c(O)c1 ZINC000800496861 1045633378 /nfs/dbraw/zinc/63/33/78/1045633378.db2.gz ZVEIFZHJNXEKEU-LRDDRELGSA-N 1 0 301.817 4.172 20 10 DICDRO CC[C@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccc(C)cc1O ZINC000800500011 1045635264 /nfs/dbraw/zinc/63/52/64/1045635264.db2.gz MKFGSKHTSJDTRZ-SFHVURJKSA-N 1 0 308.425 4.465 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCC12CCOCC2)c1cc(Cl)ccc1O ZINC000800498480 1045635818 /nfs/dbraw/zinc/63/58/18/1045635818.db2.gz LCOLAJUTHTUITC-DOTOQJQBSA-N 1 0 323.864 4.436 20 10 DICDRO C[C@@H]([NH2+]CCCc1c[nH]c2ccc(F)cc12)c1ccccc1O ZINC000800501639 1045637838 /nfs/dbraw/zinc/63/78/38/1045637838.db2.gz WVVJRDPACAPVCZ-CYBMUJFWSA-N 1 0 312.388 4.296 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000800857195 1045658929 /nfs/dbraw/zinc/65/89/29/1045658929.db2.gz IRNWQNSUNFWHQY-FQEVSTJZSA-N 1 0 322.383 4.011 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc(N2CCCCC2)cc1)C(F)(F)F ZINC000800889464 1045662344 /nfs/dbraw/zinc/66/23/44/1045662344.db2.gz XIXAAWRVMARBIX-UHFFFAOYSA-N 1 0 314.395 4.355 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1C ZINC000752266447 1045669167 /nfs/dbraw/zinc/66/91/67/1045669167.db2.gz QMYLZGQRJUSVER-UKRRQHHQSA-N 1 0 315.379 4.467 20 10 DICDRO FC(F)(F)[C@@H]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000752265665 1045669516 /nfs/dbraw/zinc/66/95/16/1045669516.db2.gz LDHLLZCNZKPEBF-SWLSCSKDSA-N 1 0 313.363 4.080 20 10 DICDRO FCCC[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000800966873 1045671274 /nfs/dbraw/zinc/67/12/74/1045671274.db2.gz DYSYPZLJJDUNDA-IEBWSBKVSA-N 1 0 304.453 4.295 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](O)c1cc(C)cc(C)c1)c1ccc(C)cc1O ZINC000800991363 1045678442 /nfs/dbraw/zinc/67/84/42/1045678442.db2.gz FXQPQDFRSUVTEA-QUCCMNQESA-N 1 0 313.441 4.092 20 10 DICDRO Cc1cccc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)c1O ZINC000779431880 1045711288 /nfs/dbraw/zinc/71/12/88/1045711288.db2.gz GTIJUNBWQZCMLL-MRXNPFEDSA-N 1 0 317.816 4.358 20 10 DICDRO Cc1cc(C[NH+]2CCC(Oc3ccccc3)CC2)ccc1N(C)C ZINC001139669849 1045737888 /nfs/dbraw/zinc/73/78/88/1045737888.db2.gz QCBNUYFZFVVQSI-UHFFFAOYSA-N 1 0 324.468 4.104 20 10 DICDRO CCCC[N@H+](Cc1cn2cccc(C)c2n1)Cc1ccccc1O ZINC000801595821 1045748680 /nfs/dbraw/zinc/74/86/80/1045748680.db2.gz JRDGKGHJZWTEEO-UHFFFAOYSA-N 1 0 323.440 4.151 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC1(Cl)Cl ZINC000801596553 1045748725 /nfs/dbraw/zinc/74/87/25/1045748725.db2.gz FHDNJNCWEKXPOZ-ZDUSSCGKSA-N 1 0 302.245 4.188 20 10 DICDRO CCCC[N@H+](Cc1cn2c(cccc2C)n1)Cc1ccccc1O ZINC000801596098 1045749198 /nfs/dbraw/zinc/74/91/98/1045749198.db2.gz ONFRBKFIRFNVNB-UHFFFAOYSA-N 1 0 323.440 4.151 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1ccncc1Cl ZINC000801596837 1045751505 /nfs/dbraw/zinc/75/15/05/1045751505.db2.gz QLCUVXKSVKOOFT-UHFFFAOYSA-N 1 0 304.821 4.243 20 10 DICDRO Cc1occc1C[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000753552896 1045761361 /nfs/dbraw/zinc/76/13/61/1045761361.db2.gz VSYTXHBILNWBEU-UHFFFAOYSA-N 1 0 323.392 4.162 20 10 DICDRO Oc1ccccc1C[N@@H+]1CC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000753586739 1045769210 /nfs/dbraw/zinc/76/92/10/1045769210.db2.gz CCPGSOGHNRDZEB-CQSZACIVSA-N 1 0 321.342 4.401 20 10 DICDRO Oc1ccccc1C[N@@H+]1CC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000753586734 1045770905 /nfs/dbraw/zinc/77/09/05/1045770905.db2.gz CCPGSOGHNRDZEB-AWEZNQCLSA-N 1 0 321.342 4.401 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@@H](c3cccc(C)c3)C2)c1O ZINC000753586504 1045771274 /nfs/dbraw/zinc/77/12/74/1045771274.db2.gz AYFWTHOHFRWMTR-QGZVFWFLSA-N 1 0 311.425 4.089 20 10 DICDRO COc1ccc(O)c(C[NH2+]C/C(C)=C\c2ccc(Cl)cc2)c1 ZINC000753854592 1045810184 /nfs/dbraw/zinc/81/01/84/1045810184.db2.gz UTNHMPAOSJYTAY-LCYFTJDESA-N 1 0 317.816 4.247 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C)cc2OC(C)(C)C)c1 ZINC000754047004 1045837827 /nfs/dbraw/zinc/83/78/27/1045837827.db2.gz SPPMHZPSUVLBLC-UHFFFAOYSA-N 1 0 313.441 4.476 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](C)c2ccc(C)s2)c1O ZINC000754677836 1045910596 /nfs/dbraw/zinc/91/05/96/1045910596.db2.gz XEDYXFBVJKKVNP-SNVBAGLBSA-N 1 0 323.845 4.469 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)CCc2ccc(Cl)cc2)c1O ZINC000754725810 1045919986 /nfs/dbraw/zinc/91/99/86/1045919986.db2.gz AGBDSOMRTHDZSF-UHFFFAOYSA-N 1 0 319.832 4.037 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@@H]2CSC)c(O)c(C(C)(C)C)c1 ZINC000754741822 1045922573 /nfs/dbraw/zinc/92/25/73/1045922573.db2.gz RXNYVRXPCTUMNH-CQSZACIVSA-N 1 0 323.502 4.026 20 10 DICDRO CCC[N@H+](Cc1cc(C)cc(C)c1O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000754742648 1045924086 /nfs/dbraw/zinc/92/40/86/1045924086.db2.gz VXAIAAMSAXITAY-QRQLOZEOSA-N 1 0 317.473 4.035 20 10 DICDRO CC[C@H]([NH2+]CCC1C[C@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000802309007 1045951078 /nfs/dbraw/zinc/95/10/78/1045951078.db2.gz LPTIUSCTUPVOOD-FTRWYGJKSA-N 1 0 318.505 4.387 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@]3(C2)CCCCO3)c(C)n1-c1ccccc1 ZINC001137855882 1045988315 /nfs/dbraw/zinc/98/83/15/1045988315.db2.gz IUOFXANEJCGBDA-NRFANRHFSA-N 1 0 324.468 4.239 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1O ZINC000802657471 1046026506 /nfs/dbraw/zinc/02/65/06/1046026506.db2.gz FWZQREZUBJAAPF-AWEZNQCLSA-N 1 0 313.363 4.255 20 10 DICDRO CCOc1cccc(C[N@H+](C)C/C(C)=C\c2ccccc2)c1O ZINC000756123759 1046053108 /nfs/dbraw/zinc/05/31/08/1046053108.db2.gz YERRJGZLDIJEHN-SSZFMOIBSA-N 1 0 311.425 4.326 20 10 DICDRO CC[NH+](CC)CCC[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000756340241 1046067892 /nfs/dbraw/zinc/06/78/92/1046067892.db2.gz IINIWWLDENGLAU-LLVKDONJSA-N 1 0 319.276 4.082 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCSCc2ccccc2)c1 ZINC000756355187 1046069360 /nfs/dbraw/zinc/06/93/60/1046069360.db2.gz KQMCROQRHXTWFJ-OAHLLOKOSA-N 1 0 301.455 4.285 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCOC2CCCCC2)c(O)c1C ZINC000756358686 1046070314 /nfs/dbraw/zinc/07/03/14/1046070314.db2.gz MGSJZFJBYRGTQK-INIZCTEOSA-N 1 0 305.462 4.399 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2cccs2)N(C)C)c(O)c1C ZINC000756374194 1046071617 /nfs/dbraw/zinc/07/16/17/1046071617.db2.gz YSIMCXNXJPPWJU-GOEBONIOSA-N 1 0 318.486 4.024 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCOc2ccccc2F)c(O)c1C ZINC000756410334 1046076462 /nfs/dbraw/zinc/07/64/62/1046076462.db2.gz HEGFSKSYMAYWBB-HNNXBMFYSA-N 1 0 317.404 4.268 20 10 DICDRO C[C@@H]([NH2+]CCN1CCCC[C@H]1C)c1ccc2ccccc2c1O ZINC000756419466 1046078034 /nfs/dbraw/zinc/07/80/34/1046078034.db2.gz UQPHAYIFUHABKS-HZPDHXFCSA-N 1 0 312.457 4.070 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCOCCc2ccccc2)c(O)c1 ZINC000756434781 1046080619 /nfs/dbraw/zinc/08/06/19/1046080619.db2.gz PTSPHXZDBJWONB-KRWDZBQOSA-N 1 0 313.441 4.001 20 10 DICDRO CCOc1ccccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756442658 1046080716 /nfs/dbraw/zinc/08/07/16/1046080716.db2.gz FRWQHMMNCDCSMV-SWLSCSKDSA-N 1 0 315.388 4.268 20 10 DICDRO CO[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccccc1 ZINC000756445201 1046081377 /nfs/dbraw/zinc/08/13/77/1046081377.db2.gz LGUFZPBPSFIJKY-ISTRZQFTSA-N 1 0 315.388 4.057 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCCN(C)c2ccccc2)c(O)c1 ZINC000756447833 1046081777 /nfs/dbraw/zinc/08/17/77/1046081777.db2.gz YUIVAPPNXHMTEQ-QGZVFWFLSA-N 1 0 312.457 4.268 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCCN(C)c2ccccc2)c1 ZINC000756447420 1046082160 /nfs/dbraw/zinc/08/21/60/1046082160.db2.gz WKEAJJRZCHYDHN-QGZVFWFLSA-N 1 0 312.457 4.268 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756435238 1046083130 /nfs/dbraw/zinc/08/31/30/1046083130.db2.gz YDFIDUIJCKSLOI-WQGACYEGSA-N 1 0 315.388 4.439 20 10 DICDRO Cc1[nH]c2ccc(C[NH2+][C@@H](C)c3cc(F)ccc3O)cc2c1C ZINC000756463731 1046083556 /nfs/dbraw/zinc/08/35/56/1046083556.db2.gz CFSZXBKPOFOISR-ZDUSSCGKSA-N 1 0 312.388 4.480 20 10 DICDRO C[C@@H]([NH2+]Cc1cn2ccsc2n1)c1ccc2ccccc2c1O ZINC000756457240 1046083878 /nfs/dbraw/zinc/08/38/78/1046083878.db2.gz QWDBNAHSGBIMFV-GFCCVEGCSA-N 1 0 323.421 4.105 20 10 DICDRO CC(C)COc1ccccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756455649 1046084290 /nfs/dbraw/zinc/08/42/90/1046084290.db2.gz AOXSVDKTCDDCCB-AWEZNQCLSA-N 1 0 317.404 4.417 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1 ZINC000756455686 1046085199 /nfs/dbraw/zinc/08/51/99/1046085199.db2.gz KMHVEVWKEPIZII-MLGOLLRUSA-N 1 0 315.388 4.268 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CC=CCC1)c1cc(Br)ccc1O ZINC000756474410 1046086255 /nfs/dbraw/zinc/08/62/55/1046086255.db2.gz IGGZZWMLVIQLRW-RYUDHWBXSA-N 1 0 310.235 4.162 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(-n3ccnc3)cc2)c(O)c1C ZINC000756476242 1046086502 /nfs/dbraw/zinc/08/65/02/1046086502.db2.gz RERHAIYFCNDCFY-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOc2cccc(Cl)c2)c1 ZINC000756477008 1046086900 /nfs/dbraw/zinc/08/69/00/1046086900.db2.gz VLFDYEBTWDGOFQ-CYBMUJFWSA-N 1 0 305.805 4.084 20 10 DICDRO CC(C)OCc1ccccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756466383 1046087486 /nfs/dbraw/zinc/08/74/86/1046087486.db2.gz QGZMTJOMQDWPSV-AWEZNQCLSA-N 1 0 317.404 4.307 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)c(O)c1 ZINC000756481088 1046087757 /nfs/dbraw/zinc/08/77/57/1046087757.db2.gz BMQHHJVVGRQECA-GUYCJALGSA-N 1 0 315.388 4.404 20 10 DICDRO CCCOc1cccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)c1 ZINC000756477030 1046088034 /nfs/dbraw/zinc/08/80/34/1046088034.db2.gz WHEYELKSWXLTAH-AWEZNQCLSA-N 1 0 315.413 4.040 20 10 DICDRO C[C@@H]([NH2+][C@H]1CSCc2ccccc21)c1cc(F)ccc1O ZINC000756490053 1046088572 /nfs/dbraw/zinc/08/85/72/1046088572.db2.gz SMTPPOZNDLZRQV-BZNIZROVSA-N 1 0 303.402 4.170 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOc2ccc(F)cc21)c1cc(F)ccc1O ZINC000756483778 1046088745 /nfs/dbraw/zinc/08/87/45/1046088745.db2.gz XMFDJVHTSVRLPO-ZBEGNZNMSA-N 1 0 319.351 4.235 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCOC2CCCCC2)c2c1c(F)ccc2O ZINC000756490712 1046088867 /nfs/dbraw/zinc/08/88/67/1046088867.db2.gz RHLZLGYGYVUBKD-WFASDCNBSA-N 1 0 307.409 4.019 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)c1 ZINC000756483508 1046089831 /nfs/dbraw/zinc/08/98/31/1046089831.db2.gz RVQQXMFRFJBFSN-SUMWQHHRSA-N 1 0 315.388 4.404 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CSCc3ccccc32)c1 ZINC000756491310 1046090212 /nfs/dbraw/zinc/09/02/12/1046090212.db2.gz ZNXIJSDDFVVXOG-PXAZEXFGSA-N 1 0 315.438 4.040 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCOC2CCCCC2)c2c1c(F)ccc2O ZINC000756490706 1046090219 /nfs/dbraw/zinc/09/02/19/1046090219.db2.gz RHLZLGYGYVUBKD-IUODEOHRSA-N 1 0 307.409 4.019 20 10 DICDRO COc1ccccc1C(C)(C)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000756494770 1046092300 /nfs/dbraw/zinc/09/23/00/1046092300.db2.gz GTXGEQINOJRPRC-HNNXBMFYSA-N 1 0 313.441 4.338 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc3cccnc32)c(O)c1C ZINC000756497403 1046092865 /nfs/dbraw/zinc/09/28/65/1046092865.db2.gz UJGVXUGKWBSJJO-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO COc1ccccc1C(C)(C)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000756494771 1046093035 /nfs/dbraw/zinc/09/30/35/1046093035.db2.gz GTXGEQINOJRPRC-OAHLLOKOSA-N 1 0 313.441 4.338 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2c[nH]c3cc(C)ccc23)c1 ZINC000756516984 1046093308 /nfs/dbraw/zinc/09/33/08/1046093308.db2.gz MHQCGRYVBCNPKX-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@@H](C)c3cc(F)ccc3O)c[nH]c2c1 ZINC000756516187 1046093957 /nfs/dbraw/zinc/09/39/57/1046093957.db2.gz IFCXJJKWVCTMTF-ZDUSSCGKSA-N 1 0 312.388 4.214 20 10 DICDRO Clc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000756517539 1046094842 /nfs/dbraw/zinc/09/48/42/1046094842.db2.gz WPYGZLBZYXZXTH-SFHVURJKSA-N 1 0 313.828 4.442 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2ccccc2c1O ZINC000756514939 1046094910 /nfs/dbraw/zinc/09/49/10/1046094910.db2.gz KOQNTVOBOIAKKA-AWEZNQCLSA-N 1 0 319.404 4.331 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2c[nH]c3cc(F)ccc23)c1 ZINC000756510721 1046095159 /nfs/dbraw/zinc/09/51/59/1046095159.db2.gz UONRMMKUJZGYCJ-CYBMUJFWSA-N 1 0 312.388 4.214 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN([C@H](C)c3ccccc3)C2)c(O)c1 ZINC000756535945 1046095739 /nfs/dbraw/zinc/09/57/39/1046095739.db2.gz SSUGPVIYRPHYBO-SCTDSRPQSA-N 1 0 324.468 4.187 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](O)C1CCCCC1)c1ccc2ccccc2c1O ZINC000756534873 1046095796 /nfs/dbraw/zinc/09/57/96/1046095796.db2.gz LIEFZHHEBTZQCH-AUUYWEPGSA-N 1 0 313.441 4.137 20 10 DICDRO Cc1cccc2[nH]cc(CC[NH2+][C@H](C)c3cc(F)ccc3O)c21 ZINC000756537259 1046095845 /nfs/dbraw/zinc/09/58/45/1046095845.db2.gz XUZSYSIAEDEPKO-CYBMUJFWSA-N 1 0 312.388 4.214 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000756531864 1046096835 /nfs/dbraw/zinc/09/68/35/1046096835.db2.gz AKGQDEBHRWPCKQ-SCTDSRPQSA-N 1 0 324.468 4.187 20 10 DICDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756536353 1046097147 /nfs/dbraw/zinc/09/71/47/1046097147.db2.gz VCBNCJITSQFJBU-XHBSWPGZSA-N 1 0 315.388 4.006 20 10 DICDRO Cc1csc([C@H](C)[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC000756533227 1046097233 /nfs/dbraw/zinc/09/72/33/1046097233.db2.gz DDKCHCKCZDIDGV-PEXQALLHSA-N 1 0 306.406 4.195 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C(C)(C)c2ccccc2)c1 ZINC000756539531 1046098555 /nfs/dbraw/zinc/09/85/55/1046098555.db2.gz PTXUGEXCSYEIML-CABCVRRESA-N 1 0 313.441 4.418 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3O)c2c1c(F)ccc2O ZINC000756549957 1046098613 /nfs/dbraw/zinc/09/86/13/1046098613.db2.gz PPEYBSDHOGLDGX-VCTAVGKDSA-N 1 0 313.372 4.062 20 10 DICDRO CCN1CCCC[C@@H]1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756563027 1046101051 /nfs/dbraw/zinc/10/10/51/1046101051.db2.gz LAZKFDODJIVUHV-NVXWUHKLSA-N 1 0 312.457 4.070 20 10 DICDRO CC(C)n1cc([C@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)cn1 ZINC000756575865 1046101918 /nfs/dbraw/zinc/10/19/18/1046101918.db2.gz QSCXBSRKQFVWGS-TYNCELHUSA-N 1 0 317.408 4.208 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000756582346 1046102075 /nfs/dbraw/zinc/10/20/75/1046102075.db2.gz HOETUUYZHXAQPD-IAGOWNOFSA-N 1 0 310.441 4.020 20 10 DICDRO CC(C)n1cc([C@@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)cn1 ZINC000756575864 1046102492 /nfs/dbraw/zinc/10/24/92/1046102492.db2.gz QSCXBSRKQFVWGS-LALPHHSUSA-N 1 0 317.408 4.208 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2)c(O)c1C ZINC000756572407 1046102975 /nfs/dbraw/zinc/10/29/75/1046102975.db2.gz GEKARBHFJXBLFZ-LSDHHAIUSA-N 1 0 301.434 4.198 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c(O)c1C ZINC000756583583 1046104750 /nfs/dbraw/zinc/10/47/50/1046104750.db2.gz BIQNEZBHTUZZIO-MRXNPFEDSA-N 1 0 312.457 4.234 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCN(c3ccccc3)C2)c1 ZINC000756581521 1046104989 /nfs/dbraw/zinc/10/49/89/1046104989.db2.gz DCDIPBJCIUIGTG-IRXDYDNUSA-N 1 0 310.441 4.020 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)c2cccc(F)c2)c1 ZINC000756592012 1046106789 /nfs/dbraw/zinc/10/67/89/1046106789.db2.gz RNXFKRPCQNLUIW-ZDUSSCGKSA-N 1 0 317.404 4.168 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccc(Cl)cc1 ZINC000756608478 1046107940 /nfs/dbraw/zinc/10/79/40/1046107940.db2.gz CLQRARWRMAQHTL-GTNSWQLSSA-N 1 0 323.795 4.223 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(C)c(C)c2O)C12CCC2 ZINC000756613728 1046109444 /nfs/dbraw/zinc/10/94/44/1046109444.db2.gz QKRAGFLAXAYNCU-HYVNUMGLSA-N 1 0 303.446 4.007 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Sc1ccccc1 ZINC000756611406 1046109567 /nfs/dbraw/zinc/10/95/67/1046109567.db2.gz SKYFFPLAOUPVOU-STQMWFEESA-N 1 0 305.418 4.363 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000756624920 1046112005 /nfs/dbraw/zinc/11/20/05/1046112005.db2.gz HIPXQYIMZBYWJA-LBPRGKRZSA-N 1 0 305.418 4.412 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1SCCc2ccccc21)c1cc(F)ccc1O ZINC000756636862 1046113744 /nfs/dbraw/zinc/11/37/44/1046113744.db2.gz XENVZSBXXHFASO-KZULUSFZSA-N 1 0 317.429 4.213 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CCCC[C@H]1O)c1ccc2ccccc2c1O ZINC000756639035 1046113811 /nfs/dbraw/zinc/11/38/11/1046113811.db2.gz VQJRQYMZGRTSCN-QMIHWGKISA-N 1 0 313.441 4.137 20 10 DICDRO Cc1ccccc1[C@H](CO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756635034 1046114699 /nfs/dbraw/zinc/11/46/99/1046114699.db2.gz DFMBPPDIDCEPPF-YWZLYKJASA-N 1 0 321.420 4.238 20 10 DICDRO CCO[C@@H](CC[NH2+][C@@H](C)c1ccc(C)cc1O)C1CCCC1 ZINC000756635698 1046114920 /nfs/dbraw/zinc/11/49/20/1046114920.db2.gz HDMULXJSKDDBEX-KXBFYZLASA-N 1 0 305.462 4.337 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCCC1 ZINC000756644560 1046116702 /nfs/dbraw/zinc/11/67/02/1046116702.db2.gz BEXVVQSWOKOUMC-MRXNPFEDSA-N 1 0 305.462 4.257 20 10 DICDRO COc1ccc(CC[NH2+][C@@H](C)c2cc(F)ccc2O)c(Cl)c1 ZINC000756647283 1046116712 /nfs/dbraw/zinc/11/67/12/1046116712.db2.gz SAJQDOXZPIPHFA-NSHDSACASA-N 1 0 323.795 4.087 20 10 DICDRO CC(C)c1csc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC000756657738 1046118620 /nfs/dbraw/zinc/11/86/20/1046118620.db2.gz FWFXAZUOEXWLFO-JQWIXIFHSA-N 1 0 320.433 4.449 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@@H](O)c2ccccc2)c(O)c1C ZINC000756674824 1046119749 /nfs/dbraw/zinc/11/97/49/1046119749.db2.gz BNWSYXRIVAPMON-URLQWDBASA-N 1 0 313.441 4.172 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1ccc(C)cc1O ZINC000756684146 1046119840 /nfs/dbraw/zinc/11/98/40/1046119840.db2.gz LAFSQAGNDQJNIV-KDOFPFPSSA-N 1 0 311.425 4.437 20 10 DICDRO COc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000756683689 1046120305 /nfs/dbraw/zinc/12/03/05/1046120305.db2.gz UBAJBVOUJDBTTL-OAHLLOKOSA-N 1 0 313.441 4.338 20 10 DICDRO COc1ccc2c(c1)CN(Cc1ccc(N3CCCCC3)cc1)C2 ZINC001138219428 1046120506 /nfs/dbraw/zinc/12/05/06/1046120506.db2.gz AOBQZEBIPMLAKK-UHFFFAOYSA-N 1 0 322.452 4.201 20 10 DICDRO CCC1(O)CCC([NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000756677647 1046120722 /nfs/dbraw/zinc/12/07/22/1046120722.db2.gz RVWJNMUGTLWKKM-FNMUINPESA-N 1 0 317.473 4.005 20 10 DICDRO COc1cccc2c1CN(Cc1ccc(N3CCCCC3)cc1)C2 ZINC001138220417 1046120841 /nfs/dbraw/zinc/12/08/41/1046120841.db2.gz BRBFHZVMJLBWQO-UHFFFAOYSA-N 1 0 322.452 4.201 20 10 DICDRO FC(F)[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138219749 1046121075 /nfs/dbraw/zinc/12/10/75/1046121075.db2.gz MXDBDDRRKMPOPZ-MRXNPFEDSA-N 1 0 308.416 4.154 20 10 DICDRO C[C@]1(F)CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001138215674 1046121128 /nfs/dbraw/zinc/12/11/28/1046121128.db2.gz OCFABRUYNGYSBG-IBGZPJMESA-N 1 0 304.453 4.391 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1cc(Cl)ccc1O ZINC000756706107 1046121712 /nfs/dbraw/zinc/12/17/12/1046121712.db2.gz GWOBWLRESDWVNI-SGTLLEGYSA-N 1 0 317.816 4.010 20 10 DICDRO COc1cccc(C[C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000756706911 1046122041 /nfs/dbraw/zinc/12/20/41/1046122041.db2.gz ITUWPQGAMXZFLY-STQMWFEESA-N 1 0 319.832 4.336 20 10 DICDRO COc1cccc(C[C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000756708596 1046122463 /nfs/dbraw/zinc/12/24/63/1046122463.db2.gz RXICTRKZTORKIZ-GDBMZVCRSA-N 1 0 313.441 4.299 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCNc2ccc3ccccc3n2)c1 ZINC000756738296 1046124070 /nfs/dbraw/zinc/12/40/70/1046124070.db2.gz FBJBXUYEZOZOFV-OAHLLOKOSA-N 1 0 321.424 4.012 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccccc2Cl)c(O)c1C ZINC000756741289 1046125550 /nfs/dbraw/zinc/12/55/50/1046125550.db2.gz WZWVIDZNSVKQIU-SUMWQHHRSA-N 1 0 319.832 4.047 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000756755596 1046126389 /nfs/dbraw/zinc/12/63/89/1046126389.db2.gz BGODSHPGSZNUOP-BLLLJJGKSA-N 1 0 311.853 4.292 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccccc2Cl)c(O)c1C ZINC000756741287 1046126681 /nfs/dbraw/zinc/12/66/81/1046126681.db2.gz WZWVIDZNSVKQIU-GUYCJALGSA-N 1 0 319.832 4.047 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c(C)c1 ZINC000756761115 1046127293 /nfs/dbraw/zinc/12/72/93/1046127293.db2.gz RGWMXYVZCQBUNH-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)CO2 ZINC000756758461 1046127440 /nfs/dbraw/zinc/12/74/40/1046127440.db2.gz FSYKVWXUGYHKGR-ABAIWWIYSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cc3c(cc1O)CCCC3)CO2 ZINC000756757787 1046127903 /nfs/dbraw/zinc/12/79/03/1046127903.db2.gz BWVCWNCZUULNLT-AUUYWEPGSA-N 1 0 323.436 4.364 20 10 DICDRO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cc(Cl)ccc1O ZINC000756757746 1046128102 /nfs/dbraw/zinc/12/81/02/1046128102.db2.gz BJCXBNQDCDMTEO-YMTOWFKASA-N 1 0 324.207 4.483 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1Cl ZINC000756760960 1046128120 /nfs/dbraw/zinc/12/81/20/1046128120.db2.gz QDIHONJJXMZJMD-UGSOOPFHSA-N 1 0 319.832 4.392 20 10 DICDRO C[C@H]([NH2+]CCC[C@@H]1CCCC[C@@H]1O)c1cc(Cl)ccc1O ZINC000756761747 1046128180 /nfs/dbraw/zinc/12/81/80/1046128180.db2.gz UZWHRCLTCXAMHS-XEZPLFJOSA-N 1 0 311.853 4.028 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c(C)c1 ZINC000756757701 1046128439 /nfs/dbraw/zinc/12/84/39/1046128439.db2.gz APRUYFMZOAPSOL-BLLLJJGKSA-N 1 0 315.388 4.186 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)cc1 ZINC000195662010 1046129346 /nfs/dbraw/zinc/12/93/46/1046129346.db2.gz LOKLZKBSGQCCOC-FQEVSTJZSA-N 1 0 310.441 4.098 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000756766159 1046129477 /nfs/dbraw/zinc/12/94/77/1046129477.db2.gz WAFVBJXARLRCGY-DOMZBBRYSA-N 1 0 309.400 4.500 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2c3ccccc3n(C)c2C)cc1 ZINC001138253717 1046129770 /nfs/dbraw/zinc/12/97/70/1046129770.db2.gz DPBMWCJQKLLCTI-UHFFFAOYSA-N 1 0 308.425 4.127 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756769253 1046129867 /nfs/dbraw/zinc/12/98/67/1046129867.db2.gz PGRREZSZIDFFBS-RBZYPMLTSA-N 1 0 318.392 4.078 20 10 DICDRO COc1cccc(C(C)(C)C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000756770383 1046130298 /nfs/dbraw/zinc/13/02/98/1046130298.db2.gz UXYREYHKLSFBOO-CYBMUJFWSA-N 1 0 317.404 4.168 20 10 DICDRO CCOc1cc(Cl)ccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756770592 1046130505 /nfs/dbraw/zinc/13/05/05/1046130505.db2.gz WKYPQFYXXPXQFC-NSHDSACASA-N 1 0 323.795 4.434 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756779032 1046131688 /nfs/dbraw/zinc/13/16/88/1046131688.db2.gz IHENGSTUWBPXMT-ZUZCIYMTSA-N 1 0 319.351 4.017 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000756781602 1046132184 /nfs/dbraw/zinc/13/21/84/1046132184.db2.gz HIWAQZKUZXOPDI-TYILLQQXSA-N 1 0 317.404 4.267 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756779026 1046132266 /nfs/dbraw/zinc/13/22/66/1046132266.db2.gz IHENGSTUWBPXMT-BMIGLBTASA-N 1 0 319.351 4.017 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C)[C@H]2c2ccccc2)c(O)c1C ZINC000756784018 1046133551 /nfs/dbraw/zinc/13/35/51/1046133551.db2.gz KBRAQCMAKBITRD-DBVUQKKJSA-N 1 0 324.468 4.105 20 10 DICDRO COc1ccc(C[C@H](C)C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756785024 1046133619 /nfs/dbraw/zinc/13/36/19/1046133619.db2.gz RRBBQKOINSTQRS-KBPBESRZSA-N 1 0 317.404 4.069 20 10 DICDRO COc1ccc(C[C@@H](C)C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000756786020 1046133856 /nfs/dbraw/zinc/13/38/56/1046133856.db2.gz WQMPWCRRMDZBPS-HZPDHXFCSA-N 1 0 313.441 4.239 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]C2(c3ccccc3F)CC2)c2c1c(F)ccc2O ZINC000756833174 1046141866 /nfs/dbraw/zinc/14/18/66/1046141866.db2.gz JTPGDCWPRDMUML-XHDPSFHLSA-N 1 0 315.363 4.498 20 10 DICDRO COc1cccc(C2([NH2+][C@H](C)c3cc(Cl)ccc3O)CC2)c1 ZINC000756845022 1046142154 /nfs/dbraw/zinc/14/21/54/1046142154.db2.gz QJPMAFGUDIFTLI-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c(O)c1C ZINC000756858253 1046145934 /nfs/dbraw/zinc/14/59/34/1046145934.db2.gz SPMOFBKFRUKOOP-RGIVZKHGSA-N 1 0 315.457 4.007 20 10 DICDRO CCC[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@H](C)CC ZINC001138338344 1046153764 /nfs/dbraw/zinc/15/37/64/1046153764.db2.gz OURMICGDJHXBFW-OAHLLOKOSA-N 1 0 316.489 4.102 20 10 DICDRO CN1CCCc2cc(C[NH+]3CCC4(CC[C@H](F)C4)CC3)ccc21 ZINC001138355793 1046155611 /nfs/dbraw/zinc/15/56/11/1046155611.db2.gz CZGNEONSIVUWSP-SFHVURJKSA-N 1 0 316.464 4.173 20 10 DICDRO CN1CCCc2cc(C[N@H+](C)[C@@H]3CCc4ccccc43)ccc21 ZINC001138360357 1046156737 /nfs/dbraw/zinc/15/67/37/1046156737.db2.gz ULZYDGZGMAXGMP-OAQYLSRUSA-N 1 0 306.453 4.188 20 10 DICDRO C[C@@H](c1ccccc1)N(CC[NH+]1CCCC1)Cc1ccccc1O ZINC000757272582 1046172012 /nfs/dbraw/zinc/17/20/12/1046172012.db2.gz AWIHTUXMHUCTDA-SFHVURJKSA-N 1 0 324.468 4.051 20 10 DICDRO C[C@H](c1ccccc1)N(CC[NH+]1CCCC1)Cc1ccccc1O ZINC000757272581 1046172526 /nfs/dbraw/zinc/17/25/26/1046172526.db2.gz AWIHTUXMHUCTDA-GOSISDBHSA-N 1 0 324.468 4.051 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2nccc3c2CCCC3)c(O)c1 ZINC000903182847 1046185460 /nfs/dbraw/zinc/18/54/60/1046185460.db2.gz VTNHCWMQGNMSFO-OAHLLOKOSA-N 1 0 310.441 4.134 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2nc3c(s2)CCC3)c1O ZINC000903190604 1046186967 /nfs/dbraw/zinc/18/69/67/1046186967.db2.gz BUIHXKIGWSEDKC-JTQLQIEISA-N 1 0 322.861 4.150 20 10 DICDRO Cc1c2ccccc2sc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001138463745 1046191880 /nfs/dbraw/zinc/19/18/80/1046191880.db2.gz NAYLOVZQUHAYOG-UHFFFAOYSA-N 1 0 309.434 4.474 20 10 DICDRO CC[N@H+](Cc1ccc(OC)c(Cl)c1)Cc1ccccc1O ZINC001138474311 1046193383 /nfs/dbraw/zinc/19/33/83/1046193383.db2.gz BZZPCFZOBHQLOG-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CC(C)(C)OC2(C)C)c2c1c(F)ccc2O ZINC000757632162 1046196021 /nfs/dbraw/zinc/19/60/21/1046196021.db2.gz VZJLRIXXBINEBC-OSMZGAPFSA-N 1 0 307.409 4.015 20 10 DICDRO COC1CCC(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000757681174 1046201509 /nfs/dbraw/zinc/20/15/09/1046201509.db2.gz XVSRSCWCYUNABW-USPMSXPRSA-N 1 0 321.436 4.265 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2c[nH]c(=O)c3ccccc23)c(O)c1C ZINC000903235988 1046202627 /nfs/dbraw/zinc/20/26/27/1046202627.db2.gz RUACNMMMSPFIES-CQSZACIVSA-N 1 0 322.408 4.114 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(OC)c2O)cc1C ZINC000903235694 1046202718 /nfs/dbraw/zinc/20/27/18/1046202718.db2.gz ZTNSXRVCSUMNID-ZIAGYGMSSA-N 1 0 315.413 4.130 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C)cc2OC)cc1 ZINC000757694576 1046203061 /nfs/dbraw/zinc/20/30/61/1046203061.db2.gz PJRNNMKJLFCEBO-UHFFFAOYSA-N 1 0 312.457 4.140 20 10 DICDRO COc1c(Cl)cccc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000903246106 1046207341 /nfs/dbraw/zinc/20/73/41/1046207341.db2.gz MLCVJGJKBZBEKJ-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO CCCc1ccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)s1 ZINC001138528496 1046212481 /nfs/dbraw/zinc/21/24/81/1046212481.db2.gz VIZOHFJLGBQWOV-UHFFFAOYSA-N 1 0 317.454 4.060 20 10 DICDRO Cc1cc(CO)cc(C)c1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000903303963 1046230455 /nfs/dbraw/zinc/23/04/55/1046230455.db2.gz XEBPYDXDMUVUAI-ZDUSSCGKSA-N 1 0 319.832 4.006 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]C2CC3(C2)COC(C)(C)C3)c2c1c(F)ccc2O ZINC000903323272 1046236911 /nfs/dbraw/zinc/23/69/11/1046236911.db2.gz IHUOYHRBROSEPU-UEWHRMHWSA-N 1 0 319.420 4.017 20 10 DICDRO CC[C@@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1cc(Cl)ccc1O ZINC000903325507 1046240243 /nfs/dbraw/zinc/24/02/43/1046240243.db2.gz IECOXSZCNZXUGR-GDBMZVCRSA-N 1 0 317.820 4.028 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000903334675 1046245719 /nfs/dbraw/zinc/24/57/19/1046245719.db2.gz FDVWXRKZEFGUTN-SZNDQCEHSA-N 1 0 322.452 4.468 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(C(F)(F)F)s2)cc1C ZINC000758334252 1046262479 /nfs/dbraw/zinc/26/24/79/1046262479.db2.gz HMJDIEOZHUVOOL-UHFFFAOYSA-N 1 0 315.360 4.374 20 10 DICDRO COC(C)(C)C[N@H+](C)Cc1cc2oc3ccccc3c2cc1O ZINC000758405702 1046266134 /nfs/dbraw/zinc/26/61/34/1046266134.db2.gz SRGGNCIZCSJYEK-UHFFFAOYSA-N 1 0 313.397 4.148 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)CCCO2 ZINC001138716911 1046276091 /nfs/dbraw/zinc/27/60/91/1046276091.db2.gz CKGPISGYWXNLRG-UHFFFAOYSA-N 1 0 324.468 4.100 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccc(Cl)cc1O ZINC000903427836 1046278005 /nfs/dbraw/zinc/27/80/05/1046278005.db2.gz AAZAKQQPDVKYEV-APPDUMDISA-N 1 0 302.805 4.243 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1cccc(F)c1F ZINC001202859238 1046279159 /nfs/dbraw/zinc/27/91/59/1046279159.db2.gz DTPZMAPJEPUWGD-AWEZNQCLSA-N 1 0 318.411 4.060 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H](C)Cc1ccc(Cl)cc1 ZINC001168187087 1046328851 /nfs/dbraw/zinc/32/88/51/1046328851.db2.gz DUOFZDYVPBPGBL-CQSZACIVSA-N 1 0 303.833 4.499 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](COC)c2ccccc2)cc1 ZINC000246441222 1046354085 /nfs/dbraw/zinc/35/40/85/1046354085.db2.gz ONDLYXJIVFCMAY-OXQOHEQNSA-N 1 0 312.457 4.181 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CC2)OCc2ccccc23)cc1C ZINC000759749989 1046378944 /nfs/dbraw/zinc/37/89/44/1046378944.db2.gz KADNQMMXVRYKDD-UHFFFAOYSA-N 1 0 323.436 4.031 20 10 DICDRO Cc1cc(O)c(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)cc1C ZINC000780793880 1046406596 /nfs/dbraw/zinc/40/65/96/1046406596.db2.gz WHSZOTHAQLQAPY-OCCSQVGLSA-N 1 0 301.352 4.172 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](OC(F)F)C2)cc1C(C)C ZINC000781149665 1046426696 /nfs/dbraw/zinc/42/66/96/1046426696.db2.gz OXWZYCUNAAXTDV-AWEZNQCLSA-N 1 0 313.388 4.028 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)C1CCCCC1 ZINC000749130106 1046431948 /nfs/dbraw/zinc/43/19/48/1046431948.db2.gz OZBZAOKKVWHVIY-SJORKVTESA-N 1 0 316.489 4.143 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCCO1)c1ccc(N(C)C)cc1 ZINC000247078641 1046458744 /nfs/dbraw/zinc/45/87/44/1046458744.db2.gz QSBZTIWDOJPKLW-DQLDELGASA-N 1 0 324.468 4.324 20 10 DICDRO COc1cc(Cl)cc(C[NH+]2CCC(c3ccco3)CC2)c1O ZINC000826877215 1046489727 /nfs/dbraw/zinc/48/97/27/1046489727.db2.gz DEHFLTKFPADQSC-UHFFFAOYSA-N 1 0 321.804 4.027 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](CC)[C@@H](C)c2cccc(O)c2)c1 ZINC000091975274 1046490396 /nfs/dbraw/zinc/49/03/96/1046490396.db2.gz IIRXBXDZQUEPLT-AWEZNQCLSA-N 1 0 315.413 4.080 20 10 DICDRO Cc1csc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1Cl ZINC001137292941 1046490864 /nfs/dbraw/zinc/49/08/64/1046490864.db2.gz WPJVDAHYMRNFER-UHFFFAOYSA-N 1 0 308.878 4.408 20 10 DICDRO Cc1cc(CN2Cc3cccc(Cl)c3C2)ccc1N(C)C ZINC001139673370 1046496821 /nfs/dbraw/zinc/49/68/21/1046496821.db2.gz FRUSYLPSFRYITM-UHFFFAOYSA-N 1 0 300.833 4.230 20 10 DICDRO Cc1cc(CN(C)Cc2csc(C(C)C)n2)ccc1N(C)C ZINC001139673564 1046497619 /nfs/dbraw/zinc/49/76/19/1046497619.db2.gz SNSJYPCGRHKBTD-UHFFFAOYSA-N 1 0 317.502 4.273 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1Br ZINC000782530455 1046534435 /nfs/dbraw/zinc/53/44/35/1046534435.db2.gz GIQTZPVDAIDULU-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO Cc1ccc(C(F)(F)F)cc1C[N@H+](C)Cc1ccccc1O ZINC001139886638 1046545687 /nfs/dbraw/zinc/54/56/87/1046545687.db2.gz HKUDFOXZBYXPKH-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO COc1cc(C[N@H+](C)Cc2cc(C)ccc2O)ccc1SC ZINC000092674463 1046550122 /nfs/dbraw/zinc/55/01/22/1046550122.db2.gz XRHRMSPIUVEDOR-UHFFFAOYSA-N 1 0 317.454 4.063 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cnc(C)s2)cc1 ZINC000179134381 1046551686 /nfs/dbraw/zinc/55/16/86/1046551686.db2.gz UEDRNKUWTIKCEL-CYBMUJFWSA-N 1 0 303.475 4.149 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccc(F)c1 ZINC000783229266 1046566598 /nfs/dbraw/zinc/56/65/98/1046566598.db2.gz DLYBDWWVCODTOA-IBGZPJMESA-N 1 0 312.432 4.449 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(n2ccc3ccccc32)CC1 ZINC001140058732 1046578798 /nfs/dbraw/zinc/57/87/98/1046578798.db2.gz KBVHHBJIXGWOQJ-UHFFFAOYSA-N 1 0 324.399 4.323 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC=CO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000783309701 1046579050 /nfs/dbraw/zinc/57/90/50/1046579050.db2.gz JOXTTWMKLQDAOM-RDJZCZTQSA-N 1 0 318.436 4.159 20 10 DICDRO CC(C)[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000783330337 1046582808 /nfs/dbraw/zinc/58/28/08/1046582808.db2.gz LZELFUXCWBMSDS-IUODEOHRSA-N 1 0 302.384 4.380 20 10 DICDRO CC(C)[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000783330336 1046583470 /nfs/dbraw/zinc/58/34/70/1046583470.db2.gz LZELFUXCWBMSDS-DOMZBBRYSA-N 1 0 302.384 4.380 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000237088357 1046594057 /nfs/dbraw/zinc/59/40/57/1046594057.db2.gz WIQVAUQRUMSTOQ-FQEVSTJZSA-N 1 0 323.392 4.263 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@@H]1CC2CCC1CC2 ZINC001203005078 1046596647 /nfs/dbraw/zinc/59/66/47/1046596647.db2.gz ALATVUDEESOZFT-USPMSXPRSA-N 1 0 322.443 4.335 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@H]1CC2CCC1CC2 ZINC001203005086 1046597847 /nfs/dbraw/zinc/59/78/47/1046597847.db2.gz ALATVUDEESOZFT-WLIAPVHPSA-N 1 0 322.443 4.335 20 10 DICDRO C[C@H]([NH2+][C@@H](CN1CCCCC1)c1ccccc1)c1ccccc1O ZINC000783504757 1046601909 /nfs/dbraw/zinc/60/19/09/1046601909.db2.gz DLCXNLCDMFCZIH-PXNSSMCTSA-N 1 0 324.468 4.270 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1ccccc1Cl ZINC000783520749 1046603416 /nfs/dbraw/zinc/60/34/16/1046603416.db2.gz YNLAGJKKSHLLQG-PXAZEXFGSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1O ZINC000783521461 1046603749 /nfs/dbraw/zinc/60/37/49/1046603749.db2.gz YNFYONBODUPUMS-RWMBFGLXSA-N 1 0 301.352 4.412 20 10 DICDRO C[C@H]([NH2+][C@@H]1COc2c1ccc(Cl)c2Cl)c1ccccc1O ZINC000783519281 1046603850 /nfs/dbraw/zinc/60/38/50/1046603850.db2.gz RBVHPOPWDQXEHK-TVQRCGJNSA-N 1 0 324.207 4.483 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2O)C12CCCCC2 ZINC000783519111 1046604200 /nfs/dbraw/zinc/60/42/00/1046604200.db2.gz VVRZIUPZCUEEHI-ZTFGCOKTSA-N 1 0 303.446 4.171 20 10 DICDRO C[C@@H]([NH2+]C1(CCOCc2ccccc2)CC1)c1ccccc1O ZINC000783528447 1046605118 /nfs/dbraw/zinc/60/51/18/1046605118.db2.gz NQLCICGNEVACGE-MRXNPFEDSA-N 1 0 311.425 4.182 20 10 DICDRO CC[N@H+](Cc1ccc(-c2ccncc2)cc1)Cc1ccccc1O ZINC001140171171 1046606149 /nfs/dbraw/zinc/60/61/49/1046606149.db2.gz GTSNSIHZVYSXMP-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841746841 1046607901 /nfs/dbraw/zinc/60/79/01/1046607901.db2.gz LOPVZAYMXYFYDX-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc(C)c(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1O ZINC001140182231 1046608990 /nfs/dbraw/zinc/60/89/90/1046608990.db2.gz LLXHMUMLVQJGCZ-GOSISDBHSA-N 1 0 313.466 4.299 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(C)ccc(C)c2O)cc1 ZINC001140179850 1046609183 /nfs/dbraw/zinc/60/91/83/1046609183.db2.gz QCVHYWWASOTYOJ-LJQANCHMSA-N 1 0 311.425 4.355 20 10 DICDRO Cc1ccc(C)c(C[NH+]2CCC(C(=O)c3ccccc3)CC2)c1O ZINC001140179258 1046609507 /nfs/dbraw/zinc/60/95/07/1046609507.db2.gz DJMDCCLRRUTDCC-UHFFFAOYSA-N 1 0 323.436 4.104 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(C)ccc(C)c2O)cc1 ZINC001140179848 1046609854 /nfs/dbraw/zinc/60/98/54/1046609854.db2.gz QCVHYWWASOTYOJ-IBGZPJMESA-N 1 0 311.425 4.355 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](C)c2nc(C)cs2)cc1 ZINC000248488687 1046618035 /nfs/dbraw/zinc/61/80/35/1046618035.db2.gz GUGLUIUNYMPCGO-ZFWWWQNUSA-N 1 0 317.502 4.362 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(F)ccc2O)CCO1 ZINC000248485980 1046619217 /nfs/dbraw/zinc/61/92/17/1046619217.db2.gz FIOFQINRPLPNJJ-DWQUBVKVSA-N 1 0 309.425 4.166 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCO[C@H]2C(C)(C)C)c1 ZINC000248483714 1046619240 /nfs/dbraw/zinc/61/92/40/1046619240.db2.gz CXDNIASFCGAGHY-RLFYNMQTSA-N 1 0 305.462 4.193 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccccn1 ZINC000093338668 1046622059 /nfs/dbraw/zinc/62/20/59/1046622059.db2.gz KWUQLGOCVRIBMO-UHFFFAOYSA-N 1 0 309.457 4.094 20 10 DICDRO COCc1ccc(C[N@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000093319219 1046622172 /nfs/dbraw/zinc/62/21/72/1046622172.db2.gz BBSUCFCPTSYKKY-UHFFFAOYSA-N 1 0 315.413 4.076 20 10 DICDRO C[C@H](OCCC[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834496614 1046623564 /nfs/dbraw/zinc/62/35/64/1046623564.db2.gz NYFSFLQNMKGRAG-MAUKXSAKSA-N 1 0 311.425 4.137 20 10 DICDRO C[C@H](CCCc1cccnc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000834509089 1046624901 /nfs/dbraw/zinc/62/49/01/1046624901.db2.gz WDTLAPNUPBAWCP-GOSISDBHSA-N 1 0 323.484 4.183 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000834519435 1046625405 /nfs/dbraw/zinc/62/54/05/1046625405.db2.gz UIONNDKQMVRGFN-GOSISDBHSA-N 1 0 310.441 4.016 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)c2ncc(C)s2)cc1 ZINC000248647285 1046630580 /nfs/dbraw/zinc/63/05/80/1046630580.db2.gz SWXMCYXAWBGWBZ-DZGCQCFKSA-N 1 0 317.502 4.362 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H](c2ccccc2)N(C)C)c(O)c1 ZINC000248640268 1046631611 /nfs/dbraw/zinc/63/16/11/1046631611.db2.gz NOTBVMYCEZVCFG-RZQQEMMASA-N 1 0 312.457 4.043 20 10 DICDRO Cc1cccc(NC2CC[NH+](Cc3cc(C)ccc3O)CC2)c1 ZINC000093607800 1046635457 /nfs/dbraw/zinc/63/54/57/1046635457.db2.gz MWOIUNDZTCDMSW-UHFFFAOYSA-N 1 0 310.441 4.086 20 10 DICDRO CO[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(Cl)cc1 ZINC000834602011 1046636308 /nfs/dbraw/zinc/63/63/08/1046636308.db2.gz HHGNWOBGHUGVBI-WBVHZDCISA-N 1 0 317.816 4.010 20 10 DICDRO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1cc(C)ccc1O)CCC2 ZINC000093768012 1046637000 /nfs/dbraw/zinc/63/70/00/1046637000.db2.gz BQZARTBTIDLFQL-OAHLLOKOSA-N 1 0 316.470 4.229 20 10 DICDRO CCCC[NH+](CCCC)Cc1ccc(N2CCC(O)CC2)cc1 ZINC001140285137 1046637691 /nfs/dbraw/zinc/63/76/91/1046637691.db2.gz DSNJBKLOMBGESP-UHFFFAOYSA-N 1 0 318.505 4.050 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)C1)CC2 ZINC000834615704 1046639724 /nfs/dbraw/zinc/63/97/24/1046639724.db2.gz IAPTYYUGJDFPOE-KWCYVHTRSA-N 1 0 313.363 4.338 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccccc1N(C)C ZINC000093945475 1046645478 /nfs/dbraw/zinc/64/54/78/1046645478.db2.gz RVVOTMIBOOEZLD-ZDUSSCGKSA-N 1 0 321.515 4.042 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](c3ccc(C)cc3)C2)c1O ZINC000784027714 1046652550 /nfs/dbraw/zinc/65/25/50/1046652550.db2.gz XIXFXXMZDXOKTQ-QGZVFWFLSA-N 1 0 311.425 4.007 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccccc1-c1cccnc1)CC2 ZINC001140318462 1046652966 /nfs/dbraw/zinc/65/29/66/1046652966.db2.gz AJOPGHMVWKWTKC-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO Oc1cccc2c1[C@@H](Nc1cccc(C[NH+]3CCCCC3)c1)CC2 ZINC000834709759 1046653731 /nfs/dbraw/zinc/65/37/31/1046653731.db2.gz NAWLUZHZYQSXJC-IBGZPJMESA-N 1 0 322.452 4.478 20 10 DICDRO Cc1ccccc1C1([NH2+]Cc2ccc3c(c2)CCCO3)CCC1 ZINC001203025182 1046656973 /nfs/dbraw/zinc/65/69/73/1046656973.db2.gz SPLXYXZKGQSULN-UHFFFAOYSA-N 1 0 307.437 4.489 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C1(CCOCc3ccccc3)CC1)CC2 ZINC000834733744 1046658359 /nfs/dbraw/zinc/65/83/59/1046658359.db2.gz UTPTWRFDITWDGT-GOSISDBHSA-N 1 0 323.436 4.109 20 10 DICDRO Oc1cccc(Cl)c1C[NH+]1CCC(c2ccccc2)CC1 ZINC001140338239 1046666143 /nfs/dbraw/zinc/66/61/43/1046666143.db2.gz BYJZMSHUWSXKAY-UHFFFAOYSA-N 1 0 301.817 4.425 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001140344019 1046667777 /nfs/dbraw/zinc/66/77/77/1046667777.db2.gz DMPYYKFJKAWFIT-HNNXBMFYSA-N 1 0 317.816 4.089 20 10 DICDRO Cc1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834779144 1046670111 /nfs/dbraw/zinc/67/01/11/1046670111.db2.gz IDZYQZOZASCMSA-OAHLLOKOSA-N 1 0 321.342 4.497 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccc([N+](=O)[O-])cc1 ZINC000834815300 1046673969 /nfs/dbraw/zinc/67/39/69/1046673969.db2.gz UOGZCACXKDEXDQ-QWRGUYRKSA-N 1 0 320.776 4.366 20 10 DICDRO C[C@@H]([NH2+]CCCC(C)(F)F)c1cc(Br)ccc1O ZINC000834818971 1046675921 /nfs/dbraw/zinc/67/59/21/1046675921.db2.gz QSQHHQCPZWOHAW-SECBINFHSA-N 1 0 322.193 4.241 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc(F)cnc2Cl)c2c1c(F)ccc2O ZINC000834836280 1046680740 /nfs/dbraw/zinc/68/07/40/1046680740.db2.gz LWIOJPWAZOIYSM-PRHODGIISA-N 1 0 324.758 4.057 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000834856396 1046688679 /nfs/dbraw/zinc/68/86/79/1046688679.db2.gz QHWOPDMVRBHUEQ-GOSISDBHSA-N 1 0 311.473 4.166 20 10 DICDRO C[C@H]([NH2+]CC1=CCOCC1)c1ccc(N2CCCCCC2)cc1 ZINC000834867800 1046690127 /nfs/dbraw/zinc/69/01/27/1046690127.db2.gz USQGTOLPRRZXER-KRWDZBQOSA-N 1 0 314.473 4.064 20 10 DICDRO C[C@@H]([NH2+]CC1=CCOCC1)c1ccc(N2CCCCCC2)cc1 ZINC000834867801 1046690579 /nfs/dbraw/zinc/69/05/79/1046690579.db2.gz USQGTOLPRRZXER-QGZVFWFLSA-N 1 0 314.473 4.064 20 10 DICDRO C[C@H](CCCCO)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834876393 1046693182 /nfs/dbraw/zinc/69/31/82/1046693182.db2.gz BKUZZBPOFKHHRN-MSOLQXFVSA-N 1 0 318.505 4.269 20 10 DICDRO C[C@H](CC(C)(C)O)[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000834880426 1046695175 /nfs/dbraw/zinc/69/51/75/1046695175.db2.gz ZGCSFJFMEHQQJZ-HUUCEWRRSA-N 1 0 322.468 4.016 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCOC3(CCC3)C2)c2c1c(F)ccc2O ZINC000834883523 1046696614 /nfs/dbraw/zinc/69/66/14/1046696614.db2.gz QPCOOWZFKVHBPD-UMVBOHGHSA-N 1 0 319.420 4.019 20 10 DICDRO C[C@@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1cc(Cl)ccc1O ZINC000834884561 1046696860 /nfs/dbraw/zinc/69/68/60/1046696860.db2.gz NNWRIUGOAMKMQE-PELKAZGASA-N 1 0 308.636 4.280 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c(O)c1C ZINC000834883345 1046697012 /nfs/dbraw/zinc/69/70/12/1046697012.db2.gz QAEJAXKRZCUOES-CVEARBPZSA-N 1 0 303.446 4.009 20 10 DICDRO Cc1cccnc1CCC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000834882493 1046697260 /nfs/dbraw/zinc/69/72/60/1046697260.db2.gz BFSJXGLJCWYDFY-ZDUSSCGKSA-N 1 0 304.821 4.032 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@H]2CCOC3(CCC3)C2)c2c1c(F)ccc2O ZINC000834883382 1046697342 /nfs/dbraw/zinc/69/73/42/1046697342.db2.gz QPCOOWZFKVHBPD-IPYPFGDCSA-N 1 0 319.420 4.019 20 10 DICDRO CC[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1ccc(C)cc1O ZINC000834885806 1046698482 /nfs/dbraw/zinc/69/84/82/1046698482.db2.gz YOLARXDPLNLZBL-GXTWGEPZSA-N 1 0 302.245 4.325 20 10 DICDRO C[C@@H]([NH2+]CC[C@@]1(C)CC1(Cl)Cl)c1cc(F)ccc1O ZINC000834894375 1046704385 /nfs/dbraw/zinc/70/43/85/1046704385.db2.gz RRMBTDIAWHGCIP-RNCFNFMXSA-N 1 0 306.208 4.156 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCc3cc(F)c(F)c(F)c31)CC2 ZINC000834897196 1046707534 /nfs/dbraw/zinc/70/75/34/1046707534.db2.gz RHWQASFKBLWFAO-QWHCGFSZSA-N 1 0 319.326 4.074 20 10 DICDRO CCCc1ncc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)o1 ZINC000834900103 1046710980 /nfs/dbraw/zinc/71/09/80/1046710980.db2.gz NCUQGPXGVUZQJH-ZDUSSCGKSA-N 1 0 310.397 4.337 20 10 DICDRO CCCc1ncc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)o1 ZINC000834900094 1046711295 /nfs/dbraw/zinc/71/12/95/1046711295.db2.gz NCUQGPXGVUZQJH-CYBMUJFWSA-N 1 0 310.397 4.337 20 10 DICDRO CO[C@@H]([C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C1CC1 ZINC000834903405 1046713354 /nfs/dbraw/zinc/71/33/54/1046713354.db2.gz JEUILRHUBGVZDO-QINHECLXSA-N 1 0 316.489 4.141 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCN(C)c3ccccc32)c1 ZINC000834903702 1046713993 /nfs/dbraw/zinc/71/39/93/1046713993.db2.gz LMAYWYXMLFVKPN-MAUKXSAKSA-N 1 0 310.441 4.323 20 10 DICDRO CCn1cc([C@@H](C)[NH2+][C@H](C)c2ccc3ccccc3c2O)cn1 ZINC000834905150 1046715494 /nfs/dbraw/zinc/71/54/94/1046715494.db2.gz RHDCEYLQXIWBRD-ZIAGYGMSSA-N 1 0 309.413 4.174 20 10 DICDRO CCn1cc([C@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2O)cn1 ZINC000834905143 1046716018 /nfs/dbraw/zinc/71/60/18/1046716018.db2.gz RHDCEYLQXIWBRD-KBPBESRZSA-N 1 0 309.413 4.174 20 10 DICDRO CCn1cc([C@H](C)[NH2+][C@H](C)c2ccc3ccccc3c2O)cn1 ZINC000834905148 1046716772 /nfs/dbraw/zinc/71/67/72/1046716772.db2.gz RHDCEYLQXIWBRD-UONOGXRCSA-N 1 0 309.413 4.174 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)c1 ZINC000834910671 1046717373 /nfs/dbraw/zinc/71/73/73/1046717373.db2.gz VPMCXLGDHIWNNG-CKEIUWERSA-N 1 0 317.454 4.333 20 10 DICDRO CC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(F)cc1[O-] ZINC000796696748 1046718775 /nfs/dbraw/zinc/71/87/75/1046718775.db2.gz UFWIVOMTTKXWJR-YJBOKZPZSA-N 1 0 322.468 4.084 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(C)cn1)c1cc(Cl)ccc1O ZINC000834908163 1046718748 /nfs/dbraw/zinc/71/87/48/1046718748.db2.gz CGUPUEFSQJAPIF-INIZCTEOSA-N 1 0 304.821 4.032 20 10 DICDRO Oc1cc(Cl)ccc1C[NH+]1CCC2(CC(F)(F)C2)CC1 ZINC001140462663 1046735928 /nfs/dbraw/zinc/73/59/28/1046735928.db2.gz KUGWKYCBPCLLOZ-UHFFFAOYSA-N 1 0 301.764 4.057 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH+]2CCC(OC(C)(C)C)CC2)cc1 ZINC000835026797 1046743065 /nfs/dbraw/zinc/74/30/65/1046743065.db2.gz HZLAXQKIDUYNPK-SREVYHEPSA-N 1 0 316.489 4.045 20 10 DICDRO CC[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1nc(C)cs1 ZINC000835039120 1046745870 /nfs/dbraw/zinc/74/58/70/1046745870.db2.gz WNDUZFOBRLAEMI-LXXRFIIISA-N 1 0 315.486 4.272 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835042393 1046746617 /nfs/dbraw/zinc/74/66/17/1046746617.db2.gz HKJWNLRKYYFITA-MWWKQMNYSA-N 1 0 309.457 4.074 20 10 DICDRO CC(C)[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cccnc1 ZINC000835043571 1046747647 /nfs/dbraw/zinc/74/76/47/1046747647.db2.gz SCMGUCFYSGOJLP-XYASWCNUSA-N 1 0 323.484 4.190 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835042391 1046747780 /nfs/dbraw/zinc/74/77/80/1046747780.db2.gz HKJWNLRKYYFITA-MOEXGYKKSA-N 1 0 309.457 4.074 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@H+](C)C2CCC(F)(F)CC2)cc1 ZINC000835052799 1046751825 /nfs/dbraw/zinc/75/18/25/1046751825.db2.gz HQQUHIZAQHLBIK-SNAWJCMRSA-N 1 0 308.416 4.276 20 10 DICDRO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000797058781 1046781565 /nfs/dbraw/zinc/78/15/65/1046781565.db2.gz GWLJMWRINDOAIQ-GQIGUUNPSA-N 1 0 313.441 4.090 20 10 DICDRO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1 ZINC000797058476 1046782233 /nfs/dbraw/zinc/78/22/33/1046782233.db2.gz FMEPOAPFWDXSLS-ZJNRKIDTSA-N 1 0 319.832 4.127 20 10 DICDRO C[C@@]1(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C[C@@]1(F)Cl ZINC001203048236 1046789160 /nfs/dbraw/zinc/78/91/60/1046789160.db2.gz JKCJIAVFTXTREX-MSOLQXFVSA-N 1 0 324.871 4.471 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001140620879 1046814011 /nfs/dbraw/zinc/81/40/11/1046814011.db2.gz DPGLMEFNVLEYDN-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001140623934 1046818006 /nfs/dbraw/zinc/81/80/06/1046818006.db2.gz XSAJHBPLDFSELE-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000797586630 1046854441 /nfs/dbraw/zinc/85/44/41/1046854441.db2.gz JDCQERABVSJRLL-OLZOCXBDSA-N 1 0 309.400 4.357 20 10 DICDRO C[C@@H]([NH2+]Cc1cc2c(cc1O)OCO2)c1cccc2ccccc21 ZINC000237381847 1046880952 /nfs/dbraw/zinc/88/09/52/1046880952.db2.gz YJQSBULSRKOJGX-CYBMUJFWSA-N 1 0 321.376 4.125 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1O ZINC001140748165 1046883794 /nfs/dbraw/zinc/88/37/94/1046883794.db2.gz SUBUAITYFWKDNV-OAHLLOKOSA-N 1 0 319.351 4.022 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)c1O ZINC001140747446 1046885694 /nfs/dbraw/zinc/88/56/94/1046885694.db2.gz DLOTYGSKQCMBLM-LBPRGKRZSA-N 1 0 323.845 4.458 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1O ZINC001140748806 1046885898 /nfs/dbraw/zinc/88/58/98/1046885898.db2.gz KEYCCBFROBEEGA-CQSZACIVSA-N 1 0 317.816 4.049 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)c1 ZINC000797998729 1046917293 /nfs/dbraw/zinc/91/72/93/1046917293.db2.gz KXVKIRVGUJWXKB-XNRPHZJLSA-N 1 0 315.388 4.137 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(SC)cc1)c1ccccc1O ZINC000797999091 1046918593 /nfs/dbraw/zinc/91/85/93/1046918593.db2.gz PNGIFQAQRLSZDM-QGZVFWFLSA-N 1 0 301.455 4.398 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1cc(F)ccc1O ZINC000797998291 1046918674 /nfs/dbraw/zinc/91/86/74/1046918674.db2.gz FGZKNICUPZWCEL-AXAPSJFSSA-N 1 0 303.352 4.267 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c(O)c1 ZINC001140855522 1046930598 /nfs/dbraw/zinc/93/05/98/1046930598.db2.gz CYPANBNAQUFZRQ-YJBOKZPZSA-N 1 0 302.462 4.003 20 10 DICDRO Cc1ccc(C[NH+]2CCC3(CCc4ccccc43)CC2)c(O)c1 ZINC001140948186 1046957962 /nfs/dbraw/zinc/95/79/62/1046957962.db2.gz XDXGJPFHLKERMR-UHFFFAOYSA-N 1 0 307.437 4.181 20 10 DICDRO Cc1ccc(C[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)c(O)c1 ZINC001140958017 1046961633 /nfs/dbraw/zinc/96/16/33/1046961633.db2.gz PWTKAZGIWGVBOG-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Cc1ccc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)c(O)c1 ZINC001140957659 1046962567 /nfs/dbraw/zinc/96/25/67/1046962567.db2.gz HMXXOPZMZFIMHJ-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c(O)c1 ZINC001140957544 1046962720 /nfs/dbraw/zinc/96/27/20/1046962720.db2.gz DDQAJGPDELNQJD-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO FC1(F)CCC[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)CC1 ZINC001141074509 1046998125 /nfs/dbraw/zinc/99/81/25/1046998125.db2.gz KGNOPVADSBWUOI-UHFFFAOYSA-N 1 0 320.427 4.007 20 10 DICDRO C[N@H+](Cc1ccsc1)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141075903 1046999144 /nfs/dbraw/zinc/99/91/44/1046999144.db2.gz FUDYRIPFMNEADW-UHFFFAOYSA-N 1 0 312.482 4.079 20 10 DICDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1ccc2c(c1)OCCN2C ZINC001141144762 1047024705 /nfs/dbraw/zinc/02/47/05/1047024705.db2.gz KHXIGEFYTRZCQY-GOSISDBHSA-N 1 0 310.441 4.098 20 10 DICDRO C[N@H+](Cc1cc(O)ccc1O)C(c1ccccc1)c1ccccc1 ZINC001141156066 1047029167 /nfs/dbraw/zinc/02/91/67/1047029167.db2.gz PDGKNOBVFRHEEH-UHFFFAOYSA-N 1 0 319.404 4.319 20 10 DICDRO Oc1ccc(O)c(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)c1 ZINC001141156779 1047029528 /nfs/dbraw/zinc/02/95/28/1047029528.db2.gz UYPLRSHHNVKHCI-UHFFFAOYSA-N 1 0 315.800 4.041 20 10 DICDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c1 ZINC001141161964 1047030840 /nfs/dbraw/zinc/03/08/40/1047030840.db2.gz IPFDHFBFOHYOBT-INIZCTEOSA-N 1 0 303.789 4.088 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1ccc(C)cc1O ZINC000799727826 1047059583 /nfs/dbraw/zinc/05/95/83/1047059583.db2.gz ACEHSSYMYUKKCK-SFHVURJKSA-N 1 0 308.425 4.465 20 10 DICDRO CCc1ccc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001116102962 1047108101 /nfs/dbraw/zinc/10/81/01/1047108101.db2.gz QIFVXALSSZRSCG-UHFFFAOYSA-N 1 0 308.469 4.182 20 10 DICDRO C[C@H]([NH2+]CCCCOc1ccccc1)c1ccc(N(C)C)cc1 ZINC001116291448 1047127302 /nfs/dbraw/zinc/12/73/02/1047127302.db2.gz PEHSPEURXROZIW-KRWDZBQOSA-N 1 0 312.457 4.262 20 10 DICDRO CS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC001116444891 1047142609 /nfs/dbraw/zinc/14/26/09/1047142609.db2.gz CXOQJOKUHJLMIS-RTBURBONSA-N 1 0 318.530 4.393 20 10 DICDRO Oc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(N3CCCC3)cc2)cc1 ZINC001116442483 1047142737 /nfs/dbraw/zinc/14/27/37/1047142737.db2.gz YTZSFMABPUMNIY-OAQYLSRUSA-N 1 0 322.452 4.330 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1N(C)C)c1ccc2ccccc2c1O ZINC001116565393 1047157090 /nfs/dbraw/zinc/15/70/90/1047157090.db2.gz QUZYJHVAVZPLLM-KYNGSXCRSA-N 1 0 312.457 4.069 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC1([C@H](C)CCO)CCC1 ZINC001116589327 1047159585 /nfs/dbraw/zinc/15/95/85/1047159585.db2.gz UEOLGRYOMXGMOS-OAGGEKHMSA-N 1 0 317.473 4.027 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c(C)c1 ZINC001116589116 1047159709 /nfs/dbraw/zinc/15/97/09/1047159709.db2.gz QCMIIZFRGPAAJS-WMLDXEAASA-N 1 0 311.425 4.356 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c(C)c1 ZINC001116589112 1047160346 /nfs/dbraw/zinc/16/03/46/1047160346.db2.gz QCMIIZFRGPAAJS-PBHICJAKSA-N 1 0 311.425 4.356 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1ccc(C)nc1Cl ZINC000838859864 1047164624 /nfs/dbraw/zinc/16/46/24/1047164624.db2.gz OQEWDPNTXVFUQZ-UHFFFAOYSA-N 1 0 304.821 4.161 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccc(Cl)cn1 ZINC001116673445 1047167136 /nfs/dbraw/zinc/16/71/36/1047167136.db2.gz HFTWHHFAGDNRIA-JTQLQIEISA-N 1 0 313.879 4.025 20 10 DICDRO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001116865419 1047183856 /nfs/dbraw/zinc/18/38/56/1047183856.db2.gz OERODSTWRNJYEV-CJNGLKHVSA-N 1 0 312.379 4.060 20 10 DICDRO CC[C@H]([NH2+][C@H](C)COc1ccccc1F)c1ccc(C)cc1O ZINC001116889994 1047186523 /nfs/dbraw/zinc/18/65/23/1047186523.db2.gz MECXPZJIPIQZMB-PBHICJAKSA-N 1 0 317.404 4.348 20 10 DICDRO FC1(F)CCC(C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001116928759 1047192448 /nfs/dbraw/zinc/19/24/48/1047192448.db2.gz URBWWUSTHARDIP-UHFFFAOYSA-N 1 0 308.416 4.202 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000839180801 1047202073 /nfs/dbraw/zinc/20/20/73/1047202073.db2.gz XZUFZVHQPIKIOZ-ONEGZZNKSA-N 1 0 308.416 4.179 20 10 DICDRO COC1CCC([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000839173236 1047202303 /nfs/dbraw/zinc/20/23/03/1047202303.db2.gz UNAMNTMLCCKVJF-UHFFFAOYSA-N 1 0 311.425 4.106 20 10 DICDRO C[N@H+](Cc1c[nH]c2cc(Cl)ccc12)Cc1ccccc1O ZINC001141590966 1047207955 /nfs/dbraw/zinc/20/79/55/1047207955.db2.gz MPNMOODPCYSGNO-UHFFFAOYSA-N 1 0 300.789 4.159 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc(Cl)c1F ZINC001118005459 1047257204 /nfs/dbraw/zinc/25/72/04/1047257204.db2.gz IDGDCLHVWKULFF-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO CSc1cccc(F)c1C[NH2+]Cc1c(O)cccc1Cl ZINC000796440717 1047284776 /nfs/dbraw/zinc/28/47/76/1047284776.db2.gz BRIHMMQTDGVRHD-UHFFFAOYSA-N 1 0 311.809 4.196 20 10 DICDRO CC(C)CCOCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000387723374 1047284989 /nfs/dbraw/zinc/28/49/89/1047284989.db2.gz NIEYXSJGKVBXCQ-OAHLLOKOSA-N 1 0 301.430 4.259 20 10 DICDRO CSc1cccc(F)c1C[NH2+]Cc1cc(C)c(C)cc1O ZINC000796440658 1047284907 /nfs/dbraw/zinc/28/49/07/1047284907.db2.gz AWHQLSXXOTWQGK-UHFFFAOYSA-N 1 0 305.418 4.160 20 10 DICDRO CCc1nocc1C[N@H+](C)Cc1cc(C(C)C)c(C)cc1O ZINC000840087849 1047287085 /nfs/dbraw/zinc/28/70/85/1047287085.db2.gz BMPHSDBZPXDRQG-UHFFFAOYSA-N 1 0 302.418 4.006 20 10 DICDRO CO[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)CC1(C)C ZINC000840125298 1047288836 /nfs/dbraw/zinc/28/88/36/1047288836.db2.gz HPPJLLAHRQZRAN-SFHVURJKSA-N 1 0 305.462 4.071 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1O ZINC000840139243 1047288920 /nfs/dbraw/zinc/28/89/20/1047288920.db2.gz KGIXVZWPVFINKB-GOSISDBHSA-N 1 0 313.397 4.029 20 10 DICDRO CO[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)CC1(C)C ZINC000840125289 1047289066 /nfs/dbraw/zinc/28/90/66/1047289066.db2.gz HPPJLLAHRQZRAN-GOSISDBHSA-N 1 0 305.462 4.071 20 10 DICDRO CC[C@H]([NH2+]Cc1occc1C)c1cc(Br)ccc1O ZINC000388728115 1047290435 /nfs/dbraw/zinc/29/04/35/1047290435.db2.gz IFCGRTKLBCIUOT-ZDUSSCGKSA-N 1 0 324.218 4.297 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CCOCc1ccccc1)c1ccccc1O ZINC000389952066 1047293097 /nfs/dbraw/zinc/29/30/97/1047293097.db2.gz XJGKZDWVCJWALP-VQIMIIECSA-N 1 0 313.441 4.428 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)c2c1c(F)ccc2O ZINC001118428301 1047294418 /nfs/dbraw/zinc/29/44/18/1047294418.db2.gz SCEXHQVPSOTRSK-YFVNTRNASA-N 1 0 311.347 4.103 20 10 DICDRO COCc1csc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001118430433 1047294779 /nfs/dbraw/zinc/29/47/79/1047294779.db2.gz IBTOZVYGPFPMLI-WFASDCNBSA-N 1 0 317.454 4.247 20 10 DICDRO COCc1csc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001118430430 1047295924 /nfs/dbraw/zinc/29/59/24/1047295924.db2.gz IBTOZVYGPFPMLI-DOMZBBRYSA-N 1 0 317.454 4.247 20 10 DICDRO COCc1csc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001118430431 1047295985 /nfs/dbraw/zinc/29/59/85/1047295985.db2.gz IBTOZVYGPFPMLI-IUODEOHRSA-N 1 0 317.454 4.247 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000390557193 1047297645 /nfs/dbraw/zinc/29/76/45/1047297645.db2.gz IIYROFJUNANWAX-HKUYNNGSSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C2CC3(CC3(F)F)C2)c1O ZINC001118493160 1047300714 /nfs/dbraw/zinc/30/07/14/1047300714.db2.gz QXRIZTRPUQBPEB-VOIZVOFFSA-N 1 0 301.764 4.192 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C2CC3(CC3(F)F)C2)c1O ZINC001118493158 1047300746 /nfs/dbraw/zinc/30/07/46/1047300746.db2.gz QXRIZTRPUQBPEB-FDMSEYEVSA-N 1 0 301.764 4.192 20 10 DICDRO Cc1cccnc1[C@H]([NH2+]Cc1cc(F)ccc1O)C(C)(C)C ZINC000897996324 1047308750 /nfs/dbraw/zinc/30/87/50/1047308750.db2.gz ZMMIUONZOCWEBZ-KRWDZBQOSA-N 1 0 302.393 4.112 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000725845545 1047318864 /nfs/dbraw/zinc/31/88/64/1047318864.db2.gz CYTFUJNQGSFBSK-UHFFFAOYSA-N 1 0 318.848 4.182 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](c2cccs2)C2CC2)c1 ZINC000725844505 1047318986 /nfs/dbraw/zinc/31/89/86/1047318986.db2.gz ZSTQTRNFHVABKW-KRWDZBQOSA-N 1 0 303.427 4.093 20 10 DICDRO CC(C)COCCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725844323 1047319281 /nfs/dbraw/zinc/31/92/81/1047319281.db2.gz USMQVYFPSWZRGP-UHFFFAOYSA-N 1 0 313.441 4.212 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]Cc1ccc(F)cc1 ZINC000725843590 1047319850 /nfs/dbraw/zinc/31/98/50/1047319850.db2.gz GRWXNMNCSMTFII-UHFFFAOYSA-N 1 0 307.368 4.488 20 10 DICDRO Oc1ccccc1CC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725851107 1047321534 /nfs/dbraw/zinc/32/15/34/1047321534.db2.gz ILJBCQKJTNABMT-UHFFFAOYSA-N 1 0 319.404 4.097 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)c(O)c1 ZINC000725847809 1047321883 /nfs/dbraw/zinc/32/18/83/1047321883.db2.gz FJIIMPHCMXHASF-UHFFFAOYSA-N 1 0 324.424 4.179 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H](C)c2ccc3ccccc3c2O)cn1 ZINC000397104089 1047324694 /nfs/dbraw/zinc/32/46/94/1047324694.db2.gz QOMBLBLYZQSVSP-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccccc1O ZINC000398163650 1047327594 /nfs/dbraw/zinc/32/75/94/1047327594.db2.gz CTIAPOBFSIIPNE-QRFRQXIXSA-N 1 0 324.468 4.096 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2(C(F)(F)F)CC2)cc1F ZINC000796491970 1047340533 /nfs/dbraw/zinc/34/05/33/1047340533.db2.gz XBSLQHWSARKDAL-UHFFFAOYSA-N 1 0 318.358 4.104 20 10 DICDRO C[C@H]([NH2+]Cc1cnccc1C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000840856775 1047346202 /nfs/dbraw/zinc/34/62/02/1047346202.db2.gz UIJMSCJMZSNVFB-HNNXBMFYSA-N 1 0 311.473 4.296 20 10 DICDRO C[C@H]([NH2+]C[C@H]1C[C@@H](C)O[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000840872654 1047348970 /nfs/dbraw/zinc/34/89/70/1047348970.db2.gz LWINJEOCIGDNBS-VUHPKUFZSA-N 1 0 316.489 4.141 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1C[C@@H](C)O[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000840872657 1047349248 /nfs/dbraw/zinc/34/92/48/1047349248.db2.gz LWINJEOCIGDNBS-YWTNHNAXSA-N 1 0 316.489 4.141 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)c1 ZINC000840876451 1047349984 /nfs/dbraw/zinc/34/99/84/1047349984.db2.gz QLXIRWRCGIQXHF-UHFFFAOYSA-N 1 0 305.805 4.043 20 10 DICDRO Cc1nc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)cs1 ZINC000840894403 1047356242 /nfs/dbraw/zinc/35/62/42/1047356242.db2.gz RBGQIQSUDZJYFA-UONOGXRCSA-N 1 0 317.502 4.108 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(O)cc(C)cc1Cl)c1nc(C)cs1 ZINC000840892261 1047357483 /nfs/dbraw/zinc/35/74/83/1047357483.db2.gz PBLSTJZPYDNQSX-CYBMUJFWSA-N 1 0 310.850 4.360 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3ccccn3)CC2)c(Cl)c1 ZINC000840911749 1047358372 /nfs/dbraw/zinc/35/83/72/1047358372.db2.gz ORYSYICCBVWUGA-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)c(Cl)c1 ZINC000840906421 1047358408 /nfs/dbraw/zinc/35/84/08/1047358408.db2.gz HCHMNSQWKCECIE-LRDDRELGSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OC(C)(C)C)CC2)c(Cl)c1 ZINC000840911704 1047358686 /nfs/dbraw/zinc/35/86/86/1047358686.db2.gz NHPWJPQVXCKWFY-UHFFFAOYSA-N 1 0 311.853 4.134 20 10 DICDRO Cc1cc(O)c(CNc2ccc(CC[NH+](C)C)cc2)c(Cl)c1 ZINC000840906240 1047359736 /nfs/dbraw/zinc/35/97/36/1047359736.db2.gz NNTJAKUUVWSTCE-UHFFFAOYSA-N 1 0 318.848 4.070 20 10 DICDRO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)C(C)C ZINC000840934663 1047360777 /nfs/dbraw/zinc/36/07/77/1047360777.db2.gz UVLWJCPLDIILDN-IBGZPJMESA-N 1 0 311.473 4.251 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCOc3ccc(F)cc32)c(Cl)c1 ZINC000840938426 1047361687 /nfs/dbraw/zinc/36/16/87/1047361687.db2.gz DKBXNPQXLSNXLR-HNNXBMFYSA-N 1 0 321.779 4.107 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000840950475 1047362477 /nfs/dbraw/zinc/36/24/77/1047362477.db2.gz ODBRDCVIWKTIIP-IBGZPJMESA-N 1 0 309.457 4.039 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000840939936 1047362799 /nfs/dbraw/zinc/36/27/99/1047362799.db2.gz ZUDIWFCMGFZQGM-SFHVURJKSA-N 1 0 316.489 4.033 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](CC)c2ccccc2)ccc1OC ZINC000840956050 1047363555 /nfs/dbraw/zinc/36/35/55/1047363555.db2.gz IBQXPQOVPTVGMI-LJQANCHMSA-N 1 0 313.441 4.473 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCOc3c(F)cccc32)c(Cl)c1 ZINC000840940168 1047363907 /nfs/dbraw/zinc/36/39/07/1047363907.db2.gz VPFGVWXXYUZZAP-HNNXBMFYSA-N 1 0 321.779 4.107 20 10 DICDRO CSCc1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000796514270 1047366767 /nfs/dbraw/zinc/36/67/67/1047366767.db2.gz IHKDFBHPHAMRBC-UHFFFAOYSA-N 1 0 307.846 4.198 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000841034647 1047373138 /nfs/dbraw/zinc/37/31/38/1047373138.db2.gz JBEIQJQUAOUHLW-OALUTQOASA-N 1 0 314.860 4.391 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1 ZINC000841058414 1047376812 /nfs/dbraw/zinc/37/68/12/1047376812.db2.gz GJRVQGUCGFAPFJ-OLEQZPESSA-N 1 0 321.468 4.015 20 10 DICDRO C[C@@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)c1ccncc1 ZINC000749298956 1047408395 /nfs/dbraw/zinc/40/83/95/1047408395.db2.gz ZQZQBQBYQKAVFD-INIZCTEOSA-N 1 0 318.420 4.348 20 10 DICDRO CCC[N@H+](CCc1cccs1)Cc1ccc(N(C)C)cc1 ZINC000749441392 1047417606 /nfs/dbraw/zinc/41/76/06/1047417606.db2.gz GLIROFGNERDPMP-UHFFFAOYSA-N 1 0 302.487 4.269 20 10 DICDRO C[C@@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1ccc(Cl)cc1O ZINC000841743643 1047446945 /nfs/dbraw/zinc/44/69/45/1047446945.db2.gz JDSQLVUAKXYRLX-BXUZGUMPSA-N 1 0 324.877 4.061 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccccc1 ZINC000841744482 1047447043 /nfs/dbraw/zinc/44/70/43/1047447043.db2.gz HYWOCFKLFIQXJM-PXAZEXFGSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1ccc(Cl)cc1O ZINC000841744467 1047447099 /nfs/dbraw/zinc/44/70/99/1047447099.db2.gz OJKWJNHBNYGLOH-NHYWBVRUSA-N 1 0 324.877 4.061 20 10 DICDRO C[C@@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccc(Cl)cc1O ZINC000841748947 1047449791 /nfs/dbraw/zinc/44/97/91/1047449791.db2.gz CFCDKMMTMOHFEL-CXAGYDPISA-N 1 0 319.832 4.210 20 10 DICDRO COc1ccc(C2([NH2+][C@H](C)c3ccc(Cl)cc3O)CC2)cc1 ZINC000841751107 1047450093 /nfs/dbraw/zinc/45/00/93/1047450093.db2.gz WQFDYTRFNHUTJO-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841751808 1047451270 /nfs/dbraw/zinc/45/12/70/1047451270.db2.gz KPJCAABZXFRXSB-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccc(Cl)cc1O ZINC000841753752 1047452111 /nfs/dbraw/zinc/45/21/11/1047452111.db2.gz VPQZRFYZXIAAFY-ZUZCIYMTSA-N 1 0 321.779 4.359 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccco1 ZINC000841753148 1047452598 /nfs/dbraw/zinc/45/25/98/1047452598.db2.gz JTCRCCMVRRFZBN-FZMZJTMJSA-N 1 0 309.793 4.067 20 10 DICDRO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841757255 1047453566 /nfs/dbraw/zinc/45/35/66/1047453566.db2.gz COYSTNILIZJRJQ-VHSXEESVSA-N 1 0 310.850 4.476 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841756795 1047453649 /nfs/dbraw/zinc/45/36/49/1047453649.db2.gz CHWUBHUUGBVLMH-SNVBAGLBSA-N 1 0 308.809 4.009 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2COCc3ccccc32)cc1 ZINC000841759406 1047453757 /nfs/dbraw/zinc/45/37/57/1047453757.db2.gz FPYCLEBBSBLGRR-YWZLYKJASA-N 1 0 310.441 4.065 20 10 DICDRO C[C@@H]([NH2+][C@H]1COCc2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000841760379 1047453941 /nfs/dbraw/zinc/45/39/41/1047453941.db2.gz KDJXSRRWSYLPDX-VLIAUNLRSA-N 1 0 323.436 4.193 20 10 DICDRO c1ccc2c(c1)COC[C@@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841889969 1047460850 /nfs/dbraw/zinc/46/08/50/1047460850.db2.gz FLGDTVGFZPOVQY-NRFANRHFSA-N 1 0 322.452 4.038 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCOC2)cc1C(C)C ZINC000842612846 1047493438 /nfs/dbraw/zinc/49/34/38/1047493438.db2.gz PFXDFUZGRPAVNC-VQIMIIECSA-N 1 0 317.473 4.215 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(c3ccccc3Cl)CC2)cc1C ZINC000842724748 1047499142 /nfs/dbraw/zinc/49/91/42/1047499142.db2.gz FQVDUVNNICUFQN-UHFFFAOYSA-N 1 0 301.817 4.441 20 10 DICDRO CC(C)C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccncc1 ZINC000842835565 1047506658 /nfs/dbraw/zinc/50/66/58/1047506658.db2.gz IGQVNJDUAHGPOA-GOSISDBHSA-N 1 0 315.436 4.164 20 10 DICDRO CC(C)C[C@H]([NH2+]CCCSc1nccs1)c1ccncc1 ZINC000842843805 1047508014 /nfs/dbraw/zinc/50/80/14/1047508014.db2.gz DSDFXLROSXGPOG-HNNXBMFYSA-N 1 0 321.515 4.397 20 10 DICDRO CC[C@H]([NH2+]C1(c2ccccc2OC)CC1)c1ccc(C)cc1O ZINC000842904214 1047513500 /nfs/dbraw/zinc/51/35/00/1047513500.db2.gz SUNWJIAFHRWENH-KRWDZBQOSA-N 1 0 311.425 4.439 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1cccc(C(C)(C)C)c1O)C2 ZINC001143110329 1047531965 /nfs/dbraw/zinc/53/19/65/1047531965.db2.gz CZJWAFVSYNMGPG-UHFFFAOYSA-N 1 0 311.425 4.214 20 10 DICDRO CCC[N@H+](Cc1cccc(C(C)(C)C)c1O)C1CCOCC1 ZINC001143111862 1047532510 /nfs/dbraw/zinc/53/25/10/1047532510.db2.gz GUWYHMLAKLASKB-UHFFFAOYSA-N 1 0 305.462 4.081 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)[C@H]1CCc2ncsc2C1 ZINC000843435960 1047550928 /nfs/dbraw/zinc/55/09/28/1047550928.db2.gz XCXWUJISTPNDBO-HNNXBMFYSA-N 1 0 316.470 4.008 20 10 DICDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000237492596 1047585243 /nfs/dbraw/zinc/58/52/43/1047585243.db2.gz FAFHXKBVDRRKEG-HZPDHXFCSA-N 1 0 312.457 4.130 20 10 DICDRO Oc1c(CNc2cc3[nH]ccc3c[nH+]2)cc(Cl)c2cccnc12 ZINC001157724976 1047751051 /nfs/dbraw/zinc/75/10/51/1047751051.db2.gz ZOOJADSUHMAAMV-UHFFFAOYSA-N 1 0 324.771 4.082 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCCC23CCCCC3)c(O)c1OC ZINC001182844943 1047847499 /nfs/dbraw/zinc/84/74/99/1047847499.db2.gz PTNJBPSCBTVULD-MRXNPFEDSA-N 1 0 319.445 4.002 20 10 DICDRO Nc1ccc(Cc2ccccc2Nc2ccc3c(c2)C[NH2+]C3)cc1 ZINC001159740765 1047913702 /nfs/dbraw/zinc/91/37/02/1047913702.db2.gz CLHFZBMFJXZMKG-UHFFFAOYSA-N 1 0 315.420 4.206 20 10 DICDRO C[C@H](CCc1ccc(F)cc1F)[NH2+][C@H](C)c1ccccc1O ZINC001183355492 1047919588 /nfs/dbraw/zinc/91/95/88/1047919588.db2.gz QWLZNJXLTCKTJP-CHWSQXEVSA-N 1 0 305.368 4.342 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)cc2cccnc21)c1ccc(N(C)C)cc1 ZINC000775834304 1047943359 /nfs/dbraw/zinc/94/33/59/1047943359.db2.gz QSZCOCGAQWWSJQ-AWEZNQCLSA-N 1 0 323.415 4.291 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)c(O)cc1Br ZINC001250120778 1047952902 /nfs/dbraw/zinc/95/29/02/1047952902.db2.gz QAVOSARCQRETSU-OLZOCXBDSA-N 1 0 324.262 4.085 20 10 DICDRO CC(C)Nc1ccc(Nc2ccc(N3CCC[C@@H]([NH3+])C3)cc2)cc1 ZINC001159982508 1047963883 /nfs/dbraw/zinc/96/38/83/1047963883.db2.gz UIAKWPIZJDEDLR-MRXNPFEDSA-N 1 0 324.472 4.178 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)cc1 ZINC001174749302 1047977192 /nfs/dbraw/zinc/97/71/92/1047977192.db2.gz JCDCPWVNHUDGNA-MRXNPFEDSA-N 1 0 324.468 4.319 20 10 DICDRO Cc1[nH+]c(NCc2cc3ccccc3cc2O)cc2[nH]ccc21 ZINC001160206583 1047996135 /nfs/dbraw/zinc/99/61/35/1047996135.db2.gz LGBCIANQKLCVQK-UHFFFAOYSA-N 1 0 303.365 4.342 20 10 DICDRO Oc1cc2ccccc2cc1CNc1cc(N2CCCC2)cc[nH+]1 ZINC001160207945 1047996959 /nfs/dbraw/zinc/99/69/59/1047996959.db2.gz XRDDIPRDKRJPPA-UHFFFAOYSA-N 1 0 319.408 4.153 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000773425753 1048025847 /nfs/dbraw/zinc/02/58/47/1048025847.db2.gz BYOZXZQDEPXIKO-MRXNPFEDSA-N 1 0 311.473 4.341 20 10 DICDRO CC[C@@H](C)C[N@H+](CC)Cc1cc(Br)cc(C)c1O ZINC000160970532 1048028772 /nfs/dbraw/zinc/02/87/72/1048028772.db2.gz GGZKBXZNOCQVBF-LLVKDONJSA-N 1 0 314.267 4.331 20 10 DICDRO CC1(C)CCNc2ccc(Nc3cccc4c3CC[NH2+]C4)cc21 ZINC001160332047 1048035548 /nfs/dbraw/zinc/03/55/48/1048035548.db2.gz GGRKXEIXTKJZFF-UHFFFAOYSA-N 1 0 307.441 4.169 20 10 DICDRO CCc1onc(C)c1C[NH2+][C@H](CC)c1cccc(Cl)c1[O-] ZINC000927134119 1048054716 /nfs/dbraw/zinc/05/47/16/1048054716.db2.gz HMZGXNUKTMJPGF-CQSZACIVSA-N 1 0 308.809 4.145 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)CCc2ccccc2Cl)cc1 ZINC001203934034 1048060460 /nfs/dbraw/zinc/06/04/60/1048060460.db2.gz KMVGMVFOMQVLBY-UHFFFAOYSA-N 1 0 302.849 4.081 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(F)ccc2C)cc1 ZINC001199403260 1048063995 /nfs/dbraw/zinc/06/39/95/1048063995.db2.gz ODMXIAPYHHJBCO-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](CC)c2ccccc2OC)c(O)c1 ZINC000775975206 1048069610 /nfs/dbraw/zinc/06/96/10/1048069610.db2.gz HQAHJUPQUPWACJ-QGZVFWFLSA-N 1 0 315.413 4.040 20 10 DICDRO CCC[N@H+](Cc1cccc(C)c1O)[C@@H]1CCCc2cccnc21 ZINC000775995047 1048081041 /nfs/dbraw/zinc/08/10/41/1048081041.db2.gz PNRPNVNSTPIDGP-GOSISDBHSA-N 1 0 310.441 4.385 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]Cc2ccoc2)cc1 ZINC001199630297 1048081809 /nfs/dbraw/zinc/08/18/09/1048081809.db2.gz VRIPOBZUXFIPAS-UHFFFAOYSA-N 1 0 312.438 4.267 20 10 DICDRO C[C@H]([NH2+]Cc1ncccc1C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000776005418 1048082709 /nfs/dbraw/zinc/08/27/09/1048082709.db2.gz BESRYVWLZGEWIW-LBPRGKRZSA-N 1 0 323.362 4.017 20 10 DICDRO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000776013665 1048090115 /nfs/dbraw/zinc/09/01/15/1048090115.db2.gz MXCBWDZYUQZNPQ-WCQYABFASA-N 1 0 318.358 4.055 20 10 DICDRO CC[C@H]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC001199830339 1048105319 /nfs/dbraw/zinc/10/53/19/1048105319.db2.gz JAOIRNWSBCJWKG-DLBZAZTESA-N 1 0 300.490 4.375 20 10 DICDRO CC(C)c1cccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC001199821963 1048108836 /nfs/dbraw/zinc/10/88/36/1048108836.db2.gz CYPROINTJYCYCC-UHFFFAOYSA-N 1 0 308.469 4.482 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCCOc3ccccc32)cc1 ZINC001199971743 1048128715 /nfs/dbraw/zinc/12/87/15/1048128715.db2.gz FKUPKFZLWOPDET-ZEZYUPADSA-N 1 0 322.452 4.269 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCc3c2cccc3O)cc1 ZINC000105487209 1048138345 /nfs/dbraw/zinc/13/83/45/1048138345.db2.gz UUAIRWFSXSUWJI-LJQANCHMSA-N 1 0 310.441 4.016 20 10 DICDRO CCS[C@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001200921058 1048156801 /nfs/dbraw/zinc/15/68/01/1048156801.db2.gz CJLMOBNHIDJAPI-SJORKVTESA-N 1 0 305.487 4.166 20 10 DICDRO COc1ccc(C[NH2+]C[C@H](OC)c2ccccc2Cl)cc1C ZINC001201017513 1048172091 /nfs/dbraw/zinc/17/20/91/1048172091.db2.gz IEVGRSHOEVKXLB-SFHVURJKSA-N 1 0 319.832 4.134 20 10 DICDRO COc1ccc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2)c(O)c1 ZINC001203629380 1048240318 /nfs/dbraw/zinc/24/03/18/1048240318.db2.gz YYYHYOHGACQKQH-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO C[C@@H]([NH2+]Cc1coc(-c2ccccc2F)n1)c1ccccc1O ZINC001175418641 1048299497 /nfs/dbraw/zinc/29/94/97/1048299497.db2.gz MXZQPXBFHYGUFS-GFCCVEGCSA-N 1 0 312.344 4.037 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCO[C@H](CC(C)C)C1 ZINC001201663405 1048345089 /nfs/dbraw/zinc/34/50/89/1048345089.db2.gz DEPZESUZBKNISZ-DLBZAZTESA-N 1 0 314.473 4.170 20 10 DICDRO CCC[N@@H+]1CCCC[C@@H]1c1ccc(NCc2ccc(N)cc2)nc1 ZINC001162791109 1048358728 /nfs/dbraw/zinc/35/87/28/1048358728.db2.gz ZRGWLEMQJZGZIR-LJQANCHMSA-N 1 0 324.472 4.213 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC1(c2cccc(F)c2)CC1 ZINC000776207229 1048366631 /nfs/dbraw/zinc/36/66/31/1048366631.db2.gz DXXPXHUQGJUBHY-UHFFFAOYSA-N 1 0 305.780 4.006 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2c(O)cccc2Cl)cc1[N+](=O)[O-] ZINC000776222534 1048391793 /nfs/dbraw/zinc/39/17/93/1048391793.db2.gz NZBPODLIZBAMFH-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO Cc1oc2ccccc2c1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001201880501 1048392978 /nfs/dbraw/zinc/39/29/78/1048392978.db2.gz DOPOIIBLNZBKTM-UHFFFAOYSA-N 1 0 307.393 4.356 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000775139955 1048432177 /nfs/dbraw/zinc/43/21/77/1048432177.db2.gz GVNSWCHIMSPLLB-HOCLYGCPSA-N 1 0 314.395 4.483 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000775139960 1048432505 /nfs/dbraw/zinc/43/25/05/1048432505.db2.gz GVNSWCHIMSPLLB-ZBFHGGJFSA-N 1 0 314.395 4.483 20 10 DICDRO C[C@H]([NH2+]Cc1cc2ccccc2n1C)c1ccc(N(C)C)cc1 ZINC001202066262 1048436857 /nfs/dbraw/zinc/43/68/57/1048436857.db2.gz RKWLXGKSBBVOHS-HNNXBMFYSA-N 1 0 307.441 4.095 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC2CC(c3ccccc3)C2)cc1F ZINC001202127809 1048457436 /nfs/dbraw/zinc/45/74/36/1048457436.db2.gz XNSCKRNJPAPOOI-UHFFFAOYSA-N 1 0 312.432 4.175 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)c1O ZINC000776252823 1048467676 /nfs/dbraw/zinc/46/76/76/1048467676.db2.gz FXTVZJBRNABOJZ-LSDHHAIUSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCOC3(CCCCC3)C2)c1O ZINC000776249717 1048472934 /nfs/dbraw/zinc/47/29/34/1048472934.db2.gz VSJXJNBJXFUCAW-MRXNPFEDSA-N 1 0 323.864 4.326 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(Br)cc1)c1ccccc1O ZINC000042352326 1048578309 /nfs/dbraw/zinc/57/83/09/1048578309.db2.gz MJRHFKZPHHUBLP-HNNXBMFYSA-N 1 0 320.230 4.396 20 10 DICDRO Cc1ccc2cc(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)[nH]c2c1 ZINC000850252434 1048628580 /nfs/dbraw/zinc/62/85/80/1048628580.db2.gz SIMZYRJRADCKRP-HNNXBMFYSA-N 1 0 307.441 4.393 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCc3ccc(O)cc32)cc1 ZINC000850386664 1048646312 /nfs/dbraw/zinc/64/63/12/1048646312.db2.gz LAXMERFOXRCMPL-FQEVSTJZSA-N 1 0 310.441 4.016 20 10 DICDRO COc1cccc(C2([NH2+]Cc3cc(Cl)ccc3O)CCC2)c1 ZINC000850405148 1048650237 /nfs/dbraw/zinc/65/02/37/1048650237.db2.gz IJNFBBAUPPKUPY-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(C(F)F)nc1 ZINC000850430147 1048653283 /nfs/dbraw/zinc/65/32/83/1048653283.db2.gz ITSFMSQAHDQSNY-NSHDSACASA-N 1 0 323.362 4.075 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cc2cnccc2o1 ZINC000850462726 1048666093 /nfs/dbraw/zinc/66/60/93/1048666093.db2.gz QCBZNFYSQKWXLN-KBPBESRZSA-N 1 0 309.413 4.306 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)c1ccccn1 ZINC000850481328 1048669574 /nfs/dbraw/zinc/66/95/74/1048669574.db2.gz GKIGGLZMKUENJM-HUUCEWRRSA-N 1 0 306.409 4.395 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1ccccn1)c1cc(Cl)ccc1O ZINC000850482368 1048671540 /nfs/dbraw/zinc/67/15/40/1048671540.db2.gz OVMTWXJUODDKGZ-DOMZBBRYSA-N 1 0 304.821 4.285 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1cc2c(cc1O)CCCC2)c1cscn1 ZINC000850512236 1048674645 /nfs/dbraw/zinc/67/46/45/1048674645.db2.gz YUQOPAVSJYISBH-VXGBXAGGSA-N 1 0 302.443 4.139 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)COc1c(F)cccc1F)c1ccccc1O ZINC000850522877 1048676250 /nfs/dbraw/zinc/67/62/50/1048676250.db2.gz QFBVEIVAQGUCDX-LRDDRELGSA-N 1 0 321.367 4.179 20 10 DICDRO CC[C@H]([NH2+][C@H](C)COc1c(F)cccc1F)c1ccccc1O ZINC000850522879 1048677137 /nfs/dbraw/zinc/67/71/37/1048677137.db2.gz QFBVEIVAQGUCDX-WBMJQRKESA-N 1 0 321.367 4.179 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc(Cl)cc1O ZINC000850542174 1048687142 /nfs/dbraw/zinc/68/71/42/1048687142.db2.gz ISULCAOYSQJKBY-QLJPJBMISA-N 1 0 303.789 4.089 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(O)cc32)c2c1c(F)ccc2O ZINC000850543481 1048687286 /nfs/dbraw/zinc/68/72/86/1048687286.db2.gz KJTWDOICMNULJS-GTTSAUCSSA-N 1 0 313.372 4.062 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H](O)C(C)C)c1 ZINC000850554795 1048688817 /nfs/dbraw/zinc/68/88/17/1048688817.db2.gz KZUYHNOFXGUAOL-YSSFQJQWSA-N 1 0 313.441 4.109 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc(N(C)C)cc1 ZINC000850544446 1048688926 /nfs/dbraw/zinc/68/89/26/1048688926.db2.gz XDPGEQAPIALTAB-VQTJNVASSA-N 1 0 310.441 4.186 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@H](O)C(C)C)c1ccccc1O ZINC000850555198 1048689600 /nfs/dbraw/zinc/68/96/00/1048689600.db2.gz NGLADUQUIFZQJG-DFQSSKMNSA-N 1 0 313.441 4.191 20 10 DICDRO COc1cccc(C2([NH2+][C@@H](C)c3ccc(C)cc3O)CCC2)c1 ZINC000850567249 1048696830 /nfs/dbraw/zinc/69/68/30/1048696830.db2.gz YVOLECRCUYLRGV-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCOC1(C)C)c1ccc(N2CCCCC2)cc1 ZINC000850571064 1048698070 /nfs/dbraw/zinc/69/80/70/1048698070.db2.gz MBJLHGOCSYXJAG-AEFFLSMTSA-N 1 0 316.489 4.143 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c(Cl)c1 ZINC000775363142 1048704223 /nfs/dbraw/zinc/70/42/23/1048704223.db2.gz KOLODVDVJSJMHZ-CYBMUJFWSA-N 1 0 318.848 4.265 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)c1ccc(N(C)C)cc1 ZINC000775362616 1048704366 /nfs/dbraw/zinc/70/43/66/1048704366.db2.gz IYXWTZZRERLWHU-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2c(F)cccc2Cl)c1 ZINC000775363408 1048705045 /nfs/dbraw/zinc/70/50/45/1048705045.db2.gz KQHZTQJEQGZQNT-LLVKDONJSA-N 1 0 323.795 4.087 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)c1ccc(N(C)C)cc1 ZINC000775366078 1048707492 /nfs/dbraw/zinc/70/74/92/1048707492.db2.gz ZQVKPXZFSURGOQ-OAHLLOKOSA-N 1 0 324.468 4.317 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)[C@@H](OC)c2ccccc2F)cc1C ZINC000776498927 1048727689 /nfs/dbraw/zinc/72/76/89/1048727689.db2.gz QZTMBUMOASYTEE-IFXJQAMLSA-N 1 0 317.404 4.009 20 10 DICDRO CC[C@H]([NH2+]CCCOc1ccc(F)cc1)c1ccccc1O ZINC000775416317 1048794194 /nfs/dbraw/zinc/79/41/94/1048794194.db2.gz UPLKDFBQZHMCJP-KRWDZBQOSA-N 1 0 303.377 4.041 20 10 DICDRO CC(C)=CCC[C@H](C)[NH2+]Cc1c(O)cccc1Br ZINC001202483832 1048797785 /nfs/dbraw/zinc/79/77/85/1048797785.db2.gz TZGNJCROAFKMPF-LBPRGKRZSA-N 1 0 312.251 4.379 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CCc2ccc(Cl)cc2)cc1F ZINC001177108469 1048831145 /nfs/dbraw/zinc/83/11/45/1048831145.db2.gz AFIFVWMOCOBBSZ-UHFFFAOYSA-N 1 0 324.802 4.017 20 10 DICDRO Clc1ccc(CC[NH2+]Cc2ccc3c(c2)CCCO3)s1 ZINC001177307927 1048874710 /nfs/dbraw/zinc/87/47/10/1048874710.db2.gz JOUDPQJAQYRNGF-UHFFFAOYSA-N 1 0 307.846 4.059 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccc2c(c1)CCCO2 ZINC000853239486 1048888123 /nfs/dbraw/zinc/88/81/23/1048888123.db2.gz BWSMYYBWCAULHH-CHWSQXEVSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1cc(C)c(C)cc1O)CCC2 ZINC000111172732 1048888440 /nfs/dbraw/zinc/88/84/40/1048888440.db2.gz SGLDIRRLIMMHDZ-MRXNPFEDSA-N 1 0 316.470 4.283 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)CC(F)(F)F)c1 ZINC000853241211 1048890894 /nfs/dbraw/zinc/89/08/94/1048890894.db2.gz PUYSJIITMWCXIM-JTQLQIEISA-N 1 0 305.340 4.030 20 10 DICDRO CC[C@@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccccc1O ZINC000853241726 1048892057 /nfs/dbraw/zinc/89/20/57/1048892057.db2.gz MUEFDKVAEQUHQV-CQSZACIVSA-N 1 0 310.319 4.047 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c(O)c1 ZINC000853241618 1048892120 /nfs/dbraw/zinc/89/21/20/1048892120.db2.gz LZLDQHRXBUIYKL-LSDHHAIUSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc3c(c2)CCCN3C)ccc1Cl ZINC001177529199 1048909117 /nfs/dbraw/zinc/90/91/17/1048909117.db2.gz NLUJSKRXGJFHJQ-UHFFFAOYSA-N 1 0 314.860 4.321 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1c(F)ccc(C)c1F ZINC001191290026 1048916563 /nfs/dbraw/zinc/91/65/63/1048916563.db2.gz YGIXUZWCZYAWJU-UHFFFAOYSA-N 1 0 305.368 4.391 20 10 DICDRO CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177641944 1048922548 /nfs/dbraw/zinc/92/25/48/1048922548.db2.gz PLABDBHATFFCRW-GUYCJALGSA-N 1 0 310.432 4.479 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2ccccc2Cl)CC1 ZINC001203558339 1048928211 /nfs/dbraw/zinc/92/82/11/1048928211.db2.gz GDBHIMHFMPFTCW-UHFFFAOYSA-N 1 0 301.817 4.425 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2ccc(F)cc2F)CC1 ZINC001203562062 1048931369 /nfs/dbraw/zinc/93/13/69/1048931369.db2.gz COMSSHQMVQDXFU-UHFFFAOYSA-N 1 0 303.352 4.050 20 10 DICDRO C[N@H+](CCc1ccc(C(F)(F)F)cc1)Cc1ccccc1O ZINC001203562061 1048931621 /nfs/dbraw/zinc/93/16/21/1048931621.db2.gz CNSOMARKSISMKD-UHFFFAOYSA-N 1 0 309.331 4.086 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c1O ZINC001203595991 1048937028 /nfs/dbraw/zinc/93/70/28/1048937028.db2.gz WXDNVOQUQDWZLU-CYBMUJFWSA-N 1 0 317.816 4.044 20 10 DICDRO Cc1cccc2c1CC[C@@H]2[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001177774186 1048937568 /nfs/dbraw/zinc/93/75/68/1048937568.db2.gz BIZNWPACYBWVNQ-XYASWCNUSA-N 1 0 306.453 4.351 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2cc(C)cc(C)c2)c1O ZINC001203601732 1048938980 /nfs/dbraw/zinc/93/89/80/1048938980.db2.gz IUKDFHJIZFKEDI-SFHVURJKSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1O ZINC001203601667 1048939972 /nfs/dbraw/zinc/93/99/72/1048939972.db2.gz GHCNEZSAOXDSNC-MRXNPFEDSA-N 1 0 319.351 4.016 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(C)cc2)c1O ZINC001203609256 1048940585 /nfs/dbraw/zinc/94/05/85/1048940585.db2.gz NURWLOJEUYDULN-GOSISDBHSA-N 1 0 311.425 4.436 20 10 DICDRO COc1ccc(C[N@H+](Cc2cccc(C)c2C)C2CC2)c(O)c1 ZINC001203635367 1048944351 /nfs/dbraw/zinc/94/43/51/1048944351.db2.gz RFWONLSROFIXBJ-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)c(O)c1 ZINC001203627622 1048944943 /nfs/dbraw/zinc/94/49/43/1048944943.db2.gz MASFBRYHIMLVKT-CYBMUJFWSA-N 1 0 323.845 4.453 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001203657819 1048950593 /nfs/dbraw/zinc/95/05/93/1048950593.db2.gz NSKVYMRLMDFDCF-OAHLLOKOSA-N 1 0 301.817 4.110 20 10 DICDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)c1 ZINC001203663713 1048953249 /nfs/dbraw/zinc/95/32/49/1048953249.db2.gz FDEFWMAGCQAVAD-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1cccc([C@@H]2CC[N@H+](Cc3cc(Cl)ccc3O)C2)c1 ZINC001203664727 1048953527 /nfs/dbraw/zinc/95/35/27/1048953527.db2.gz SHJGSXAEIGRPOC-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC(C)(C)Cc2ccccc2)cc1F ZINC001177855397 1048953891 /nfs/dbraw/zinc/95/38/91/1048953891.db2.gz UUZZLHMCCGRHSS-UHFFFAOYSA-N 1 0 314.448 4.250 20 10 DICDRO CC[C@@H]([NH2+]CC1([NH3+])CCCC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000854223099 1048954935 /nfs/dbraw/zinc/95/49/35/1048954935.db2.gz NFSOXOFGYGLBNN-GFCCVEGCSA-N 1 0 317.260 4.011 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1cc2c(cc1O)CCCC2 ZINC000854225486 1048954976 /nfs/dbraw/zinc/95/49/76/1048954976.db2.gz GJZXIUYVMHIJBG-RBZFPXEDSA-N 1 0 322.452 4.191 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(N)c1)c1ccc(C(F)(F)F)cc1O ZINC000854215484 1048955242 /nfs/dbraw/zinc/95/52/42/1048955242.db2.gz IHGJZUWWBXXGRX-HNNXBMFYSA-N 1 0 324.346 4.234 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2ccccc2F)c1 ZINC001203675108 1048959732 /nfs/dbraw/zinc/95/97/32/1048959732.db2.gz NHXCRXGTANUVLG-SFHVURJKSA-N 1 0 315.388 4.267 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001203681188 1048960636 /nfs/dbraw/zinc/96/06/36/1048960636.db2.gz PVCZFSYLXXFQOG-MRXNPFEDSA-N 1 0 319.351 4.016 20 10 DICDRO CCS[C@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177971920 1048966779 /nfs/dbraw/zinc/96/67/79/1048966779.db2.gz AODLUZQAFCDPRG-AEFFLSMTSA-N 1 0 305.487 4.166 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCc3c2cccc3F)cc1 ZINC001203707038 1048971206 /nfs/dbraw/zinc/97/12/06/1048971206.db2.gz WJBPSDPTMYZLJL-SGSXCFNPSA-N 1 0 310.416 4.182 20 10 DICDRO C[C@H]1COC[C@H]1[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001203769991 1048993264 /nfs/dbraw/zinc/99/32/64/1048993264.db2.gz BFKARQNAAWIXHB-SUMWQHHRSA-N 1 0 319.489 4.112 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H]2CC(C)(C)OC2(C)C)cc1C ZINC001203819554 1049009479 /nfs/dbraw/zinc/00/94/79/1049009479.db2.gz GPSIDRVRLAODFZ-QGZVFWFLSA-N 1 0 319.489 4.467 20 10 DICDRO COCCCCN(CCc1ccccc1)c1ccc(OC)cc1 ZINC001191891908 1049015972 /nfs/dbraw/zinc/01/59/72/1049015972.db2.gz REVJFVHJGOTWEP-UHFFFAOYSA-N 1 0 313.441 4.171 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001178347401 1049018900 /nfs/dbraw/zinc/01/89/00/1049018900.db2.gz VNXQCYDUWNPPLV-KRWDZBQOSA-N 1 0 318.464 4.381 20 10 DICDRO CC[C@@H]([NH2+]CCCOc1ccccc1F)c1ccccc1O ZINC000775491595 1049019709 /nfs/dbraw/zinc/01/97/09/1049019709.db2.gz FJSZXDBOLWDTMX-MRXNPFEDSA-N 1 0 303.377 4.041 20 10 DICDRO Fc1cc(Cl)cc(C[NH2+]CCCSc2nccs2)c1 ZINC000776801778 1049021782 /nfs/dbraw/zinc/02/17/82/1049021782.db2.gz ZIPOPQJRNZFCIG-UHFFFAOYSA-N 1 0 316.854 4.208 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](c1ccc(C)cc1)N(C)C)c1ccccc1O ZINC000775497199 1049028794 /nfs/dbraw/zinc/02/87/94/1049028794.db2.gz OBPCEBKZPBQAIQ-OALUTQOASA-N 1 0 312.457 4.044 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](c1ccc(C)cc1)N(C)C)c1ccccc1O ZINC000775497198 1049029765 /nfs/dbraw/zinc/02/97/65/1049029765.db2.gz OBPCEBKZPBQAIQ-MOPGFXCFSA-N 1 0 312.457 4.044 20 10 DICDRO COc1ccc2cc(C[NH2+]Cc3cc(C)ccc3O)ccc2c1 ZINC000113316750 1049032221 /nfs/dbraw/zinc/03/22/21/1049032221.db2.gz QBYVNAQLNIHPCK-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCOc2ccc(F)cc21)c1ccccc1O ZINC000775496682 1049032376 /nfs/dbraw/zinc/03/23/76/1049032376.db2.gz JBLIDGZAFVXSQP-DLBZAZTESA-N 1 0 315.388 4.486 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCOc2ccc(F)cc21)c1ccccc1O ZINC000775496689 1049032610 /nfs/dbraw/zinc/03/26/10/1049032610.db2.gz JBLIDGZAFVXSQP-SJORKVTESA-N 1 0 315.388 4.486 20 10 DICDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)c1 ZINC001203937923 1049035963 /nfs/dbraw/zinc/03/59/63/1049035963.db2.gz ZTPNTVYQLOROFJ-FQEVSTJZSA-N 1 0 310.441 4.098 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)CC/C=C/c2cccnc2)cc1 ZINC001203942132 1049036720 /nfs/dbraw/zinc/03/67/20/1049036720.db2.gz LLPAWYSTSCOMLI-RMKNXTFCSA-N 1 0 323.484 4.463 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2cccc3cc[nH]c32)cc1 ZINC001178496742 1049039534 /nfs/dbraw/zinc/03/95/34/1049039534.db2.gz IXKWFKJCVHOVIA-SNAWJCMRSA-N 1 0 305.425 4.037 20 10 DICDRO CC[C@@H]([NH2+][C@H](Cn1cccn1)c1ccccc1)c1ccccc1O ZINC000775509974 1049046602 /nfs/dbraw/zinc/04/66/02/1049046602.db2.gz STGZUPAWCPEDSR-RTBURBONSA-N 1 0 321.424 4.071 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1cc(Cl)ccc1O ZINC000775510003 1049046684 /nfs/dbraw/zinc/04/66/84/1049046684.db2.gz UGBFWQCCQVNSOG-OAHLLOKOSA-N 1 0 307.825 4.064 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000775507609 1049047022 /nfs/dbraw/zinc/04/70/22/1049047022.db2.gz NRASWIRTXKFATM-APWZRJJASA-N 1 0 310.441 4.102 20 10 DICDRO CC[C@@H]([NH2+]CCc1sc(C)nc1C)c1cc(Cl)ccc1O ZINC000775503873 1049047686 /nfs/dbraw/zinc/04/76/86/1049047686.db2.gz OLESCLSNBMZYSA-CQSZACIVSA-N 1 0 324.877 4.402 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775508913 1049049542 /nfs/dbraw/zinc/04/95/42/1049049542.db2.gz YIGHGJWWXQZIJD-OTYXRUKQSA-N 1 0 308.809 4.452 20 10 DICDRO CC[C@H]([NH2+][C@H](C)C[C@@H](O)c1ccco1)c1cc(Cl)ccc1O ZINC000775513443 1049050004 /nfs/dbraw/zinc/05/00/04/1049050004.db2.gz JKVCRTCNOGJLII-DIOULYMOSA-N 1 0 323.820 4.192 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)cc1 ZINC001178542842 1049054920 /nfs/dbraw/zinc/05/49/20/1049054920.db2.gz STRJLHOLTITCEQ-WOJBJXKFSA-N 1 0 318.505 4.216 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCCC23CCOCC3)cc1C ZINC001178552845 1049059805 /nfs/dbraw/zinc/05/98/05/1049059805.db2.gz HMLIDZCHIVAABL-LJQANCHMSA-N 1 0 317.473 4.223 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](c3ccccc3OC)C2)cc1 ZINC000773753971 1049063541 /nfs/dbraw/zinc/06/35/41/1049063541.db2.gz ODCHKSFCJXKXRL-SFHVURJKSA-N 1 0 324.468 4.141 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)c(Cl)c1 ZINC001178601262 1049064881 /nfs/dbraw/zinc/06/48/81/1049064881.db2.gz MUJZBNBUIXIYTI-SHTZXODSSA-N 1 0 301.817 4.390 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2(c3ccccn3)CCC2)cc1C ZINC001178655150 1049069855 /nfs/dbraw/zinc/06/98/55/1049069855.db2.gz VYOTXLPLCBXZQA-UHFFFAOYSA-N 1 0 324.468 4.390 20 10 DICDRO Cc1cc2cc(C[NH2+]Cc3ccc4c(c3)CCCO4)ccc2[nH]1 ZINC001178653872 1049070107 /nfs/dbraw/zinc/07/01/07/1049070107.db2.gz CPVFSADSILOBDG-UHFFFAOYSA-N 1 0 306.409 4.091 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(Cl)ccc1O ZINC000775520886 1049070711 /nfs/dbraw/zinc/07/07/11/1049070711.db2.gz ZYCRRXISJBMATR-HNNXBMFYSA-N 1 0 320.776 4.195 20 10 DICDRO CCN(C)c1ccc(C[N@H+](CCC(F)(F)F)CC2CC2)cc1 ZINC000773764753 1049076284 /nfs/dbraw/zinc/07/62/84/1049076284.db2.gz DMYLBGNNJGZRQB-UHFFFAOYSA-N 1 0 314.395 4.307 20 10 DICDRO CC[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccccc1O ZINC000775522157 1049078261 /nfs/dbraw/zinc/07/82/61/1049078261.db2.gz KQYDYOORMNAQJS-GJZGRUSLSA-N 1 0 303.789 4.220 20 10 DICDRO CC[C@@H]([NH2+]CCNc1ccc2ccccc2n1)c1ccccc1O ZINC000775525030 1049090117 /nfs/dbraw/zinc/09/01/17/1049090117.db2.gz DCJNEIHYSNLXTK-QGZVFWFLSA-N 1 0 321.424 4.093 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](Cc2ccccc2)C(C)C)c1O ZINC001204153789 1049095977 /nfs/dbraw/zinc/09/59/77/1049095977.db2.gz KCZIOANWIASMKM-UHFFFAOYSA-N 1 0 319.832 4.465 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CO)C1CCCCC1)c1cc(Cl)ccc1O ZINC000775527676 1049098010 /nfs/dbraw/zinc/09/80/10/1049098010.db2.gz SMVYBSWEISVLDL-CVEARBPZSA-N 1 0 311.853 4.028 20 10 DICDRO C[C@@H]1CC[C@@H](C)[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001204163201 1049099576 /nfs/dbraw/zinc/09/95/76/1049099576.db2.gz QAOCLHKTOMJGJB-CHWSQXEVSA-N 1 0 314.395 4.392 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C(C)(C)c2ccc(F)cc2)cc1 ZINC000773774196 1049101328 /nfs/dbraw/zinc/10/13/28/1049101328.db2.gz UZYZUGDIOPCCEK-UHFFFAOYSA-N 1 0 300.421 4.307 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CC(C)(C)C2=CCCC2)cc1F ZINC001178872841 1049103192 /nfs/dbraw/zinc/10/31/92/1049103192.db2.gz NDBRASXYPHQBRB-UHFFFAOYSA-N 1 0 308.416 4.257 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](C(F)F)C2)c2ccccc21 ZINC001204241958 1049117657 /nfs/dbraw/zinc/11/76/57/1049117657.db2.gz LCXULJQVUBRHQL-HNNXBMFYSA-N 1 0 318.411 4.383 20 10 DICDRO CC[N@H+](Cc1ccccn1)Cc1ccc(N(C)C)c2ccccc12 ZINC001204240251 1049118859 /nfs/dbraw/zinc/11/88/59/1049118859.db2.gz MJGCGHIVORKZIQ-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO Oc1c(C[NH2+]CC[C@H]2CC2(Cl)Cl)ccc2ccccc21 ZINC000857062347 1049124798 /nfs/dbraw/zinc/12/47/98/1049124798.db2.gz KABRERBMKGXQAP-ZDUSSCGKSA-N 1 0 310.224 4.219 20 10 DICDRO C[C@H](c1cccc2ccccc21)[N@H+](C)Cc1ccc(O)cc1O ZINC001204277690 1049125379 /nfs/dbraw/zinc/12/53/79/1049125379.db2.gz IIPNUHQRMMPYBN-CQSZACIVSA-N 1 0 307.393 4.444 20 10 DICDRO Oc1ccc(C[NH+]2CCC(c3ccccc3Cl)CC2)c(O)c1 ZINC001204279644 1049125455 /nfs/dbraw/zinc/12/54/55/1049125455.db2.gz DMUHJWVZKHNMBY-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1ccc(O)cc1O ZINC001204272996 1049126097 /nfs/dbraw/zinc/12/60/97/1049126097.db2.gz IUGZTAZALMEQBW-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO CC[C@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1ccc(C)cc1O ZINC000857082876 1049127858 /nfs/dbraw/zinc/12/78/58/1049127858.db2.gz RHZZQXHQRNMHJP-AAEUAGOBSA-N 1 0 302.245 4.325 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@]1(C)C[C@]1(F)Cl ZINC001179095001 1049129939 /nfs/dbraw/zinc/12/99/39/1049129939.db2.gz GEUWUOCIZNDPJW-IAGOWNOFSA-N 1 0 308.828 4.281 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1cc(Cl)ccc1O ZINC000775546173 1049133965 /nfs/dbraw/zinc/13/39/65/1049133965.db2.gz FYLYGIVCDRDEBZ-BONVTDFDSA-N 1 0 308.784 4.382 20 10 DICDRO CCc1cccc(C[N@H+](CCc2cccc(F)c2)C2CC2)c1O ZINC001204299277 1049134811 /nfs/dbraw/zinc/13/48/11/1049134811.db2.gz UCFHTPHKHPFJQX-UHFFFAOYSA-N 1 0 313.416 4.301 20 10 DICDRO Cc1ccc(C[C@H](C)[N@H+](C)Cc2ccc(Cl)cc2O)cc1 ZINC001204308407 1049138711 /nfs/dbraw/zinc/13/87/11/1049138711.db2.gz SYNDQOYLFIMXKO-AWEZNQCLSA-N 1 0 303.833 4.417 20 10 DICDRO CC[N@H+](Cc1ccc(F)cc1)Cc1ccc(N2CCCC2)cc1 ZINC001204320799 1049140332 /nfs/dbraw/zinc/14/03/32/1049140332.db2.gz ATDSCPOQHIDRIE-UHFFFAOYSA-N 1 0 312.432 4.448 20 10 DICDRO c1cc([C@H]2CCC[N@H+]2Cc2ccc(N3CCCC3)cc2)ccn1 ZINC001204326033 1049142582 /nfs/dbraw/zinc/14/25/82/1049142582.db2.gz DCXYNXMPKHTLEU-HXUWFJFHSA-N 1 0 307.441 4.019 20 10 DICDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001204322063 1049142637 /nfs/dbraw/zinc/14/26/37/1049142637.db2.gz NFRZCBYQGBXOGJ-KRWDZBQOSA-N 1 0 324.468 4.488 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(F)c(F)c1F)c1ccccc1O ZINC000775550778 1049143041 /nfs/dbraw/zinc/14/30/41/1049143041.db2.gz BGXCIRDBLXSWKG-CQSZACIVSA-N 1 0 309.331 4.093 20 10 DICDRO CC[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000775554589 1049146809 /nfs/dbraw/zinc/14/68/09/1049146809.db2.gz BVDUYCNEGSGPAV-HOCLYGCPSA-N 1 0 311.853 4.436 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1nnc(C)s1)c1cc(Cl)ccc1O ZINC000775555900 1049153594 /nfs/dbraw/zinc/15/35/94/1049153594.db2.gz SMZKKBMNNSXUJL-PELKAZGASA-N 1 0 311.838 4.007 20 10 DICDRO CC(C)C[N@H+](Cc1ccccc1)Cc1cc(F)cc(F)c1[O-] ZINC001204429427 1049162681 /nfs/dbraw/zinc/16/26/81/1049162681.db2.gz DILQUZDABUNWCR-UHFFFAOYSA-N 1 0 305.368 4.329 20 10 DICDRO COC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CCCCC1 ZINC000775562365 1049167698 /nfs/dbraw/zinc/16/76/98/1049167698.db2.gz HZINDKQWPWAUMN-TZMCWYRMSA-N 1 0 307.409 4.019 20 10 DICDRO COC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CCCCC1 ZINC000775562363 1049168007 /nfs/dbraw/zinc/16/80/07/1049168007.db2.gz HZINDKQWPWAUMN-JSGCOSHPSA-N 1 0 307.409 4.019 20 10 DICDRO CCN(CC)c1ccc(CNc2ccc3c([nH+]2)CCCC3)cc1 ZINC001179515751 1049173284 /nfs/dbraw/zinc/17/32/84/1049173284.db2.gz IAUXSKAAGJTKTD-UHFFFAOYSA-N 1 0 309.457 4.419 20 10 DICDRO C[C@H]([NH2+][C@@H]1CN(Cc2ccccc2)C(C)(C)C1)c1ccccc1O ZINC001179493745 1049174606 /nfs/dbraw/zinc/17/46/06/1049174606.db2.gz FOMVPTVQGWYBLK-WMZOPIPTSA-N 1 0 324.468 4.096 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(O)c(Cl)c2)cc1C ZINC001179507526 1049175322 /nfs/dbraw/zinc/17/53/22/1049175322.db2.gz YAVKZKKATXQNCA-UHFFFAOYSA-N 1 0 319.832 4.433 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCc3c2cccc3F)cc1 ZINC001179617023 1049185202 /nfs/dbraw/zinc/18/52/02/1049185202.db2.gz WJBPSDPTMYZLJL-BBIZLLLXSA-N 1 0 310.416 4.182 20 10 DICDRO COc1ccc(C2([NH2+][C@@H](C)c3ccc(N(C)C)cc3)CC2)cc1 ZINC000776957831 1049195951 /nfs/dbraw/zinc/19/59/51/1049195951.db2.gz HCPIKHPZGKLIQX-HNNXBMFYSA-N 1 0 310.441 4.101 20 10 DICDRO COc1ccc(C2([NH2+][C@H](C)c3ccc(N(C)C)cc3)CC2)cc1 ZINC000776957832 1049196090 /nfs/dbraw/zinc/19/60/90/1049196090.db2.gz HCPIKHPZGKLIQX-OAHLLOKOSA-N 1 0 310.441 4.101 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C)c(Br)c2)c1 ZINC000858238514 1049228901 /nfs/dbraw/zinc/22/89/01/1049228901.db2.gz AAIIFJONIUJPOX-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+]C/C=C/c2ccc(N(C)C)cc2)nc1 ZINC000858242039 1049229400 /nfs/dbraw/zinc/22/94/00/1049229400.db2.gz NHFRLFCIFUISLG-VOTSOKGWSA-N 1 0 323.484 4.037 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+]C/C=C\c2ccc(N(C)C)cc2)nc1 ZINC000858242038 1049229416 /nfs/dbraw/zinc/22/94/16/1049229416.db2.gz NHFRLFCIFUISLG-SREVYHEPSA-N 1 0 323.484 4.037 20 10 DICDRO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ccc2O)C1 ZINC001179936382 1049231437 /nfs/dbraw/zinc/23/14/37/1049231437.db2.gz GMTMWZHULQLNCP-SJKOYZFVSA-N 1 0 303.352 4.254 20 10 DICDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cccc(CC)c2O)C1(CC)CC ZINC001179953710 1049234315 /nfs/dbraw/zinc/23/43/15/1049234315.db2.gz YURSICGNNKKGEG-QZTJIDSGSA-N 1 0 319.489 4.370 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(F)nc2)c(C)n1-c1cccc(C)c1 ZINC000858293735 1049237389 /nfs/dbraw/zinc/23/73/89/1049237389.db2.gz PCEWINUZWYSSKL-UHFFFAOYSA-N 1 0 323.415 4.226 20 10 DICDRO CCOc1ccc(C[NH2+]CC2(C(F)(F)F)CCCC2)c(O)c1 ZINC000858307068 1049237997 /nfs/dbraw/zinc/23/79/97/1049237997.db2.gz ABGQWRVHEOPOFI-UHFFFAOYSA-N 1 0 317.351 4.003 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1 ZINC000858321285 1049242897 /nfs/dbraw/zinc/24/28/97/1049242897.db2.gz XVMRXMMNOAFJTF-QGZVFWFLSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccccc2CC(F)(F)F)c1 ZINC000858330565 1049243899 /nfs/dbraw/zinc/24/38/99/1049243899.db2.gz XUIHIBIKTFCMTC-UHFFFAOYSA-N 1 0 309.331 4.095 20 10 DICDRO C[N@H+](CCCOc1ccc(F)cc1)Cc1ccc(Cl)cc1O ZINC001179984714 1049244925 /nfs/dbraw/zinc/24/49/25/1049244925.db2.gz UCOKFYPINUHZFZ-UHFFFAOYSA-N 1 0 323.795 4.086 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C[C@H]1C ZINC001204769831 1049259476 /nfs/dbraw/zinc/25/94/76/1049259476.db2.gz WXEUXFWIWNSALG-IYBDPMFKSA-N 1 0 311.425 4.059 20 10 DICDRO Cc1ncccc1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000858519094 1049270262 /nfs/dbraw/zinc/27/02/62/1049270262.db2.gz RSHZHIPQRHWSDA-INIZCTEOSA-N 1 0 309.457 4.231 20 10 DICDRO C[C@@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1cc(F)ccc1O ZINC000858563043 1049274532 /nfs/dbraw/zinc/27/45/32/1049274532.db2.gz LMTBLLFXKDNOKM-MRVPVSSYSA-N 1 0 319.323 4.462 20 10 DICDRO CO[C@H]1C[C@@H](C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000858590566 1049282101 /nfs/dbraw/zinc/28/21/01/1049282101.db2.gz ABGBGUGPLBHIOJ-HLIPFELVSA-N 1 0 316.489 4.143 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C1(c3c(F)cccc3F)CCC1)CC2 ZINC000858603676 1049285058 /nfs/dbraw/zinc/28/50/58/1049285058.db2.gz FQXSCQMOWDUEET-OAHLLOKOSA-N 1 0 315.363 4.327 20 10 DICDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2cc(F)ccc2O)C12CCCCC2 ZINC001180099082 1049285555 /nfs/dbraw/zinc/28/55/55/1049285555.db2.gz SNEVWOXJNUFLGM-ROUUACIJSA-N 1 0 321.436 4.091 20 10 DICDRO CC[C@H](C)C[N@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC001204865307 1049289194 /nfs/dbraw/zinc/28/91/94/1049289194.db2.gz ARVZGENSDDXBSC-INIZCTEOSA-N 1 0 313.441 4.449 20 10 DICDRO CCC1CCC([N@H+](Cc2cc(OC)ccc2O)C2CC2)CC1 ZINC001204892062 1049301223 /nfs/dbraw/zinc/30/12/23/1049301223.db2.gz UOBPCTTXMYJSLG-UHFFFAOYSA-N 1 0 303.446 4.334 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC001204898921 1049303710 /nfs/dbraw/zinc/30/37/10/1049303710.db2.gz NFCZKJQLSUWOQE-UTKZUKDTSA-N 1 0 324.468 4.023 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC001204898919 1049304130 /nfs/dbraw/zinc/30/41/30/1049304130.db2.gz NFCZKJQLSUWOQE-DYESRHJHSA-N 1 0 324.468 4.023 20 10 DICDRO C[C@H]([NH2+]Cc1cccnc1C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000859258555 1049326237 /nfs/dbraw/zinc/32/62/37/1049326237.db2.gz PPNGFFWIDKABGO-LBPRGKRZSA-N 1 0 323.362 4.017 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2C)c1O ZINC001204974982 1049329281 /nfs/dbraw/zinc/32/92/81/1049329281.db2.gz FCRXKQIRLXQPJQ-LIRRHRJNSA-N 1 0 311.425 4.122 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)cc1Cl ZINC001180288742 1049337894 /nfs/dbraw/zinc/33/78/94/1049337894.db2.gz LCECJJGLTMQFHH-LBPRGKRZSA-N 1 0 305.805 4.253 20 10 DICDRO C[N@H+](CCc1ccc(Cl)cc1)Cc1ccc(Cl)cc1O ZINC001205008043 1049340125 /nfs/dbraw/zinc/34/01/25/1049340125.db2.gz QQLOKASLTVEEQH-UHFFFAOYSA-N 1 0 310.224 4.374 20 10 DICDRO C[C@@H]([NH2+]CCOC1CCC1)c1ccc(N2CCCCCC2)cc1 ZINC000777118416 1049343882 /nfs/dbraw/zinc/34/38/82/1049343882.db2.gz CWZIEOBEZZPXSU-QGZVFWFLSA-N 1 0 316.489 4.287 20 10 DICDRO CC(C)C[C@H]1C[C@H]([NH2+]Cc2cc(C(C)C)ccc2O)CCO1 ZINC001180326684 1049344406 /nfs/dbraw/zinc/34/44/06/1049344406.db2.gz OUMRUHNQRFXFAI-MSOLQXFVSA-N 1 0 305.462 4.199 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(-c2cnco2)cc1)c1ccc(N(C)C)cc1 ZINC000906527129 1049353558 /nfs/dbraw/zinc/35/35/58/1049353558.db2.gz ZMJVNXCJUCJYAJ-OAHLLOKOSA-N 1 0 321.424 4.258 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(F)cc(F)c1 ZINC001180480240 1049364463 /nfs/dbraw/zinc/36/44/63/1049364463.db2.gz XOUSEKSMGLCSQD-UHFFFAOYSA-N 1 0 304.384 4.053 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001180540263 1049379768 /nfs/dbraw/zinc/37/97/68/1049379768.db2.gz KAGLAGJWOSCUHF-TUYSUELWSA-N 1 0 324.468 4.467 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](Cc1cccs1)C1CC1 ZINC001180557874 1049382201 /nfs/dbraw/zinc/38/22/01/1049382201.db2.gz HXMJOJFVBPFXNI-UHFFFAOYSA-N 1 0 300.471 4.287 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(F)ccc1C ZINC001205143700 1049392816 /nfs/dbraw/zinc/39/28/16/1049392816.db2.gz VJMAOQVBMBUJFR-UHFFFAOYSA-N 1 0 300.421 4.222 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)CC1(CCCOC)CCC1 ZINC001205142805 1049392888 /nfs/dbraw/zinc/39/28/88/1049392888.db2.gz BUXSAVZOXPGQET-UHFFFAOYSA-N 1 0 318.505 4.171 20 10 DICDRO CC[C@H](C[N@H+](CC)Cc1cc(OC)ccc1O)c1ccccc1 ZINC001181042058 1049429743 /nfs/dbraw/zinc/42/97/43/1049429743.db2.gz BSZYKLUCFIFRLD-MRXNPFEDSA-N 1 0 313.441 4.417 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)c(O)c1 ZINC001181196501 1049452293 /nfs/dbraw/zinc/45/22/93/1049452293.db2.gz PUPAOINTDOIBEQ-OALUTQOASA-N 1 0 311.425 4.217 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2cc3ccccc3s2)c1 ZINC001205423064 1049465594 /nfs/dbraw/zinc/46/55/94/1049465594.db2.gz CVGCMJTTYXHEKX-LBPRGKRZSA-N 1 0 313.422 4.466 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c(Cl)c1 ZINC001181350525 1049466619 /nfs/dbraw/zinc/46/66/19/1049466619.db2.gz SKXQOQGVZNWPSZ-ONGXEEELSA-N 1 0 307.743 4.127 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H](C(F)(F)F)[C@@H]1C ZINC001205437814 1049470966 /nfs/dbraw/zinc/47/09/66/1049470966.db2.gz KTXOVZPWOQIPDT-BBRMVZONSA-N 1 0 314.395 4.224 20 10 DICDRO Cc1cc(C[N@H+]2C[C@H](C)[C@@H](C)[C@H]2C)ccc1N1CCCCC1 ZINC001195288732 1049511000 /nfs/dbraw/zinc/51/10/00/1049511000.db2.gz GSVHEMRGKCFJJB-RCCFBDPRSA-N 1 0 300.490 4.462 20 10 DICDRO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)Cc1cccc(C)c1O ZINC000775652281 1049520144 /nfs/dbraw/zinc/52/01/44/1049520144.db2.gz WXIXGDOQVXBPRY-LJQANCHMSA-N 1 0 311.425 4.219 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@H]([C@@H]3CCCC3(C)C)C2)cc1 ZINC001195427366 1049531749 /nfs/dbraw/zinc/53/17/49/1049531749.db2.gz RPIWOTJVDSDCLJ-HKUYNNGSSA-N 1 0 300.490 4.401 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CSc3ccccc32)cc1Cl ZINC001181970218 1049559144 /nfs/dbraw/zinc/55/91/44/1049559144.db2.gz BBNXFFCLAATBAI-ZDUSSCGKSA-N 1 0 319.857 4.333 20 10 DICDRO CC(C)[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)[C@H]1C(C)C ZINC001205788741 1049563833 /nfs/dbraw/zinc/56/38/33/1049563833.db2.gz GBQLCFKCKPFZHB-COJDAZNPSA-N 1 0 300.490 4.378 20 10 DICDRO CCCO[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000775688966 1049624916 /nfs/dbraw/zinc/62/49/16/1049624916.db2.gz WCQYGPLVLAPOLU-MRXNPFEDSA-N 1 0 311.853 4.135 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)Cc2ccc(Cl)cc2)c1 ZINC000775705270 1049635163 /nfs/dbraw/zinc/63/51/63/1049635163.db2.gz IEHJMQCLCXRYAY-CYBMUJFWSA-N 1 0 319.832 4.117 20 10 DICDRO CCc1cccc(C[NH2+]C2CCC(OC(C)(C)C)CC2)c1O ZINC000864054168 1049638093 /nfs/dbraw/zinc/63/80/93/1049638093.db2.gz SRFDNAXUJXFSAP-UHFFFAOYSA-N 1 0 305.462 4.171 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC001182423718 1049642395 /nfs/dbraw/zinc/64/23/95/1049642395.db2.gz IGSRLQWFWBAYGC-YSSFQJQWSA-N 1 0 300.490 4.160 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1 ZINC001206062671 1049644106 /nfs/dbraw/zinc/64/41/06/1049644106.db2.gz COMFENSLABBBOW-MOPGFXCFSA-N 1 0 315.457 4.049 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1 ZINC001206062676 1049644679 /nfs/dbraw/zinc/64/46/79/1049644679.db2.gz COMFENSLABBBOW-RTBURBONSA-N 1 0 315.457 4.049 20 10 DICDRO COc1cc(C)cc(C[NH2+]C(C)(C)Cc2ccc(C)cc2)c1O ZINC001182441363 1049650536 /nfs/dbraw/zinc/65/05/36/1049650536.db2.gz BPIVARCRTDVMHR-UHFFFAOYSA-N 1 0 313.441 4.129 20 10 DICDRO CCc1cccc(C[N@@H+]2Cc3ccccc3OC(C)(C)C2)c1O ZINC001206084424 1049650653 /nfs/dbraw/zinc/65/06/53/1049650653.db2.gz JXCSPXPKWRMTHC-UHFFFAOYSA-N 1 0 311.425 4.128 20 10 DICDRO COc1cc(O)c(C[N@H+](C)[C@H]2CCC[C@H]2C(C)(C)C)cc1OC ZINC001182443874 1049652273 /nfs/dbraw/zinc/65/22/73/1049652273.db2.gz MZBFVCCYKDEFOV-CABCVRRESA-N 1 0 321.461 4.056 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)c1 ZINC000775721246 1049661900 /nfs/dbraw/zinc/66/19/00/1049661900.db2.gz UTCKFACMAQGNHP-DNVCBOLYSA-N 1 0 311.425 4.026 20 10 DICDRO CCO[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000774496340 1049676849 /nfs/dbraw/zinc/67/68/49/1049676849.db2.gz KHBCXYPRERLPLM-OXJNMPFZSA-N 1 0 312.457 4.181 20 10 DICDRO CC[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(C)cc1O ZINC000794800573 1049696335 /nfs/dbraw/zinc/69/63/35/1049696335.db2.gz DTUWGWVACREORQ-FUHWJXTLSA-N 1 0 306.494 4.108 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H](O)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000794800660 1049696663 /nfs/dbraw/zinc/69/66/63/1049696663.db2.gz FQDZXOVEQBARIH-FMEYXAORSA-N 1 0 317.404 4.003 20 10 DICDRO CCc1cnc(CC[NH2+][C@H](CC)c2ccc(C)cc2O)s1 ZINC000794802423 1049697461 /nfs/dbraw/zinc/69/74/61/1049697461.db2.gz NZQDQCISIXXJEY-OAHLLOKOSA-N 1 0 304.459 4.003 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)N1CCCCC1)c1ccc(C)cc1O ZINC000794792882 1049698610 /nfs/dbraw/zinc/69/86/10/1049698610.db2.gz GUBZTRIBYVSWCF-KRWDZBQOSA-N 1 0 304.478 4.006 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccc(C)cc1O ZINC000794801607 1049699187 /nfs/dbraw/zinc/69/91/87/1049699187.db2.gz JTYGZDMXBAVHPN-IBGZPJMESA-N 1 0 312.457 4.316 20 10 DICDRO CC[C@H]([NH2+]CCCSc1nccs1)c1ccc(C)cc1O ZINC000794802281 1049699253 /nfs/dbraw/zinc/69/92/53/1049699253.db2.gz NBERBOAPPQKRNX-AWEZNQCLSA-N 1 0 322.499 4.380 20 10 DICDRO Oc1cc(Br)ccc1C[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC001206343703 1049716539 /nfs/dbraw/zinc/71/65/39/1049716539.db2.gz SUVQLAMQYNALCU-SWLSCSKDSA-N 1 0 324.262 4.213 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)CC2 ZINC001206517558 1049750644 /nfs/dbraw/zinc/75/06/44/1049750644.db2.gz WIUMFICCSIIGFZ-QGZVFWFLSA-N 1 0 301.817 4.440 20 10 DICDRO Cc1ccc(C[NH+]2CCC3(CCc4ccccc4C3)CC2)c(O)c1 ZINC001206536491 1049751458 /nfs/dbraw/zinc/75/14/58/1049751458.db2.gz AUQGGYINKPBYFO-UHFFFAOYSA-N 1 0 321.464 4.472 20 10 DICDRO C[C@@H]([NH2+]C1CC(c2cc(F)cc(F)c2)C1)c1ccccc1O ZINC001207159050 1049845747 /nfs/dbraw/zinc/84/57/47/1049845747.db2.gz CRBGSIJCMFIKOA-FFKNIBCLSA-N 1 0 303.352 4.267 20 10 DICDRO Cc1csc([C@H]2CC[N@@H+](Cc3cc(C(C)C)ccc3O)C2)n1 ZINC001207447183 1049893874 /nfs/dbraw/zinc/89/38/74/1049893874.db2.gz AYOYJLDBCPQQTO-HNNXBMFYSA-N 1 0 316.470 4.270 20 10 DICDRO CCSc1ccccc1CC[NH2+]Cc1cccc(CC)c1O ZINC001207493547 1049898670 /nfs/dbraw/zinc/89/86/70/1049898670.db2.gz PUFNXNNMGDGBKZ-UHFFFAOYSA-N 1 0 315.482 4.399 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@]2(C)CCOc3ccccc32)c1 ZINC001207654267 1049921023 /nfs/dbraw/zinc/92/10/23/1049921023.db2.gz KDZYXIOWWIRWGR-HXUWFJFHSA-N 1 0 311.425 4.303 20 10 DICDRO CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cccnc1 ZINC000164140517 1049921465 /nfs/dbraw/zinc/92/14/65/1049921465.db2.gz QHZWCJAAJAERPX-JXFKEZNVSA-N 1 0 311.473 4.238 20 10 DICDRO CC[C@@H]([NH2+]CCc1nc2c(s1)CCCC2)c1ccccc1O ZINC000156571965 1049932299 /nfs/dbraw/zinc/93/22/99/1049932299.db2.gz VLGVFOHWHZNWHX-CQSZACIVSA-N 1 0 316.470 4.011 20 10 DICDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000164396117 1049936794 /nfs/dbraw/zinc/93/67/94/1049936794.db2.gz CZVAJVNWQKPKBF-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@H]2Cc2ccccc2)cc1Cl ZINC001207806262 1049942163 /nfs/dbraw/zinc/94/21/63/1049942163.db2.gz SAJGURDHBHHKQE-CVEARBPZSA-N 1 0 315.844 4.322 20 10 DICDRO Cc1ccc(CCC[N@@H+](C)Cc2ccc(N3CCCC3)cc2)o1 ZINC001207948559 1049963102 /nfs/dbraw/zinc/96/31/02/1049963102.db2.gz WDJBAEKGGLAWTB-UHFFFAOYSA-N 1 0 312.457 4.253 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1-n1ccc(C)n1)c1ccccc1O ZINC000156757979 1049970897 /nfs/dbraw/zinc/97/08/97/1049970897.db2.gz BCLPVZGRXCAZBC-GOSISDBHSA-N 1 0 321.424 4.127 20 10 DICDRO Cc1ccc([C@@H](C)CC[N@H+](C)Cc2ccc(N(C)C)cc2)o1 ZINC001208165699 1049980250 /nfs/dbraw/zinc/98/02/50/1049980250.db2.gz GYLGJKKBPRQYBS-HNNXBMFYSA-N 1 0 300.446 4.280 20 10 DICDRO COC(C)(C)CCC[C@@H](C)CC[N@@H+]1CCc2cccc(O)c2C1 ZINC001208218882 1049987902 /nfs/dbraw/zinc/98/79/02/1049987902.db2.gz ONGVMXNLVPFHDS-MRXNPFEDSA-N 1 0 319.489 4.372 20 10 DICDRO CCOCCC1(C[NH2+]Cc2c(O)cccc2Cl)CCCC1 ZINC000760700331 1049991930 /nfs/dbraw/zinc/99/19/30/1049991930.db2.gz GFZNBTZUYTTYOC-UHFFFAOYSA-N 1 0 311.853 4.122 20 10 DICDRO CCOCCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000165085794 1050018418 /nfs/dbraw/zinc/01/84/18/1050018418.db2.gz VTVQPTNAXSOBND-INIZCTEOSA-N 1 0 322.468 4.283 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)cc1 ZINC001209516446 1050064893 /nfs/dbraw/zinc/06/48/93/1050064893.db2.gz GTAHLCBOEKTNHX-PZJWPPBQSA-N 1 0 324.468 4.095 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@H+](C)CCc2ccncc2)cc1 ZINC001209518908 1050065635 /nfs/dbraw/zinc/06/56/35/1050065635.db2.gz WCQCBQCZAAZHRI-UHFFFAOYSA-N 1 0 319.452 4.164 20 10 DICDRO CO[C@H]1CCC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)CC1 ZINC001209520305 1050065689 /nfs/dbraw/zinc/06/56/89/1050065689.db2.gz UXSWRGQTKAYDIS-FQEVSTJZSA-N 1 0 312.457 4.095 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)cc1 ZINC001209519025 1050065892 /nfs/dbraw/zinc/06/58/92/1050065892.db2.gz QHATWGMVMUHRRQ-FPOVZHCZSA-N 1 0 324.468 4.095 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[NH+]2CCC(F)(F)CC2)cc1 ZINC001209519440 1050066516 /nfs/dbraw/zinc/06/65/16/1050066516.db2.gz UNAPOKPRTKULOM-UHFFFAOYSA-N 1 0 304.384 4.325 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(OC)c(Cl)cc1F ZINC001209667720 1050076132 /nfs/dbraw/zinc/07/61/32/1050076132.db2.gz LWSAFOOVDMYHOO-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000770285136 1050148367 /nfs/dbraw/zinc/14/83/67/1050148367.db2.gz AOVPLZTXUGYRMZ-UYAOXDASSA-N 1 0 323.436 4.060 20 10 DICDRO Cc1nc([C@@H](C)[NH2+]CCCSc2nccs2)c(C)s1 ZINC000772875932 1050153396 /nfs/dbraw/zinc/15/33/96/1050153396.db2.gz CXEGEHCJPRUOBD-SECBINFHSA-N 1 0 313.517 4.049 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCOC[C@H]2CC(C)C)cc1C(C)C ZINC000733790148 1050155399 /nfs/dbraw/zinc/15/53/99/1050155399.db2.gz GEMVBMNUKSMVFA-QGZVFWFLSA-N 1 0 305.462 4.071 20 10 DICDRO COc1cccc(C=C2CC[NH+](Cc3ccccc3O)CC2)c1 ZINC000770506139 1050160850 /nfs/dbraw/zinc/16/08/50/1050160850.db2.gz USOWLZMEVQIQBA-UHFFFAOYSA-N 1 0 309.409 4.080 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]Cc2cc[nH]n2)c(O)c(C(C)(C)C)c1 ZINC000733900595 1050188214 /nfs/dbraw/zinc/18/82/14/1050188214.db2.gz WELGIZQSCXKJOJ-UHFFFAOYSA-N 1 0 315.461 4.000 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](CC)c2ccccc2OC)c1O ZINC000378891438 1050192469 /nfs/dbraw/zinc/19/24/69/1050192469.db2.gz LLUCYWMUHWTBFM-MRXNPFEDSA-N 1 0 315.413 4.040 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)[C@@H]2CCCCO2)c(C)n1-c1ccccc1 ZINC000379148797 1050195599 /nfs/dbraw/zinc/19/55/99/1050195599.db2.gz BENAOEYZKIMRRK-JXFKEZNVSA-N 1 0 312.457 4.141 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)c(O)c1 ZINC000824462784 1050214599 /nfs/dbraw/zinc/21/45/99/1050214599.db2.gz NMHZJVWIQGPQEP-NSHDSACASA-N 1 0 323.795 4.434 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H]2CCCc3c(F)cccc32)c1 ZINC000824468842 1050217617 /nfs/dbraw/zinc/21/76/17/1050217617.db2.gz OSOZHOCMAYHAJE-SFHVURJKSA-N 1 0 315.388 4.097 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2ccccc2c1O)c1ccccn1 ZINC000824592085 1050227866 /nfs/dbraw/zinc/22/78/66/1050227866.db2.gz YMBQSZFKLZNELV-UHFFFAOYSA-N 1 0 306.409 4.008 20 10 DICDRO Oc1ccccc1C[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171063942 1050239514 /nfs/dbraw/zinc/23/95/14/1050239514.db2.gz PJTFMWKUMJHEOQ-AWEZNQCLSA-N 1 0 322.235 4.346 20 10 DICDRO C[C@@]1(C[NH2+]Cc2ccc3ccccc3c2O)CC1(Cl)Cl ZINC000824780332 1050245105 /nfs/dbraw/zinc/24/51/05/1050245105.db2.gz KOHKQQJQZYAAJX-HNNXBMFYSA-N 1 0 310.224 4.219 20 10 DICDRO CC[C@H]([NH2+]CC[C@]1(C)CC1(Cl)Cl)c1ccccc1O ZINC000824976561 1050263965 /nfs/dbraw/zinc/26/39/65/1050263965.db2.gz BZLJEUVSVQAVJI-GXTWGEPZSA-N 1 0 302.245 4.407 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)c2nccn21 ZINC000825017098 1050266912 /nfs/dbraw/zinc/26/69/12/1050266912.db2.gz LLXYNXKOMTUXQI-KBXCAEBGSA-N 1 0 319.408 4.051 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1O ZINC000825104086 1050269212 /nfs/dbraw/zinc/26/92/12/1050269212.db2.gz MRRTYNLUWZWTJF-GOSISDBHSA-N 1 0 313.397 4.111 20 10 DICDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000734476361 1050277211 /nfs/dbraw/zinc/27/72/11/1050277211.db2.gz FNCYEDWZNDFPTC-DNVCBOLYSA-N 1 0 307.437 4.259 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2nc(C(C)(C)C)cs2)cc1Cl ZINC000825247247 1050287981 /nfs/dbraw/zinc/28/79/81/1050287981.db2.gz PMTIFVAWARXYCS-UHFFFAOYSA-N 1 0 324.877 4.398 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(c3ccccc3F)CC2)cc1Cl ZINC000825291900 1050291394 /nfs/dbraw/zinc/29/13/94/1050291394.db2.gz RBGBVUWPGCYOFJ-UHFFFAOYSA-N 1 0 305.780 4.272 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)C[C@H](C)O ZINC000157679972 1050301830 /nfs/dbraw/zinc/30/18/30/1050301830.db2.gz KZTMBRZOOYGAJD-SQNIBIBYSA-N 1 0 318.505 4.125 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)C[C@@H](C)c2nccs2)cc1Cl ZINC000825500849 1050310484 /nfs/dbraw/zinc/31/04/84/1050310484.db2.gz JBHGBEJULMWQCT-LLVKDONJSA-N 1 0 310.850 4.046 20 10 DICDRO Cc1ccc(C(F)(F)F)c(C[N@H+](C)Cc2ccccc2O)c1 ZINC001143680959 1050336293 /nfs/dbraw/zinc/33/62/93/1050336293.db2.gz QGQGGKLKLLANCB-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CCCNc1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000766212325 1050352492 /nfs/dbraw/zinc/35/24/92/1050352492.db2.gz ITOSKRBQGOXWRT-UHFFFAOYSA-N 1 0 304.821 4.157 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@H]1Cc1ccccc1)CCC2 ZINC000844257173 1050391344 /nfs/dbraw/zinc/39/13/44/1050391344.db2.gz SOPKLBLUTAGLHE-FQEVSTJZSA-N 1 0 307.437 4.088 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCC[C@@H](C)CC1)c1ccc(N2CCOCC2)cc1 ZINC000785571340 1050395261 /nfs/dbraw/zinc/39/52/61/1050395261.db2.gz YFHYGNUMJRMDMF-LMMKCTJWSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1ccccc1[C@H]([C@H](C)[NH2+][C@@H](C)c1ccccc1O)N(C)C ZINC000785572727 1050397791 /nfs/dbraw/zinc/39/77/91/1050397791.db2.gz KUZNRBRSCFPPDR-FTRWYGJKSA-N 1 0 312.457 4.043 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)ccc1N1CCCCC1 ZINC000844469027 1050434254 /nfs/dbraw/zinc/43/42/54/1050434254.db2.gz UAINWVAHSVYURN-SFHVURJKSA-N 1 0 320.427 4.216 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](CC)Cc2c[nH]c3ccccc23)c1 ZINC000785993820 1050443093 /nfs/dbraw/zinc/44/30/93/1050443093.db2.gz YRQBQGIQXDJMGV-UHFFFAOYSA-N 1 0 324.424 4.294 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)Oc1ccccc1F ZINC000766215913 1050464492 /nfs/dbraw/zinc/46/44/92/1050464492.db2.gz IFCBCDFQXZIONJ-GJZGRUSLSA-N 1 0 316.420 4.010 20 10 DICDRO Oc1ccccc1C[NH2+][C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171139874 1050468963 /nfs/dbraw/zinc/46/89/63/1050468963.db2.gz SAMXTBGCRSFLNC-CQSZACIVSA-N 1 0 322.235 4.346 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(Cl)c(F)cc1F ZINC001144133945 1050474591 /nfs/dbraw/zinc/47/45/91/1050474591.db2.gz HDVPOCRLFAFWCG-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CC3(F)F)CC2)cc1C(C)C ZINC000844725999 1050488357 /nfs/dbraw/zinc/48/83/57/1050488357.db2.gz SLPCNEFEIVTGHW-UHFFFAOYSA-N 1 0 309.400 4.445 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844746309 1050490266 /nfs/dbraw/zinc/49/02/66/1050490266.db2.gz JTBRVISYATWKIU-KRWDZBQOSA-N 1 0 303.352 4.167 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844746311 1050490792 /nfs/dbraw/zinc/49/07/92/1050490792.db2.gz JTBRVISYATWKIU-QGZVFWFLSA-N 1 0 303.352 4.167 20 10 DICDRO C[NH2+]Cc1cccc(N(Cc2ccccc2)c2ccc(N)cc2)c1 ZINC001211139485 1050493177 /nfs/dbraw/zinc/49/31/77/1050493177.db2.gz HVQILNONJUFMSR-UHFFFAOYSA-N 1 0 317.436 4.327 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCCC[C@H]1C)c1ccc(N2CCOCC2)cc1 ZINC000766225941 1050503653 /nfs/dbraw/zinc/50/36/53/1050503653.db2.gz KDXRNADDKOOIDX-UWVAXJGDSA-N 1 0 316.489 4.143 20 10 DICDRO CC[N@H+](Cc1ccc(-n2cccc2)cc1)Cc1ccccc1O ZINC001144252539 1050519774 /nfs/dbraw/zinc/51/97/74/1050519774.db2.gz QKOYOKVZMHAVTM-UHFFFAOYSA-N 1 0 306.409 4.205 20 10 DICDRO Cn1c[nH+]cc1Nc1ccc(Cl)cc1C(=O)c1ccccc1 ZINC001211249650 1050527059 /nfs/dbraw/zinc/52/70/59/1050527059.db2.gz XWSZVYMRJGRHBO-UHFFFAOYSA-N 1 0 311.772 4.048 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000168203676 1050531132 /nfs/dbraw/zinc/53/11/32/1050531132.db2.gz GFJSLUDEBWVTMB-SJKOYZFVSA-N 1 0 301.434 4.159 20 10 DICDRO Cc1ccc([C@H](C)C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000738436792 1050536909 /nfs/dbraw/zinc/53/69/09/1050536909.db2.gz ZCARNXRLLKJXTQ-OAHLLOKOSA-N 1 0 300.421 4.093 20 10 DICDRO CCC(CC)[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766236499 1050547327 /nfs/dbraw/zinc/54/73/27/1050547327.db2.gz DXKWMSLSADLWLJ-AWEZNQCLSA-N 1 0 312.404 4.035 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C/C=C/c2ccc(Cl)cc2)c1 ZINC000787278319 1050580434 /nfs/dbraw/zinc/58/04/34/1050580434.db2.gz DGLXDUDIAFHYCT-ITDFMYJTSA-N 1 0 317.816 4.418 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cc1F ZINC000787417500 1050597088 /nfs/dbraw/zinc/59/70/88/1050597088.db2.gz OCHDTLHYBNTBRY-CQSZACIVSA-N 1 0 318.358 4.055 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(F)cc(C)cc2Cl)c1 ZINC000845972532 1050638725 /nfs/dbraw/zinc/63/87/25/1050638725.db2.gz RLMMRTRPYYVLAM-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(F)cc(Cl)c2)c1 ZINC000845971127 1050639588 /nfs/dbraw/zinc/63/95/88/1050639588.db2.gz HHGBVNONAWJVFY-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO CCCC[N@H+](Cc1cc2cnccc2o1)Cc1ccccc1O ZINC000845969674 1050639772 /nfs/dbraw/zinc/63/97/72/1050639772.db2.gz UGNIDUQWFYGOTL-UHFFFAOYSA-N 1 0 310.397 4.336 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)cc2Cl)c1 ZINC000845971437 1050640116 /nfs/dbraw/zinc/64/01/16/1050640116.db2.gz KICIDKOEKMCRIY-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CSCCS1)c1ccc2ccccc2c1O ZINC000168819766 1050656106 /nfs/dbraw/zinc/65/61/06/1050656106.db2.gz IVLXRRQSBUQJFY-OCCSQVGLSA-N 1 0 319.495 4.045 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccccc2OC(F)F)c1 ZINC000788259670 1050660756 /nfs/dbraw/zinc/66/07/56/1050660756.db2.gz OLJORCIJPFTMCR-ZDUSSCGKSA-N 1 0 321.367 4.195 20 10 DICDRO CCO[C@H](CC[NH2+][C@H](C)c1cccc(OC)c1O)C1CCCC1 ZINC000846148879 1050671817 /nfs/dbraw/zinc/67/18/17/1050671817.db2.gz UGMCBNMIFQOZBN-RHSMWYFYSA-N 1 0 321.461 4.037 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c1 ZINC000846108023 1050671838 /nfs/dbraw/zinc/67/18/38/1050671838.db2.gz BHQOAHBPLUGOEV-MNOVXSKESA-N 1 0 318.244 4.025 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1cc(F)ccc1F ZINC000846153357 1050674631 /nfs/dbraw/zinc/67/46/31/1050674631.db2.gz GLYSCOZEYOEIGF-BZNIZROVSA-N 1 0 321.367 4.481 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2c3ccccc3CC[C@@H]2C)c1O ZINC000846155653 1050674726 /nfs/dbraw/zinc/67/47/26/1050674726.db2.gz BMMBNXIQCNXYGW-NJSLBKSFSA-N 1 0 311.425 4.375 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1cc(F)ccc1F ZINC000846153355 1050675056 /nfs/dbraw/zinc/67/50/56/1050675056.db2.gz GLYSCOZEYOEIGF-BDJLRTHQSA-N 1 0 321.367 4.481 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2cccc(CSC)c2)c1O ZINC000846166199 1050678101 /nfs/dbraw/zinc/67/81/01/1050678101.db2.gz UCQCZRNHCUXLMP-ZDUSSCGKSA-N 1 0 317.454 4.115 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCc3sccc32)c1O ZINC000846163244 1050678549 /nfs/dbraw/zinc/67/85/49/1050678549.db2.gz GYYPVOWSXCVISN-FZMZJTMJSA-N 1 0 303.427 4.191 20 10 DICDRO CC[C@H](C[NH2+][C@@H](C)c1cccc(OC)c1O)CC(F)(F)F ZINC000846170548 1050680307 /nfs/dbraw/zinc/68/03/07/1050680307.db2.gz AYGATDJKDAKVBJ-QWRGUYRKSA-N 1 0 305.340 4.030 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC[C@@H]2CCc3ccccc32)c1O ZINC000846171009 1050680511 /nfs/dbraw/zinc/68/05/11/1050680511.db2.gz QGQHQLKBBFWBIA-HOCLYGCPSA-N 1 0 311.425 4.172 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCC2CC(OC(C)(C)C)C2)c1O ZINC000846167271 1050681032 /nfs/dbraw/zinc/68/10/32/1050681032.db2.gz VWMONXBJKOUGKI-WLYUNCDWSA-N 1 0 321.461 4.035 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(OC(C)C)cc2)c1O ZINC000846138399 1050681750 /nfs/dbraw/zinc/68/17/50/1050681750.db2.gz KELORIJFERSIJE-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2OC)c1O ZINC000846138133 1050682083 /nfs/dbraw/zinc/68/20/83/1050682083.db2.gz SWOWVRGBUJVDDI-ZIAGYGMSSA-N 1 0 315.413 4.130 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)c1O ZINC000846135437 1050682246 /nfs/dbraw/zinc/68/22/46/1050682246.db2.gz DLTZUEYACPMKOJ-NEPJUHHUSA-N 1 0 305.443 4.491 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccccc1OC ZINC000846138763 1050682659 /nfs/dbraw/zinc/68/26/59/1050682659.db2.gz GPVQAZZIBHRUTH-CZUORRHYSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)c1O ZINC000846136624 1050682663 /nfs/dbraw/zinc/68/26/63/1050682663.db2.gz IHWVJCBEUAHKIF-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)c1O ZINC000846137837 1050682672 /nfs/dbraw/zinc/68/26/72/1050682672.db2.gz REZIPUVBRAZTFZ-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO CCS[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846143970 1050684483 /nfs/dbraw/zinc/68/44/83/1050684483.db2.gz BSVNXBDKDXPEQV-DUVNUKRYSA-N 1 0 309.475 4.116 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCc2c[nH]c3cc(C)ccc23)c1O ZINC000846142710 1050684676 /nfs/dbraw/zinc/68/46/76/1050684676.db2.gz VREAHIDLSWXHOD-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)c1O ZINC000846145209 1050686131 /nfs/dbraw/zinc/68/61/31/1050686131.db2.gz PBTNLQPOGNUIHW-CQSZACIVSA-N 1 0 324.424 4.350 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](c2ncccc2C)C(C)C)c1O ZINC000846145172 1050686732 /nfs/dbraw/zinc/68/67/32/1050686732.db2.gz NDNLDHFVVHLTQI-RHSMWYFYSA-N 1 0 314.429 4.152 20 10 DICDRO C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)c1cc(Cl)ccc1O ZINC000846185835 1050687987 /nfs/dbraw/zinc/68/79/87/1050687987.db2.gz SWQQVHGCORVARR-CUOATXAZSA-N 1 0 306.208 4.401 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C2CC2)C2CCOCC2)c1O ZINC000846187617 1050690078 /nfs/dbraw/zinc/69/00/78/1050690078.db2.gz LKZWRCQFVPNSIT-YVEFUNNKSA-N 1 0 323.864 4.210 20 10 DICDRO C[N@H+](Cc1cc2ccccc2c(Cl)n1)Cc1ccccc1O ZINC000788493265 1050690726 /nfs/dbraw/zinc/69/07/26/1050690726.db2.gz HZWDQNZQQCKGKZ-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2c[nH]c3ccccc23)c(O)c1 ZINC000788497524 1050691929 /nfs/dbraw/zinc/69/19/29/1050691929.db2.gz JLDZAPFQTGLFPG-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccccc1F ZINC000846191624 1050693077 /nfs/dbraw/zinc/69/30/77/1050693077.db2.gz XHTURFUCFORLTB-LRDDRELGSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2OC(F)F)c(O)c1 ZINC000788504370 1050693965 /nfs/dbraw/zinc/69/39/65/1050693965.db2.gz HQOVQLFZJUFANC-ZDUSSCGKSA-N 1 0 321.367 4.461 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c1 ZINC000846214653 1050694901 /nfs/dbraw/zinc/69/49/01/1050694901.db2.gz LCAQDYOTYJYNKA-NEPJUHHUSA-N 1 0 302.245 4.325 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c(O)c1 ZINC000788585420 1050712027 /nfs/dbraw/zinc/71/20/27/1050712027.db2.gz VABQATAXWBQAPE-MRXNPFEDSA-N 1 0 324.468 4.242 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3c(C)cc(C)cc3O)nc2c1 ZINC000788611655 1050715406 /nfs/dbraw/zinc/71/54/06/1050715406.db2.gz NWTPRVVJKGJTBQ-CQSZACIVSA-N 1 0 309.413 4.045 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCN(c3ccccc3)C2)c1 ZINC000788620981 1050718411 /nfs/dbraw/zinc/71/84/11/1050718411.db2.gz SSQVCOMHAILGTE-ZWKOTPCHSA-N 1 0 324.468 4.268 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCCC1 ZINC000788630731 1050722105 /nfs/dbraw/zinc/72/21/05/1050722105.db2.gz INEHOQJEESDPEL-INIZCTEOSA-N 1 0 305.462 4.257 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCCO[C@@H]2C(C)C)c(O)c1 ZINC000788661631 1050726898 /nfs/dbraw/zinc/72/68/98/1050726898.db2.gz BLUAZGRUOKAANY-FRQCXROJSA-N 1 0 305.462 4.111 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CCC1 ZINC000788666408 1050728242 /nfs/dbraw/zinc/72/82/42/1050728242.db2.gz BYNQYCWVGJZOHT-MRXNPFEDSA-N 1 0 305.462 4.257 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c(F)c1 ZINC000788670517 1050729220 /nfs/dbraw/zinc/72/92/20/1050729220.db2.gz TWVSDFRUPJHSMV-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cccc3[nH]ccc32)c(O)c1 ZINC000788821394 1050756936 /nfs/dbraw/zinc/75/69/36/1050756936.db2.gz FDWKGEHYFJFVQX-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO COc1c2ccccc2oc1C[NH2+]Cc1cc(Cl)ccc1O ZINC000788969795 1050767538 /nfs/dbraw/zinc/76/75/38/1050767538.db2.gz NZKFSUZOHYARAQ-UHFFFAOYSA-N 1 0 317.772 4.090 20 10 DICDRO COc1c2ccccc2oc1C[NH2+]Cc1c(O)cccc1Cl ZINC000788971002 1050768349 /nfs/dbraw/zinc/76/83/49/1050768349.db2.gz ZMLSCSRMVRDSCB-UHFFFAOYSA-N 1 0 317.772 4.090 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](Cc2ccco2)C(C)C)c1O ZINC000761191858 1050772783 /nfs/dbraw/zinc/77/27/83/1050772783.db2.gz YABXCNTXKZTYTG-UHFFFAOYSA-N 1 0 309.793 4.058 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](Cc2ccc(C)o2)C2CC2)c1O ZINC000761190472 1050773193 /nfs/dbraw/zinc/77/31/93/1050773193.db2.gz AQXGGYPWCCLDKA-UHFFFAOYSA-N 1 0 321.804 4.120 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H](c2cccs2)C2CC2)c1O ZINC000761198455 1050775023 /nfs/dbraw/zinc/77/50/23/1050775023.db2.gz OYRBHOBEUMJZEY-OAHLLOKOSA-N 1 0 323.845 4.357 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c1O ZINC000761205599 1050782962 /nfs/dbraw/zinc/78/29/62/1050782962.db2.gz GWOLRSISBBUJFO-LALPHHSUSA-N 1 0 309.837 4.113 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)c1O ZINC000761205603 1050783729 /nfs/dbraw/zinc/78/37/29/1050783729.db2.gz GWOLRSISBBUJFO-SLEUVZQESA-N 1 0 309.837 4.113 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)c1O ZINC000761205611 1050783854 /nfs/dbraw/zinc/78/38/54/1050783854.db2.gz GWOLRSISBBUJFO-YWPYICTPSA-N 1 0 309.837 4.113 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1C)c1ccc(N2CCOCC2)cc1Cl ZINC000772959499 1050805677 /nfs/dbraw/zinc/80/56/77/1050805677.db2.gz PXTHKWABGMWEBQ-SUNYJGFJSA-N 1 0 322.880 4.016 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000772961414 1050807599 /nfs/dbraw/zinc/80/75/99/1050807599.db2.gz QKLCWYUJXOMWDP-MGPUTAFESA-N 1 0 324.468 4.489 20 10 DICDRO COc1cccc(CCC[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000772961154 1050808331 /nfs/dbraw/zinc/80/83/31/1050808331.db2.gz ZKWRRHINGMUAIV-MRXNPFEDSA-N 1 0 312.457 4.045 20 10 DICDRO COc1cccc(CCC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000772961153 1050808512 /nfs/dbraw/zinc/80/85/12/1050808512.db2.gz ZKWRRHINGMUAIV-INIZCTEOSA-N 1 0 312.457 4.045 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H](SC)C2)cc1F ZINC000742383769 1050826780 /nfs/dbraw/zinc/82/67/80/1050826780.db2.gz TXCHLXZLLDURHL-HUUCEWRRSA-N 1 0 310.482 4.046 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000742384002 1050827378 /nfs/dbraw/zinc/82/73/78/1050827378.db2.gz XUWVZFTVLIIHAJ-CYBMUJFWSA-N 1 0 324.207 4.231 20 10 DICDRO CS[C@@H]1CC[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000742382793 1050828157 /nfs/dbraw/zinc/82/81/57/1050828157.db2.gz GHILSCUQVGJEIA-QZTJIDSGSA-N 1 0 313.466 4.433 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1F ZINC000742390745 1050830331 /nfs/dbraw/zinc/83/03/31/1050830331.db2.gz MRJKDZUYDXLSMK-GFCCVEGCSA-N 1 0 322.374 4.063 20 10 DICDRO C[C@H]1CC[C@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC000742369367 1050833335 /nfs/dbraw/zinc/83/33/35/1050833335.db2.gz BKAZGNICTMTSIJ-ZFWWWQNUSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c1 ZINC000789481972 1050837278 /nfs/dbraw/zinc/83/72/78/1050837278.db2.gz ALXUIMJUHFBXIN-HIFRSBDPSA-N 1 0 314.256 4.025 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](CC2CC2)c2ccccc2)c1O ZINC000742377473 1050837291 /nfs/dbraw/zinc/83/72/91/1050837291.db2.gz DLPWLBGKAQFUOK-SFHVURJKSA-N 1 0 311.425 4.422 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)ccc1OC ZINC000742378210 1050837461 /nfs/dbraw/zinc/83/74/61/1050837461.db2.gz DTSSPTSBFNWVQU-JENIJYKNSA-N 1 0 317.473 4.290 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2C[C@H]2C2CCCCC2)ccc1OC ZINC000742375426 1050837941 /nfs/dbraw/zinc/83/79/41/1050837941.db2.gz MYRVIGYNFKQCFM-OALUTQOASA-N 1 0 317.473 4.290 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2OCCc3ccccc32)cc1 ZINC000772980475 1050880657 /nfs/dbraw/zinc/88/06/57/1050880657.db2.gz PFMXKHRQRINUAL-IIBYNOLFSA-N 1 0 324.468 4.107 20 10 DICDRO c1ccc2cc(CC[NH2+]Cc3ccc4c(c3)CCO4)ccc2c1 ZINC000742700079 1050923533 /nfs/dbraw/zinc/92/35/33/1050923533.db2.gz WPJVBHJOPNEPSN-UHFFFAOYSA-N 1 0 303.405 4.107 20 10 DICDRO C[C@@H](COc1ccccc1)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000742723304 1050924914 /nfs/dbraw/zinc/92/49/14/1050924914.db2.gz IVEQKAGAQABBLN-SFHVURJKSA-N 1 0 324.468 4.234 20 10 DICDRO COc1cc(C[N@@H+]2CCSCC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000790481455 1050963558 /nfs/dbraw/zinc/96/35/58/1050963558.db2.gz FQAMDYNDDCFKCF-ZDUSSCGKSA-N 1 0 323.502 4.026 20 10 DICDRO C[C@@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1cc(Cl)ccc1O ZINC000790703701 1050986794 /nfs/dbraw/zinc/98/67/94/1050986794.db2.gz UEXDOVUORNEBAB-SJKOYZFVSA-N 1 0 311.853 4.028 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(O)c1C ZINC000790695263 1050987228 /nfs/dbraw/zinc/98/72/28/1050987228.db2.gz LPUPFTCITRIJCU-AWEZNQCLSA-N 1 0 314.385 4.076 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(OCC2CC2)cc1)c1ccc(N(C)C)cc1 ZINC000790989259 1051013756 /nfs/dbraw/zinc/01/37/56/1051013756.db2.gz ALDPZQHYYVDEDO-MRXNPFEDSA-N 1 0 324.468 4.392 20 10 DICDRO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000773001409 1051014620 /nfs/dbraw/zinc/01/46/20/1051014620.db2.gz RXKPGRSAROKLGF-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCc3c(O)cccc32)cc1 ZINC000790995453 1051015310 /nfs/dbraw/zinc/01/53/10/1051015310.db2.gz MTGPTGBFSLBUSV-FQEVSTJZSA-N 1 0 324.468 4.406 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1ccccc1OC ZINC000772999518 1051015878 /nfs/dbraw/zinc/01/58/78/1051015878.db2.gz LPRJGQLYGUJAKV-SFHVURJKSA-N 1 0 312.457 4.311 20 10 DICDRO C[C@H]([NH2+]CCCC1CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000773001765 1051016556 /nfs/dbraw/zinc/01/65/56/1051016556.db2.gz PSHJJBIZYSRFRS-AWEZNQCLSA-N 1 0 322.880 4.017 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccccc2N(C)C)cc1 ZINC000773003570 1051017947 /nfs/dbraw/zinc/01/79/47/1051017947.db2.gz FEGOPQWAGZCIOO-INIZCTEOSA-N 1 0 311.473 4.060 20 10 DICDRO CC[C@H](O)CCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773015846 1051025430 /nfs/dbraw/zinc/02/54/30/1051025430.db2.gz OHQUIALWQGYBJY-PXNSSMCTSA-N 1 0 318.505 4.269 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)cc1F)c1ccc(N(C)C)cc1 ZINC000773041604 1051034343 /nfs/dbraw/zinc/03/43/43/1051034343.db2.gz RHTANRIUTVXPDN-IBGZPJMESA-N 1 0 316.420 4.141 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)cc1F)c1ccc(N(C)C)cc1 ZINC000773041606 1051037841 /nfs/dbraw/zinc/03/78/41/1051037841.db2.gz RHTANRIUTVXPDN-LJQANCHMSA-N 1 0 316.420 4.141 20 10 DICDRO Cc1cc(C[NH2+]Cc2cccn2C)c(C)n1-c1cccc(C)c1 ZINC000743497192 1051038636 /nfs/dbraw/zinc/03/86/36/1051038636.db2.gz DSTPHXJKUZXOQC-UHFFFAOYSA-N 1 0 307.441 4.031 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1COc2ccc(C)cc21)c1ccc(N(C)C)cc1 ZINC000773058679 1051041756 /nfs/dbraw/zinc/04/17/56/1051041756.db2.gz IRXJZYOOHXRCTE-RTBURBONSA-N 1 0 310.441 4.235 20 10 DICDRO CCC1(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2Cl)CC1 ZINC000773050801 1051042516 /nfs/dbraw/zinc/04/25/16/1051042516.db2.gz UTHXDGBHBYKKQJ-CQSZACIVSA-N 1 0 322.880 4.017 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC[C@@H]2CCCC[C@H]2O)cc1 ZINC000773080880 1051054518 /nfs/dbraw/zinc/05/45/18/1051054518.db2.gz NXNSJGIQPMUZTO-XKGZKEIXSA-N 1 0 318.505 4.125 20 10 DICDRO CS[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773095288 1051061592 /nfs/dbraw/zinc/06/15/92/1051061592.db2.gz RGZPHNZIKMGHFM-HOTGVXAUSA-N 1 0 306.519 4.469 20 10 DICDRO C[C@@H]([NH2+][C@H]1CC[C@H](O)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000773102415 1051063052 /nfs/dbraw/zinc/06/30/52/1051063052.db2.gz MORMPWRMLJDODZ-YVWKXTFCSA-N 1 0 316.489 4.021 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000037092629 1051109600 /nfs/dbraw/zinc/10/96/00/1051109600.db2.gz CKTZPYCOZOECQX-UHFFFAOYSA-N 1 0 307.743 4.256 20 10 DICDRO CC[C@@H]1C[C@H]([NH2+][C@@H]2c3c(c(C)cc(C)c3O)CC2(C)C)CCO1 ZINC001170201538 1051155423 /nfs/dbraw/zinc/15/54/23/1051155423.db2.gz DBGMPKGLJLVSCX-SPYBWZPUSA-N 1 0 317.473 4.180 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(Br)cc1O)c1ccccc1 ZINC000691415497 1051163505 /nfs/dbraw/zinc/16/35/05/1051163505.db2.gz QEKSVEVKFRUIGR-OAHLLOKOSA-N 1 0 320.230 4.396 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@@H]1Cc2cccc(F)c2C1 ZINC001171806054 1051224217 /nfs/dbraw/zinc/22/42/17/1051224217.db2.gz XIAZYGLXOFQUQZ-LJQANCHMSA-N 1 0 324.443 4.025 20 10 DICDRO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000793231280 1051264150 /nfs/dbraw/zinc/26/41/50/1051264150.db2.gz LYZJECGHGIAIOL-XHDPSFHLSA-N 1 0 309.331 4.318 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000793270670 1051276551 /nfs/dbraw/zinc/27/65/51/1051276551.db2.gz XZOSLXPWDGYONZ-CXAGYDPISA-N 1 0 303.352 4.096 20 10 DICDRO CO[C@@]1(C)CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000793341446 1051280346 /nfs/dbraw/zinc/28/03/46/1051280346.db2.gz VFHFWOFWBGCMAY-FQEVSTJZSA-N 1 0 316.489 4.068 20 10 DICDRO COc1ccc(C[NH2+]Cc2csc(Cl)c2Cl)c(O)c1 ZINC000793387854 1051293391 /nfs/dbraw/zinc/29/33/91/1051293391.db2.gz BDQNYBOJXCWDIS-UHFFFAOYSA-N 1 0 318.225 4.059 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)[C@@H](C)c2ccc(Cl)cc2)c(O)c1 ZINC000793386533 1051294234 /nfs/dbraw/zinc/29/42/34/1051294234.db2.gz VRUQBMVAUWZOQV-CHWSQXEVSA-N 1 0 319.832 4.336 20 10 DICDRO CCC[N@H+](Cc1ccc(F)cc1)Cc1c(O)ccc2ccncc21 ZINC000746033508 1051308062 /nfs/dbraw/zinc/30/80/62/1051308062.db2.gz AZKIFFYNXGPWQI-UHFFFAOYSA-N 1 0 324.399 4.492 20 10 DICDRO Oc1ccc2ccncc2c1C[N@H+](CCc1ccccc1)C1CC1 ZINC000746022974 1051308177 /nfs/dbraw/zinc/30/81/77/1051308177.db2.gz LXEJOCLSTCIGMK-UHFFFAOYSA-N 1 0 318.420 4.148 20 10 DICDRO CCC[N@H+](Cc1ccccc1F)Cc1c(O)ccc2ccncc21 ZINC000746039686 1051308670 /nfs/dbraw/zinc/30/86/70/1051308670.db2.gz ZQOOEROBNGAXIW-UHFFFAOYSA-N 1 0 324.399 4.492 20 10 DICDRO CCOC1(C)CC[NH+](Cc2cc(C)cc(C(C)(C)C)c2O)CC1 ZINC000793543832 1051314947 /nfs/dbraw/zinc/31/49/47/1051314947.db2.gz RRNUAEOGMSKARA-UHFFFAOYSA-N 1 0 319.489 4.389 20 10 DICDRO C[C@H]([NH2+][C@H]1CSc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC001172196748 1051323657 /nfs/dbraw/zinc/32/36/57/1051323657.db2.gz LJQXVIPAWJZYGR-WMLDXEAASA-N 1 0 312.482 4.120 20 10 DICDRO CC1(C)C[N@H+](Cc2cc3c(cc2O)CCCC3)[C@@H]1c1cccnc1 ZINC000793573303 1051325450 /nfs/dbraw/zinc/32/54/50/1051325450.db2.gz VYVOLDWFHUKMAL-HXUWFJFHSA-N 1 0 322.452 4.249 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@@H]1CSc2ccccc2C1 ZINC001172200033 1051326069 /nfs/dbraw/zinc/32/60/69/1051326069.db2.gz GZVSHVRGTCSUAU-SFHVURJKSA-N 1 0 321.445 4.352 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)cc1F ZINC000793621524 1051329044 /nfs/dbraw/zinc/32/90/44/1051329044.db2.gz XJBGLJXQQXIERR-UHFFFAOYSA-N 1 0 318.358 4.056 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000793620104 1051329453 /nfs/dbraw/zinc/32/94/53/1051329453.db2.gz LDSWDUOGKJRIFS-OAQYLSRUSA-N 1 0 323.436 4.062 20 10 DICDRO CCCOc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000746197151 1051334968 /nfs/dbraw/zinc/33/49/68/1051334968.db2.gz VLHZIMUIFOYYKL-OAHLLOKOSA-N 1 0 311.425 4.261 20 10 DICDRO CCCCCC[C@@H](CCC)[NH2+]CCc1cc(O)c(O)cc1O ZINC001172379282 1051355481 /nfs/dbraw/zinc/35/54/81/1051355481.db2.gz SRCLXOWLZGLCPJ-OAHLLOKOSA-N 1 0 309.450 4.075 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000752267284 1051383898 /nfs/dbraw/zinc/38/38/98/1051383898.db2.gz WZKNIJYISIBIFZ-TZMCWYRMSA-N 1 0 301.352 4.159 20 10 DICDRO CCCCCC[C@@H](CCC)[NH2+]CC(=O)c1ccc(O)c(O)c1 ZINC001172392700 1051394973 /nfs/dbraw/zinc/39/49/73/1051394973.db2.gz ZQFKAPXFPWIRRJ-OAHLLOKOSA-N 1 0 307.434 4.009 20 10 DICDRO CC[C@H](CC(C)C)[NH2+]Cc1ccc(Br)cc1O ZINC001172394680 1051396042 /nfs/dbraw/zinc/39/60/42/1051396042.db2.gz XWODDSJLRMHTPZ-CYBMUJFWSA-N 1 0 300.240 4.069 20 10 DICDRO CC[C@H]([NH2+]CCOCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000766400486 1051414917 /nfs/dbraw/zinc/41/49/17/1051414917.db2.gz HDPRJSAHPGFZGG-FQEVSTJZSA-N 1 0 312.457 4.010 20 10 DICDRO Oc1cc2c(cc1O)C[N@@H+]([C@H]1CC[C@@H](c3ccccc3)C1)CCC2 ZINC001172570313 1051447196 /nfs/dbraw/zinc/44/71/96/1051447196.db2.gz VVPFWDWVAMPJRQ-MJGOQNOKSA-N 1 0 323.436 4.182 20 10 DICDRO C[C@H]([NH2+]C1CC(C)(C)OC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC001172650307 1051470907 /nfs/dbraw/zinc/47/09/07/1051470907.db2.gz KZWKFBIFIHSDEN-AWEZNQCLSA-N 1 0 304.478 4.139 20 10 DICDRO CC[C@H]([NH2+]CC1(CCOC)CCCC1)c1ccc(N(C)C)cc1 ZINC000766583015 1051514723 /nfs/dbraw/zinc/51/47/23/1051514723.db2.gz AUDMHXLPPDXCBH-IBGZPJMESA-N 1 0 318.505 4.390 20 10 DICDRO CC[C@@H]([NH2+]CC1(CCOC)CCCC1)c1ccc(N(C)C)cc1 ZINC000766583016 1051514787 /nfs/dbraw/zinc/51/47/87/1051514787.db2.gz AUDMHXLPPDXCBH-LJQANCHMSA-N 1 0 318.505 4.390 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCCC1 ZINC000766586314 1051517372 /nfs/dbraw/zinc/51/73/72/1051517372.db2.gz YXDXZKRUQQJJSV-QGZVFWFLSA-N 1 0 318.505 4.390 20 10 DICDRO CCC1(C[NH2+]C2CCN(c3ccc(OC)cc3)CC2)CCCC1 ZINC000766595490 1051523748 /nfs/dbraw/zinc/52/37/48/1051523748.db2.gz MNHPSCJUYYZUBN-UHFFFAOYSA-N 1 0 316.489 4.224 20 10 DICDRO C[C@H](Cc1c(F)cccc1Cl)[N@H+](C)Cc1ccccc1O ZINC001172857512 1051542738 /nfs/dbraw/zinc/54/27/38/1051542738.db2.gz QBXJQLUEBUFHPI-GFCCVEGCSA-N 1 0 307.796 4.248 20 10 DICDRO CO[C@@H]1CCC[C@H]([NH2+][C@H]2c3c(c(C)cc(C)c3O)CC2(C)C)C1 ZINC001172930485 1051576700 /nfs/dbraw/zinc/57/67/00/1051576700.db2.gz IZEMYOQCFIZJKD-KHYOSLBOSA-N 1 0 317.473 4.180 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC001169367241 1051591404 /nfs/dbraw/zinc/59/14/04/1051591404.db2.gz QKNFVQHIOBMCBX-CTNGQTDRSA-N 1 0 308.469 4.254 20 10 DICDRO C[C@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001168456646 1051592575 /nfs/dbraw/zinc/59/25/75/1051592575.db2.gz UOCPVTCEEOUJAV-MRXNPFEDSA-N 1 0 312.432 4.147 20 10 DICDRO CCCOC1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001173091674 1051597285 /nfs/dbraw/zinc/59/72/85/1051597285.db2.gz YUDDIPSHFZHGEO-UHFFFAOYSA-N 1 0 316.489 4.114 20 10 DICDRO C[C@H]([NH2+]C1CCC(Oc2ccccc2)CC1)c1ccccc1O ZINC001173196073 1051629332 /nfs/dbraw/zinc/62/93/32/1051629332.db2.gz IMFZTXQBZRZJRN-HJOIGYKYSA-N 1 0 311.425 4.433 20 10 DICDRO CC[C@H]1CC[C@H]([N@@H+]2CCc3c(c4cc(OC)ccc4n3C)C2)C1 ZINC001173286016 1051690009 /nfs/dbraw/zinc/69/00/09/1051690009.db2.gz CEXLQWUSVGNPSE-GJZGRUSLSA-N 1 0 312.457 4.124 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@H]3C(C)(C)C)CC2)cc1 ZINC000806137856 1051737666 /nfs/dbraw/zinc/73/76/66/1051737666.db2.gz SQAPSQXFTFAZNH-RTBURBONSA-N 1 0 316.489 4.078 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000806176117 1051747779 /nfs/dbraw/zinc/74/77/79/1051747779.db2.gz LFQZIAGGAYJDGK-TZMCWYRMSA-N 1 0 309.425 4.122 20 10 DICDRO CC[C@H]([NH2+]CCCC(C)(C)COC)c1ccc(N(C)C)cc1 ZINC000806176106 1051748146 /nfs/dbraw/zinc/74/81/46/1051748146.db2.gz KTRMEBBUHJXRLM-SFHVURJKSA-N 1 0 306.494 4.246 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cccc(Cl)c1[O-] ZINC000806160980 1051762649 /nfs/dbraw/zinc/76/26/49/1051762649.db2.gz HAFZNMXCEIMVGC-MRXNPFEDSA-N 1 0 324.896 4.208 20 10 DICDRO Cc1ccc(O)c(C[N@H+](Cc2ccco2)Cc2ccccc2)c1 ZINC000768183246 1051896617 /nfs/dbraw/zinc/89/66/17/1051896617.db2.gz CFQWPNHQORFGSF-UHFFFAOYSA-N 1 0 307.393 4.496 20 10 DICDRO C[C@H](c1ccccc1)[N@H+](C)Cc1cc(Br)ccc1O ZINC000768197542 1051904163 /nfs/dbraw/zinc/90/41/63/1051904163.db2.gz JVCJJSVBFNICFK-GFCCVEGCSA-N 1 0 320.230 4.348 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccccc2F)c1 ZINC000768263398 1051911509 /nfs/dbraw/zinc/91/15/09/1051911509.db2.gz FQVDZXDKVZLQAX-ZDUSSCGKSA-N 1 0 303.377 4.123 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CC(F)(F)F)c1cc2c(cc1O)CCCC2 ZINC000768271744 1051912751 /nfs/dbraw/zinc/91/27/51/1051912751.db2.gz NPUJZCOPPGBRSB-WDEREUQCSA-N 1 0 301.352 4.263 20 10 DICDRO CCOc1ccc(C[N@H+](Cc2cccs2)C(C)C)c(O)c1 ZINC000768334990 1051919774 /nfs/dbraw/zinc/91/97/74/1051919774.db2.gz SPJRNZGZNOJVIS-UHFFFAOYSA-N 1 0 305.443 4.263 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c[nH]nc2c1 ZINC000768352640 1051920884 /nfs/dbraw/zinc/92/08/84/1051920884.db2.gz PUSXBWPYMXKFBE-UHFFFAOYSA-N 1 0 322.456 4.040 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1 ZINC000768361872 1051923495 /nfs/dbraw/zinc/92/34/95/1051923495.db2.gz XSHLWTVJGSJXEO-HXUWFJFHSA-N 1 0 309.457 4.265 20 10 DICDRO COc1cc(C[N@H+](C)Cc2ccc(Cl)s2)c(O)cc1C ZINC000768443160 1051932131 /nfs/dbraw/zinc/93/21/31/1051932131.db2.gz ZUONXYLHYRHHIS-UHFFFAOYSA-N 1 0 311.834 4.056 20 10 DICDRO COCc1ccc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)o1 ZINC000768541545 1051942739 /nfs/dbraw/zinc/94/27/39/1051942739.db2.gz PFCUFCWYZHRYCC-OAHLLOKOSA-N 1 0 321.804 4.122 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1cc(-c2ccccc2)ccc1O ZINC000768872772 1051975231 /nfs/dbraw/zinc/97/52/31/1051975231.db2.gz IODLNZYSBOWVBT-UHFFFAOYSA-N 1 0 319.404 4.397 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1ccc(F)cc1C(F)(F)F ZINC000768873714 1051975617 /nfs/dbraw/zinc/97/56/17/1051975617.db2.gz VCQGHJKVJWUGCH-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO CC[N@H+](Cc1c(O)cccc1Cl)[C@H](C)c1cccc(O)c1 ZINC000768874015 1051976035 /nfs/dbraw/zinc/97/60/35/1051976035.db2.gz YFOWXCJHDWOEQI-GFCCVEGCSA-N 1 0 305.805 4.334 20 10 DICDRO CC[N@H+](Cc1c(O)cccc1OC)[C@H](C)c1ccc(F)cc1 ZINC000768911953 1051980424 /nfs/dbraw/zinc/98/04/24/1051980424.db2.gz UNTDQLNLAQUPQA-CYBMUJFWSA-N 1 0 303.377 4.123 20 10 DICDRO CC(C)OC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000768992925 1051988663 /nfs/dbraw/zinc/98/86/63/1051988663.db2.gz ROGQFXJYXBBBDH-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@H]1CCCCO1 ZINC000769032191 1051990277 /nfs/dbraw/zinc/99/02/77/1051990277.db2.gz CUHIQUMVSYSOAW-LJQANCHMSA-N 1 0 311.425 4.060 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)CC1=Cc2ccccc2OC1 ZINC000769200653 1052007095 /nfs/dbraw/zinc/00/70/95/1052007095.db2.gz GVRMWFQZXHMPCK-UHFFFAOYSA-N 1 0 309.409 4.080 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2c3ccccc3O[C@H]2C)cc1 ZINC000808443589 1052021557 /nfs/dbraw/zinc/02/15/57/1052021557.db2.gz GNMLRYKJIGRNPZ-MGPUTAFESA-N 1 0 310.441 4.145 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)c1O ZINC000769309132 1052022486 /nfs/dbraw/zinc/02/24/86/1052022486.db2.gz REWGNSWFTVVJOR-KRWDZBQOSA-N 1 0 311.425 4.171 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000769317431 1052024657 /nfs/dbraw/zinc/02/46/57/1052024657.db2.gz QWWKVUJYDZYNTI-GOSISDBHSA-N 1 0 317.816 4.009 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CC[C@H](c3ccccc3)O2)cc1C ZINC000808450885 1052026034 /nfs/dbraw/zinc/02/60/34/1052026034.db2.gz DVMPAVKOLJSSDM-UYAOXDASSA-N 1 0 311.425 4.019 20 10 DICDRO CCOCC(C)(C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000808450697 1052026158 /nfs/dbraw/zinc/02/61/58/1052026158.db2.gz SBADYOKSHBWULH-UHFFFAOYSA-N 1 0 313.441 4.212 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCc3c(Cl)cccc3C2)c1O ZINC000769387519 1052036899 /nfs/dbraw/zinc/03/68/99/1052036899.db2.gz LEGQGMNMIJVXRG-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO CC1(C)C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCS1 ZINC000769447596 1052056186 /nfs/dbraw/zinc/05/61/86/1052056186.db2.gz HQAPUHMPPNAUBP-UHFFFAOYSA-N 1 0 304.503 4.004 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)c1O ZINC000769456097 1052059174 /nfs/dbraw/zinc/05/91/74/1052059174.db2.gz HHDCAVPMTCOCOK-GUYCJALGSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccc(F)cc2F)c1O ZINC000808685276 1052060363 /nfs/dbraw/zinc/06/03/63/1052060363.db2.gz SDULJKJOLSURJP-JTQLQIEISA-N 1 0 311.759 4.483 20 10 DICDRO CSCC[C@H](C)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000769464314 1052060415 /nfs/dbraw/zinc/06/04/15/1052060415.db2.gz ZEDMARQSCDMZOE-INIZCTEOSA-N 1 0 306.519 4.250 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCc3c2cccc3O)c1O ZINC000808691998 1052061613 /nfs/dbraw/zinc/06/16/13/1052061613.db2.gz MMWWFXKIOCQNCU-ZBEGNZNMSA-N 1 0 317.816 4.398 20 10 DICDRO Cc1c(Br)cccc1C[N@@H+](C)Cc1ccccc1O ZINC000761681078 1052063264 /nfs/dbraw/zinc/06/32/64/1052063264.db2.gz QVVUMUPFEPVUOL-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cc(F)ccc2F)c1O ZINC000808692848 1052063737 /nfs/dbraw/zinc/06/37/37/1052063737.db2.gz VLLBAJJJUXRYHK-JTQLQIEISA-N 1 0 311.759 4.483 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2CC(=O)c2ccccc2)cc1C ZINC000769492816 1052066371 /nfs/dbraw/zinc/06/63/71/1052066371.db2.gz NRJXMUTWBHTLSM-IBGZPJMESA-N 1 0 323.436 4.246 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccco2)c1O ZINC000808703828 1052069244 /nfs/dbraw/zinc/06/92/44/1052069244.db2.gz XYMAZRJOVPQYGZ-HUBLWGQQSA-N 1 0 323.820 4.110 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c1O ZINC000808706328 1052069583 /nfs/dbraw/zinc/06/95/83/1052069583.db2.gz HDILQTDRKRCGSG-DZGCQCFKSA-N 1 0 323.864 4.496 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC(C)(C)[C@H](O)C(C)C)c1O ZINC000808708534 1052070137 /nfs/dbraw/zinc/07/01/37/1052070137.db2.gz MRGBGWIOHZVBCT-BLLLJJGKSA-N 1 0 313.869 4.048 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc(Cl)o2)c1O ZINC000808709116 1052070704 /nfs/dbraw/zinc/07/07/04/1052070704.db2.gz CBRZALGOYYEIRR-SECBINFHSA-N 1 0 300.185 4.451 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC(C)(C)[C@@H](O)C(C)C)c1O ZINC000808708535 1052071536 /nfs/dbraw/zinc/07/15/36/1052071536.db2.gz MRGBGWIOHZVBCT-LRDDRELGSA-N 1 0 313.869 4.048 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCc2nccs2)c1O ZINC000808706894 1052071633 /nfs/dbraw/zinc/07/16/33/1052071633.db2.gz AORSTHKHVCAVON-LLVKDONJSA-N 1 0 310.850 4.094 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](CSc3ccccc3)C2)c1 ZINC000769513013 1052073311 /nfs/dbraw/zinc/07/33/11/1052073311.db2.gz WUMJFMOGVLHBPO-MRXNPFEDSA-N 1 0 313.466 4.315 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)c1O ZINC000769526437 1052074722 /nfs/dbraw/zinc/07/47/22/1052074722.db2.gz LOAADCBHEYACKN-ZBFHGGJFSA-N 1 0 315.413 4.357 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808717390 1052076300 /nfs/dbraw/zinc/07/63/00/1052076300.db2.gz CVTVMPVBTRRWHJ-CYBMUJFWSA-N 1 0 313.869 4.457 20 10 DICDRO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000769538795 1052077505 /nfs/dbraw/zinc/07/75/05/1052077505.db2.gz WQVSWYYWBFZEKF-INIZCTEOSA-N 1 0 304.821 4.111 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)c1O ZINC000769548937 1052080550 /nfs/dbraw/zinc/08/05/50/1052080550.db2.gz IWXRBDZRFKUPLW-CJNGLKHVSA-N 1 0 315.413 4.275 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[C@H](c3ccccc3)O2)c(O)c1 ZINC000808728041 1052083805 /nfs/dbraw/zinc/08/38/05/1052083805.db2.gz NLRYMCAQSTXHLA-XAUMDUMWSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1COc2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000808728393 1052084593 /nfs/dbraw/zinc/08/45/93/1052084593.db2.gz QXAUMYNJZIZRGV-RHSMWYFYSA-N 1 0 323.436 4.098 20 10 DICDRO C[C@@H](CCSc1ccccc1)[N@H+](C)Cc1ccccc1O ZINC000770168043 1052155854 /nfs/dbraw/zinc/15/58/54/1052155854.db2.gz RCKKSSKSMJFLOY-HNNXBMFYSA-N 1 0 301.455 4.395 20 10 DICDRO C[C@H]1C[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)CC[NH2+]1 ZINC001218052625 1052189351 /nfs/dbraw/zinc/18/93/51/1052189351.db2.gz LROWHENNWWXHFL-UGSOOPFHSA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CC[C@]23CC[NH2+]C3)=C1 ZINC001218120047 1052198984 /nfs/dbraw/zinc/19/89/84/1052198984.db2.gz SDVDPFICNHGEDY-QSDHIIRHSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001218135062 1052201317 /nfs/dbraw/zinc/20/13/17/1052201317.db2.gz RZGPCDTUCUSKHG-RYMDOBDFSA-N 1 0 323.396 4.184 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@H]3C[NH2+][C@@H]4CCCO[C@@H]43)cc2)cc1 ZINC001218166453 1052202471 /nfs/dbraw/zinc/20/24/71/1052202471.db2.gz CKLHWOLTLOXTSF-ICMABPITSA-N 1 0 323.396 4.000 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)C=C1 ZINC001218188706 1052204096 /nfs/dbraw/zinc/20/40/96/1052204096.db2.gz OOLOOPUBACSTPE-MNZLEMJZSA-N 1 0 323.396 4.469 20 10 DICDRO CCC(=O)[C@H]1C[C@@H](Oc2ccc(/N=N/c3ccccc3)cc2)C[NH2+]1 ZINC001218327812 1052225936 /nfs/dbraw/zinc/22/59/36/1052225936.db2.gz OGCRWABLQUNVME-IPCNLGOESA-N 1 0 323.396 4.190 20 10 DICDRO C[C@@H]1[NH2+]C[C@H]1Oc1ccc2ccccc2c1/N=N/c1nccs1 ZINC001218387525 1052233012 /nfs/dbraw/zinc/23/30/12/1052233012.db2.gz QCSFKGVOPHTZFE-QYCMIYGMSA-N 1 0 324.409 4.451 20 10 DICDRO C[C@@H]1CC[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C[NH2+]1 ZINC001218404258 1052234663 /nfs/dbraw/zinc/23/46/63/1052234663.db2.gz ZRXRZOYYAKQPIL-FZKQIMNGSA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC001218478987 1052244912 /nfs/dbraw/zinc/24/49/12/1052244912.db2.gz JKRQPVVCZTVAKG-NUEGRFTBSA-N 1 0 309.369 4.079 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(OC)cc1 ZINC000324389805 1052308057 /nfs/dbraw/zinc/30/80/57/1052308057.db2.gz YPNAESCHXHNHJD-HXUWFJFHSA-N 1 0 324.468 4.319 20 10 DICDRO C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000762136994 1052315836 /nfs/dbraw/zinc/31/58/36/1052315836.db2.gz GTECZSCRMPNZQI-CYBMUJFWSA-N 1 0 303.446 4.160 20 10 DICDRO Cc1cnc(C2CC[NH+](Cc3cc(C)c(C)cc3O)CC2)s1 ZINC000762171571 1052324626 /nfs/dbraw/zinc/32/46/26/1052324626.db2.gz PJXZIOHFHVOVRZ-UHFFFAOYSA-N 1 0 316.470 4.154 20 10 DICDRO Cc1nc(C)c(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC000315005466 1052328746 /nfs/dbraw/zinc/32/87/46/1052328746.db2.gz WZZGHHMTVWMWCZ-MFKMUULPSA-N 1 0 302.443 4.112 20 10 DICDRO COc1ccccc1[C@H]1CC[N@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000153507320 1052362711 /nfs/dbraw/zinc/36/27/11/1052362711.db2.gz GNXUCRZCJVITDL-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)[C@@H]2CCCC[C@H]12 ZINC000915208802 1052366917 /nfs/dbraw/zinc/36/69/17/1052366917.db2.gz IDXAPMWWNPWXTC-IDHHARJASA-N 1 0 310.441 4.341 20 10 DICDRO COc1ccc(C[NH2+]CCCCOc2ccc(F)cc2)cc1C ZINC000915228527 1052371116 /nfs/dbraw/zinc/37/11/16/1052371116.db2.gz CITUSZRLHGFYMS-UHFFFAOYSA-N 1 0 317.404 4.092 20 10 DICDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000317361038 1052385715 /nfs/dbraw/zinc/38/57/15/1052385715.db2.gz ISJLRINVKMPKIY-ZDUSSCGKSA-N 1 0 319.832 4.117 20 10 DICDRO Cc1cc(C)c(O)c(CN(C)Cc2c(F)cccc2Cl)c1 ZINC000915822503 1052492683 /nfs/dbraw/zinc/49/26/83/1052492683.db2.gz MJUZUHIXWWFWQC-UHFFFAOYSA-N 1 0 307.796 4.434 20 10 DICDRO C[C@H]([NH2+]C[C@@H](O)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000153873255 1052592292 /nfs/dbraw/zinc/59/22/92/1052592292.db2.gz ANBGMKBOKTXYRW-LAUBAEHRSA-N 1 0 324.468 4.061 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)cc1F ZINC000763396394 1052623311 /nfs/dbraw/zinc/62/33/11/1052623311.db2.gz STWBILSCLRIEBQ-KRWDZBQOSA-N 1 0 318.823 4.322 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@H]1C1CCCCC1 ZINC000917480073 1052729203 /nfs/dbraw/zinc/72/92/03/1052729203.db2.gz IJGCGTYZLFXBSE-IBGZPJMESA-N 1 0 310.441 4.485 20 10 DICDRO Cc1ccc(O)c(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000154719164 1052797503 /nfs/dbraw/zinc/79/75/03/1052797503.db2.gz GEAUAPJRAMRUIN-UHFFFAOYSA-N 1 0 323.392 4.202 20 10 DICDRO CC(C)(C)Oc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000920415423 1052938320 /nfs/dbraw/zinc/93/83/20/1052938320.db2.gz SFSGLNGJWJRJJF-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1F ZINC000237786840 1053028435 /nfs/dbraw/zinc/02/84/35/1053028435.db2.gz FRSNUCNNSAHYFM-UHFFFAOYSA-N 1 0 312.432 4.414 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccco2)Cc2ccc(O)cc2)c1O ZINC000180029967 1053041753 /nfs/dbraw/zinc/04/17/53/1053041753.db2.gz YZNKSHIRSRLULO-UHFFFAOYSA-N 1 0 323.392 4.202 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2nc(C)cs2)cc1 ZINC000069168498 1053127733 /nfs/dbraw/zinc/12/77/33/1053127733.db2.gz PRWPFOCTVSJRIU-CQSZACIVSA-N 1 0 303.475 4.149 20 10 DICDRO CCCc1ccc(C[NH2+]CCCSc2nccs2)cc1 ZINC001560348353 1053142807 /nfs/dbraw/zinc/14/28/07/1053142807.db2.gz WYOCOEUIZLMZDN-UHFFFAOYSA-N 1 0 306.500 4.368 20 10 DICDRO Fc1cccc(C2([NH2+]Cc3ccc(N4CCCC4)cc3)CC2)c1 ZINC001318770677 1053191777 /nfs/dbraw/zinc/19/17/77/1053191777.db2.gz HTKOLHLAMICYGO-UHFFFAOYSA-N 1 0 310.416 4.205 20 10 DICDRO Cc1nc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(C)s1 ZINC001319415030 1053241020 /nfs/dbraw/zinc/24/10/20/1053241020.db2.gz NPMSHUATDMRRMK-UHFFFAOYSA-N 1 0 317.502 4.237 20 10 DICDRO C[C@H](COc1ccccc1F)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC001319751820 1053269714 /nfs/dbraw/zinc/26/97/14/1053269714.db2.gz XVGPQFKYNYKUPT-HUUCEWRRSA-N 1 0 316.420 4.010 20 10 DICDRO C[C@H](COc1ccccc1F)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001319751818 1053270365 /nfs/dbraw/zinc/27/03/65/1053270365.db2.gz XVGPQFKYNYKUPT-CABCVRRESA-N 1 0 316.420 4.010 20 10 DICDRO CS[C@H]1CCCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001319841775 1053279591 /nfs/dbraw/zinc/27/95/91/1053279591.db2.gz WBDSOUKFUKZARR-SFHVURJKSA-N 1 0 304.503 4.004 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1CCOc2ccccc21 ZINC001320118663 1053307485 /nfs/dbraw/zinc/30/74/85/1053307485.db2.gz OQYTUQFMHVAGLS-HLLBOEOZSA-N 1 0 323.436 4.405 20 10 DICDRO COc1ccc(Cl)cc1CC[NH2+][C@H](C)c1cc(F)ccc1O ZINC001320129027 1053307532 /nfs/dbraw/zinc/30/75/32/1053307532.db2.gz ADJROHNRGWUGGG-LLVKDONJSA-N 1 0 323.795 4.087 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001320118649 1053307669 /nfs/dbraw/zinc/30/76/69/1053307669.db2.gz OKNCNEQCNWQCQQ-NVXWUHKLSA-N 1 0 324.468 4.495 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@](C)(O)CCC(C)C ZINC001320119103 1053308057 /nfs/dbraw/zinc/30/80/57/1053308057.db2.gz WNRGKRIZIKZGDX-SPYBWZPUSA-N 1 0 305.462 4.026 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCCOC1CCCC1 ZINC001320119258 1053308517 /nfs/dbraw/zinc/30/85/17/1053308517.db2.gz YVLIRBYZDYNQGO-HOCLYGCPSA-N 1 0 303.446 4.188 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)cc1 ZINC001320121428 1053308786 /nfs/dbraw/zinc/30/87/86/1053308786.db2.gz AVMKENWDYXPWFP-YOEHRIQHSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC001320260385 1053320282 /nfs/dbraw/zinc/32/02/82/1053320282.db2.gz UTLSQSVBKYDNLF-SCRDCRAPSA-N 1 0 316.470 4.407 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC001320411892 1053334154 /nfs/dbraw/zinc/33/41/54/1053334154.db2.gz XBGYMUWJHAVLJS-YCPHGPKFSA-N 1 0 313.445 4.377 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](c2nc(C)cs2)C2CC2)cc1 ZINC001320859885 1053367693 /nfs/dbraw/zinc/36/76/93/1053367693.db2.gz YVYGRSHJGZYPMX-KRWDZBQOSA-N 1 0 315.486 4.149 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCc1ccc2c(c1)CCO2 ZINC001321017858 1053382061 /nfs/dbraw/zinc/38/20/61/1053382061.db2.gz SSRLLCPGKZGNBZ-PBHICJAKSA-N 1 0 323.436 4.016 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1cccc(N(C)C)c1 ZINC001321023672 1053382519 /nfs/dbraw/zinc/38/25/19/1053382519.db2.gz OIPJRIOGRQBWPY-PBHICJAKSA-N 1 0 310.441 4.105 20 10 DICDRO Cc1ccc(C(C)(C)[NH2+]Cc2ccc(N3CCCC3)cc2)cn1 ZINC001321048537 1053385081 /nfs/dbraw/zinc/38/50/81/1053385081.db2.gz JDRVXAMBAOVPBM-UHFFFAOYSA-N 1 0 309.457 4.015 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC001321038626 1053385202 /nfs/dbraw/zinc/38/52/02/1053385202.db2.gz YZKZVFAKTCYDOE-YOZCEPSOSA-N 1 0 319.448 4.424 20 10 DICDRO COc1cccc(F)c1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC001352776773 1053404506 /nfs/dbraw/zinc/40/45/06/1053404506.db2.gz OZXFEOHHVSPXLO-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO c1cc2c(cccc2CC[NH2+]Cc2ccc(N3CCCC3)cc2)[nH]1 ZINC001321694613 1053428369 /nfs/dbraw/zinc/42/83/69/1053428369.db2.gz AWLHQPYLATUGDF-UHFFFAOYSA-N 1 0 319.452 4.100 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2csc(C(C)(C)C)n2)c1 ZINC000182429483 1053432341 /nfs/dbraw/zinc/43/23/41/1053432341.db2.gz UKVFEJQAIWVMDF-NSHDSACASA-N 1 0 320.458 4.006 20 10 DICDRO Cc1cccc(CCC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC001321859174 1053438530 /nfs/dbraw/zinc/43/85/30/1053438530.db2.gz VUYXGRCAVXBVBV-PBHICJAKSA-N 1 0 310.441 4.175 20 10 DICDRO COc1ccc(C[NH2+]CCc2cccc3ccccc32)cc1C ZINC001200302438 1053537415 /nfs/dbraw/zinc/53/74/15/1053537415.db2.gz VBXHRKWWYPTQOP-UHFFFAOYSA-N 1 0 305.421 4.489 20 10 DICDRO Cc1cccnc1C[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC001323660136 1053593697 /nfs/dbraw/zinc/59/36/97/1053593697.db2.gz PXKCXBQPDHIVEY-UHFFFAOYSA-N 1 0 323.484 4.449 20 10 DICDRO COc1cccc(C2([NH2+]Cc3ccc(N4CCCC4)cc3)CC2)c1 ZINC001323696605 1053595617 /nfs/dbraw/zinc/59/56/17/1053595617.db2.gz UPOJFNCVKNFIKM-UHFFFAOYSA-N 1 0 322.452 4.074 20 10 DICDRO CCOCCC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001323829885 1053603027 /nfs/dbraw/zinc/60/30/27/1053603027.db2.gz NDWLOLDSCIZYRO-CABCVRRESA-N 1 0 303.446 4.045 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001323828852 1053603245 /nfs/dbraw/zinc/60/32/45/1053603245.db2.gz DUNZFXLOFZWRCH-RHSMWYFYSA-N 1 0 311.425 4.356 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](c1cccnc1)C1CC1 ZINC001323828845 1053604168 /nfs/dbraw/zinc/60/41/68/1053604168.db2.gz DOLLRSYQADKRIY-PSGMQZRDSA-N 1 0 308.425 4.385 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)c1ccc(F)cc1 ZINC001324239522 1053636317 /nfs/dbraw/zinc/63/63/17/1053636317.db2.gz IBCDPSXOJRPGPY-KSSFIOAISA-N 1 0 317.404 4.186 20 10 DICDRO CCN(CC)[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccsc1 ZINC000183415613 1053653792 /nfs/dbraw/zinc/65/37/92/1053653792.db2.gz HZYSFSIMANRCNJ-WMLDXEAASA-N 1 0 318.486 4.187 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCC3)c2c1c(F)ccc2O ZINC001325340134 1053713967 /nfs/dbraw/zinc/71/39/67/1053713967.db2.gz NNMMTHRBPJMNHW-SJKOYZFVSA-N 1 0 311.400 4.358 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1cc(C(C)C)no1 ZINC001325341342 1053714403 /nfs/dbraw/zinc/71/44/03/1053714403.db2.gz VCQZOFKVEVVYQB-WFASDCNBSA-N 1 0 300.402 4.150 20 10 DICDRO COCc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)cc1 ZINC001325340844 1053714703 /nfs/dbraw/zinc/71/47/03/1053714703.db2.gz SGQHUPJSMWNUEH-PBHICJAKSA-N 1 0 311.425 4.185 20 10 DICDRO COCC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)c1ccco1 ZINC001325357934 1053716692 /nfs/dbraw/zinc/71/66/92/1053716692.db2.gz YAERJLYCBKEKER-SOUVJXGZSA-N 1 0 315.413 4.209 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001325356425 1053716804 /nfs/dbraw/zinc/71/68/04/1053716804.db2.gz KDRCPGYRANZEEE-GDBMZVCRSA-N 1 0 311.425 4.356 20 10 DICDRO COCC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C)c1ccco1 ZINC001325357928 1053716849 /nfs/dbraw/zinc/71/68/49/1053716849.db2.gz YAERJLYCBKEKER-ILXRZTDVSA-N 1 0 315.413 4.209 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCC[C@H]1CCCCO1 ZINC001325420755 1053718044 /nfs/dbraw/zinc/71/80/44/1053718044.db2.gz BRKWUQTZXJRNNJ-OAGGEKHMSA-N 1 0 303.446 4.188 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CC(C)(C)OCC1CC1 ZINC001325572995 1053722072 /nfs/dbraw/zinc/72/20/72/1053722072.db2.gz DQUANUVQSAFOIP-DZGCQCFKSA-N 1 0 303.446 4.044 20 10 DICDRO Oc1c(C[NH2+]Cc2ccc3c(c2)CCC3)ccc2ccccc21 ZINC001326327486 1053774246 /nfs/dbraw/zinc/77/42/46/1053774246.db2.gz SBWWFTQQDHMEIO-UHFFFAOYSA-N 1 0 303.405 4.324 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CC2 ZINC001326426077 1053780135 /nfs/dbraw/zinc/78/01/35/1053780135.db2.gz FMKFHZSCJWTGTR-OAQYLSRUSA-N 1 0 306.453 4.372 20 10 DICDRO Cc1cccc(C[NH+]2CCC(Oc3ccccc3C)CC2)c1O ZINC001231591267 1053790968 /nfs/dbraw/zinc/79/09/68/1053790968.db2.gz XSICYIRDVIMROI-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO CC1(C)C[N@H+](Cc2c(O)ccc3ccccc32)CCC1(F)F ZINC001231587755 1053791688 /nfs/dbraw/zinc/79/16/88/1053791688.db2.gz YPKOJZZAFUFDNQ-UHFFFAOYSA-N 1 0 305.368 4.413 20 10 DICDRO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(C)c2O)cc1 ZINC001231592075 1053791871 /nfs/dbraw/zinc/79/18/71/1053791871.db2.gz GABYSPUNODZJKC-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO Oc1ccc2ccccc2c1C[N@H+](C1CCC1)C1CCOCC1 ZINC001231589580 1053792141 /nfs/dbraw/zinc/79/21/41/1053792141.db2.gz LVVCUKXSVGDPAA-UHFFFAOYSA-N 1 0 311.425 4.079 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@@H](Cc3ccc(F)cc3)C2)c1O ZINC001231593726 1053793241 /nfs/dbraw/zinc/79/32/41/1053793241.db2.gz LNDQTRVSPWUNQI-KRWDZBQOSA-N 1 0 313.416 4.294 20 10 DICDRO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cccc(C)c1O ZINC001231594699 1053793462 /nfs/dbraw/zinc/79/34/62/1053793462.db2.gz NQWACUBILYKYEX-SFHVURJKSA-N 1 0 311.425 4.184 20 10 DICDRO COc1cc(C)c(C[N@H+](C)Cc2ccccc2O)cc1C(C)C ZINC001231628788 1053809227 /nfs/dbraw/zinc/80/92/27/1053809227.db2.gz LWTTUIVKTJHSAI-UHFFFAOYSA-N 1 0 313.441 4.465 20 10 DICDRO CSCC1(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001327269684 1053846369 /nfs/dbraw/zinc/84/63/69/1053846369.db2.gz ZTUAHHBPJQUHHI-ZIAGYGMSSA-N 1 0 305.487 4.372 20 10 DICDRO C[C@H]([NH2+]C1CC2(CC2(F)F)C1)c1cc2c(cc1O)CCCC2 ZINC001327279884 1053846997 /nfs/dbraw/zinc/84/69/97/1053846997.db2.gz OLZOEIXVHJOHAK-HUZSNBGSSA-N 1 0 307.384 4.109 20 10 DICDRO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc3ccccc3c2O)s1 ZINC000274281534 1053863126 /nfs/dbraw/zinc/86/31/26/1053863126.db2.gz YMJOOWBKLHDVPX-GHMZBOCLSA-N 1 0 313.426 4.117 20 10 DICDRO COCC1(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC001327835696 1053882436 /nfs/dbraw/zinc/88/24/36/1053882436.db2.gz XUAOASPONHXWSG-HUUCEWRRSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1cc(C)c(C[N@H+](C)Cc2ncccc2C(F)(F)F)c(O)c1 ZINC001231841886 1053887238 /nfs/dbraw/zinc/88/72/38/1053887238.db2.gz FRXYISIHAABCOG-UHFFFAOYSA-N 1 0 324.346 4.055 20 10 DICDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(C)cc(C)cc2O)c1 ZINC001231847491 1053889524 /nfs/dbraw/zinc/88/95/24/1053889524.db2.gz ZHJSZCUHSRYANK-IBGZPJMESA-N 1 0 311.425 4.355 20 10 DICDRO COc1ccc(C2=CC[N@H+](Cc3c(C)cc(C)cc3O)CC2)cc1 ZINC001231851068 1053889804 /nfs/dbraw/zinc/88/98/04/1053889804.db2.gz YYGNKXSRTCYGFG-UHFFFAOYSA-N 1 0 323.436 4.307 20 10 DICDRO Cc1cc(C)c(C[N@H+](C)Cc2cccc3cccnc32)c(O)c1 ZINC001231846837 1053890056 /nfs/dbraw/zinc/89/00/56/1053890056.db2.gz QXDUWZKFJLVHBK-UHFFFAOYSA-N 1 0 306.409 4.189 20 10 DICDRO COc1cccc(CCC[N@H+](C)Cc2c(C)cc(C)cc2O)c1 ZINC001231849149 1053890408 /nfs/dbraw/zinc/89/04/08/1053890408.db2.gz ONTCKFKNMKBLRF-UHFFFAOYSA-N 1 0 313.441 4.082 20 10 DICDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1ccc(N(C)C)cc1OC ZINC001231855000 1053891194 /nfs/dbraw/zinc/89/11/94/1053891194.db2.gz NTPBJPYFJIWTNN-LJQANCHMSA-N 1 0 312.457 4.344 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCCC[C@H]2c2cccnc2)cc1Cl ZINC001231868320 1053895176 /nfs/dbraw/zinc/89/51/76/1053895176.db2.gz AEUPKPMPELSJSK-KRWDZBQOSA-N 1 0 316.832 4.476 20 10 DICDRO CC[C@H](C[NH2+]CCCSc1nccs1)c1ccccc1 ZINC001200692772 1053897846 /nfs/dbraw/zinc/89/78/46/1053897846.db2.gz UWJPMMQGKGONIK-CQSZACIVSA-N 1 0 306.500 4.409 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)cc1Cl ZINC001231870170 1053899410 /nfs/dbraw/zinc/89/94/10/1053899410.db2.gz MCNBCENNIDAPAL-CQSZACIVSA-N 1 0 311.828 4.458 20 10 DICDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)c(C)cc2O)cn1 ZINC001231870052 1053899492 /nfs/dbraw/zinc/89/94/92/1053899492.db2.gz HLQYQBBIZDFIAM-KRWDZBQOSA-N 1 0 316.832 4.395 20 10 DICDRO Cc1cc(O)c(CN2CCC(=O)[C@@H](C)C23CCCC3)cc1Cl ZINC001231872229 1053900512 /nfs/dbraw/zinc/90/05/12/1053900512.db2.gz XXZGDIYVFPXKHP-CYBMUJFWSA-N 1 0 321.848 4.078 20 10 DICDRO CC1(C)C[N@H+](Cc2ccc3ccccc3c2O)CCC1(F)F ZINC001231879985 1053901220 /nfs/dbraw/zinc/90/12/20/1053901220.db2.gz ZEQLBKHCYDCHJW-UHFFFAOYSA-N 1 0 305.368 4.413 20 10 DICDRO Oc1c(C[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)ccc2ccccc21 ZINC001231879342 1053901573 /nfs/dbraw/zinc/90/15/73/1053901573.db2.gz CEEJVNKKKJZELO-CJNGLKHVSA-N 1 0 303.352 4.023 20 10 DICDRO Cc1cccc2c1CC[N@H+](Cc1ccc3ccccc3c1O)C2 ZINC001231879553 1053902458 /nfs/dbraw/zinc/90/24/58/1053902458.db2.gz IFYWDZQEXNJGFV-UHFFFAOYSA-N 1 0 303.405 4.412 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(F)F)c1O ZINC001328102382 1053907975 /nfs/dbraw/zinc/90/79/75/1053907975.db2.gz DIZJDNDGSJJAGZ-HMHPOGMRSA-N 1 0 301.764 4.048 20 10 DICDRO CCC[N@H+](Cc1ccc(N2CCOCC2)c(Cl)c1)[C@H](C)CC ZINC001232196559 1053985815 /nfs/dbraw/zinc/98/58/15/1053985815.db2.gz ARZIDRNVOGPGOW-OAHLLOKOSA-N 1 0 324.896 4.187 20 10 DICDRO CCC[N@H+](Cc1ccc(N2CCOCC2)c(Cl)c1)[C@@H](C)CC ZINC001232196558 1053987349 /nfs/dbraw/zinc/98/73/49/1053987349.db2.gz ARZIDRNVOGPGOW-HNNXBMFYSA-N 1 0 324.896 4.187 20 10 DICDRO COc1cc(O)c(C[NH+]2CCC3(CCCC3)CC2)cc1Cl ZINC001232265874 1054005152 /nfs/dbraw/zinc/00/51/52/1054005152.db2.gz GRZDJUWDZBNFDR-UHFFFAOYSA-N 1 0 309.837 4.210 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1Cl ZINC001232259854 1054005350 /nfs/dbraw/zinc/00/53/50/1054005350.db2.gz LQLKQAVKTRSTGK-HNNXBMFYSA-N 1 0 321.779 4.227 20 10 DICDRO Oc1cc(O)c(C[NH+]2CCC(c3cccs3)CC2)cc1Cl ZINC001232264597 1054006442 /nfs/dbraw/zinc/00/64/42/1054006442.db2.gz DCOFPNBMEVUCGD-UHFFFAOYSA-N 1 0 323.845 4.192 20 10 DICDRO CC(C)[N@H+](Cc1ccccc1)Cc1cc(Cl)c(O)cc1O ZINC001232259315 1054007022 /nfs/dbraw/zinc/00/70/22/1054007022.db2.gz VPHFIXBEQFOTIW-UHFFFAOYSA-N 1 0 305.805 4.162 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cc1Cl ZINC001232268753 1054009138 /nfs/dbraw/zinc/00/91/38/1054009138.db2.gz RBUCSHLODDFYTJ-OAHLLOKOSA-N 1 0 321.779 4.227 20 10 DICDRO CCc1cccc(C[NH+]2CCC(Nc3ccccc3)CC2)c1O ZINC001329982170 1054013091 /nfs/dbraw/zinc/01/30/91/1054013091.db2.gz IJGXATDHNNVUOR-UHFFFAOYSA-N 1 0 310.441 4.031 20 10 DICDRO CC1CCN(c2ccc(C[NH2+]Cc3cccn3C3CC3)cc2)CC1 ZINC001330529624 1054038127 /nfs/dbraw/zinc/03/81/27/1054038127.db2.gz SSXHKUNURBAVIP-UHFFFAOYSA-N 1 0 323.484 4.349 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccc(OC(F)F)c1 ZINC000296182919 1054085420 /nfs/dbraw/zinc/08/54/20/1054085420.db2.gz YEUIPMAOAOAXTJ-NHYWBVRUSA-N 1 0 319.351 4.332 20 10 DICDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCSC2(CCC2)C1 ZINC001332328765 1054115111 /nfs/dbraw/zinc/11/51/11/1054115111.db2.gz CBBAOYQVHLRZRG-KRWDZBQOSA-N 1 0 316.514 4.195 20 10 DICDRO CC(C)C[N@H+](Cc1ccccc1)Cc1ccc(N(C)C)cc1O ZINC001232834954 1054127682 /nfs/dbraw/zinc/12/76/82/1054127682.db2.gz RWCSFQVIQYHETD-UHFFFAOYSA-N 1 0 312.457 4.116 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2ccccc2)C(C)(C)C)c(O)c1 ZINC001232834754 1054128092 /nfs/dbraw/zinc/12/80/92/1054128092.db2.gz LOMUBLUXUVWRSD-UHFFFAOYSA-N 1 0 312.457 4.259 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c(O)c1 ZINC001232834055 1054128103 /nfs/dbraw/zinc/12/81/03/1054128103.db2.gz FRFOEFJJGZPCHK-LJQANCHMSA-N 1 0 310.441 4.185 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccccc1F ZINC000848555854 1054147835 /nfs/dbraw/zinc/14/78/35/1054147835.db2.gz GIDPOKDNGRMJFB-YVEFUNNKSA-N 1 0 303.377 4.342 20 10 DICDRO C[N@H+](Cc1cncc(-c2ccccc2)c1)Cc1ccccc1O ZINC001232902382 1054148010 /nfs/dbraw/zinc/14/80/10/1054148010.db2.gz KBTXNUUCHCPPDO-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO C[C@H]([NH2+][C@H](C1CC1)[C@H]1CCCCO1)c1ccc(Cl)cc1O ZINC000848557804 1054149438 /nfs/dbraw/zinc/14/94/38/1054149438.db2.gz HOERGIOUSRIVDX-YMRXKLBXSA-N 1 0 309.837 4.044 20 10 DICDRO Cc1cnc(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)c(C)c1 ZINC000848560498 1054149711 /nfs/dbraw/zinc/14/97/11/1054149711.db2.gz MZHQFMSSAJWYMA-MRXNPFEDSA-N 1 0 320.436 4.451 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)Cc2ccccn2)c1O ZINC000848565974 1054153233 /nfs/dbraw/zinc/15/32/33/1054153233.db2.gz VTEZZHCCGBKTNS-QWHCGFSZSA-N 1 0 304.821 4.031 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)c(O)c1 ZINC000848574927 1054156367 /nfs/dbraw/zinc/15/63/67/1054156367.db2.gz JAWDSPPLKRBVJK-LBPRGKRZSA-N 1 0 313.388 4.095 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c(Cl)n1 ZINC001333595601 1054161795 /nfs/dbraw/zinc/16/17/95/1054161795.db2.gz LSKXYAXCNBJMOJ-RISCZKNCSA-N 1 0 316.832 4.396 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc(N2CCCC2)cc1)CC(F)(F)F ZINC001333671496 1054167041 /nfs/dbraw/zinc/16/70/41/1054167041.db2.gz IGYGOFNMJBJNHQ-UHFFFAOYSA-N 1 0 314.395 4.355 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC001333766389 1054170282 /nfs/dbraw/zinc/17/02/82/1054170282.db2.gz JDZFVRWTZSIXFV-CSMYWGQOSA-N 1 0 308.425 4.108 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCc2cc(N)ccc21 ZINC001333766391 1054170290 /nfs/dbraw/zinc/17/02/90/1054170290.db2.gz JDZFVRWTZSIXFV-DQYPLSBCSA-N 1 0 308.425 4.108 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C1CC2(C1)COC(C)(C)C2 ZINC001334729912 1054195414 /nfs/dbraw/zinc/19/54/14/1054195414.db2.gz HKXGWGUJDVZRJX-OVCBBOEUSA-N 1 0 315.457 4.186 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(Cl)c(F)c1F ZINC001233212113 1054203938 /nfs/dbraw/zinc/20/39/38/1054203938.db2.gz JCNFJMQQVUJARX-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC(c3ccncc3)CC2)c1 ZINC001233286320 1054221618 /nfs/dbraw/zinc/22/16/18/1054221618.db2.gz OMDOKCQHGPMGDW-UHFFFAOYSA-N 1 0 324.468 4.464 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c1 ZINC001233284435 1054222006 /nfs/dbraw/zinc/22/20/06/1054222006.db2.gz USMNCLMLNJYQNS-OAHLLOKOSA-N 1 0 315.379 4.259 20 10 DICDRO C[N@H+](Cc1ccccc1F)Cc1cc(C(C)(C)C)ccc1O ZINC001233286109 1054222108 /nfs/dbraw/zinc/22/21/08/1054222108.db2.gz FZNLPIBSDXTCOY-UHFFFAOYSA-N 1 0 301.405 4.461 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC3(CCCOC3)CC2)c1 ZINC001233286906 1054224051 /nfs/dbraw/zinc/22/40/51/1054224051.db2.gz NZSSHWSYLNGGJB-UHFFFAOYSA-N 1 0 317.473 4.082 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2cc(Cl)cc(OC)c2O)cc1 ZINC001233290073 1054226625 /nfs/dbraw/zinc/22/66/25/1054226625.db2.gz GYNUUSNELKNKPN-UHFFFAOYSA-N 1 0 319.832 4.249 20 10 DICDRO C[N@H+](Cc1cccc2ccccc21)Cc1c([O-])ccc(F)c1F ZINC001233334404 1054236276 /nfs/dbraw/zinc/23/62/76/1054236276.db2.gz FJNFDMFCSWVYKB-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccccn1 ZINC001337010750 1054252863 /nfs/dbraw/zinc/25/28/63/1054252863.db2.gz YJTYJYHPQKHWFJ-UHFFFAOYSA-N 1 0 309.457 4.092 20 10 DICDRO CCSCC[C@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001337042063 1054255061 /nfs/dbraw/zinc/25/50/61/1054255061.db2.gz GRPBGAWQSADKRS-INIZCTEOSA-N 1 0 306.519 4.250 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H](C)Cc1ccc(O)cc1 ZINC001337784517 1054285555 /nfs/dbraw/zinc/28/55/55/1054285555.db2.gz BUIOICSAWUIJPZ-CKEIUWERSA-N 1 0 311.425 4.175 20 10 DICDRO CO[C@H](C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C)c1ccccc1 ZINC001337784350 1054285822 /nfs/dbraw/zinc/28/58/22/1054285822.db2.gz AUVULQIKEONQKI-QILLFSRXSA-N 1 0 311.425 4.226 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1OCCc2ccccc21 ZINC001337797759 1054285974 /nfs/dbraw/zinc/28/59/74/1054285974.db2.gz CWINSXLSRRWXJG-DKSSEZFCSA-N 1 0 323.436 4.153 20 10 DICDRO CO[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C)c1ccccc1 ZINC001337784353 1054286090 /nfs/dbraw/zinc/28/60/90/1054286090.db2.gz AUVULQIKEONQKI-UWWQBHOKSA-N 1 0 311.425 4.226 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccccc2COC(C)C)c1O ZINC000848892698 1054286085 /nfs/dbraw/zinc/28/60/85/1054286085.db2.gz FCBUUYTWNZQPNJ-UHFFFAOYSA-N 1 0 313.441 4.169 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)c1O ZINC000848892613 1054286135 /nfs/dbraw/zinc/28/61/35/1054286135.db2.gz BUHMWSAOJSJENJ-LBPRGKRZSA-N 1 0 321.367 4.407 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc(N(C)C)cc1C ZINC001337784563 1054286127 /nfs/dbraw/zinc/28/61/27/1054286127.db2.gz CAIBIPDGSOQBAL-MAUKXSAKSA-N 1 0 324.468 4.413 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC001337797717 1054286320 /nfs/dbraw/zinc/28/63/20/1054286320.db2.gz BWOXDENNNWYZNI-YPMHNXCESA-N 1 0 314.454 4.373 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1OCCc2ccccc21 ZINC001337797757 1054286548 /nfs/dbraw/zinc/28/65/48/1054286548.db2.gz CWINSXLSRRWXJG-BJZITVGISA-N 1 0 323.436 4.153 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CCC3(CCOCC3)CC2)c(O)c1C ZINC001337801003 1054286702 /nfs/dbraw/zinc/28/67/02/1054286702.db2.gz PJSNYKWLEVVJMJ-INIZCTEOSA-N 1 0 317.473 4.399 20 10 DICDRO CCc1cccc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)c1O ZINC000848897186 1054287265 /nfs/dbraw/zinc/28/72/65/1054287265.db2.gz FWYDJPQJUBYRDK-UHFFFAOYSA-N 1 0 305.368 4.258 20 10 DICDRO CCc1cccc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)c1O ZINC000848897776 1054287497 /nfs/dbraw/zinc/28/74/97/1054287497.db2.gz VONCJKMQZOJWEK-UHFFFAOYSA-N 1 0 304.459 4.053 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)c1O ZINC000848899227 1054289950 /nfs/dbraw/zinc/28/99/50/1054289950.db2.gz LKUKUWSKBVOETB-GOSISDBHSA-N 1 0 323.436 4.491 20 10 DICDRO CCc1cccc(C[NH+]2CCC(CC(F)(F)F)CC2)c1O ZINC000848910200 1054295227 /nfs/dbraw/zinc/29/52/27/1054295227.db2.gz IIOZVEVRGYPUOB-UHFFFAOYSA-N 1 0 301.352 4.119 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)c1O ZINC000848913947 1054296304 /nfs/dbraw/zinc/29/63/04/1054296304.db2.gz CJOZNFGPBZXFPV-HZPDHXFCSA-N 1 0 317.454 4.026 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)c1O ZINC000848914334 1054296625 /nfs/dbraw/zinc/29/66/25/1054296625.db2.gz LPTNEUKEOJXIHZ-UHFFFAOYSA-N 1 0 305.368 4.356 20 10 DICDRO CC[C@H]1CCCC[N@@H+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233760059 1054353925 /nfs/dbraw/zinc/35/39/25/1054353925.db2.gz AWNRBHMGZLDLMT-LBPRGKRZSA-N 1 0 303.324 4.055 20 10 DICDRO Oc1c(C[NH+]2CC3(C2)CCCCC3)cccc1OC(F)(F)F ZINC001233767990 1054355383 /nfs/dbraw/zinc/35/53/83/1054355383.db2.gz IXKZGQZREVHLGG-UHFFFAOYSA-N 1 0 315.335 4.057 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCc2c1cccc2O ZINC001342391531 1054420795 /nfs/dbraw/zinc/42/07/95/1054420795.db2.gz ZWRMCWLVVRMEHC-UHOFOFEASA-N 1 0 309.409 4.232 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)c2ccccc2O1 ZINC001344074815 1054464065 /nfs/dbraw/zinc/46/40/65/1054464065.db2.gz LITDPMQHFLHUSM-OXQOHEQNSA-N 1 0 322.452 4.289 20 10 DICDRO c1cnc2ccc(C[NH2+]Cc3ccc(N4CCCC4)cc3)cc2c1 ZINC001344393653 1054466963 /nfs/dbraw/zinc/46/69/63/1054466963.db2.gz OKCBYXBXHGVMBF-UHFFFAOYSA-N 1 0 317.436 4.125 20 10 DICDRO CCN(CC)[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccco1 ZINC000185227831 1054482224 /nfs/dbraw/zinc/48/22/24/1054482224.db2.gz UNJBHHKFIQPOIQ-DOTOQJQBSA-N 1 0 316.445 4.027 20 10 DICDRO C[C@H]([NH2+]CCc1ccccc1O)c1ccc2ccccc2c1O ZINC000185303052 1054513328 /nfs/dbraw/zinc/51/33/28/1054513328.db2.gz FCERNIDLZRPQAQ-AWEZNQCLSA-N 1 0 307.393 4.144 20 10 DICDRO COc1ccc2ccc(O)c(C[NH+]3C[C@H]4CCCC[C@@H]4C3)c2c1 ZINC001234526073 1054543281 /nfs/dbraw/zinc/54/32/81/1054543281.db2.gz PTIKJZLILOCNQB-HZPDHXFCSA-N 1 0 311.425 4.176 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@](C)(F)CC3)c2c1 ZINC001234525413 1054543727 /nfs/dbraw/zinc/54/37/27/1054543727.db2.gz GKKVGQLFRUMNNS-IBGZPJMESA-N 1 0 317.404 4.268 20 10 DICDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)cn1 ZINC000185421946 1054546067 /nfs/dbraw/zinc/54/60/67/1054546067.db2.gz VCVYDVFTVMTWRH-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO COc1ccc2ccc(O)c(C[N@H+](C)Cc3ccsc3)c2c1 ZINC001234552574 1054546895 /nfs/dbraw/zinc/54/68/95/1054546895.db2.gz ACHZGTKWNRPXEN-UHFFFAOYSA-N 1 0 313.422 4.248 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@@H]4CCC[C@@H]43)c2c1 ZINC001234562935 1054547044 /nfs/dbraw/zinc/54/70/44/1054547044.db2.gz XTINPRGPOAXDGR-KXBFYZLASA-N 1 0 311.425 4.319 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCCC4(CCC4)C3)c2c1 ZINC001234570334 1054548753 /nfs/dbraw/zinc/54/87/53/1054548753.db2.gz YSLXLHOITHSNNC-UHFFFAOYSA-N 1 0 311.425 4.320 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCO[C@@H]2C(C)(C)C)c(O)c1 ZINC000185488963 1054552584 /nfs/dbraw/zinc/55/25/84/1054552584.db2.gz JPSSCTQDXFNDEF-MPGHIAIKSA-N 1 0 305.462 4.193 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCO[C@@H]2C(C)(C)C)c1 ZINC000185488735 1054554291 /nfs/dbraw/zinc/55/42/91/1054554291.db2.gz CXDNIASFCGAGHY-DAYGRLMNSA-N 1 0 305.462 4.193 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C)c1cc(F)ccc1O ZINC000185489142 1054555075 /nfs/dbraw/zinc/55/50/75/1054555075.db2.gz MGBULJUZYGGWOZ-AHIWAGSCSA-N 1 0 309.425 4.023 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2OCC2CC2)c1 ZINC000185516489 1054559719 /nfs/dbraw/zinc/55/97/19/1054559719.db2.gz GQGZWBJTHKYZCY-HNNXBMFYSA-N 1 0 311.425 4.340 20 10 DICDRO CC(C)([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccc1F ZINC001347513597 1054571511 /nfs/dbraw/zinc/57/15/11/1054571511.db2.gz JLYYSXIWMUXSGH-UHFFFAOYSA-N 1 0 312.432 4.451 20 10 DICDRO Fc1ccc([C@H]2C[C@H]([NH2+]Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001347603465 1054572888 /nfs/dbraw/zinc/57/28/88/1054572888.db2.gz PZWRFEIGOSJIHS-KESTWPANSA-N 1 0 324.443 4.462 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185566908 1054583467 /nfs/dbraw/zinc/58/34/67/1054583467.db2.gz IONOFHRGRCSGPR-STQMWFEESA-N 1 0 303.377 4.260 20 10 DICDRO Cc1ccc(OC(F)F)c(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000185695120 1054621180 /nfs/dbraw/zinc/62/11/80/1054621180.db2.gz LGXDPZHNQQFUFD-ZDUSSCGKSA-N 1 0 321.367 4.461 20 10 DICDRO C[C@@H]1c2cccn2CC[N@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996305 1054637248 /nfs/dbraw/zinc/63/72/48/1054637248.db2.gz FINOTMSTOGAMIH-MRXNPFEDSA-N 1 0 318.420 4.438 20 10 DICDRO Oc1c(C[NH+]2CC(c3cccnc3)C2)cccc1-c1ccccc1 ZINC001234996373 1054637404 /nfs/dbraw/zinc/63/74/04/1054637404.db2.gz GPXGXTVXKFCDBH-UHFFFAOYSA-N 1 0 316.404 4.054 20 10 DICDRO COC1(C)CC[NH+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001234991314 1054638319 /nfs/dbraw/zinc/63/83/19/1054638319.db2.gz LZWHQXVINSBRDX-UHFFFAOYSA-N 1 0 311.425 4.060 20 10 DICDRO CC[N@H+](Cc1cccc(N2CCCC2)c1)Cc1ccccc1O ZINC001235095249 1054656237 /nfs/dbraw/zinc/65/62/37/1054656237.db2.gz HIVICZPHYPEJAS-UHFFFAOYSA-N 1 0 310.441 4.015 20 10 DICDRO C[N@H+](Cc1ccc(Cl)nc1)Cc1ccc(C(C)(C)C)cc1O ZINC001235677105 1054769410 /nfs/dbraw/zinc/76/94/10/1054769410.db2.gz BBYMUMIJDPLXPS-UHFFFAOYSA-N 1 0 318.848 4.370 20 10 DICDRO CC(C)(C)c1ccc(C[NH+]2CCC3(CCOCC3)CC2)c(O)c1 ZINC001235680096 1054773464 /nfs/dbraw/zinc/77/34/64/1054773464.db2.gz SEWGSJWHPFAHMW-UHFFFAOYSA-N 1 0 317.473 4.082 20 10 DICDRO Cc1nc2c(s1)C[N@H+](Cc1ccc(C(C)(C)C)cc1O)CC2 ZINC001235683475 1054773753 /nfs/dbraw/zinc/77/37/53/1054773753.db2.gz GKJGZCAMTOMZNS-UHFFFAOYSA-N 1 0 316.470 4.013 20 10 DICDRO C[N@H+](Cc1ccc(C(C)(C)C)cc1O)Cc1ccccc1F ZINC001235685178 1054776761 /nfs/dbraw/zinc/77/67/61/1054776761.db2.gz MJFLJTVXWHHYFS-UHFFFAOYSA-N 1 0 301.405 4.461 20 10 DICDRO C[N@H+](CCc1cccs1)Cc1ccc(C(C)(C)C)cc1O ZINC001235685247 1054778736 /nfs/dbraw/zinc/77/87/36/1054778736.db2.gz NTBSRVYPIYLZTQ-UHFFFAOYSA-N 1 0 303.471 4.426 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCCO[C@H]2CC(C)C)cc1C ZINC001474121499 1054785072 /nfs/dbraw/zinc/78/50/72/1054785072.db2.gz XAGKHJCPXGXIMT-ICSRJNTNSA-N 1 0 319.489 4.467 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC2(CCCC2)[C@@H]1C(C)C ZINC001474575675 1054825517 /nfs/dbraw/zinc/82/55/17/1054825517.db2.gz ARZSVIAXKOEAPJ-IBGZPJMESA-N 1 0 300.490 4.462 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2OC2CCC2)c1 ZINC000186055512 1054871429 /nfs/dbraw/zinc/87/14/29/1054871429.db2.gz QTKGZZTVAFJDKC-OAHLLOKOSA-N 1 0 311.425 4.483 20 10 DICDRO Nc1ccc(C[NH+]2CCC(n3ccc4ccccc43)CC2)cc1 ZINC001236073717 1054926592 /nfs/dbraw/zinc/92/65/92/1054926592.db2.gz WAINBLQXMHXLMK-UHFFFAOYSA-N 1 0 305.425 4.061 20 10 DICDRO CCCCC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000764526451 1055205075 /nfs/dbraw/zinc/20/50/75/1055205075.db2.gz ZDSVDUFUXXIMTF-CQSZACIVSA-N 1 0 310.869 4.017 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)CCc2ccco2)cc1 ZINC000764606261 1055217501 /nfs/dbraw/zinc/21/75/01/1055217501.db2.gz HFMPDBCYUAJJTC-CVEARBPZSA-N 1 0 300.446 4.408 20 10 DICDRO CC[C@H]1CCC[N@H+](Cc2cc(C)cc(Br)c2[O-])C1 ZINC001236668356 1055221624 /nfs/dbraw/zinc/22/16/24/1055221624.db2.gz COQQRYWBCNILMX-LBPRGKRZSA-N 1 0 312.251 4.085 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(C)c(F)c2)cc1 ZINC000764739948 1055242119 /nfs/dbraw/zinc/24/21/19/1055242119.db2.gz UTIIZHNSLOESMM-OAHLLOKOSA-N 1 0 300.421 4.441 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(F)c(C)c1)c1ccc(N(C)C)cc1 ZINC000764744305 1055243357 /nfs/dbraw/zinc/24/33/57/1055243357.db2.gz SCUYSHOSCPVGCG-IBGZPJMESA-N 1 0 300.421 4.441 20 10 DICDRO CCc1ccc(C[N@@H+](CC)Cc2cccc(F)c2F)c(O)c1 ZINC001236786294 1055258863 /nfs/dbraw/zinc/25/88/63/1055258863.db2.gz AKGXPDVLLQDVAL-UHFFFAOYSA-N 1 0 305.368 4.255 20 10 DICDRO CC[C@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000764810587 1055265243 /nfs/dbraw/zinc/26/52/43/1055265243.db2.gz NSWFMYBXJGATIO-OXJNMPFZSA-N 1 0 316.489 4.222 20 10 DICDRO COc1cc(O)c(C[N@H+](C)CCCc2ccccc2)c(Cl)c1 ZINC001236798377 1055265653 /nfs/dbraw/zinc/26/56/53/1055265653.db2.gz FZHSSFDVVRAUGC-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO CC(C)[N@H+](Cc1cc(Cl)c(Cl)cc1[O-])C1CCOCC1 ZINC001236805183 1055267325 /nfs/dbraw/zinc/26/73/25/1055267325.db2.gz WSTFARWADJJCPF-UHFFFAOYSA-N 1 0 318.244 4.088 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)c(Cl)cc2[O-])cn1 ZINC001236803560 1055269094 /nfs/dbraw/zinc/26/90/94/1055269094.db2.gz MVXFOLZYNQFBEU-UHFFFAOYSA-N 1 0 311.212 4.034 20 10 DICDRO CCC[N@H+](Cc1ccccc1)Cc1ccc(OC)c(Cl)c1[O-] ZINC001236813429 1055273434 /nfs/dbraw/zinc/27/34/34/1055273434.db2.gz LWAGKSZDOMOFHC-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)c([O-])c1Cl ZINC001236811466 1055274075 /nfs/dbraw/zinc/27/40/75/1055274075.db2.gz KIVUVRWTOKTOBS-JSGCOSHPSA-N 1 0 309.837 4.209 20 10 DICDRO COc1cc(C)c(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c(O)c1 ZINC001236821871 1055275473 /nfs/dbraw/zinc/27/54/73/1055275473.db2.gz VBJCEYKEXQLOIN-UHFFFAOYSA-N 1 0 311.425 4.003 20 10 DICDRO COc1cc(C)c(C[N@H+](C)C(C)(C)Cc2ccccc2)c(O)c1 ZINC001236821655 1055275542 /nfs/dbraw/zinc/27/55/42/1055275542.db2.gz SGYJBUWJHFQXQZ-UHFFFAOYSA-N 1 0 313.441 4.162 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001236826414 1055279010 /nfs/dbraw/zinc/27/90/10/1055279010.db2.gz JCFWPZILJIUHRI-INIZCTEOSA-N 1 0 309.331 4.115 20 10 DICDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC000764900484 1055288420 /nfs/dbraw/zinc/28/84/20/1055288420.db2.gz BTWGCIIHWHSYSC-KRWDZBQOSA-N 1 0 324.468 4.016 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001236839328 1055289938 /nfs/dbraw/zinc/28/99/38/1055289938.db2.gz FRFLXIRGZXBFRK-GOSISDBHSA-N 1 0 318.420 4.320 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)c1 ZINC000764988462 1055306377 /nfs/dbraw/zinc/30/63/77/1055306377.db2.gz GKBDPKLDQUKGBI-INIZCTEOSA-N 1 0 312.457 4.392 20 10 DICDRO CCCC[N@H+](CCC)Cc1ccc(N2CCOCC2)cc1Cl ZINC001236921726 1055315176 /nfs/dbraw/zinc/31/51/76/1055315176.db2.gz NARPXGYHLBOREG-UHFFFAOYSA-N 1 0 324.896 4.189 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCc3ccc(OC)cc32)cc1 ZINC000765108183 1055332165 /nfs/dbraw/zinc/33/21/65/1055332165.db2.gz VKNROBUEQSMEGF-NRFANRHFSA-N 1 0 324.468 4.319 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](OC)c2ccccc2)cc1 ZINC000765261836 1055346718 /nfs/dbraw/zinc/34/67/18/1055346718.db2.gz ONWFBGLKMOBZDI-UZLBHIALSA-N 1 0 312.457 4.181 20 10 DICDRO CCOc1ccc(C[NH+]2CCC(c3cccs3)CC2)c(O)c1 ZINC001237041986 1055347512 /nfs/dbraw/zinc/34/75/12/1055347512.db2.gz ROXVRVGZAISWQW-UHFFFAOYSA-N 1 0 317.454 4.232 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC[C@H]2c2nccs2)c(O)c1 ZINC001237050051 1055348858 /nfs/dbraw/zinc/34/88/58/1055348858.db2.gz WKULWVGTHHNRSJ-HNNXBMFYSA-N 1 0 302.443 4.309 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CC[C@@](CF)(C(F)(F)F)C2)c(O)c1 ZINC001237046665 1055350042 /nfs/dbraw/zinc/35/00/42/1055350042.db2.gz VDTHGTYJCPAFFK-HNNXBMFYSA-N 1 0 319.342 4.240 20 10 DICDRO COc1ccc(CCC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000765257025 1055350354 /nfs/dbraw/zinc/35/03/54/1055350354.db2.gz GEFPNDSUVPAXEA-INIZCTEOSA-N 1 0 312.457 4.045 20 10 DICDRO CCOc1ccc(C[N@H+](C)CCc2ccc(Cl)cc2)c(O)c1 ZINC001237044698 1055351928 /nfs/dbraw/zinc/35/19/28/1055351928.db2.gz SEZMMHNRMLDEGL-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC3(CCC(=O)CC3)CC2)c(O)c1 ZINC001237055862 1055353128 /nfs/dbraw/zinc/35/31/28/1055353128.db2.gz REJDBUYBVROWOG-UHFFFAOYSA-N 1 0 315.457 4.241 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC(Cc3ccncc3)CC2)c(O)c1 ZINC001237054695 1055354192 /nfs/dbraw/zinc/35/41/92/1055354192.db2.gz DPMGDPJIEWCVKK-UHFFFAOYSA-N 1 0 324.468 4.365 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(O)c1 ZINC001237054930 1055354916 /nfs/dbraw/zinc/35/49/16/1055354916.db2.gz IJJLLJCXTPWWMS-UHFFFAOYSA-N 1 0 312.457 4.214 20 10 DICDRO CC(C)=CCC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000765329435 1055362660 /nfs/dbraw/zinc/36/26/60/1055362660.db2.gz JFCWFAMQCGDQKY-QZTJIDSGSA-N 1 0 316.489 4.309 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000765334039 1055365316 /nfs/dbraw/zinc/36/53/16/1055365316.db2.gz WGWUHUPYEBTBFD-SFHVURJKSA-N 1 0 304.384 4.272 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001237127396 1055377811 /nfs/dbraw/zinc/37/78/11/1055377811.db2.gz ZFWVEZRDXUFEOU-LBPRGKRZSA-N 1 0 323.770 4.313 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC001237138245 1055379917 /nfs/dbraw/zinc/37/99/17/1055379917.db2.gz WCZXPEVYNZZLDC-CQSZACIVSA-N 1 0 321.342 4.401 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[NH+]1CCC2(CC[C@@H](F)C2)CC1 ZINC001237131831 1055380369 /nfs/dbraw/zinc/38/03/69/1055380369.db2.gz XONGQZISERNNIF-LLVKDONJSA-N 1 0 315.791 4.289 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CCCc2ccccc2C1 ZINC001237126969 1055380746 /nfs/dbraw/zinc/38/07/46/1055380746.db2.gz RDSPCIBJQFDTOC-UHFFFAOYSA-N 1 0 305.780 4.133 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c2ccccc2n1 ZINC000765408182 1055381588 /nfs/dbraw/zinc/38/15/88/1055381588.db2.gz JFFQDJDTSAABJT-MRXNPFEDSA-N 1 0 319.452 4.460 20 10 DICDRO C[C@H]1CC[N@H+](Cc2cc(C(F)(F)F)ccc2O)CCC1(F)F ZINC001237135654 1055381760 /nfs/dbraw/zinc/38/17/60/1055381760.db2.gz KIQPEZGRGSEOAX-JTQLQIEISA-N 1 0 323.305 4.278 20 10 DICDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C(C)(C)O1 ZINC000765447364 1055390580 /nfs/dbraw/zinc/39/05/80/1055390580.db2.gz BMPBIPJDFNRSMQ-GOSISDBHSA-N 1 0 316.489 4.113 20 10 DICDRO C[C@H]([NH2+]Cc1cnc2ccccc2c1)c1ccc(N(C)C)cc1 ZINC000765450700 1055392238 /nfs/dbraw/zinc/39/22/38/1055392238.db2.gz RDJIJPPEEFKNMB-HNNXBMFYSA-N 1 0 305.425 4.152 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(F)cc1F)c1ccc(N(C)C)cc1 ZINC000765462664 1055398771 /nfs/dbraw/zinc/39/87/71/1055398771.db2.gz DWFLTOHUJVEMGV-SFHVURJKSA-N 1 0 304.384 4.272 20 10 DICDRO Cc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765485223 1055401162 /nfs/dbraw/zinc/40/11/62/1055401162.db2.gz KYWCPLPOEYWMDH-FQEVSTJZSA-N 1 0 306.453 4.155 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cc(F)cc(F)c1 ZINC000765481941 1055403131 /nfs/dbraw/zinc/40/31/31/1055403131.db2.gz RYIIDVWUCONMJH-CYBMUJFWSA-N 1 0 316.395 4.198 20 10 DICDRO CC[N@H+](Cc1c(C)cccc1O)[C@H](C)Cc1ccc(OC)cc1 ZINC001237483921 1055458852 /nfs/dbraw/zinc/45/88/52/1055458852.db2.gz VTJNPAKGZQEJHW-MRXNPFEDSA-N 1 0 313.441 4.162 20 10 DICDRO Cc1cccc(OC2CC[NH+](Cc3c(C)cccc3O)CC2)c1 ZINC001237488262 1055458894 /nfs/dbraw/zinc/45/88/94/1055458894.db2.gz SSQLHLHWVAZNLA-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC2(C=Cc3ccccc32)CC1 ZINC001237484277 1055459135 /nfs/dbraw/zinc/45/91/35/1055459135.db2.gz AAODDLIZWGHYKU-UHFFFAOYSA-N 1 0 305.421 4.261 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H](Cc2ccc(F)cc2)C1 ZINC001237489532 1055459515 /nfs/dbraw/zinc/45/95/15/1055459515.db2.gz BTAYVTOQERDBGV-KRWDZBQOSA-N 1 0 313.416 4.294 20 10 DICDRO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1c(C)cccc1O ZINC001237494791 1055462259 /nfs/dbraw/zinc/46/22/59/1055462259.db2.gz LLJBRSVMTRJSEI-SFHVURJKSA-N 1 0 311.425 4.184 20 10 DICDRO COc1cccc(C2CC[NH+](Cc3c(C)cccc3O)CC2)c1 ZINC001237495616 1055462641 /nfs/dbraw/zinc/46/26/41/1055462641.db2.gz SWSUQQLAWZADHK-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO CC1(C)C[C@@H]([NH2+]Cc2cc(F)cc(F)c2[O-])c2ccccc21 ZINC001620847453 1055474800 /nfs/dbraw/zinc/47/48/00/1055474800.db2.gz WRZUBYSLLOCBAS-MRXNPFEDSA-N 1 0 303.352 4.183 20 10 DICDRO COCC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765574893 1055478920 /nfs/dbraw/zinc/47/89/20/1055478920.db2.gz NIUHCVMTDIBULM-DLBZAZTESA-N 1 0 304.478 4.143 20 10 DICDRO COCC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765574896 1055479726 /nfs/dbraw/zinc/47/97/26/1055479726.db2.gz NIUHCVMTDIBULM-IRXDYDNUSA-N 1 0 304.478 4.143 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@H+](Cc1ccccc1)C1CC1 ZINC001237621897 1055484692 /nfs/dbraw/zinc/48/46/92/1055484692.db2.gz IPELBFZGKBODON-UHFFFAOYSA-N 1 0 305.780 4.349 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC001237620229 1055485987 /nfs/dbraw/zinc/48/59/87/1055485987.db2.gz LDVHCUAVRKXGSM-NSHDSACASA-N 1 0 323.770 4.313 20 10 DICDRO CCOCc1cc(C[NH2+]CC2(CC)CCCC2)ccc1OC ZINC001620860541 1055488670 /nfs/dbraw/zinc/48/86/70/1055488670.db2.gz KZOHVLNIPKKQIH-UHFFFAOYSA-N 1 0 305.462 4.292 20 10 DICDRO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237641311 1055490372 /nfs/dbraw/zinc/49/03/72/1055490372.db2.gz RHMWZSQILIWINE-PXAZEXFGSA-N 1 0 303.352 4.131 20 10 DICDRO COCC[N@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)C(C)C ZINC001237643360 1055491642 /nfs/dbraw/zinc/49/16/42/1055491642.db2.gz LCSPVRSXHDEUIK-UHFFFAOYSA-N 1 0 317.404 4.055 20 10 DICDRO CCC(CC)[C@@H](CC[NH2+]Cc1c(O)cc(C)cc1Cl)OC ZINC001620868424 1055496065 /nfs/dbraw/zinc/49/60/65/1055496065.db2.gz CKKANAJIVPPGKB-QGZVFWFLSA-N 1 0 313.869 4.285 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+](C)CCC(=O)c2ccccc2)c1O ZINC001237686326 1055501714 /nfs/dbraw/zinc/50/17/14/1055501714.db2.gz KOJGACRSRMMECV-UHFFFAOYSA-N 1 0 317.816 4.059 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+]2CCC(=O)[C@H](C)C23CCCC3)c1O ZINC001237688180 1055502823 /nfs/dbraw/zinc/50/28/23/1055502823.db2.gz GAXRMOKJBFYXGX-ZDUSSCGKSA-N 1 0 321.848 4.078 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+](C)CC/C=C/c2cccnc2)c1O ZINC001237688401 1055504257 /nfs/dbraw/zinc/50/42/57/1055504257.db2.gz IULTXQNNKKJRLD-ZZXKWVIFSA-N 1 0 316.832 4.284 20 10 DICDRO Cc1cc(Cl)cc(CN(C)Cc2nc3ccccc3o2)c1O ZINC001237685074 1055504611 /nfs/dbraw/zinc/50/46/11/1055504611.db2.gz DSOQXOMZLKPOCM-UHFFFAOYSA-N 1 0 316.788 4.127 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc2c(s1)CCCC2 ZINC000765608816 1055513835 /nfs/dbraw/zinc/51/38/35/1055513835.db2.gz LRGCSMASIRYCMM-CYBMUJFWSA-N 1 0 313.466 4.413 20 10 DICDRO Oc1ccccc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000765627025 1055525251 /nfs/dbraw/zinc/52/52/51/1055525251.db2.gz UMUAQGDGCIZUNG-OAHLLOKOSA-N 1 0 303.789 4.049 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC001620905286 1055528979 /nfs/dbraw/zinc/52/89/79/1055528979.db2.gz KJVQYTPSFSUSRM-KRWDZBQOSA-N 1 0 324.399 4.239 20 10 DICDRO COc1cc(C)c(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(C)c1 ZINC001142941855 1055544458 /nfs/dbraw/zinc/54/44/58/1055544458.db2.gz KTNADZIXPYARHU-UHFFFAOYSA-N 1 0 312.457 4.010 20 10 DICDRO CC(C)C1=[NH+]CCc2ccc(C[N@H+](C)Cc3ccccc3O)cc21 ZINC001237886124 1055551950 /nfs/dbraw/zinc/55/19/50/1055551950.db2.gz KQSBCMJFCCJDGZ-UHFFFAOYSA-N 1 0 322.452 4.025 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@H]2CC)ccc1OC ZINC001620941225 1055554956 /nfs/dbraw/zinc/55/49/56/1055554956.db2.gz QJDJYLVNVUHFQN-SJORKVTESA-N 1 0 305.462 4.148 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CCOC3(CCC3)C1)oc1ccccc12 ZINC000765723495 1055556098 /nfs/dbraw/zinc/55/60/98/1055556098.db2.gz FHQRRLWPYCCCDM-UHFFFAOYSA-N 1 0 323.392 4.047 20 10 DICDRO C[N@H+](Cc1cccc(Cl)c1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237938054 1055562424 /nfs/dbraw/zinc/56/24/24/1055562424.db2.gz XGKLCYWVFVAZDV-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO Cc1cc(F)cc(C[N@H+](C)CCc2ccc(Cl)cc2)c1O ZINC001238063341 1055597574 /nfs/dbraw/zinc/59/75/74/1055597574.db2.gz VTLGRQOPPQPNLC-UHFFFAOYSA-N 1 0 307.796 4.168 20 10 DICDRO CCCOc1ccc(C[NH2+]CCOCC2CCCC2)cc1C ZINC001620959985 1055597912 /nfs/dbraw/zinc/59/79/12/1055597912.db2.gz QEQDYHKMZYBDJH-UHFFFAOYSA-N 1 0 305.462 4.080 20 10 DICDRO Cc1cc(F)cc(C[N@@H+](C)C23CC4CC(CC(C4)C2)C3)c1O ZINC001238061835 1055598580 /nfs/dbraw/zinc/59/85/80/1055598580.db2.gz JORZQYRXKIDNOV-UHFFFAOYSA-N 1 0 303.421 4.240 20 10 DICDRO COc1ccsc1[C@H](C)[NH2+]CCCSc1nccs1 ZINC000186171066 1055645295 /nfs/dbraw/zinc/64/52/95/1055645295.db2.gz XRNNSKBOXZCRSL-JTQLQIEISA-N 1 0 314.501 4.046 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001620964521 1055662795 /nfs/dbraw/zinc/66/27/95/1055662795.db2.gz VBIMVOGGXLAIOC-TUYSUELWSA-N 1 0 324.468 4.434 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001620964518 1055663274 /nfs/dbraw/zinc/66/32/74/1055663274.db2.gz VBIMVOGGXLAIOC-DKRLNXSXSA-N 1 0 324.468 4.434 20 10 DICDRO CC(C)C[C@@H]1C[C@H]1[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001620965479 1055680133 /nfs/dbraw/zinc/68/01/33/1055680133.db2.gz HSDJWOUNXAKWGB-CZUORRHYSA-N 1 0 314.395 4.296 20 10 DICDRO CCOc1cc(F)c(F)cc1C[N@H+](CC)Cc1ccccc1O ZINC001238661749 1055712014 /nfs/dbraw/zinc/71/20/14/1055712014.db2.gz QKQWZAWDDINNSL-UHFFFAOYSA-N 1 0 321.367 4.091 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1ccccc1Cl ZINC001620974678 1055815817 /nfs/dbraw/zinc/81/58/17/1055815817.db2.gz TXWHYUHSWGNSNX-HNNXBMFYSA-N 1 0 316.876 4.435 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCc3cc(F)ccc32)cc1 ZINC001649070689 1055879316 /nfs/dbraw/zinc/87/93/16/1055879316.db2.gz ITPDUCYHJJXEPD-XQQSMPNESA-N 1 0 310.416 4.182 20 10 DICDRO Cc1c(Cl)cccc1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001620751707 1055925168 /nfs/dbraw/zinc/92/51/68/1055925168.db2.gz ADACYZQYVACAAN-UHFFFAOYSA-N 1 0 314.860 4.321 20 10 DICDRO Clc1cc2cccnc2c(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC001620760726 1055932144 /nfs/dbraw/zinc/93/21/44/1055932144.db2.gz PLLRUXFNLCVCRP-UHFFFAOYSA-N 1 0 324.811 4.113 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](COC)CC(C)(C)C)cc1 ZINC001620986113 1055959187 /nfs/dbraw/zinc/95/91/87/1055959187.db2.gz FWCWUWUNHZUWCH-KRWDZBQOSA-N 1 0 306.494 4.074 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H]2CCC3(CCCC3)O2)cc1C ZINC001620988794 1055961437 /nfs/dbraw/zinc/96/14/37/1055961437.db2.gz VHESCOYPYQAYQC-GOSISDBHSA-N 1 0 317.473 4.365 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H]2CCC3(CCCC3)O2)cc1C ZINC001620988798 1055961871 /nfs/dbraw/zinc/96/18/71/1055961871.db2.gz VHESCOYPYQAYQC-SFHVURJKSA-N 1 0 317.473 4.365 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@H]2CCC[C@@H](C)O2)cc1 ZINC001621008819 1055975571 /nfs/dbraw/zinc/97/55/71/1055975571.db2.gz IVVXRDKMWGLTBW-YLJYHZDGSA-N 1 0 318.505 4.360 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2CCC[C@H](C)O2)cc1 ZINC001621008817 1055976495 /nfs/dbraw/zinc/97/64/95/1055976495.db2.gz IVVXRDKMWGLTBW-PXNSSMCTSA-N 1 0 318.505 4.360 20 10 DICDRO CCCOc1ccc(C[NH2+]CCC2SCCS2)cc1C ZINC001621017917 1055982704 /nfs/dbraw/zinc/98/27/04/1055982704.db2.gz GAXSXXSAJPWYBC-UHFFFAOYSA-N 1 0 311.516 4.070 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1noc2ccc(F)cc12 ZINC001621037380 1055998074 /nfs/dbraw/zinc/99/80/74/1055998074.db2.gz KGPIJYJHJHELQE-UHFFFAOYSA-N 1 0 323.371 4.057 20 10 DICDRO CC[C@@](C)([NH2+]Cc1c(C)c2ccccc2n1C)c1nccs1 ZINC001620806283 1056000612 /nfs/dbraw/zinc/00/06/12/1056000612.db2.gz CJTIFZSJNNFHMY-GOSISDBHSA-N 1 0 313.470 4.358 20 10 DICDRO CC(C)OC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCC1 ZINC001621056036 1056011992 /nfs/dbraw/zinc/01/19/92/1056011992.db2.gz OBMTUGDJFIVXTF-UHFFFAOYSA-N 1 0 316.489 4.114 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CC2(c3ccccn3)CCC2)c1 ZINC001621318458 1056025805 /nfs/dbraw/zinc/02/58/05/1056025805.db2.gz GKLMCKOHPBZOSH-UHFFFAOYSA-N 1 0 310.441 4.122 20 10 DICDRO Cc1ccc(C)n1-c1ccc(-c2ccccc2C[NH+](C)C)cn1 ZINC001239683685 1056026708 /nfs/dbraw/zinc/02/67/08/1056026708.db2.gz IEKYDXZVQAQNOD-UHFFFAOYSA-N 1 0 305.425 4.218 20 10 DICDRO CCO[C@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)C1(CC)CC ZINC001620819612 1056132640 /nfs/dbraw/zinc/13/26/40/1056132640.db2.gz XHGOIPRQVSPIDI-HOTGVXAUSA-N 1 0 311.853 4.119 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1nc2ccccc2s1 ZINC000921742117 1056438634 /nfs/dbraw/zinc/43/86/34/1056438634.db2.gz CIWQTWRZGTYEMT-ZDUSSCGKSA-N 1 0 324.449 4.472 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1nc2ccccc2[nH]1 ZINC000921759905 1056464923 /nfs/dbraw/zinc/46/49/23/1056464923.db2.gz BVYIYLPWJWJRPI-INIZCTEOSA-N 1 0 321.424 4.129 20 10 DICDRO CCC(CC)[C@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765921853 1056484603 /nfs/dbraw/zinc/48/46/03/1056484603.db2.gz MKNVFRLHHDPWRA-OXJNMPFZSA-N 1 0 318.505 4.125 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1scnc1Cl)C1CCCC1 ZINC001615465498 1056514936 /nfs/dbraw/zinc/51/49/36/1056514936.db2.gz DLIBDMINOZAKGF-UHFFFAOYSA-N 1 0 322.861 4.447 20 10 DICDRO CCC[C@](C)(O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765941268 1056532086 /nfs/dbraw/zinc/53/20/86/1056532086.db2.gz GHOWDWMDOGTXKW-KXBFYZLASA-N 1 0 322.468 4.018 20 10 DICDRO Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001615622033 1056547487 /nfs/dbraw/zinc/54/74/87/1056547487.db2.gz OFEUFOKRHTZXIY-PKOBYXMFSA-N 1 0 308.469 4.439 20 10 DICDRO CC(C)[C@](C)(O)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765955494 1056622813 /nfs/dbraw/zinc/62/28/13/1056622813.db2.gz WNHSKIYBZVYVML-YLJYHZDGSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000765957898 1056648813 /nfs/dbraw/zinc/64/88/13/1056648813.db2.gz KVLLGPXQQUSIIU-FXAWDEMLSA-N 1 0 316.489 4.144 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@@H](C)C[C@@H]3C)CC2)cc1 ZINC000765959839 1056648942 /nfs/dbraw/zinc/64/89/42/1056648942.db2.gz SIDVQZWANYQQOQ-GQIGUUNPSA-N 1 0 316.489 4.078 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2O)CCO1 ZINC000186503660 1056746179 /nfs/dbraw/zinc/74/61/79/1056746179.db2.gz FIOFQINRPLPNJJ-QITLCBANSA-N 1 0 309.425 4.166 20 10 DICDRO COc1cccc2[nH]cc(CC[NH2+][C@H](C)c3cc(C)ccc3O)c21 ZINC000186507078 1056762228 /nfs/dbraw/zinc/76/22/28/1056762228.db2.gz IQXXJQULTHOHLB-CQSZACIVSA-N 1 0 324.424 4.084 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c1O ZINC001143104389 1056769516 /nfs/dbraw/zinc/76/95/16/1056769516.db2.gz SQCAZPMQVSRSIN-CQSZACIVSA-N 1 0 315.379 4.259 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000765971228 1056815736 /nfs/dbraw/zinc/81/57/36/1056815736.db2.gz TYDKFVLYLRAFEP-PWIZWCRZSA-N 1 0 316.489 4.021 20 10 DICDRO c1ccc([C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CCC2)nc1 ZINC000922286570 1056998527 /nfs/dbraw/zinc/99/85/27/1056998527.db2.gz ZAUUEUSLDAWSMY-FQEVSTJZSA-N 1 0 308.425 4.038 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCC[C@H](C2CCOCC2)C1)c1ccccc1O ZINC000922330518 1057010180 /nfs/dbraw/zinc/01/01/80/1057010180.db2.gz YLBSKYABIULNGF-PVAVHDDUSA-N 1 0 303.446 4.028 20 10 DICDRO CC[NH+](CC)Cc1cncc(C2=CCN(c3ccccc3)CC2)c1 ZINC001241355770 1057025339 /nfs/dbraw/zinc/02/53/39/1057025339.db2.gz PCCVEJDWDWZOOS-UHFFFAOYSA-N 1 0 321.468 4.217 20 10 DICDRO Cc1ccc(NCc2c(O)cccc2Cl)c(C[NH+](C)C)c1 ZINC000132650086 1057079853 /nfs/dbraw/zinc/07/98/53/1057079853.db2.gz KDJYVOGAXGEQTA-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000282420264 1057102675 /nfs/dbraw/zinc/10/26/75/1057102675.db2.gz CQUGJWTYZODIFZ-JTQLQIEISA-N 1 0 311.212 4.253 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)c1ncc(C)s1)c1ccc(N(C)C)cc1 ZINC000186772647 1057121898 /nfs/dbraw/zinc/12/18/98/1057121898.db2.gz PWIRPYQLBUVAJH-GUYCJALGSA-N 1 0 317.502 4.362 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1F ZINC000766029460 1057130551 /nfs/dbraw/zinc/13/05/51/1057130551.db2.gz LADPAMFSCMNVCM-HNNXBMFYSA-N 1 0 300.421 4.359 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1F ZINC000766029468 1057130783 /nfs/dbraw/zinc/13/07/83/1057130783.db2.gz LADPAMFSCMNVCM-OAHLLOKOSA-N 1 0 300.421 4.359 20 10 DICDRO Cc1cc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)ccc1F ZINC000766030926 1057132392 /nfs/dbraw/zinc/13/23/92/1057132392.db2.gz XYDYKKMEDHVUBX-HNNXBMFYSA-N 1 0 300.421 4.359 20 10 DICDRO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000766030038 1057132438 /nfs/dbraw/zinc/13/24/38/1057132438.db2.gz STWKLDNFXLZBNH-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(N(C)C)cc1C ZINC000766030997 1057134392 /nfs/dbraw/zinc/13/43/92/1057134392.db2.gz YNFNCNNWFZJBOD-OAQYLSRUSA-N 1 0 324.468 4.237 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2F)cc1 ZINC000133015879 1057163400 /nfs/dbraw/zinc/16/34/00/1057163400.db2.gz APKWPNFDYVKDEQ-CYBMUJFWSA-N 1 0 304.384 4.272 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+]CCCSc2nccs2)c1 ZINC000766072786 1057285685 /nfs/dbraw/zinc/28/56/85/1057285685.db2.gz MSMFKJJVBILSIU-ZDUSSCGKSA-N 1 0 322.499 4.375 20 10 DICDRO CSC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766073511 1057286265 /nfs/dbraw/zinc/28/62/65/1057286265.db2.gz AMOILEOHVQSXKC-ZIAGYGMSSA-N 1 0 310.482 4.218 20 10 DICDRO CC[C@@H]([NH2+]CCCSc1nccs1)c1ccc(OC)cc1 ZINC000766074687 1057286812 /nfs/dbraw/zinc/28/68/12/1057286812.db2.gz ZHOWSDODEAEJNF-OAHLLOKOSA-N 1 0 322.499 4.375 20 10 DICDRO CC[C@H]([NH2+]CCCSc1nccs1)c1ccc(OC)cc1 ZINC000766074685 1057286941 /nfs/dbraw/zinc/28/69/41/1057286941.db2.gz ZHOWSDODEAEJNF-HNNXBMFYSA-N 1 0 322.499 4.375 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)CCC(C)(C)C)CC2)cc1 ZINC000766074926 1057287860 /nfs/dbraw/zinc/28/78/60/1057287860.db2.gz JLBOWOKRYUQISC-MRXNPFEDSA-N 1 0 318.505 4.468 20 10 DICDRO C[C@H](CCC(C)(C)C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000766075309 1057287870 /nfs/dbraw/zinc/28/78/70/1057287870.db2.gz LTLVVJYJJCKEPZ-IAGOWNOFSA-N 1 0 318.505 4.389 20 10 DICDRO CSCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766083881 1057301898 /nfs/dbraw/zinc/30/18/98/1057301898.db2.gz QMXFFFAZHLGYTE-CVEARBPZSA-N 1 0 306.519 4.469 20 10 DICDRO CC[C@H](COC)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766093059 1057323641 /nfs/dbraw/zinc/32/36/41/1057323641.db2.gz GZRJJXFXPLSYJH-FUHWJXTLSA-N 1 0 304.478 4.143 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000766117720 1057348996 /nfs/dbraw/zinc/34/89/96/1057348996.db2.gz LXEJCOOLAXCJRT-GFCCVEGCSA-N 1 0 309.331 4.320 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1)CCCC2 ZINC000766119624 1057352143 /nfs/dbraw/zinc/35/21/43/1057352143.db2.gz QJNQRHKAFWSIRQ-LBPRGKRZSA-N 1 0 313.363 4.045 20 10 DICDRO c1c(C2=CC[C@H]([NH+]3CCCC3)CC2)cc2c3c1CCCN3CCC2 ZINC001242692149 1057449045 /nfs/dbraw/zinc/44/90/45/1057449045.db2.gz GURTXTWALSFZMW-NRFANRHFSA-N 1 0 322.496 4.417 20 10 DICDRO Cc1cccc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCCC2)c1 ZINC000727471790 1057653487 /nfs/dbraw/zinc/65/34/87/1057653487.db2.gz MBMCUQYZIJDNNV-UHFFFAOYSA-N 1 0 307.437 4.489 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc(F)cc2Cl)cc1C ZINC000730454813 1057715546 /nfs/dbraw/zinc/71/55/46/1057715546.db2.gz NMTLIBGMJMFRLW-UHFFFAOYSA-N 1 0 307.796 4.434 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OC(C)C)CC2)cc1C(C)C ZINC000730563919 1057718417 /nfs/dbraw/zinc/71/84/17/1057718417.db2.gz MXVVYVGOYCPEJC-UHFFFAOYSA-N 1 0 305.462 4.213 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCOc3ccccc32)cc1 ZINC000731218168 1057738778 /nfs/dbraw/zinc/73/87/78/1057738778.db2.gz QHRHJILWHZDQHC-GOSISDBHSA-N 1 0 324.468 4.189 20 10 DICDRO c1cncc([C@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CCCCC2)c1 ZINC000731449905 1057743993 /nfs/dbraw/zinc/74/39/93/1057743993.db2.gz CMZOHCOBNSTJTC-OAQYLSRUSA-N 1 0 322.452 4.428 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000731450217 1057744096 /nfs/dbraw/zinc/74/40/96/1057744096.db2.gz QNWCVFGASICBLM-UHFFFAOYSA-N 1 0 315.722 4.354 20 10 DICDRO c1ccc2c(c1)CC[C@H]2C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000732229705 1057771400 /nfs/dbraw/zinc/77/14/00/1057771400.db2.gz BNJILKMFJJKONO-FQEVSTJZSA-N 1 0 320.480 4.497 20 10 DICDRO COc1ccc(C[N@H+](Cc2cc(C)cc(C)c2O)C2CC2)cc1 ZINC000732473770 1057775783 /nfs/dbraw/zinc/77/57/83/1057775783.db2.gz AFWJCHJAOZDZOI-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO C[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733321425 1057811992 /nfs/dbraw/zinc/81/19/92/1057811992.db2.gz CFJBCPAXBZVKGW-HNNXBMFYSA-N 1 0 300.421 4.003 20 10 DICDRO CC(C)c1cnc(C[N@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000733310181 1057812144 /nfs/dbraw/zinc/81/21/44/1057812144.db2.gz NMYARUCBAYHLLY-UHFFFAOYSA-N 1 0 314.429 4.448 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCCSc1ccccc1 ZINC000733323000 1057812272 /nfs/dbraw/zinc/81/22/72/1057812272.db2.gz IKRCOCMRCSNRJJ-UHFFFAOYSA-N 1 0 307.846 4.318 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)cc1F ZINC000733326584 1057812758 /nfs/dbraw/zinc/81/27/58/1057812758.db2.gz NEWOLLQUABWBBR-UHFFFAOYSA-N 1 0 318.823 4.324 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1OC ZINC000733324207 1057813022 /nfs/dbraw/zinc/81/30/22/1057813022.db2.gz NVOSTKILNFFKKH-KRWDZBQOSA-N 1 0 316.420 4.141 20 10 DICDRO CC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733326956 1057813123 /nfs/dbraw/zinc/81/31/23/1057813123.db2.gz IWYOGFALPSNJNS-QGZVFWFLSA-N 1 0 300.421 4.003 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@H]1CC1(Cl)Cl)C1CCCC1 ZINC000733613180 1057827383 /nfs/dbraw/zinc/82/73/83/1057827383.db2.gz CAWPHDANMNMEFB-CYBMUJFWSA-N 1 0 314.256 4.331 20 10 DICDRO C[C@H](CSc1ccc(Cl)cc1)[NH2+]CCc1ccc(N)cc1 ZINC001246462523 1058949468 /nfs/dbraw/zinc/94/94/68/1058949468.db2.gz APOBJXDXIDOFCJ-CYBMUJFWSA-N 1 0 320.889 4.235 20 10 DICDRO C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]CCc1ccc(N)cc1 ZINC001246464113 1058950111 /nfs/dbraw/zinc/95/01/11/1058950111.db2.gz FYJJXJYIPFBHKO-LBPRGKRZSA-N 1 0 323.267 4.339 20 10 DICDRO Nc1ccc(CC[NH2+]C2CCC(Cc3ccccc3)CC2)cc1 ZINC001246468027 1058953404 /nfs/dbraw/zinc/95/34/04/1058953404.db2.gz VSHBZUOAGSIULB-UHFFFAOYSA-N 1 0 308.469 4.202 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)c(C)c1)Cc1ccccc1F ZINC001559506953 1059299060 /nfs/dbraw/zinc/29/90/60/1059299060.db2.gz LPJKUDBVVLAEGR-UHFFFAOYSA-N 1 0 300.421 4.222 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@@H]1CCC2(CCC2)O1)C1CCCC1 ZINC001559529967 1059331527 /nfs/dbraw/zinc/33/15/27/1059331527.db2.gz GSCMDNYJJWJEFY-SFHVURJKSA-N 1 0 315.457 4.239 20 10 DICDRO C=C/C=C\CC[N@@H+](CC)Cc1cc(Br)ccc1O ZINC001559568989 1059395482 /nfs/dbraw/zinc/39/54/82/1059395482.db2.gz LPBRHXHCMYWRDZ-WAYWQWQTSA-N 1 0 310.235 4.109 20 10 DICDRO C[C@@H]1CCC[C@@H](C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)C1 ZINC001559635147 1059464357 /nfs/dbraw/zinc/46/43/57/1059464357.db2.gz LYWDYRFCVQSETL-ZHALLVOQSA-N 1 0 317.473 4.200 20 10 DICDRO CCOc1ccc(N2CC[NH+]([C@H]3C=CCCCCC3)CC2)cc1 ZINC001559667053 1059496172 /nfs/dbraw/zinc/49/61/72/1059496172.db2.gz JHQOZFCYEUZQFI-SFHVURJKSA-N 1 0 314.473 4.096 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)CC[C@H]2CCC[C@@H](C)C2)cc1 ZINC001559966973 1059776261 /nfs/dbraw/zinc/77/62/61/1059776261.db2.gz PWGRNLFVJXYTSB-QZTJIDSGSA-N 1 0 318.505 4.280 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@]2(C)C2CCCCC2)c1O ZINC001560096102 1059905848 /nfs/dbraw/zinc/90/58/48/1059905848.db2.gz LXIRUPBGGIQQHH-IBGZPJMESA-N 1 0 319.420 4.279 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cnc3ccccc3c1Cl)CC2 ZINC001248814120 1059991629 /nfs/dbraw/zinc/99/16/29/1059991629.db2.gz ZGWCVYJOOPAUEP-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO CC(=O)C1CC[NH+](Cc2cc(Cl)c(C(C)(C)C)cc2O)CC1 ZINC001248883992 1060037722 /nfs/dbraw/zinc/03/77/22/1060037722.db2.gz VNOHVPDCJHSUFD-UHFFFAOYSA-N 1 0 323.864 4.144 20 10 DICDRO CC(=O)[C@H]1CCC[N@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001248883741 1060038192 /nfs/dbraw/zinc/03/81/92/1060038192.db2.gz PIAQEDNEFJBGSK-ZDUSSCGKSA-N 1 0 323.864 4.144 20 10 DICDRO CCCc1ccccc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560283181 1060060378 /nfs/dbraw/zinc/06/03/78/1060060378.db2.gz BJRCKTWXUXCSSS-UHFFFAOYSA-N 1 0 323.484 4.003 20 10 DICDRO C[NH2+][C@H](c1nc(-c2ccc(-n3c(C)ccc3C)cc2)no1)C(C)C ZINC001249000630 1060106920 /nfs/dbraw/zinc/10/69/20/1060106920.db2.gz ZSXQCILIUSNLAW-KRWDZBQOSA-N 1 0 324.428 4.061 20 10 DICDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1c(O)cccc1Br ZINC001560322589 1060109935 /nfs/dbraw/zinc/10/99/35/1060109935.db2.gz LJYZYGAAXZOFOR-QWRGUYRKSA-N 1 0 312.251 4.069 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc(N2CCCC2)cc1)Cc1cccs1 ZINC001560360499 1060148004 /nfs/dbraw/zinc/14/80/04/1060148004.db2.gz PBPDMOZWPLIAPU-MRXNPFEDSA-N 1 0 314.498 4.317 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001560379996 1060167794 /nfs/dbraw/zinc/16/77/94/1060167794.db2.gz MPLSXOVLHVRSOW-HXUWFJFHSA-N 1 0 322.452 4.073 20 10 DICDRO Fc1cccc([C@@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)c1 ZINC001560463239 1060255894 /nfs/dbraw/zinc/25/58/94/1060255894.db2.gz KOOAIDFZLHMSDZ-VQIMIIECSA-N 1 0 311.400 4.187 20 10 DICDRO COc1cc(C[NH2+][C@@H]2CC3CCC2CC3)c(O)c(C(C)(C)C)c1 ZINC001560482746 1060271312 /nfs/dbraw/zinc/27/13/12/1060271312.db2.gz ZXVGXJKMJOUDAH-WTNGLUPJSA-N 1 0 317.473 4.367 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cc(F)cc3cc[nH]c32)cc1 ZINC001249525821 1060277922 /nfs/dbraw/zinc/27/79/22/1060277922.db2.gz DHVKLRCXGSVIQF-UHFFFAOYSA-N 1 0 311.404 4.005 20 10 DICDRO COc1ccc(N2CC[C@@H](C[NH2+][C@@H]3CCCC(C)(C)C3)C2)cc1 ZINC001560512302 1060309685 /nfs/dbraw/zinc/30/96/85/1060309685.db2.gz QKKRPOYQCJZTNC-DLBZAZTESA-N 1 0 316.489 4.080 20 10 DICDRO COc1cc(C[NH2+][C@H]2CCC[C@H](F)C2)c(O)c(C(C)(C)C)c1 ZINC001560516049 1060314197 /nfs/dbraw/zinc/31/41/97/1060314197.db2.gz RILDIDHXUUJEHW-KBPBESRZSA-N 1 0 309.425 4.069 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccc(C)c(C)c2)cc1 ZINC001560527174 1060326109 /nfs/dbraw/zinc/32/61/09/1060326109.db2.gz XULVPKFRCPEMTR-UHFFFAOYSA-N 1 0 310.485 4.482 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2(O)CCC(C)(C)CC2)cc1C ZINC001560543314 1060350931 /nfs/dbraw/zinc/35/09/31/1060350931.db2.gz OPJPGBHPTDCGGS-UHFFFAOYSA-N 1 0 319.489 4.205 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)cc1 ZINC001560568592 1060378322 /nfs/dbraw/zinc/37/83/22/1060378322.db2.gz UBUQZFBLGVZYKS-JVRGAZCGSA-N 1 0 324.443 4.381 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCSC(C)(C)C2)cc1 ZINC001560602480 1060417465 /nfs/dbraw/zinc/41/74/65/1060417465.db2.gz RKBBYAFEPOOMCX-KJPDOMRESA-N 1 0 304.503 4.030 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCc3ccccc3[C@H]2C)cc1Cl ZINC001560628679 1060440352 /nfs/dbraw/zinc/44/03/52/1060440352.db2.gz YUFKDVUJOQCSAG-CYBMUJFWSA-N 1 0 301.817 4.473 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)c1O ZINC001560639987 1060455845 /nfs/dbraw/zinc/45/58/45/1060455845.db2.gz IMWIRWXHRVEJOF-MRXNPFEDSA-N 1 0 315.413 4.420 20 10 DICDRO CC[C@@]1(C)CCC[N@H+](Cc2c(O)cccc2Br)C1 ZINC001560644502 1060468473 /nfs/dbraw/zinc/46/84/73/1060468473.db2.gz BJQUWACOKNTSID-HNNXBMFYSA-N 1 0 312.251 4.167 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1 ZINC001560662044 1060488038 /nfs/dbraw/zinc/48/80/38/1060488038.db2.gz OHOGHWMAFKIWPJ-ZYHOBAKYSA-N 1 0 316.514 4.126 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC001560661378 1060488327 /nfs/dbraw/zinc/48/83/27/1060488327.db2.gz BVTFACABXDTDJR-QGZVFWFLSA-N 1 0 316.832 4.122 20 10 DICDRO Cc1cccc(OCC[N@@H+](C)Cc2cc(C(C)C)ccc2O)c1 ZINC001560680347 1060521579 /nfs/dbraw/zinc/52/15/79/1060521579.db2.gz WASFNFWHOYODRF-UHFFFAOYSA-N 1 0 313.441 4.335 20 10 DICDRO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(C(C)C)ccc2O)on1 ZINC001560693673 1060545706 /nfs/dbraw/zinc/54/57/06/1060545706.db2.gz FHMCBDIEMRWMCJ-INIZCTEOSA-N 1 0 300.402 4.149 20 10 DICDRO CC(C)(C)[N@H+](Cc1ccc(F)cc1)Cc1cccc(F)c1[O-] ZINC001560700224 1060553516 /nfs/dbraw/zinc/55/35/16/1060553516.db2.gz ORHMEOJXLCTWHH-UHFFFAOYSA-N 1 0 305.368 4.471 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2cc(Cl)cc(F)c2[O-])cc1C ZINC001560700176 1060554859 /nfs/dbraw/zinc/55/48/59/1060554859.db2.gz NMQCBFGGFFMCLG-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO Oc1ccc(C[N@H+](Cc2ccccc2O)C2CCCC2)cc1F ZINC001560702409 1060557623 /nfs/dbraw/zinc/55/76/23/1060557623.db2.gz RRLGVXFHWKCIEI-UHFFFAOYSA-N 1 0 315.388 4.182 20 10 DICDRO CO[C@@H](CC(C)C)C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC001560702636 1060558449 /nfs/dbraw/zinc/55/84/49/1060558449.db2.gz YXHWDEYEQFECLM-SFHVURJKSA-N 1 0 305.462 4.198 20 10 DICDRO C[C@@H]1C[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@H]2CCCC[C@@H]12 ZINC001560705678 1060560655 /nfs/dbraw/zinc/56/06/55/1060560655.db2.gz ORUCOUQPMSMLPZ-IFIJOSMWSA-N 1 0 308.416 4.041 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC001560728624 1060595335 /nfs/dbraw/zinc/59/53/35/1060595335.db2.gz ZIXFBXRJXLKTQJ-RWKBYAJOSA-N 1 0 320.480 4.473 20 10 DICDRO CCC1(CC)C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC001560734263 1060603889 /nfs/dbraw/zinc/60/38/89/1060603889.db2.gz GLCYDHRNLLLHSJ-FPLPWBNLSA-N 1 0 318.530 4.373 20 10 DICDRO CC1=CCC[C@H](C)[C@H]1CN(C)c1ccc(OCC[NH+](C)C)cc1 ZINC001560738779 1060607468 /nfs/dbraw/zinc/60/74/68/1060607468.db2.gz WOEVBJHJNLLUBI-PXNSSMCTSA-N 1 0 316.489 4.056 20 10 DICDRO CC1=CCC[C@H](C)[C@@H]1CN(C)c1ccc(OCC[NH+](C)C)cc1 ZINC001560738778 1060608317 /nfs/dbraw/zinc/60/83/17/1060608317.db2.gz WOEVBJHJNLLUBI-FXAWDEMLSA-N 1 0 316.489 4.056 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2c(O)cccc2Br)CC12CCC2 ZINC001560744613 1060610693 /nfs/dbraw/zinc/61/06/93/1060610693.db2.gz SOXDKMULSSPOKP-GFCCVEGCSA-N 1 0 324.262 4.167 20 10 DICDRO Cc1cc(C[N@H+]2CCC[C@H]2C(C)C)c(O)cc1Br ZINC001250132622 1060634632 /nfs/dbraw/zinc/63/46/32/1060634632.db2.gz AXLUHIYGSWNTHQ-AWEZNQCLSA-N 1 0 312.251 4.084 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@H](C)[C@@H]2C)c1O ZINC001560786825 1060649359 /nfs/dbraw/zinc/64/93/59/1060649359.db2.gz CFBUJOPDMVSYBS-AVGNSLFASA-N 1 0 311.853 4.216 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(C3(C)CC3)CC2)c(C(F)(F)F)c1 ZINC001560831887 1060689626 /nfs/dbraw/zinc/68/96/26/1060689626.db2.gz VSTPGGNEPFUCJX-UHFFFAOYSA-N 1 0 312.379 4.194 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@H]1CCCc2c(F)cc(F)cc21 ZINC001560856611 1060715179 /nfs/dbraw/zinc/71/51/79/1060715179.db2.gz PCUAAHOMDCEFNF-INIZCTEOSA-N 1 0 323.770 4.491 20 10 DICDRO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001560888441 1060751844 /nfs/dbraw/zinc/75/18/44/1060751844.db2.gz DSUAWBNPJAIPHX-GFCCVEGCSA-N 1 0 314.395 4.392 20 10 DICDRO CC1=Nc2ccccc2C12CC[NH+](Cc1ccc(C)cc1O)CC2 ZINC001560911095 1060772465 /nfs/dbraw/zinc/77/24/65/1060772465.db2.gz ROFXYIJVFYISHW-UHFFFAOYSA-N 1 0 320.436 4.340 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cnc(-c2ccco2)s1 ZINC001560913562 1060773254 /nfs/dbraw/zinc/77/32/54/1060773254.db2.gz NPMWYDYQSXTNHW-UHFFFAOYSA-N 1 0 320.801 4.052 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1Cc1ccccc1F ZINC001560920299 1060783120 /nfs/dbraw/zinc/78/31/20/1060783120.db2.gz AZPAPKGLMHOTBO-QGZVFWFLSA-N 1 0 317.379 4.268 20 10 DICDRO CCC1(CC)CCC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001560931017 1060795635 /nfs/dbraw/zinc/79/56/35/1060795635.db2.gz VKQWBAQMSSHDCM-UHFFFAOYSA-N 1 0 310.432 4.433 20 10 DICDRO Cc1oc(-c2cccs2)nc1C[NH2+]Cc1cc(C)ccc1O ZINC001560937990 1060802107 /nfs/dbraw/zinc/80/21/07/1060802107.db2.gz RZCXKKQUCXUALG-UHFFFAOYSA-N 1 0 314.410 4.015 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccc2c(c1)CCCO2 ZINC001560940171 1060803130 /nfs/dbraw/zinc/80/31/30/1060803130.db2.gz FCXQEGRLIZLYIC-MRXNPFEDSA-N 1 0 324.468 4.237 20 10 DICDRO CN(C)c1cc(F)c(C[N@H+](CCC2CC2)CC2CC2)cc1F ZINC001560944148 1060811185 /nfs/dbraw/zinc/81/11/85/1060811185.db2.gz LVHMCSLXUWSEDU-UHFFFAOYSA-N 1 0 308.416 4.043 20 10 DICDRO Cc1cc(C[NH2+]C[C@@]2(C)CCCCO2)c(C)n1-c1ccccc1 ZINC001560965154 1060829224 /nfs/dbraw/zinc/82/92/24/1060829224.db2.gz KXFSSZWHXJNCBF-HXUWFJFHSA-N 1 0 312.457 4.143 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2cc3cnccc3o2)cc1Cl ZINC001560982168 1060846113 /nfs/dbraw/zinc/84/61/13/1060846113.db2.gz YPYDYGLRNJWPBR-LLVKDONJSA-N 1 0 316.788 4.346 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C(C)C)ccc1O)[C@@H](O)c1ccccc1 ZINC001560998989 1060858446 /nfs/dbraw/zinc/85/84/46/1060858446.db2.gz LBNRABWAJPPBSL-ICSRJNTNSA-N 1 0 313.441 4.117 20 10 DICDRO COc1cc(C)c(C[NH2+]CCC2CCC(F)(F)CC2)c(O)c1 ZINC001561042730 1060893015 /nfs/dbraw/zinc/89/30/15/1060893015.db2.gz IAVKJWLIUBHLKQ-UHFFFAOYSA-N 1 0 313.388 4.014 20 10 DICDRO CC(C)(C)[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CCO1 ZINC001561052168 1060902140 /nfs/dbraw/zinc/90/21/40/1060902140.db2.gz TYSPGJNPICBXQB-GOSISDBHSA-N 1 0 313.441 4.182 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)Cc2cc(F)cc(F)c2)c1 ZINC001462187891 1061008519 /nfs/dbraw/zinc/00/85/19/1061008519.db2.gz IVWZGWXCHBVQBW-UHFFFAOYSA-N 1 0 305.368 4.426 20 10 DICDRO CC[C@H](CCc1ccccc1)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC001462211081 1061028721 /nfs/dbraw/zinc/02/87/21/1061028721.db2.gz UFURFUJTUQEHMO-DOTOQJQBSA-N 1 0 313.441 4.463 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2O)c2ccccc2O1 ZINC001462256066 1061058192 /nfs/dbraw/zinc/05/81/92/1061058192.db2.gz AGHNFTUVCKZPLY-IAQYHMDHSA-N 1 0 303.789 4.048 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccccc2)c1O ZINC001462292939 1061084224 /nfs/dbraw/zinc/08/42/24/1061084224.db2.gz JRCHAMYSKIGNOU-HXUWFJFHSA-N 1 0 323.436 4.436 20 10 DICDRO CCc1cccc(C[NH2+]Cc2nc(-c3ccccc3)cs2)c1O ZINC001462304111 1061092085 /nfs/dbraw/zinc/09/20/85/1061092085.db2.gz HYVVAXVENBVJCE-UHFFFAOYSA-N 1 0 324.449 4.368 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@@H](C)CC(C)(C)C)c1O ZINC001462314719 1061101068 /nfs/dbraw/zinc/10/10/68/1061101068.db2.gz KRRRJMHKUDDNOM-NSHDSACASA-N 1 0 314.267 4.377 20 10 DICDRO COc1cc(C)c(C[NH2+]Cc2ccc(C3CC3)cc2F)c(O)c1 ZINC001462318044 1061103023 /nfs/dbraw/zinc/10/30/23/1061103023.db2.gz MEXXWKASDZIJIR-UHFFFAOYSA-N 1 0 315.388 4.016 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+][C@@H](C)CC3CCCC3)C2)cc1 ZINC001462374731 1061135598 /nfs/dbraw/zinc/13/55/98/1061135598.db2.gz NTHAWJFFMODNRM-FUHWJXTLSA-N 1 0 316.489 4.080 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC(C)(C)C[C@H]2c2ccccc2)c1 ZINC001462375968 1061135901 /nfs/dbraw/zinc/13/59/01/1061135901.db2.gz PRDXFNWERWKLQD-SFHVURJKSA-N 1 0 311.425 4.374 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCSC[C@@H]2C2CCC2)c1 ZINC001462380537 1061138152 /nfs/dbraw/zinc/13/81/52/1061138152.db2.gz ADJXBSIAYPMXAX-QGZVFWFLSA-N 1 0 305.487 4.233 20 10 DICDRO Cc1cc(CC[NH2+][C@@H](C)c2ccccn2)c(C)n1-c1ccccc1 ZINC001462480427 1061202239 /nfs/dbraw/zinc/20/22/39/1061202239.db2.gz RFYOJTLLAREBBT-KRWDZBQOSA-N 1 0 319.452 4.382 20 10 DICDRO Cc1cc(C[NH2+][C@H]2CCc3cccnc32)c(C)n1-c1ccccc1 ZINC001462505593 1061215579 /nfs/dbraw/zinc/21/55/79/1061215579.db2.gz IWPIMWVNVTXTAZ-FQEVSTJZSA-N 1 0 317.436 4.266 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](C(C)(C)C)C[C@@H]2C)c1O ZINC001473520614 1061216588 /nfs/dbraw/zinc/21/65/88/1061216588.db2.gz YQNDJTSJLSJJKV-WFASDCNBSA-N 1 0 321.436 4.381 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](C(C)(C)C)C[C@H]2C)c1O ZINC001473520612 1061218641 /nfs/dbraw/zinc/21/86/41/1061218641.db2.gz YQNDJTSJLSJJKV-IUODEOHRSA-N 1 0 321.436 4.381 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C2(c3cccc(F)c3)CCC2)cc1 ZINC001473577261 1061268942 /nfs/dbraw/zinc/26/89/42/1061268942.db2.gz QZJYFUKZIFSGOM-UHFFFAOYSA-N 1 0 312.432 4.451 20 10 DICDRO C[C@@H]1CC=CC[C@H]1[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001462653346 1061320706 /nfs/dbraw/zinc/32/07/06/1061320706.db2.gz LKBZYKDVECKXFC-MLGOLLRUSA-N 1 0 312.379 4.216 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCO[C@@H](c2ccccc2)CC1 ZINC001462679052 1061333204 /nfs/dbraw/zinc/33/32/04/1061333204.db2.gz RUFCTYBENMASAP-GOSISDBHSA-N 1 0 317.816 4.009 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@@H](C3CCCC3)C2)c(O)c1 ZINC001462679156 1061333619 /nfs/dbraw/zinc/33/36/19/1061333619.db2.gz TWCBQPMRCRLOJD-MRXNPFEDSA-N 1 0 303.446 4.111 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)cc1 ZINC001473738525 1061384441 /nfs/dbraw/zinc/38/44/41/1061384441.db2.gz TXRLWVKAWKFQCB-HZPDHXFCSA-N 1 0 312.379 4.129 20 10 DICDRO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001473781466 1061405325 /nfs/dbraw/zinc/40/53/25/1061405325.db2.gz YEIVMRMCFMHOSS-HNNXBMFYSA-N 1 0 300.421 4.359 20 10 DICDRO Cc1cccc(OC[C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001251726864 1061461633 /nfs/dbraw/zinc/46/16/33/1061461633.db2.gz LNXVVSUXPXBDCW-SFHVURJKSA-N 1 0 324.468 4.152 20 10 DICDRO CN1CCCc2cc(C[NH2+]C/C=C\c3ccc(F)cc3)ccc21 ZINC001473963823 1061505884 /nfs/dbraw/zinc/50/58/84/1061505884.db2.gz SXFXHIQQNMGKJL-RQOWECAXSA-N 1 0 310.416 4.011 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CCc2nccs2)cc1 ZINC001473968047 1061510755 /nfs/dbraw/zinc/51/07/55/1061510755.db2.gz IIISNBZWDKVGTJ-UHFFFAOYSA-N 1 0 317.502 4.102 20 10 DICDRO CCC[C@H]1CCCC[C@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001473978962 1061521402 /nfs/dbraw/zinc/52/14/02/1061521402.db2.gz UKAPKSNANKNPNS-SUMWQHHRSA-N 1 0 310.432 4.479 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]CC2CCC2)cc1 ZINC001473977924 1061522264 /nfs/dbraw/zinc/52/22/64/1061522264.db2.gz XNINHHWETXOJJS-UHFFFAOYSA-N 1 0 300.471 4.274 20 10 DICDRO Fc1ccc(Cl)cc1C[NH2+]CCCSc1nccs1 ZINC001474018499 1061558741 /nfs/dbraw/zinc/55/87/41/1061558741.db2.gz QUSHDAYLLSGXAZ-UHFFFAOYSA-N 1 0 316.854 4.208 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H](C)Oc2ccc(Cl)cc2)cc1C ZINC001474021875 1061561949 /nfs/dbraw/zinc/56/19/49/1061561949.db2.gz GGMDMPIAGWZGMG-CQSZACIVSA-N 1 0 319.832 4.214 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)c(C)c1 ZINC001474043558 1061588370 /nfs/dbraw/zinc/58/83/70/1061588370.db2.gz LRKHRFYMESFBKP-UHFFFAOYSA-N 1 0 324.468 4.284 20 10 DICDRO COc1cc(CNc2cc(C)cc(C)[nH+]2)c(O)c(C(C)(C)C)c1 ZINC001474077685 1061623653 /nfs/dbraw/zinc/62/36/53/1061623653.db2.gz KPIJOKCMZWFFSW-UHFFFAOYSA-N 1 0 314.429 4.322 20 10 DICDRO CC(C)C[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC001474080788 1061627782 /nfs/dbraw/zinc/62/77/82/1061627782.db2.gz FXODQTRKDLZCGK-HNNXBMFYSA-N 1 0 319.449 4.109 20 10 DICDRO CSCCCCCC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001474110043 1061658835 /nfs/dbraw/zinc/65/88/35/1061658835.db2.gz ZJXMDNUNTNRVGT-UHFFFAOYSA-N 1 0 316.461 4.044 20 10 DICDRO CCOCc1cc(C[NH2+][C@@]2(C)CCCC[C@H]2C)ccc1OC ZINC001474169225 1061716323 /nfs/dbraw/zinc/71/63/23/1061716323.db2.gz AJNDJTBMBCMRQH-BEFAXECRSA-N 1 0 305.462 4.290 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@H](OC(C)(C)C)C2)cc1F ZINC001474194951 1061745978 /nfs/dbraw/zinc/74/59/78/1061745978.db2.gz GVQLFWRGLJGUCJ-WKILWMFISA-N 1 0 322.468 4.108 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]Cc2ccc3occc3c2)cc1F ZINC001474204311 1061757575 /nfs/dbraw/zinc/75/75/75/1061757575.db2.gz FYEHFRIZCIWLNN-UHFFFAOYSA-N 1 0 316.351 4.067 20 10 DICDRO CC[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001474205720 1061761310 /nfs/dbraw/zinc/76/13/10/1061761310.db2.gz KPONHMWYGMXKRC-IBGZPJMESA-N 1 0 313.416 4.262 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H]2[C@@H](c3ccccc3)C2(F)F)cc1C ZINC001474259285 1061826495 /nfs/dbraw/zinc/82/64/95/1061826495.db2.gz DJONOARYSPUNOR-SJLPKXTDSA-N 1 0 317.379 4.142 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)CCc2ccc(F)cc2Cl)cc1 ZINC001474307101 1061874159 /nfs/dbraw/zinc/87/41/59/1061874159.db2.gz CEQKMMSCDXQFND-UHFFFAOYSA-N 1 0 320.839 4.220 20 10 DICDRO CCC1(CC)[C@H](OC)C[C@@H]1[N@H+](C)Cc1ccc(Cl)cc1O ZINC001474320961 1061895637 /nfs/dbraw/zinc/89/56/37/1061895637.db2.gz VJMIOMBRRYHKHE-JKSUJKDBSA-N 1 0 311.853 4.071 20 10 DICDRO CCC1(CC)[C@H]([N@H+](C)Cc2ccc(Cl)cc2O)C[C@@H]1OC ZINC001474320958 1061897076 /nfs/dbraw/zinc/89/70/76/1061897076.db2.gz VJMIOMBRRYHKHE-CVEARBPZSA-N 1 0 311.853 4.071 20 10 DICDRO CO[C@@]1(C)C[C@H]([N@H+](C)Cc2ccc3ccccc3c2O)C1(C)C ZINC001474327257 1061913518 /nfs/dbraw/zinc/91/35/18/1061913518.db2.gz QFAJYUCOWSDQTE-PXNSSMCTSA-N 1 0 313.441 4.181 20 10 DICDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2O)n1 ZINC001474327462 1061914194 /nfs/dbraw/zinc/91/41/94/1061914194.db2.gz DQSSESGKHGENMU-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+](C)[C@@H](C)C2(C)CC2)c1O ZINC001474330492 1061918358 /nfs/dbraw/zinc/91/83/58/1061918358.db2.gz XPXLRJVTWUWXIG-NSHDSACASA-N 1 0 312.251 4.084 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CC(C)(C)[C@@H]2c2ccccc2)c(O)c1 ZINC001474341063 1061939702 /nfs/dbraw/zinc/93/97/02/1061939702.db2.gz IOUBPTKFWFGVOO-IBGZPJMESA-N 1 0 311.425 4.292 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC001474344561 1061945269 /nfs/dbraw/zinc/94/52/69/1061945269.db2.gz NXVMQPFPFAKPHI-HXUWFJFHSA-N 1 0 323.484 4.138 20 10 DICDRO CC(C)c1ocnc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC001254069899 1062019865 /nfs/dbraw/zinc/01/98/65/1062019865.db2.gz IADKTRWSZDLPQS-UHFFFAOYSA-N 1 0 314.429 4.448 20 10 DICDRO COc1ccc(O)c(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)c1 ZINC001474384032 1062032451 /nfs/dbraw/zinc/03/24/51/1062032451.db2.gz KWOGLQOTRGLZLN-UHFFFAOYSA-N 1 0 317.404 4.341 20 10 DICDRO COC1CCC(C[N@H+](Cc2ccccc2O)C2CCCC2)CC1 ZINC001474386275 1062034289 /nfs/dbraw/zinc/03/42/89/1062034289.db2.gz NIVVTUPPSPHXMJ-UHFFFAOYSA-N 1 0 317.473 4.342 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1O ZINC001474420181 1062089888 /nfs/dbraw/zinc/08/98/88/1062089888.db2.gz PBYGGEDDZFREBX-LLVKDONJSA-N 1 0 321.852 4.156 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)c1O ZINC001474429216 1062103146 /nfs/dbraw/zinc/10/31/46/1062103146.db2.gz FJZTVCJWAIMNGY-GFCCVEGCSA-N 1 0 309.837 4.066 20 10 DICDRO Cc1ccc([C@H]2CC[N@@H+](Cc3ccc(N(C)C)cc3C)C2)cc1 ZINC001474438140 1062114362 /nfs/dbraw/zinc/11/43/62/1062114362.db2.gz DAJFEEFIUPJKDS-FQEVSTJZSA-N 1 0 308.469 4.359 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cccc3cc[nH]c32)cc1Cl ZINC001474446731 1062126804 /nfs/dbraw/zinc/12/68/04/1062126804.db2.gz VUIQGYBPDXESNG-UHFFFAOYSA-N 1 0 300.789 4.125 20 10 DICDRO COc1cc(C[N@@H+]2CCCCC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001474458565 1062137390 /nfs/dbraw/zinc/13/73/90/1062137390.db2.gz YNWPHQYNSGQNGP-AWEZNQCLSA-N 1 0 305.462 4.463 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](C(C)C)CC2)c(O)c1OC ZINC001474461837 1062140546 /nfs/dbraw/zinc/14/05/46/1062140546.db2.gz WJHFUINJROZKCZ-GDBMZVCRSA-N 1 0 321.461 4.104 20 10 DICDRO Oc1ccccc1C[N@H+](CC=C(Cl)Cl)C1CCCC1 ZINC001459467495 1062154657 /nfs/dbraw/zinc/15/46/57/1062154657.db2.gz MSDCAQLITDDTEB-UHFFFAOYSA-N 1 0 300.229 4.456 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC001474476911 1062157631 /nfs/dbraw/zinc/15/76/31/1062157631.db2.gz KIRRYIUPQTXKJX-HMECNJMJSA-N 1 0 324.443 4.394 20 10 DICDRO COc1ccc(O)c(C[NH2+]CC[C@H]2C[C@H](C)CC(C)(C)C2)c1 ZINC001474484027 1062163720 /nfs/dbraw/zinc/16/37/20/1062163720.db2.gz MECPCIMOAXBGCI-GJZGRUSLSA-N 1 0 305.462 4.343 20 10 DICDRO COc1cc(C)c(C[N@H+](C)Cc2ccccc2SC)c(O)c1 ZINC001474490356 1062169333 /nfs/dbraw/zinc/16/93/33/1062169333.db2.gz YBRDUVAERUELHD-UHFFFAOYSA-N 1 0 317.454 4.063 20 10 DICDRO CN(C)c1ccc(C[N@@H+](Cc2ccc(F)cc2)CC2CC2)cc1 ZINC001459503494 1062170430 /nfs/dbraw/zinc/17/04/30/1062170430.db2.gz PTOIXJSXMHVKGH-UHFFFAOYSA-N 1 0 312.432 4.304 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cc1 ZINC001459518608 1062178652 /nfs/dbraw/zinc/17/86/52/1062178652.db2.gz VUIRYDRTTGZZNM-IBGZPJMESA-N 1 0 316.395 4.368 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(C(C)C)cc2)c1 ZINC001474505073 1062186500 /nfs/dbraw/zinc/18/65/00/1062186500.db2.gz NGCVUHDUARYWMS-OAHLLOKOSA-N 1 0 313.441 4.418 20 10 DICDRO CSc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)o1 ZINC001474506321 1062188934 /nfs/dbraw/zinc/18/89/34/1062188934.db2.gz UCXOTGOQOTUKQC-UHFFFAOYSA-N 1 0 316.470 4.234 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC(C)(C)OC1(C)C ZINC001459553967 1062203906 /nfs/dbraw/zinc/20/39/06/1062203906.db2.gz IJOXPYWFDOZHJL-INIZCTEOSA-N 1 0 305.462 4.198 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCC2(CCC2)O1 ZINC001459558549 1062207441 /nfs/dbraw/zinc/20/74/41/1062207441.db2.gz WNBAWDSRVRWGDV-KRWDZBQOSA-N 1 0 303.446 4.096 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2Cc3cccc(C)c3CC2(C)C)c1 ZINC001474537402 1062226552 /nfs/dbraw/zinc/22/65/52/1062226552.db2.gz LIUVTLDCIWHADL-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO C[C@@H](COc1ccccc1F)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC001254721285 1062238730 /nfs/dbraw/zinc/23/87/30/1062238730.db2.gz ONGXLOJOEHNHBG-RYUDHWBXSA-N 1 0 323.795 4.303 20 10 DICDRO COC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)c1ccc(C)o1 ZINC001254721952 1062241609 /nfs/dbraw/zinc/24/16/09/1062241609.db2.gz XBRISWFGCYHALY-YUELXQCFSA-N 1 0 315.413 4.128 20 10 DICDRO Oc1cc(F)c(Cl)cc1CNc1cc2c(c[nH+]1)CCCC2 ZINC001474546814 1062243955 /nfs/dbraw/zinc/24/39/55/1062243955.db2.gz PVPKGPSKUFKHED-UHFFFAOYSA-N 1 0 306.768 4.071 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2CCCc3ccc(C)cc32)c1O ZINC001474556240 1062259015 /nfs/dbraw/zinc/25/90/15/1062259015.db2.gz DPXNPWDOWYZBFQ-SFHVURJKSA-N 1 0 311.425 4.185 20 10 DICDRO COc1cc(C[NH+]2CC(C3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC001474570019 1062275078 /nfs/dbraw/zinc/27/50/78/1062275078.db2.gz TUBFJVLDTUMKSU-UHFFFAOYSA-N 1 0 317.473 4.320 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CC3(CCCC3)[C@@H]2C(C)C)c(O)c1 ZINC001474578336 1062286944 /nfs/dbraw/zinc/28/69/44/1062286944.db2.gz TXEPGNVLYOOAHC-SFHVURJKSA-N 1 0 303.446 4.110 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)C2CC(OC(C)(C)C)C2)cc1Cl ZINC001474586841 1062298034 /nfs/dbraw/zinc/29/80/34/1062298034.db2.gz VRJRQZSDLNBFTK-UHFFFAOYSA-N 1 0 311.853 4.132 20 10 DICDRO CC(C)[C@@H]1[N@H+](Cc2c([O-])ccc(Cl)c2F)CC12CC=CC2 ZINC001474610344 1062324610 /nfs/dbraw/zinc/32/46/10/1062324610.db2.gz YDKCZMQJDGPYMF-INIZCTEOSA-N 1 0 309.812 4.361 20 10 DICDRO CC[N@H+](CCC[NH2+]Cc1ccc(Cl)cc1[O-])C1CCCCC1 ZINC001474615143 1062333885 /nfs/dbraw/zinc/33/38/85/1062333885.db2.gz OKNGQZMBVOXITN-UHFFFAOYSA-N 1 0 324.896 4.180 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC2C[C@@H](C)C[C@H](C)C2)c1O ZINC001474621901 1062343057 /nfs/dbraw/zinc/34/30/57/1062343057.db2.gz KTJJGOPSGOUJDY-RYUDHWBXSA-N 1 0 311.853 4.216 20 10 DICDRO CN(C)c1cc(F)c(C[NH+]2CCC(C3CCC3)CC2)cc1F ZINC001474621859 1062343850 /nfs/dbraw/zinc/34/38/50/1062343850.db2.gz LSWWUKZIJWFADQ-UHFFFAOYSA-N 1 0 308.416 4.043 20 10 DICDRO Oc1ccccc1C[N@H+](CCCC1CCCC1)C[C@H]1CCCO1 ZINC001459736593 1062352441 /nfs/dbraw/zinc/35/24/41/1062352441.db2.gz WCWUBRIUOKQCRX-LJQANCHMSA-N 1 0 317.473 4.344 20 10 DICDRO CC(C)CC1([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC001474638899 1062364641 /nfs/dbraw/zinc/36/46/41/1062364641.db2.gz QNKLXTBVYGXPKK-UHFFFAOYSA-N 1 0 314.395 4.440 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CSC[C@@H]2C)c(C)n1-c1cccc(C)c1 ZINC001474662548 1062393346 /nfs/dbraw/zinc/39/33/46/1062393346.db2.gz CMNVXDCGKDFJSD-IFXJQAMLSA-N 1 0 314.498 4.244 20 10 DICDRO CCC(C)(C)CC[NH2+]Cc1cc(Br)cc(C)c1O ZINC001474663479 1062395683 /nfs/dbraw/zinc/39/56/83/1062395683.db2.gz LIWIFQGASPCXOJ-UHFFFAOYSA-N 1 0 314.267 4.379 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@@]2(O)CCCC(C)(C)CC2)c1 ZINC001474664436 1062395877 /nfs/dbraw/zinc/39/58/77/1062395877.db2.gz YDVXFAQZYGZQEU-HXUWFJFHSA-N 1 0 319.489 4.327 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H]2CCCC[C@H]2C(C)(C)C)c1O ZINC001459790411 1062402544 /nfs/dbraw/zinc/40/25/44/1062402544.db2.gz DNENQBFYKHLYKV-SJORKVTESA-N 1 0 321.436 4.428 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc(-c3ccc(F)cc3)o1)C2 ZINC001474677267 1062408002 /nfs/dbraw/zinc/40/80/02/1062408002.db2.gz ICVRJDYJLKLMDJ-UHFFFAOYSA-N 1 0 309.340 4.307 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1O ZINC001474701614 1062429654 /nfs/dbraw/zinc/42/96/54/1062429654.db2.gz ICTWMNDFUXTVSA-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccc3c(c2)CCO3)cc1Cl ZINC001474727076 1062450537 /nfs/dbraw/zinc/45/05/37/1062450537.db2.gz WYMXUIWPMMJNPZ-GFCCVEGCSA-N 1 0 317.816 4.140 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(C)c(F)c1 ZINC001459877170 1062465695 /nfs/dbraw/zinc/46/56/95/1062465695.db2.gz LDPIARJTRIHCHA-IBGZPJMESA-N 1 0 300.421 4.441 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001255697690 1062524494 /nfs/dbraw/zinc/52/44/94/1062524494.db2.gz SEDWOGHKDWELJA-OLZOCXBDSA-N 1 0 301.352 4.220 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@@H]2CCO[C@H](c3ccccc3)C2)cc1 ZINC001256820931 1063002290 /nfs/dbraw/zinc/00/22/90/1063002290.db2.gz LSDSQDDOYNQBRN-RTWAWAEBSA-N 1 0 324.468 4.105 20 10 DICDRO CC(C)[N@@H+]1CCC[C@H]1c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001256935785 1063055161 /nfs/dbraw/zinc/05/51/61/1063055161.db2.gz SROSNCQDIIRXFZ-KRWDZBQOSA-N 1 0 322.412 4.073 20 10 DICDRO CCN(C)c1ccc(C[N@@H+](Cc2ccccn2)CC(C)C)cc1 ZINC001460834201 1063092064 /nfs/dbraw/zinc/09/20/64/1063092064.db2.gz TYBLNXSIVHOJPV-UHFFFAOYSA-N 1 0 311.473 4.196 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC001461063828 1063227758 /nfs/dbraw/zinc/22/77/58/1063227758.db2.gz KVGBJHKCYNNHNS-UHFFFAOYSA-N 1 0 318.848 4.182 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)Cc1ccccc1F ZINC001461092066 1063246594 /nfs/dbraw/zinc/24/65/94/1063246594.db2.gz AWZULOOBEJEMBH-AWEZNQCLSA-N 1 0 310.416 4.347 20 10 DICDRO CCCC[C@@H](CC)[NH2+]Cc1ccc(Br)cc1O ZINC001257413367 1063260998 /nfs/dbraw/zinc/26/09/98/1063260998.db2.gz VDNNFBXSDMWZNO-CYBMUJFWSA-N 1 0 300.240 4.213 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)c(C)c1 ZINC001461111591 1063262174 /nfs/dbraw/zinc/26/21/74/1063262174.db2.gz HREZYQCHOWDPOB-UHFFFAOYSA-N 1 0 324.468 4.066 20 10 DICDRO COC[C@@H](C)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001461113577 1063262852 /nfs/dbraw/zinc/26/28/52/1063262852.db2.gz VNMGPDNFOQOYBT-AWEZNQCLSA-N 1 0 321.505 4.359 20 10 DICDRO COc1ccc(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCCO2)cc1C ZINC001461118244 1063266961 /nfs/dbraw/zinc/26/69/61/1063266961.db2.gz ZRGANVWIMPXYAZ-PMACEKPBSA-N 1 0 311.425 4.014 20 10 DICDRO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001461118662 1063268018 /nfs/dbraw/zinc/26/80/18/1063268018.db2.gz CUZOEUJNFFQNOY-INIZCTEOSA-N 1 0 309.453 4.468 20 10 DICDRO Fc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001461156294 1063299223 /nfs/dbraw/zinc/29/92/23/1063299223.db2.gz SKEHWJVWKPNVFX-HXUWFJFHSA-N 1 0 310.416 4.203 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cn3cccc(C)c3n2)cc1C ZINC001461232698 1063351969 /nfs/dbraw/zinc/35/19/69/1063351969.db2.gz NMYZXCICLPANDP-UHFFFAOYSA-N 1 0 323.440 4.030 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1CCCSC1 ZINC001257669009 1063362555 /nfs/dbraw/zinc/36/25/55/1063362555.db2.gz YSWYYSWPMAFSDI-CXAGYDPISA-N 1 0 305.487 4.118 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC(C2CC2)C2CC2)cc1F ZINC001461259323 1063371160 /nfs/dbraw/zinc/37/11/60/1063371160.db2.gz MNJVNBRCCIXAFS-UHFFFAOYSA-N 1 0 304.453 4.198 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]CC2(C)CC2)cc1 ZINC001461266174 1063378119 /nfs/dbraw/zinc/37/81/19/1063378119.db2.gz PRYHSCSWKIZEPG-UHFFFAOYSA-N 1 0 300.471 4.274 20 10 DICDRO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC001461271472 1063380242 /nfs/dbraw/zinc/38/02/42/1063380242.db2.gz BXWAHYWRUBGRQC-ZRUQZJFASA-N 1 0 316.395 4.395 20 10 DICDRO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC001461271470 1063381783 /nfs/dbraw/zinc/38/17/83/1063381783.db2.gz BXWAHYWRUBGRQC-ISZGNANSSA-N 1 0 316.395 4.395 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)C[C@@H](O)c1ccccc1 ZINC001461416506 1063486711 /nfs/dbraw/zinc/48/67/11/1063486711.db2.gz XFGDDFDEZFUWLH-YCRPNKLZSA-N 1 0 322.452 4.089 20 10 DICDRO C[C@@H]1CC[C@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001461480982 1063529683 /nfs/dbraw/zinc/52/96/83/1063529683.db2.gz QBMXJULGDZAEBE-OLZOCXBDSA-N 1 0 314.395 4.297 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)cc1F ZINC001461541337 1063568390 /nfs/dbraw/zinc/56/83/90/1063568390.db2.gz RRFKFLRFZPGNHX-CQSZACIVSA-N 1 0 314.395 4.197 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)c(C)s1 ZINC001461586962 1063594909 /nfs/dbraw/zinc/59/49/09/1063594909.db2.gz SVCTWWLEIBZLPJ-CQSZACIVSA-N 1 0 316.514 4.460 20 10 DICDRO Cc1ccc(CC(C)(C)[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001461588689 1063597108 /nfs/dbraw/zinc/59/71/08/1063597108.db2.gz NJMQRROZAKBCNZ-UHFFFAOYSA-N 1 0 309.453 4.431 20 10 DICDRO CSC(C)(C)C[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001258317615 1063608229 /nfs/dbraw/zinc/60/82/29/1063608229.db2.gz ZWNFSFRZANRADI-OAHLLOKOSA-N 1 0 306.519 4.297 20 10 DICDRO CSC(C)(C)C[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001258317612 1063608410 /nfs/dbraw/zinc/60/84/10/1063608410.db2.gz ZWNFSFRZANRADI-HNNXBMFYSA-N 1 0 306.519 4.297 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@@]2(C)C[C@]2(F)Cl)cc1 ZINC001461616568 1063615151 /nfs/dbraw/zinc/61/51/51/1063615151.db2.gz QEULFHXDMRZSFS-DLBZAZTESA-N 1 0 312.860 4.327 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CO1 ZINC001461618348 1063616485 /nfs/dbraw/zinc/61/64/85/1063616485.db2.gz UGFANODBAWFVIR-CJNGLKHVSA-N 1 0 319.489 4.254 20 10 DICDRO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)C12CCC2 ZINC001461643908 1063630540 /nfs/dbraw/zinc/63/05/40/1063630540.db2.gz HSTZWCBDGBQJAJ-JKSUJKDBSA-N 1 0 323.864 4.262 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@@H]1CCCC1(F)F ZINC001461709140 1063672199 /nfs/dbraw/zinc/67/21/99/1063672199.db2.gz KEPRLGWXGAISBN-AWEZNQCLSA-N 1 0 306.400 4.402 20 10 DICDRO COC[C@H](C)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001461712097 1063673940 /nfs/dbraw/zinc/67/39/40/1063673940.db2.gz WIZYVGQWXFCVBF-ZDUSSCGKSA-N 1 0 307.478 4.112 20 10 DICDRO CSC1(C[NH2+]Cc2ccc(N(C)C)c(F)c2)CCCCC1 ZINC001461755813 1063698328 /nfs/dbraw/zinc/69/83/28/1063698328.db2.gz SDFYMKUFNMUZAS-UHFFFAOYSA-N 1 0 310.482 4.047 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCSC(C)(C)C1 ZINC001461784785 1063716133 /nfs/dbraw/zinc/71/61/33/1063716133.db2.gz BJKCWWWIMZJNFG-CQSZACIVSA-N 1 0 302.487 4.251 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](c1ccncc1)C1CC1 ZINC001461808911 1063728761 /nfs/dbraw/zinc/72/87/61/1063728761.db2.gz BYHPKTOQBADQFD-HXUWFJFHSA-N 1 0 305.425 4.123 20 10 DICDRO Cc1cc(O)c(CN2CC=C(C(F)(F)F)CC2)c(Cl)c1 ZINC001461860392 1063753356 /nfs/dbraw/zinc/75/33/56/1063753356.db2.gz BPVAAZGEHMYGNP-UHFFFAOYSA-N 1 0 305.727 4.048 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCCC2)c(Br)c1)C1CC1 ZINC001461867549 1063759933 /nfs/dbraw/zinc/75/99/33/1063759933.db2.gz NKMAIHRHWRZIMZ-UHFFFAOYSA-N 1 0 323.278 4.034 20 10 DICDRO C[C@H]1C[C@H]([N@@H+]2CCCc3cc(O)c(O)cc3C2)CC(C)(C)C1 ZINC001258704784 1063761148 /nfs/dbraw/zinc/76/11/48/1063761148.db2.gz UEPBIXIBSPFPEC-BBRMVZONSA-N 1 0 303.446 4.061 20 10 DICDRO C[C@H]1C[C@@H]([N@@H+]2CCCc3cc(O)c(O)cc3C2)CC(C)(C)C1 ZINC001258704787 1063761762 /nfs/dbraw/zinc/76/17/62/1063761762.db2.gz UEPBIXIBSPFPEC-XJKSGUPXSA-N 1 0 303.446 4.061 20 10 DICDRO CC[C@H]1CC[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC001461887291 1063777539 /nfs/dbraw/zinc/77/75/39/1063777539.db2.gz VCAWSSFDXUVDDP-SFHVURJKSA-N 1 0 320.480 4.481 20 10 DICDRO CC[C@@H]1CC[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC001461887289 1063777579 /nfs/dbraw/zinc/77/75/79/1063777579.db2.gz VCAWSSFDXUVDDP-GOSISDBHSA-N 1 0 320.480 4.481 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC001461926403 1063810484 /nfs/dbraw/zinc/81/04/84/1063810484.db2.gz JLMNVBBFSSYWAR-FXAWDEMLSA-N 1 0 308.469 4.439 20 10 DICDRO CC[C@@H](C)C[C@@H](CC)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258785680 1063824018 /nfs/dbraw/zinc/82/40/18/1063824018.db2.gz WIRDGFUUHXLPKF-SJLPKXTDSA-N 1 0 318.505 4.161 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(C)cc1F ZINC001462025747 1063885362 /nfs/dbraw/zinc/88/53/62/1063885362.db2.gz KVXUGUQNDXWCQE-UHFFFAOYSA-N 1 0 300.421 4.222 20 10 DICDRO COc1ccccc1C[N@H+](Cc1ccc(Cl)cc1O)C1CC1 ZINC001462043198 1063896802 /nfs/dbraw/zinc/89/68/02/1063896802.db2.gz DKNYFUJKLPJDLG-UHFFFAOYSA-N 1 0 317.816 4.219 20 10 DICDRO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N(C)C)cc1C ZINC001462051097 1063901805 /nfs/dbraw/zinc/90/18/05/1063901805.db2.gz NBHCFVFVMVTJLB-FQEVSTJZSA-N 1 0 308.469 4.398 20 10 DICDRO COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2Cc2ccc(C)cc2O)c1 ZINC001462086902 1063922387 /nfs/dbraw/zinc/92/23/87/1063922387.db2.gz KYXTZWFWTQBABC-DNVCBOLYSA-N 1 0 311.425 4.292 20 10 DICDRO Cc1ccc(C[NH2+]C[C@H](c2ccccc2)C(F)(F)F)c(O)c1 ZINC001462107659 1063932378 /nfs/dbraw/zinc/93/23/78/1063932378.db2.gz XATACWRGYPHJFQ-OAHLLOKOSA-N 1 0 309.331 4.136 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](C1CCC1)[C@H]1CCOC1 ZINC001261852404 1063949003 /nfs/dbraw/zinc/94/90/03/1063949003.db2.gz BLFKIHBDCKLKBL-WJCADGGCSA-N 1 0 315.457 4.044 20 10 DICDRO COc1ccccc1C[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000378950060 1063980932 /nfs/dbraw/zinc/98/09/32/1063980932.db2.gz GOYISZSVIXRUQS-KRWDZBQOSA-N 1 0 324.468 4.016 20 10 DICDRO CCOc1cccc(C[NH+]2CCC3(CCCCC3)CC2)c1O ZINC000388653685 1064114069 /nfs/dbraw/zinc/11/40/69/1064114069.db2.gz PILONUBEYMERGI-UHFFFAOYSA-N 1 0 303.446 4.337 20 10 DICDRO COCc1cccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC000390964364 1064175796 /nfs/dbraw/zinc/17/57/96/1064175796.db2.gz MBTBMQWHXFYCPA-YOEHRIQHSA-N 1 0 311.425 4.185 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2Cc2ccc(F)cc2)cc1 ZINC001307425415 1065385878 /nfs/dbraw/zinc/38/58/78/1065385878.db2.gz FLHWKTHRDVCFET-FQEVSTJZSA-N 1 0 312.432 4.099 20 10 DICDRO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001307481076 1065428313 /nfs/dbraw/zinc/42/83/13/1065428313.db2.gz WFKZWTIKJXMCAA-MAUKXSAKSA-N 1 0 312.432 4.270 20 10 DICDRO CC[N@@H+](Cc1cc(Br)ccc1O)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC001307499760 1065444755 /nfs/dbraw/zinc/44/47/55/1065444755.db2.gz OYWHUTSVMRXVBH-CLLJXQQHSA-N 1 0 324.262 4.023 20 10 DICDRO CCOc1ccc(N2CC[NH+](CC3CCCCCC3)CC2)cc1 ZINC001307600242 1065507104 /nfs/dbraw/zinc/50/71/04/1065507104.db2.gz VUBPNQYVBYUUAL-UHFFFAOYSA-N 1 0 316.489 4.178 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCC2(CCC2)O1 ZINC001307722724 1065586511 /nfs/dbraw/zinc/58/65/11/1065586511.db2.gz YJIVASKRNJBVEX-KRWDZBQOSA-N 1 0 303.446 4.096 20 10 DICDRO CCCCOc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001308236146 1065842927 /nfs/dbraw/zinc/84/29/27/1065842927.db2.gz XKIHAHVQFJTYSJ-UHFFFAOYSA-N 1 0 311.425 4.090 20 10 DICDRO C[C@H](C[NH2+]Cc1cc(F)c(N(C)C)cc1F)c1cccc(F)c1 ZINC001308252399 1065856699 /nfs/dbraw/zinc/85/66/99/1065856699.db2.gz XDRMSSNITOMWBY-GFCCVEGCSA-N 1 0 322.374 4.063 20 10 DICDRO Cc1cccc([C@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1C ZINC001308261216 1065864056 /nfs/dbraw/zinc/86/40/56/1065864056.db2.gz PJFJONVGSHEYEC-AWEZNQCLSA-N 1 0 318.411 4.498 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCc3ccccc32)cc1 ZINC001308265793 1065865025 /nfs/dbraw/zinc/86/50/25/1065865025.db2.gz IJFHZGCVRJZVRK-LJQANCHMSA-N 1 0 308.469 4.352 20 10 DICDRO Cc1ccc(O[C@@H](C)C[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001308287210 1065884776 /nfs/dbraw/zinc/88/47/76/1065884776.db2.gz SPLYETLCHJFJSP-XFHJGTJQSA-N 1 0 324.468 4.131 20 10 DICDRO COc1cc(C[NH2+]CC2(C(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC001308297443 1065892410 /nfs/dbraw/zinc/89/24/10/1065892410.db2.gz IHRATIWTCRLRIX-UHFFFAOYSA-N 1 0 305.462 4.224 20 10 DICDRO CC1([NH2+]Cc2ccc(N3CCCCC3)cc2)Cc2ccccc2C1 ZINC001308337131 1065923337 /nfs/dbraw/zinc/92/33/37/1065923337.db2.gz XGYKAHNTRFABDJ-UHFFFAOYSA-N 1 0 320.480 4.324 20 10 DICDRO CCCOc1ccc(C[NH2+]CCC[C@@H]2CCCCO2)cc1C ZINC001308366767 1065943403 /nfs/dbraw/zinc/94/34/03/1065943403.db2.gz RNYIYMYKIAWDIQ-SFHVURJKSA-N 1 0 305.462 4.223 20 10 DICDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001308374564 1065947822 /nfs/dbraw/zinc/94/78/22/1065947822.db2.gz NYQBTBJJZYGGBU-ZDUSSCGKSA-N 1 0 324.337 4.097 20 10 DICDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001308374563 1065948240 /nfs/dbraw/zinc/94/82/40/1065948240.db2.gz NYQBTBJJZYGGBU-CYBMUJFWSA-N 1 0 324.337 4.097 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2CCC[C@@H](C)CC2)ccc1OC ZINC001308375321 1065949436 /nfs/dbraw/zinc/94/94/36/1065949436.db2.gz WTVSCZPXTLJKMD-QAPCUYQASA-N 1 0 305.462 4.290 20 10 DICDRO C[C@H](CC1CCCCC1)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001308387296 1065956386 /nfs/dbraw/zinc/95/63/86/1065956386.db2.gz IVYRYIUVAKPLIT-CYBMUJFWSA-N 1 0 310.432 4.479 20 10 DICDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308394612 1065960232 /nfs/dbraw/zinc/96/02/32/1065960232.db2.gz DIYIUQVDTPSKJI-LBPRGKRZSA-N 1 0 301.352 4.222 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CSC[C@@H]2C)cc1 ZINC001308400744 1065962981 /nfs/dbraw/zinc/96/29/81/1065962981.db2.gz DCCRSTWHXIECIZ-YJBOKZPZSA-N 1 0 306.519 4.154 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CSC[C@@H]2C)cc1 ZINC001308400742 1065964129 /nfs/dbraw/zinc/96/41/29/1065964129.db2.gz DCCRSTWHXIECIZ-MAUKXSAKSA-N 1 0 306.519 4.154 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C2(Cc3ccc(F)cc3)CC2)cc1 ZINC001308403420 1065965120 /nfs/dbraw/zinc/96/51/20/1065965120.db2.gz DGXGLCFLRNWHPD-ARJAWSKDSA-N 1 0 324.443 4.270 20 10 DICDRO C[C@@H](C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)N(C)C ZINC001308406803 1065966624 /nfs/dbraw/zinc/96/66/24/1065966624.db2.gz FNGDVZLXJFIIOW-AWEZNQCLSA-N 1 0 320.521 4.027 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001308440819 1065988758 /nfs/dbraw/zinc/98/87/58/1065988758.db2.gz WWUNPXGAZOGBFU-QGZVFWFLSA-N 1 0 322.496 4.271 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](C)CC(F)(F)F)cc1C ZINC001308439994 1065989628 /nfs/dbraw/zinc/98/96/28/1065989628.db2.gz NVMBQIZDMBRCQX-GFCCVEGCSA-N 1 0 303.368 4.462 20 10 DICDRO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001308444387 1065991689 /nfs/dbraw/zinc/99/16/89/1065991689.db2.gz YXHINEXQACNOJO-NHCUHLMSSA-N 1 0 324.443 4.404 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1Cc2ccccc2[C@@H]1C ZINC001308455456 1065998985 /nfs/dbraw/zinc/99/89/85/1065998985.db2.gz KRINCVUAZJRVEG-IFXJQAMLSA-N 1 0 304.437 4.305 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC23CCCCC3)cc1F ZINC001308477140 1066016561 /nfs/dbraw/zinc/01/65/61/1066016561.db2.gz AODCFFMJBIBEHU-SFHVURJKSA-N 1 0 304.453 4.484 20 10 DICDRO Cc1cc(C[NH2+]Cc2cnc(F)cc2C)c(C)n1-c1ccccc1 ZINC001308489303 1066022752 /nfs/dbraw/zinc/02/27/52/1066022752.db2.gz YTJCMWDYIAPIBO-UHFFFAOYSA-N 1 0 323.415 4.226 20 10 DICDRO Cc1cc(C[NH2+]Cc2cc(C)nc(C)c2)c(C)n1-c1ccccc1 ZINC001308488500 1066023269 /nfs/dbraw/zinc/02/32/69/1066023269.db2.gz NARRBVCCBVJSRH-UHFFFAOYSA-N 1 0 319.452 4.396 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCCc3ccccc3C2)cc1 ZINC001308538735 1066055071 /nfs/dbraw/zinc/05/50/71/1066055071.db2.gz YUMSLPACBKDVSL-IZRJCCQOSA-N 1 0 320.480 4.303 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC=CCCC2)ccc1OC ZINC001308545565 1066060818 /nfs/dbraw/zinc/06/08/18/1066060818.db2.gz FZNBMSMUFBJITR-QGZVFWFLSA-N 1 0 317.473 4.458 20 10 DICDRO C[C@]1(C[N@H+](Cc2ccco2)Cc2ccccc2O)CCCS1 ZINC001308560472 1066069770 /nfs/dbraw/zinc/06/97/70/1066069770.db2.gz PWWLBSUPRYZMJQ-GOSISDBHSA-N 1 0 317.454 4.273 20 10 DICDRO Cc1ccc(C(C)(C)C[N@H+](C)Cc2cc(F)ccc2O)cc1 ZINC001308564769 1066075023 /nfs/dbraw/zinc/07/50/23/1066075023.db2.gz NHSACBGJRFQCMQ-UHFFFAOYSA-N 1 0 301.405 4.249 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2CCC2CCCC2)c1 ZINC001308570824 1066082358 /nfs/dbraw/zinc/08/23/58/1066082358.db2.gz RSAWARPTHQBSLA-KRWDZBQOSA-N 1 0 303.446 4.336 20 10 DICDRO CC[N@H+](Cc1ccccc1C)Cc1cc(F)c(N(C)C)cc1F ZINC001308571191 1066082603 /nfs/dbraw/zinc/08/26/03/1066082603.db2.gz SALKPBOTHMOSAG-UHFFFAOYSA-N 1 0 318.411 4.361 20 10 DICDRO C[N@@H+](Cc1ccc2c(c1)CCN2Cc1ccccc1)CC1CC1 ZINC001308580478 1066096734 /nfs/dbraw/zinc/09/67/34/1066096734.db2.gz TWZHGCFPMQSNHJ-UHFFFAOYSA-N 1 0 306.453 4.091 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1Cl ZINC001308595274 1066106658 /nfs/dbraw/zinc/10/66/58/1066106658.db2.gz QUZXYEYCTOLGRV-KRWDZBQOSA-N 1 0 317.816 4.397 20 10 DICDRO Oc1cc(Br)ccc1C[N@@H+]1CCCC12CCCCC2 ZINC001308596565 1066108269 /nfs/dbraw/zinc/10/82/69/1066108269.db2.gz VKCRXXQZTCQMRS-UHFFFAOYSA-N 1 0 324.262 4.453 20 10 DICDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001308634568 1066130505 /nfs/dbraw/zinc/13/05/05/1066130505.db2.gz MTHPRPBKRKMLMY-PBFPGSCMSA-N 1 0 308.416 4.184 20 10 DICDRO CN(CC1CCC(C)(C)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC001308668738 1066146990 /nfs/dbraw/zinc/14/69/90/1066146990.db2.gz DGNXNFDZRQVNIM-UHFFFAOYSA-N 1 0 318.505 4.280 20 10 DICDRO CCCC[N@H+](Cc1cc(F)ccc1O)[C@@H]1CCCC[C@H]1OC ZINC001308765053 1066237722 /nfs/dbraw/zinc/23/77/22/1066237722.db2.gz GBCDWFOEWSSHKP-SJLPKXTDSA-N 1 0 309.425 4.091 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)c(C(F)(F)F)c1 ZINC001308813063 1066289648 /nfs/dbraw/zinc/28/96/48/1066289648.db2.gz NTFJMWWKFUALKO-WPGHFRTFSA-N 1 0 312.379 4.050 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C[C@H]2CCCC(C)(C)C2)c1O ZINC001308821327 1066296057 /nfs/dbraw/zinc/29/60/57/1066296057.db2.gz VVSFSMBQZDVSFW-LBPRGKRZSA-N 1 0 311.853 4.360 20 10 DICDRO Cc1ccc(CC(C)(C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC001308825148 1066301870 /nfs/dbraw/zinc/30/18/70/1066301870.db2.gz PDWDEGIYPHRGRA-UHFFFAOYSA-N 1 0 310.485 4.480 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCC[C@H](C2CCOCC2)C1 ZINC001308846580 1066323896 /nfs/dbraw/zinc/32/38/96/1066323896.db2.gz UBSXRMFNJFXQNQ-YOEHRIQHSA-N 1 0 323.864 4.121 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)cc1Cl ZINC001308863014 1066340491 /nfs/dbraw/zinc/34/04/91/1066340491.db2.gz CYSHPIYFKQKFOQ-KSSFIOAISA-N 1 0 323.864 4.135 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H]3CC(C)(C)CC[C@@H]3C)C2)cc1 ZINC001308861486 1066342054 /nfs/dbraw/zinc/34/20/54/1066342054.db2.gz YKGFZWRNOIYMPD-BXWFABGCSA-N 1 0 316.489 4.078 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CC2([C@@H]3CCCCO3)CCC2)c1 ZINC001308886595 1066369721 /nfs/dbraw/zinc/36/97/21/1066369721.db2.gz LWVRHDVMXBBKEZ-IBGZPJMESA-N 1 0 317.473 4.345 20 10 DICDRO Cc1cc(CC[NH2+][C@H](C)COC(C)C)c(C)n1-c1ccccc1 ZINC001308889595 1066370361 /nfs/dbraw/zinc/37/03/61/1066370361.db2.gz LDQOQLMSKXSCAC-MRXNPFEDSA-N 1 0 314.473 4.040 20 10 DICDRO CCc1cccc(C[NH2+][C@H](Cc2cccnc2)C2CCCC2)c1O ZINC001308910601 1066386948 /nfs/dbraw/zinc/38/69/48/1066386948.db2.gz HNKFUFXAQQKPFC-HXUWFJFHSA-N 1 0 324.468 4.241 20 10 DICDRO C[N@H+](Cc1ccc2cc[nH]c2c1)Cc1c([O-])ccc(Cl)c1F ZINC001308910504 1066388098 /nfs/dbraw/zinc/38/80/98/1066388098.db2.gz GIAXXSYTMBPQMQ-UHFFFAOYSA-N 1 0 318.779 4.298 20 10 DICDRO CCc1cccc(C[N@@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c1O ZINC001308943271 1066411338 /nfs/dbraw/zinc/41/13/38/1066411338.db2.gz KIDRJFQHYUQTEI-HOCLYGCPSA-N 1 0 313.363 4.119 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+](Cc1ccccn1)CC(C)C ZINC001308949504 1066415586 /nfs/dbraw/zinc/41/55/86/1066415586.db2.gz SHABPYJHRAOXHB-UHFFFAOYSA-N 1 0 311.473 4.114 20 10 DICDRO Oc1c(C[NH2+]CC[C@H]2CCC3(CCC3)O2)ccc2ccccc21 ZINC001308953239 1066416943 /nfs/dbraw/zinc/41/69/43/1066416943.db2.gz PJQPOQQKMORKAZ-QGZVFWFLSA-N 1 0 311.425 4.127 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](Cc2ccccc2)c2ccccn2)c(O)c1 ZINC001308967075 1066423768 /nfs/dbraw/zinc/42/37/68/1066423768.db2.gz ADZDOGZNJUBPBE-FQEVSTJZSA-N 1 0 318.420 4.169 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2cc(F)ccc2O)C2CCC2)cc1 ZINC001308964598 1066423841 /nfs/dbraw/zinc/42/38/41/1066423841.db2.gz FULAIFRPYOSVQS-IBGZPJMESA-N 1 0 315.388 4.171 20 10 DICDRO Oc1cc(Br)ccc1C[NH2+]C[C@@H]1CCC=CCCC1 ZINC001308974491 1066427770 /nfs/dbraw/zinc/42/77/70/1066427770.db2.gz IMQVLZFDEAVQRJ-CYBMUJFWSA-N 1 0 324.262 4.381 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cc2)c1O ZINC000021044166 182262964 /nfs/dbraw/zinc/26/29/64/182262964.db2.gz CPSYPTPQEXAXKN-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3sccc32)c1 ZINC000061331120 184168777 /nfs/dbraw/zinc/16/87/77/184168777.db2.gz IOXNZUPELPKYAO-ABAIWWIYSA-N 1 0 303.427 4.191 20 10 DICDRO COc1cccc(C2([NH2+][C@@H](C)c3ccc(N(C)C)cc3)CC2)c1 ZINC000272311798 130018413 /nfs/dbraw/zinc/01/84/13/130018413.db2.gz TYCUTYYNCFCYGU-HNNXBMFYSA-N 1 0 310.441 4.101 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccc2ccccc2c1O ZINC000273516560 130131232 /nfs/dbraw/zinc/13/12/32/130131232.db2.gz SNYGZOFNQIZENX-HOCLYGCPSA-N 1 0 311.425 4.298 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2nc3c(cccc3C)o2)c(O)c1 ZINC000273609105 130144120 /nfs/dbraw/zinc/14/41/20/130144120.db2.gz VDPLBXLWMVUBML-AWEZNQCLSA-N 1 0 310.397 4.044 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H](CCCO)c2ccccc2)c(O)c1 ZINC000283912732 131033411 /nfs/dbraw/zinc/03/34/11/131033411.db2.gz DIEALVLXLNNHMT-WMZOPIPTSA-N 1 0 313.441 4.173 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(C)cc1O ZINC000285854647 131205954 /nfs/dbraw/zinc/20/59/54/131205954.db2.gz ZFUWQDOZEBQAKU-NHYWBVRUSA-N 1 0 306.356 4.176 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(C)cc1O ZINC000285854641 131206350 /nfs/dbraw/zinc/20/63/50/131206350.db2.gz ZFUWQDOZEBQAKU-ABAIWWIYSA-N 1 0 306.356 4.176 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1cccc(C)c1 ZINC000286284021 131227910 /nfs/dbraw/zinc/22/79/10/131227910.db2.gz VXABPNFTWDWTJX-NRFANRHFSA-N 1 0 324.468 4.073 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(OC)c(OC)c1 ZINC000287539955 131286587 /nfs/dbraw/zinc/28/65/87/131286587.db2.gz PFNIVAKUNSNXRR-XJKSGUPXSA-N 1 0 315.413 4.211 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cccc(Cl)c1[O-] ZINC000287747141 131298824 /nfs/dbraw/zinc/29/88/24/131298824.db2.gz PZCVUSVLLFEZKV-JKSUJKDBSA-N 1 0 317.816 4.479 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(COC)c1)c1cccc(Cl)c1[O-] ZINC000287863224 131303930 /nfs/dbraw/zinc/30/39/30/131303930.db2.gz XLBYRDUUUFSVRG-QGZVFWFLSA-N 1 0 319.832 4.433 20 10 DICDRO CC[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cccc(Cl)c1[O-] ZINC000287882792 131304700 /nfs/dbraw/zinc/30/47/00/131304700.db2.gz YMGNDJHDSLDPGM-QGZVFWFLSA-N 1 0 322.880 4.103 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)c1ccccc1O ZINC000287936554 131307026 /nfs/dbraw/zinc/30/70/26/131307026.db2.gz XEZIALFELZJTBV-MAUKXSAKSA-N 1 0 321.424 4.380 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1nccc2ccccc21 ZINC000289521227 131392858 /nfs/dbraw/zinc/39/28/58/131392858.db2.gz AUHQFROKMKFXRB-HNNXBMFYSA-N 1 0 305.425 4.152 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(N2CCCC2)c1 ZINC000297909143 132039883 /nfs/dbraw/zinc/03/98/83/132039883.db2.gz WNWKDLMTOQRLFM-HNAYVOBHSA-N 1 0 322.452 4.331 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000297470444 227211401 /nfs/dbraw/zinc/21/14/01/227211401.db2.gz YPCFAVFHXROJTB-STQMWFEESA-N 1 0 300.358 4.021 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000184611526 333198792 /nfs/dbraw/zinc/19/87/92/333198792.db2.gz XDNWXGDQNZNIDY-KGLIPLIRSA-N 1 0 315.461 4.372 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)C[C@H](O)c2cccs2)c(O)c1 ZINC000294821831 335127864 /nfs/dbraw/zinc/12/78/64/335127864.db2.gz QLWWJWZUUGRNIT-ILXRZTDVSA-N 1 0 319.470 4.233 20 10 DICDRO CC(C)OCCCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000186529906 333374287 /nfs/dbraw/zinc/37/42/87/333374287.db2.gz DLTUKLYOYQKUNY-OAHLLOKOSA-N 1 0 301.430 4.401 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273464454 334047539 /nfs/dbraw/zinc/04/75/39/334047539.db2.gz IROPIQJTPQUEHB-YPMHNXCESA-N 1 0 302.418 4.068 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(Cl)cn2)cc1 ZINC000274946517 334067884 /nfs/dbraw/zinc/06/78/84/334067884.db2.gz UMRYKMWDUUJLGP-CQSZACIVSA-N 1 0 317.864 4.432 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1nccc2ccccc21 ZINC000289873488 334169157 /nfs/dbraw/zinc/16/91/57/334169157.db2.gz SFFSPDIXSSMQIT-CQSZACIVSA-N 1 0 323.415 4.291 20 10 DICDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000192790368 336261865 /nfs/dbraw/zinc/26/18/65/336261865.db2.gz KYZGVWMZNNFGJI-ZIAGYGMSSA-N 1 0 315.413 4.130 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCSc3ccccc32)c1 ZINC000192834900 336265208 /nfs/dbraw/zinc/26/52/08/336265208.db2.gz KGZOPCJDLYQYOR-MLGOLLRUSA-N 1 0 315.438 4.289 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCc3cnn(C(C)C)c32)c(O)c1 ZINC000375170605 337005028 /nfs/dbraw/zinc/00/50/28/337005028.db2.gz HTOFNPHODIUEKS-PBHICJAKSA-N 1 0 313.445 4.206 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(N(C)C)cc1 ZINC000193901841 337079974 /nfs/dbraw/zinc/07/99/74/337079974.db2.gz CRWSVMUIGDGVID-KBPBESRZSA-N 1 0 313.401 4.073 20 10 DICDRO C[C@H]([NH2+]C1CCN([C@@H](C)c2ccccc2)CC1)c1ccccc1O ZINC000183516813 337191962 /nfs/dbraw/zinc/19/19/62/337191962.db2.gz NMWBZLASDVNNLP-IRXDYDNUSA-N 1 0 324.468 4.268 20 10 DICDRO Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183549836 337192200 /nfs/dbraw/zinc/19/22/00/337192200.db2.gz NACDJHNZKFNHHG-LSDHHAIUSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2-n2cccn2)c1 ZINC000185741629 337251020 /nfs/dbraw/zinc/25/10/20/337251020.db2.gz FFSBCVPXPOYACN-JKSUJKDBSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCOc3cc(F)ccc32)c(O)c1 ZINC000186374439 337256879 /nfs/dbraw/zinc/25/68/79/337256879.db2.gz AGXGASAAVBYJKV-CXAGYDPISA-N 1 0 315.388 4.404 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cc1O ZINC000571930858 337582165 /nfs/dbraw/zinc/58/21/65/337582165.db2.gz LNADVOOCOPHCMI-AWEZNQCLSA-N 1 0 324.424 4.052 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000479439757 339535126 /nfs/dbraw/zinc/53/51/26/339535126.db2.gz QRZXLCJFJTWVJI-SFHVURJKSA-N 1 0 308.400 4.403 20 10 DICDRO CCc1cccnc1[C@@H](C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000479454430 517854928 /nfs/dbraw/zinc/85/49/28/517854928.db2.gz OLIXCKVHGTVMHO-OAHLLOKOSA-N 1 0 307.441 4.295 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000182381057 520372311 /nfs/dbraw/zinc/37/23/11/520372311.db2.gz BTPOKBSKZIUHQP-AWEZNQCLSA-N 1 0 315.413 4.040 20 10 DICDRO CCOc1cc(C[NH2+][C@H](CC)c2ccccc2O)ccc1OC ZINC000155839337 520730334 /nfs/dbraw/zinc/73/03/34/520730334.db2.gz AEUZBLWYCJQXSC-MRXNPFEDSA-N 1 0 315.413 4.040 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1-n1cccn1)c1ccccc1O ZINC000156350713 522700060 /nfs/dbraw/zinc/70/00/60/522700060.db2.gz XPHQVQGPEZVBIR-YJBOKZPZSA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCOc2cc(F)ccc21)c1ccccc1O ZINC000157496935 522713987 /nfs/dbraw/zinc/71/39/87/522713987.db2.gz DOMMWXVJIJFJOD-DLBZAZTESA-N 1 0 315.388 4.486 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(N(C)C)cc1 ZINC000130447986 522722103 /nfs/dbraw/zinc/72/21/03/522722103.db2.gz UOEWRIBRQXTFDY-RBUKOAKNSA-N 1 0 310.441 4.186 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCOc2cc(F)ccc21)c1ccccc1O ZINC000157497207 522750789 /nfs/dbraw/zinc/75/07/89/522750789.db2.gz DOMMWXVJIJFJOD-IRXDYDNUSA-N 1 0 315.388 4.486 20 10 DICDRO CC[C@](C)([NH2+]Cc1cc(Cl)cc(C)c1O)c1nccs1 ZINC000182372655 523489397 /nfs/dbraw/zinc/48/93/97/523489397.db2.gz PWXYBMDOTTWMTQ-HNNXBMFYSA-N 1 0 310.850 4.226 20 10 DICDRO Cc1cccc(C[NH2+][C@@H]2CCSc3ccc(F)cc32)c1O ZINC000158088079 524438772 /nfs/dbraw/zinc/43/87/72/524438772.db2.gz MJJDBOIFQYEDCK-OAHLLOKOSA-N 1 0 303.402 4.166 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CCSc3ccc(F)cc32)c1O ZINC000158088236 524439978 /nfs/dbraw/zinc/43/99/78/524439978.db2.gz MJJDBOIFQYEDCK-HNNXBMFYSA-N 1 0 303.402 4.166 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3c2cccc3Cl)c1 ZINC000182472004 524774003 /nfs/dbraw/zinc/77/40/03/524774003.db2.gz ITMVCCOUJHTCFH-GTNSWQLSSA-N 1 0 317.816 4.392 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1ccncc1 ZINC000156636779 525444754 /nfs/dbraw/zinc/44/47/54/525444754.db2.gz ZXIOPNOUUWVFGX-KRWDZBQOSA-N 1 0 309.457 4.169 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(Cl)nc1 ZINC000181380273 525525789 /nfs/dbraw/zinc/52/57/89/525525789.db2.gz HYTZHUZUCXPEFA-CQSZACIVSA-N 1 0 315.848 4.186 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1cncs1 ZINC000157500707 525525888 /nfs/dbraw/zinc/52/58/88/525525888.db2.gz QPBXMMUWMHMFKJ-OAHLLOKOSA-N 1 0 315.486 4.230 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000158130013 525688317 /nfs/dbraw/zinc/68/83/17/525688317.db2.gz YSPWOLNXFIPPTH-PBEJRMEISA-N 1 0 324.468 4.324 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](c2ccccc2)[C@@H]2CCCO2)c(O)c1 ZINC000185225393 525749095 /nfs/dbraw/zinc/74/90/95/525749095.db2.gz FJJAIQTZTAGOGV-UIAACRFSSA-N 1 0 311.425 4.272 20 10 DICDRO Cc1cnc(C(C)(C)[NH2+]Cc2cc(Cl)cc(C)c2O)s1 ZINC000182553691 525981442 /nfs/dbraw/zinc/98/14/42/525981442.db2.gz MVBVVKYLHWOCKS-UHFFFAOYSA-N 1 0 310.850 4.144 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@H]3C3CCC3)c2c1 ZINC000728199594 1035727813 /nfs/dbraw/zinc/72/78/13/1035727813.db2.gz NFNRVQWNRXQADT-IBGZPJMESA-N 1 0 311.425 4.319 20 10 DICDRO CCc1onc(C)c1C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC001167108961 1036095199 /nfs/dbraw/zinc/09/51/99/1036095199.db2.gz WLSXNOQTOPYAHX-UHFFFAOYSA-N 1 0 315.461 4.022 20 10 DICDRO CCC(CC)[N@H+](CC)Cc1c(O)cccc1Br ZINC001140101011 1036311748 /nfs/dbraw/zinc/31/17/48/1036311748.db2.gz HFDCNTGORVGWIJ-UHFFFAOYSA-N 1 0 300.240 4.165 20 10 DICDRO Cc1csc([C@@H](C)[NH2+]Cc2ccc(N3CCCCC3)cc2)n1 ZINC000069168575 1036574113 /nfs/dbraw/zinc/57/41/13/1036574113.db2.gz VLVXTSUYBUBUMQ-OAHLLOKOSA-N 1 0 315.486 4.293 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)ccc2OC)cc1 ZINC001648832591 1036611627 /nfs/dbraw/zinc/61/16/27/1036611627.db2.gz CGIFEYZTWFLZHC-UHFFFAOYSA-N 1 0 312.457 4.140 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C/C=C/c2cccc(F)c2)cc1 ZINC001648832568 1036612257 /nfs/dbraw/zinc/61/22/57/1036612257.db2.gz BJJIYVYHJKDMGQ-SOFGYWHQSA-N 1 0 312.432 4.475 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCSc2ccccc21 ZINC000083551474 1036895353 /nfs/dbraw/zinc/89/53/53/1036895353.db2.gz HRYXYULZLVRXRR-AWEZNQCLSA-N 1 0 305.830 4.372 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC001167424253 1037226008 /nfs/dbraw/zinc/22/60/08/1037226008.db2.gz FRLJRYRJMJSPGD-KRWDZBQOSA-N 1 0 314.860 4.396 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCCC1(F)F)c1cc(F)cc(F)c1[O-] ZINC000834840314 1037599534 /nfs/dbraw/zinc/59/95/34/1037599534.db2.gz JDQZMBBJVDQCHT-NXEZZACHSA-N 1 0 305.315 4.147 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC[C@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834889556 1037713167 /nfs/dbraw/zinc/71/31/67/1037713167.db2.gz AYRBBDMXSWOBRY-SMDDNHRTSA-N 1 0 302.245 4.325 20 10 DICDRO Oc1cccc(Br)c1C[N@@H+]1CCC2(C1)CCCCC2 ZINC000707165500 1037874635 /nfs/dbraw/zinc/87/46/35/1037874635.db2.gz FIAXESFIUQJIRR-UHFFFAOYSA-N 1 0 324.262 4.311 20 10 DICDRO Oc1cccc(Br)c1C[N@@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC000707165595 1037875221 /nfs/dbraw/zinc/87/52/21/1037875221.db2.gz IUAVZCMWJMYBEV-STQMWFEESA-N 1 0 324.262 4.167 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(Cl)cc(OC)c1O)c1ccccc1 ZINC000228672657 1038016022 /nfs/dbraw/zinc/01/60/22/1038016022.db2.gz NPRZAQAHCNRFRJ-HNNXBMFYSA-N 1 0 305.805 4.295 20 10 DICDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc(Cl)cc1O ZINC001140466057 1038145061 /nfs/dbraw/zinc/14/50/61/1038145061.db2.gz VRDXCDFUPNZRFT-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ccc(N(C)C)cc1 ZINC000090963522 1038249090 /nfs/dbraw/zinc/24/90/90/1038249090.db2.gz ICRCKRBBYVNIGW-STQMWFEESA-N 1 0 304.384 4.443 20 10 DICDRO C[C@H]([NH2+]Cc1cc(Br)ccc1O)C1CCCCC1 ZINC000230672242 1038619420 /nfs/dbraw/zinc/61/94/20/1038619420.db2.gz LFDVELHWXXUDIE-NSHDSACASA-N 1 0 312.251 4.213 20 10 DICDRO CS[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000230698904 1038621065 /nfs/dbraw/zinc/62/10/65/1038621065.db2.gz XJPFTYIZTXFYMW-FUHWJXTLSA-N 1 0 304.503 4.051 20 10 DICDRO Cc1nc(C(C)(C)[NH2+]Cc2cc(C)c(C)cc2O)sc1C ZINC000174415641 1038934209 /nfs/dbraw/zinc/93/42/09/1038934209.db2.gz XISAKYLYBYAARX-UHFFFAOYSA-N 1 0 304.459 4.107 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)[C@@H]1CCOC1 ZINC000119675922 1038940417 /nfs/dbraw/zinc/94/04/17/1038940417.db2.gz ZRCUCOBPIYVFGK-YQVWRLOYSA-N 1 0 316.489 4.143 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2sc(C)nc2C)cc1 ZINC000119817168 1038949268 /nfs/dbraw/zinc/94/92/68/1038949268.db2.gz PRHKSSNSBFYBRR-LBPRGKRZSA-N 1 0 303.475 4.067 20 10 DICDRO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]CCCSc2nccs2)o1 ZINC000176797291 1039475250 /nfs/dbraw/zinc/47/52/50/1039475250.db2.gz JZLFHMHTYUACJS-YPMHNXCESA-N 1 0 308.472 4.132 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)c(O)c1C ZINC000278524919 1039521610 /nfs/dbraw/zinc/52/16/10/1039521610.db2.gz SUHWTVBKLFBFAF-HNNXBMFYSA-N 1 0 310.441 4.134 20 10 DICDRO COc1ccc(C[NH2+]CCc2c[nH]c3cccc(C)c23)cc1C ZINC000728593505 1040026201 /nfs/dbraw/zinc/02/62/01/1040026201.db2.gz TWHUVWCPMDLYIN-UHFFFAOYSA-N 1 0 308.425 4.126 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc(OC)c(OC)c1O)c1ccccc1 ZINC000892418798 1040247364 /nfs/dbraw/zinc/24/73/64/1040247364.db2.gz UPEKSDDIHHSIOC-INIZCTEOSA-N 1 0 315.413 4.040 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1O ZINC000309943570 1040356102 /nfs/dbraw/zinc/35/61/02/1040356102.db2.gz PEXDVUFPRVSJDN-ICSRJNTNSA-N 1 0 324.468 4.098 20 10 DICDRO CC(=O)c1cc(Cl)cc(CN(C)[C@@H](C)c2ccco2)c1O ZINC000177059806 1040450968 /nfs/dbraw/zinc/45/09/68/1040450968.db2.gz HBQIEYHKRYOQAO-JTQLQIEISA-N 1 0 307.777 4.034 20 10 DICDRO CCOC[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000318308341 1040504806 /nfs/dbraw/zinc/50/48/06/1040504806.db2.gz QBLASHXLGJTRLN-KBXCAEBGSA-N 1 0 301.430 4.257 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(Oc2ccccc2Cl)CC1 ZINC000179557745 1040508627 /nfs/dbraw/zinc/50/86/27/1040508627.db2.gz WPZBYYWKFQKYDP-UHFFFAOYSA-N 1 0 317.816 4.089 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c1O ZINC000808699898 1041007844 /nfs/dbraw/zinc/00/78/44/1041007844.db2.gz RYRRRTAIWMHKRW-AADNMHCOSA-N 1 0 323.864 4.208 20 10 DICDRO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808697020 1041008273 /nfs/dbraw/zinc/00/82/73/1041008273.db2.gz TZMDYEUPPWQSQP-UWVGGRQHSA-N 1 0 308.809 4.371 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)C1CCOCC1 ZINC000808700175 1041009084 /nfs/dbraw/zinc/00/90/84/1041009084.db2.gz IQDGJQHJVYNMMU-BLLLJJGKSA-N 1 0 311.853 4.210 20 10 DICDRO C[C@@H]([NH2+]C[C@@]1(C)CCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766558755 1041064636 /nfs/dbraw/zinc/06/46/36/1041064636.db2.gz HJXKKGTZTAELBT-DNVCBOLYSA-N 1 0 320.452 4.036 20 10 DICDRO Cc1ccncc1CCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000809573979 1041186462 /nfs/dbraw/zinc/18/64/62/1041186462.db2.gz DYJZYOUGJSKIPY-UHFFFAOYSA-N 1 0 324.468 4.473 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2CC(c3cc(F)cc(F)c3)C2)cc1 ZINC000809603536 1041202691 /nfs/dbraw/zinc/20/26/91/1041202691.db2.gz QVGQGZBZHIKZRG-UHFFFAOYSA-N 1 0 316.395 4.067 20 10 DICDRO c1cc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)ccn1 ZINC000809728921 1041227399 /nfs/dbraw/zinc/22/73/99/1041227399.db2.gz LLCYWTKJVMXZNG-NRFANRHFSA-N 1 0 321.468 4.409 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(C(F)(F)F)c1)c1cc(F)ccc1O ZINC000176980482 1041227904 /nfs/dbraw/zinc/22/79/04/1041227904.db2.gz STXBWSDGRFZEQX-JTQLQIEISA-N 1 0 313.294 4.401 20 10 DICDRO Cc1cc2cc(C[NH2+]Cc3cc(Cl)cc(C)c3O)ccc2[nH]1 ZINC000809719717 1041232525 /nfs/dbraw/zinc/23/25/25/1041232525.db2.gz NDQJMTUSTXOYAO-UHFFFAOYSA-N 1 0 314.816 4.434 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CC[C@](C)(c3ccccc3)C2)c1O ZINC000809739635 1041239563 /nfs/dbraw/zinc/23/95/63/1041239563.db2.gz ADJDJGNETWSMOX-PXNSSMCTSA-N 1 0 311.425 4.001 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CC[C@@](C)(c3ccccc3)C2)c1O ZINC000809739634 1041240477 /nfs/dbraw/zinc/24/04/77/1041240477.db2.gz ADJDJGNETWSMOX-FXAWDEMLSA-N 1 0 311.425 4.001 20 10 DICDRO COc1cccc(C[NH2+]C2CC(c3ccc(Cl)cc3)C2)c1O ZINC000809741748 1041241012 /nfs/dbraw/zinc/24/10/12/1041241012.db2.gz VFVSDGCMUZRRPT-UHFFFAOYSA-N 1 0 317.816 4.090 20 10 DICDRO CC[N@H+](Cc1cccc(-c2ccncc2)c1)Cc1ccccc1O ZINC000809748024 1041246382 /nfs/dbraw/zinc/24/63/82/1041246382.db2.gz IMKOEJHWYNCFTA-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO CC[N@H+](Cc1cc(Cl)cc(C)c1O)[C@@H](C)c1cccnc1 ZINC000809765747 1041249487 /nfs/dbraw/zinc/24/94/87/1041249487.db2.gz PVHFHOUCESVGOM-ZDUSSCGKSA-N 1 0 304.821 4.332 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000809764367 1041249686 /nfs/dbraw/zinc/24/96/86/1041249686.db2.gz DVDBEIDDVCLYAW-INIZCTEOSA-N 1 0 304.821 4.332 20 10 DICDRO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1cc(F)ccc1O ZINC000809784674 1041253744 /nfs/dbraw/zinc/25/37/44/1041253744.db2.gz WYPAMJHUMWDOOK-KRWDZBQOSA-N 1 0 303.377 4.123 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000809780716 1041254140 /nfs/dbraw/zinc/25/41/40/1041254140.db2.gz HPQXZBBZFCXMNX-UHFFFAOYSA-N 1 0 324.399 4.392 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000809783304 1041254929 /nfs/dbraw/zinc/25/49/29/1041254929.db2.gz XUSPVRJEOVIRIX-MRXNPFEDSA-N 1 0 303.427 4.045 20 10 DICDRO CCC[N@H+](Cc1cc(C(C)(C)C)on1)Cc1ccccc1O ZINC000809951147 1041282307 /nfs/dbraw/zinc/28/23/07/1041282307.db2.gz YYBDGPVFRDBTMZ-UHFFFAOYSA-N 1 0 302.418 4.090 20 10 DICDRO CSc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000810153548 1041325925 /nfs/dbraw/zinc/32/59/25/1041325925.db2.gz ZSZVHDFIWVBKLS-GFCCVEGCSA-N 1 0 306.500 4.387 20 10 DICDRO C[C@H](CCCC(F)(F)F)[NH2+][C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000756081847 1041330021 /nfs/dbraw/zinc/33/00/21/1041330021.db2.gz YTCKRWDLUQMOHI-BDAKNGLRSA-N 1 0 311.294 4.442 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(C)n1)c1ccc(C(F)(F)F)cc1O ZINC000810211549 1041337685 /nfs/dbraw/zinc/33/76/85/1041337685.db2.gz SXQYJFMPKNRJCM-HNNXBMFYSA-N 1 0 324.346 4.355 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1nccc2ccccc21 ZINC000810219055 1041339635 /nfs/dbraw/zinc/33/96/35/1041339635.db2.gz NONDMVAQINNMEY-MRXNPFEDSA-N 1 0 319.452 4.460 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccncc1)c1ccc(C(F)(F)F)cc1O ZINC000810223409 1041341843 /nfs/dbraw/zinc/34/18/43/1041341843.db2.gz LFAZNFFIZQWIDZ-OAHLLOKOSA-N 1 0 324.346 4.089 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)SC)c1ccc(C(F)(F)F)cc1O ZINC000810228000 1041341952 /nfs/dbraw/zinc/34/19/52/1041341952.db2.gz OZLRQYBKFHBRAM-BXKDBHETSA-N 1 0 307.381 4.203 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCS1)c1ccc(C(F)(F)F)cc1O ZINC000810223675 1041342096 /nfs/dbraw/zinc/34/20/96/1041342096.db2.gz NYVSKRXILWTRDU-AAEUAGOBSA-N 1 0 319.392 4.347 20 10 DICDRO Cc1cc([C@@H](C)[NH2+]CCc2cc(C)n(-c3ccccc3)c2C)no1 ZINC000810207323 1041347510 /nfs/dbraw/zinc/34/75/10/1041347510.db2.gz JKJXSKGXASKQPE-MRXNPFEDSA-N 1 0 323.440 4.284 20 10 DICDRO CO[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000810257722 1041348756 /nfs/dbraw/zinc/34/87/56/1041348756.db2.gz UVNVINYQIHGRHP-BRWVUGGUSA-N 1 0 304.478 4.141 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCC=CO1)c1ccc(C(F)(F)F)cc1O ZINC000810239055 1041352513 /nfs/dbraw/zinc/35/25/13/1041352513.db2.gz RCRYCBXDVUMROT-JSGCOSHPSA-N 1 0 315.335 4.144 20 10 DICDRO COc1cccc(C2(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)CC2)c1 ZINC000810242791 1041355565 /nfs/dbraw/zinc/35/55/65/1041355565.db2.gz UFCUNUVYLOVFNJ-INIZCTEOSA-N 1 0 324.468 4.144 20 10 DICDRO CC(C)N(C)C[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000810245140 1041356437 /nfs/dbraw/zinc/35/64/37/1041356437.db2.gz SIXHGAJQQZUZIT-ZWKOTPCHSA-N 1 0 317.521 4.056 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[C@@H](c3ccccc3)O2)c1 ZINC000810250958 1041357152 /nfs/dbraw/zinc/35/71/52/1041357152.db2.gz QMNFNNVVAFRFHT-VPWXQRGCSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@H]([NH2+][C@@H]1COc2ccccc2C1)c1ccc2ccccc2c1O ZINC000328422618 1041435776 /nfs/dbraw/zinc/43/57/76/1041435776.db2.gz ZKAIIRYHJPTGCL-YOEHRIQHSA-N 1 0 319.404 4.200 20 10 DICDRO CC(C)COCCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000314380438 1041450618 /nfs/dbraw/zinc/45/06/18/1041450618.db2.gz QQUYONAXCBKKEQ-HNNXBMFYSA-N 1 0 301.430 4.259 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000811518288 1041531031 /nfs/dbraw/zinc/53/10/31/1041531031.db2.gz JAEFZVKYNHDBOI-UXHICEINSA-N 1 0 323.436 4.079 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1O ZINC000183372129 1041582466 /nfs/dbraw/zinc/58/24/66/1041582466.db2.gz AOFDYAZPLURBKY-UHFFFAOYSA-N 1 0 323.392 4.202 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)CCC2 ZINC000363868990 1041584716 /nfs/dbraw/zinc/58/47/16/1041584716.db2.gz PPYBZEJSDGMHTB-BXUZGUMPSA-N 1 0 302.443 4.194 20 10 DICDRO CCCCOCCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000318707870 1041604647 /nfs/dbraw/zinc/60/46/47/1041604647.db2.gz ZVSDXMLHKHYHLO-HNNXBMFYSA-N 1 0 301.430 4.403 20 10 DICDRO COc1ccc(Cl)cc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185206001 1041609413 /nfs/dbraw/zinc/60/94/13/1041609413.db2.gz VCOJJLUCKAEIMR-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000162360028 1041644450 /nfs/dbraw/zinc/64/44/50/1041644450.db2.gz SMSXEUOTKICTIG-XJKSGUPXSA-N 1 0 303.475 4.319 20 10 DICDRO COc1cc(O)c(C[NH2+][C@H]2CCCCC23CCCC3)cc1OC ZINC000812780416 1041646578 /nfs/dbraw/zinc/64/65/78/1041646578.db2.gz DKHSQECIDDWNNF-SFHVURJKSA-N 1 0 319.445 4.002 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706863 1041708393 /nfs/dbraw/zinc/70/83/93/1041708393.db2.gz NRFLPHVNUDPMRL-INIZCTEOSA-N 1 0 317.379 4.050 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706864 1041709339 /nfs/dbraw/zinc/70/93/39/1041709339.db2.gz NRFLPHVNUDPMRL-MRXNPFEDSA-N 1 0 317.379 4.050 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1cc2c(cc1O)CCCC2 ZINC000756547868 1041709417 /nfs/dbraw/zinc/70/94/17/1041709417.db2.gz IBYOKCCERVFZCH-GFCCVEGCSA-N 1 0 317.379 4.400 20 10 DICDRO Cc1cc(O)c(CN(Cc2ccco2)Cc2ccco2)cc1C ZINC000162562145 1041720135 /nfs/dbraw/zinc/72/01/35/1041720135.db2.gz XOEWXQIXNSCDHF-UHFFFAOYSA-N 1 0 311.381 4.397 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCCc3ccc(C)cc32)c1 ZINC000813790643 1041731504 /nfs/dbraw/zinc/73/15/04/1041731504.db2.gz WSMLBDATAUVICG-LJQANCHMSA-N 1 0 311.425 4.267 20 10 DICDRO COc1cccc(C[NH2+]CC(C)(C)c2ccc(C)cc2C)c1O ZINC000813790288 1041732319 /nfs/dbraw/zinc/73/23/19/1041732319.db2.gz LWCSXMPQBXYICU-UHFFFAOYSA-N 1 0 313.441 4.085 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1cc(F)ccc1O ZINC000813873950 1041741452 /nfs/dbraw/zinc/74/14/52/1041741452.db2.gz BKTHWPXWJAJFRZ-LLVKDONJSA-N 1 0 303.352 4.399 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1cc(F)ccc1O ZINC000813873952 1041741670 /nfs/dbraw/zinc/74/16/70/1041741670.db2.gz BKTHWPXWJAJFRZ-NSHDSACASA-N 1 0 303.352 4.399 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(Cl)cc1 ZINC000194254965 1041785528 /nfs/dbraw/zinc/78/55/28/1041785528.db2.gz LEMWHOMLVIHOTD-CXAGYDPISA-N 1 0 319.832 4.392 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccc(F)cc2F)c(O)c1 ZINC000756620486 1041803051 /nfs/dbraw/zinc/80/30/51/1041803051.db2.gz KKUHETDAJUZHQR-CHWSQXEVSA-N 1 0 305.368 4.433 20 10 DICDRO CCO[C@H](CC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)C(C)C ZINC000756628361 1041810341 /nfs/dbraw/zinc/81/03/41/1041810341.db2.gz LSNYPQANMMDIPV-DUVNUKRYSA-N 1 0 309.425 4.120 20 10 DICDRO Cc1cc(C[NH2+]C2(c3cccc(Cl)c3)CC2)ccc1N(C)C ZINC000815083569 1041912779 /nfs/dbraw/zinc/91/27/79/1041912779.db2.gz RSYCITPFXQVNRA-UHFFFAOYSA-N 1 0 314.860 4.493 20 10 DICDRO C[C@@H]([NH2+][C@@H]1C=CCCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000815082396 1041912927 /nfs/dbraw/zinc/91/29/27/1041912927.db2.gz OMJKNLTVRFBCHN-IEBWSBKVSA-N 1 0 314.473 4.063 20 10 DICDRO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)c(C)c2)cs1 ZINC000815093986 1041917679 /nfs/dbraw/zinc/91/76/79/1041917679.db2.gz WEFCDJXZAADKBJ-GOSISDBHSA-N 1 0 315.486 4.163 20 10 DICDRO c1cc(N2CCCCC2)ccc1CNc1cc2c(c[nH+]1)CCC2 ZINC000815159434 1041921356 /nfs/dbraw/zinc/92/13/56/1041921356.db2.gz UEPRBULQVKNGAJ-UHFFFAOYSA-N 1 0 307.441 4.173 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]Cc1ccco1 ZINC000815553206 1041961590 /nfs/dbraw/zinc/96/15/90/1041961590.db2.gz ULNMOHFCZFMCMC-IBGZPJMESA-N 1 0 307.393 4.449 20 10 DICDRO CSCC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815553945 1041961734 /nfs/dbraw/zinc/96/17/34/1041961734.db2.gz NYAXLTDNXDXTMT-KRWDZBQOSA-N 1 0 301.455 4.019 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cccc(F)c2F)c(O)c1 ZINC000815592186 1041969181 /nfs/dbraw/zinc/96/91/81/1041969181.db2.gz BFHMSGXNINWUFQ-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO CS[C@@H](C)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815597951 1041970725 /nfs/dbraw/zinc/97/07/25/1041970725.db2.gz JIPGCAUGKDTHIS-YJBOKZPZSA-N 1 0 315.482 4.407 20 10 DICDRO Cc1cc(C)c([C@@H](C)Nc2ccc(C[NH+](C)C)c(F)c2)c(O)c1 ZINC000815613493 1041974218 /nfs/dbraw/zinc/97/42/18/1041974218.db2.gz OUFYKWZOYOXTJD-CQSZACIVSA-N 1 0 316.420 4.383 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1CCC=CO1 ZINC000815618996 1041974849 /nfs/dbraw/zinc/97/48/49/1041974849.db2.gz ZMQNIDVLENALMC-AZUAARDMSA-N 1 0 323.436 4.348 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CC1=CCCOC1 ZINC000815626438 1041977512 /nfs/dbraw/zinc/97/75/12/1041977512.db2.gz DEJRFEHYMUMEOU-FQEVSTJZSA-N 1 0 323.436 4.002 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](c2ccccc2)C2CC2)c1 ZINC000815630577 1041978338 /nfs/dbraw/zinc/97/83/38/1041978338.db2.gz OHYLLYKMWBPGHM-IFXJQAMLSA-N 1 0 311.425 4.245 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(Cl)c(OC)c1)c1ccccc1O ZINC000815657306 1041980378 /nfs/dbraw/zinc/98/03/78/1041980378.db2.gz VUQCNIUPISIGIZ-INIZCTEOSA-N 1 0 319.832 4.338 20 10 DICDRO COc1cc(CC[NH2+][C@@H](C)c2cc(F)ccc2O)ccc1Cl ZINC000815657374 1041981109 /nfs/dbraw/zinc/98/11/09/1041981109.db2.gz XLDWHOWFDSTSHI-NSHDSACASA-N 1 0 323.795 4.087 20 10 DICDRO CCOC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000815644595 1041983137 /nfs/dbraw/zinc/98/31/37/1041983137.db2.gz GTWUTPINIRHZPI-TZMCWYRMSA-N 1 0 307.409 4.019 20 10 DICDRO C[C@@H](F)CC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815645361 1041983298 /nfs/dbraw/zinc/98/32/98/1041983298.db2.gz CQSVWCQGAHGVBD-QAPCUYQASA-N 1 0 301.405 4.404 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)(C)O ZINC000815652063 1041985241 /nfs/dbraw/zinc/98/52/41/1041985241.db2.gz NRIYKZVPECUXIS-RDTXWAMCSA-N 1 0 322.468 4.016 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)C(C)(C)O ZINC000815652349 1041985505 /nfs/dbraw/zinc/98/55/05/1041985505.db2.gz YXPSXWICKPBEGI-LPHOPBHVSA-N 1 0 318.505 4.267 20 10 DICDRO C[C@H]([NH2+]CCC[C@@H]1CCCC[C@H]1O)c1cc(Cl)ccc1O ZINC000756761740 1041989098 /nfs/dbraw/zinc/98/90/98/1041989098.db2.gz UZWHRCLTCXAMHS-HEHGZKQESA-N 1 0 311.853 4.028 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)c1cc(Cl)ccc1O ZINC000756778769 1042017559 /nfs/dbraw/zinc/01/75/59/1042017559.db2.gz PLHFLPFLQIPMLD-NORZTCDRSA-N 1 0 311.853 4.290 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(Cl)c(F)c2)cc1 ZINC001137654203 1042040026 /nfs/dbraw/zinc/04/00/26/1042040026.db2.gz BGNOKUXQOCZOAZ-UHFFFAOYSA-N 1 0 306.812 4.177 20 10 DICDRO CC(C)COC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000816494576 1042057503 /nfs/dbraw/zinc/05/75/03/1042057503.db2.gz RLOGEOISOVHDJO-UHFFFAOYSA-N 1 0 313.441 4.182 20 10 DICDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc3ccccc3c2O)on1 ZINC000816492768 1042057622 /nfs/dbraw/zinc/05/76/22/1042057622.db2.gz BPXACLAMAPUUST-QGZVFWFLSA-N 1 0 308.381 4.179 20 10 DICDRO CS[C@H]1CCCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816520943 1042059869 /nfs/dbraw/zinc/05/98/69/1042059869.db2.gz BTJHMDIHCPSUOY-INIZCTEOSA-N 1 0 301.455 4.263 20 10 DICDRO CC[N@H+](CCc1nccs1)Cc1ccc2ccccc2c1O ZINC000816516779 1042062087 /nfs/dbraw/zinc/06/20/87/1042062087.db2.gz QMDVUBPZFYVVHU-UHFFFAOYSA-N 1 0 312.438 4.067 20 10 DICDRO COc1ccc(CCC[NH2+]Cc2ccc3ccccc3c2O)cc1 ZINC000816537740 1042063479 /nfs/dbraw/zinc/06/34/79/1042063479.db2.gz QBQBRWULEQEBHN-UHFFFAOYSA-N 1 0 321.420 4.276 20 10 DICDRO CO[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)c1ccccc1 ZINC000816537516 1042063836 /nfs/dbraw/zinc/06/38/36/1042063836.db2.gz IANJEHADOORIGW-IBGZPJMESA-N 1 0 307.393 4.023 20 10 DICDRO Cc1ccc(NCc2cc(Cl)c(F)cc2O)c(C[NH+](C)C)c1 ZINC000816526685 1042066240 /nfs/dbraw/zinc/06/62/40/1042066240.db2.gz LENGILMPANTDLC-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO Cc1cccc(OCC[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC000816528479 1042066485 /nfs/dbraw/zinc/06/64/85/1042066485.db2.gz DYAWKEHZKRDDMU-UHFFFAOYSA-N 1 0 307.393 4.022 20 10 DICDRO CC(C)[C@@H]1OCCC[C@@H]1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816555262 1042067804 /nfs/dbraw/zinc/06/78/04/1042067804.db2.gz YQCORIOIEAHRKP-XLIONFOSSA-N 1 0 313.441 4.086 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+]Cc1ccc3ccccc3c1O)CCC2 ZINC000816566018 1042068332 /nfs/dbraw/zinc/06/83/32/1042068332.db2.gz IYJYGUKTCPDYOC-INIZCTEOSA-N 1 0 324.449 4.478 20 10 DICDRO Oc1c(C[NH2+]CC2CCC(F)(F)CC2)ccc2ccccc21 ZINC000816599950 1042071358 /nfs/dbraw/zinc/07/13/58/1042071358.db2.gz FRUHUOVGUDAZCH-UHFFFAOYSA-N 1 0 305.368 4.461 20 10 DICDRO Oc1c(C[N@@H+]2CCOc3cccc(F)c3C2)ccc2ccccc21 ZINC000816600923 1042072038 /nfs/dbraw/zinc/07/20/38/1042072038.db2.gz LKDAJKJRAUXYGV-UHFFFAOYSA-N 1 0 323.367 4.079 20 10 DICDRO CCc1ccc(C[NH2+]Cc2ccc(N(CC)CC)cc2)s1 ZINC000218215790 1042090438 /nfs/dbraw/zinc/09/04/38/1042090438.db2.gz APOAFXXBQQRRRF-UHFFFAOYSA-N 1 0 302.487 4.447 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000817366436 1042106254 /nfs/dbraw/zinc/10/62/54/1042106254.db2.gz XBZNQWFGWQIKAJ-CYBMUJFWSA-N 1 0 301.352 4.173 20 10 DICDRO CC[C@@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000817415483 1042108245 /nfs/dbraw/zinc/10/82/45/1042108245.db2.gz UCXMTTYMGAJHBP-RBUKOAKNSA-N 1 0 311.425 4.106 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccncc2Cl)cc1 ZINC000817576678 1042116386 /nfs/dbraw/zinc/11/63/86/1042116386.db2.gz UZRNMEQPTFRJTP-AWEZNQCLSA-N 1 0 317.864 4.432 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CC12CCSCC2)c1ccc(C)cc1O ZINC000817588795 1042119927 /nfs/dbraw/zinc/11/99/27/1042119927.db2.gz KGKBUFCFOWKLKE-HOCLYGCPSA-N 1 0 305.487 4.275 20 10 DICDRO CC[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817947407 1042130430 /nfs/dbraw/zinc/13/04/30/1042130430.db2.gz NCFDKKJLKWQTQJ-ZPPKWKGLSA-N 1 0 317.260 4.010 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(SC(F)F)cc1 ZINC000817955721 1042131605 /nfs/dbraw/zinc/13/16/05/1042131605.db2.gz GDQXZCLFASKUGH-GFCCVEGCSA-N 1 0 322.424 4.477 20 10 DICDRO CCSc1ccccc1[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955727 1042131638 /nfs/dbraw/zinc/13/16/38/1042131638.db2.gz GFRZTPQCFMWWQZ-AWEZNQCLSA-N 1 0 300.471 4.274 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000817956730 1042131743 /nfs/dbraw/zinc/13/17/43/1042131743.db2.gz BFYZMTFXGGUGGX-VQIMIIECSA-N 1 0 314.860 4.391 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cc(Cl)c(N)c(Cl)c1 ZINC000817955637 1042131775 /nfs/dbraw/zinc/13/17/75/1042131775.db2.gz DHILTBDMBOLXQA-JTQLQIEISA-N 1 0 324.255 4.051 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cccc(Cl)c1Cl ZINC000817956305 1042132521 /nfs/dbraw/zinc/13/25/21/1042132521.db2.gz WCNYSHGVIRGULN-NSHDSACASA-N 1 0 309.240 4.469 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H](Cc2ccccc2Cl)C2CC2)cc1 ZINC000817957023 1042132612 /nfs/dbraw/zinc/13/26/12/1042132612.db2.gz HMAZKKPTOGVRML-IBGZPJMESA-N 1 0 314.860 4.076 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1cccc(Cl)c1Cl ZINC000817956304 1042132666 /nfs/dbraw/zinc/13/26/66/1042132666.db2.gz WCNYSHGVIRGULN-LLVKDONJSA-N 1 0 309.240 4.469 20 10 DICDRO COc1c(C)cc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1Cl ZINC000817958550 1042132689 /nfs/dbraw/zinc/13/26/89/1042132689.db2.gz XEHACQIOVZVLBG-ZDUSSCGKSA-N 1 0 318.848 4.133 20 10 DICDRO CC(C)[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(F)c(F)c1 ZINC000817957014 1042132784 /nfs/dbraw/zinc/13/27/84/1042132784.db2.gz HIWJBNFAFWXDBO-SFHVURJKSA-N 1 0 304.384 4.076 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1cc(Cl)ccc1OC ZINC000817956256 1042132877 /nfs/dbraw/zinc/13/28/77/1042132877.db2.gz UYPIUALJVIUDIU-KRWDZBQOSA-N 1 0 318.848 4.214 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1 ZINC000817967547 1042133406 /nfs/dbraw/zinc/13/34/06/1042133406.db2.gz KEKWNNFPFXJFFH-QVKFZJNVSA-N 1 0 323.484 4.453 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000817967801 1042133859 /nfs/dbraw/zinc/13/38/59/1042133859.db2.gz MEWBBIXUXUJSIW-SFTDATJTSA-N 1 0 323.484 4.453 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)c(O)c1 ZINC000817967187 1042134113 /nfs/dbraw/zinc/13/41/13/1042134113.db2.gz DRLDUHGLAFBYBN-KSSFIOAISA-N 1 0 310.441 4.319 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)cc(Cl)c1[O-] ZINC000817970009 1042134745 /nfs/dbraw/zinc/13/47/45/1042134745.db2.gz JMHZLWSMBRYCJP-GYSYKLTISA-N 1 0 317.260 4.010 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc2c1CCCN2)c1ccc(C)cc1O ZINC000817974865 1042134839 /nfs/dbraw/zinc/13/48/39/1042134839.db2.gz GXYKSCCVKXNHQG-GOSISDBHSA-N 1 0 310.441 4.300 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc3c2CCCN3)cc1 ZINC000817975200 1042134868 /nfs/dbraw/zinc/13/48/68/1042134868.db2.gz KBIQUYJNYSLVDL-INIZCTEOSA-N 1 0 323.484 4.352 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817969483 1042135225 /nfs/dbraw/zinc/13/52/25/1042135225.db2.gz DPYMRGCYTUIXRB-BREBYQMCSA-N 1 0 317.260 4.010 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@H]2CCCc3ccccc32)c1O ZINC000818259698 1042144961 /nfs/dbraw/zinc/14/49/61/1042144961.db2.gz JOYUWLBBPWRBDT-SFHVURJKSA-N 1 0 311.425 4.219 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH+]1CC(CC(F)F)C1 ZINC000822521118 1042289157 /nfs/dbraw/zinc/28/91/57/1042289157.db2.gz WUKISCCBDOCQDA-UHFFFAOYSA-N 1 0 303.352 4.146 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1O ZINC000279599313 1042323713 /nfs/dbraw/zinc/32/37/13/1042323713.db2.gz WBHGBGXGUIERAQ-BDAKNGLRSA-N 1 0 316.348 4.279 20 10 DICDRO Cc1cccc(C[NH2+][C@@H]2CCc3c(Cl)cccc3C2)c1O ZINC001171022015 1042335118 /nfs/dbraw/zinc/33/51/18/1042335118.db2.gz IOHKZJWHPPCVJA-OAHLLOKOSA-N 1 0 301.817 4.001 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H]2CCc3c(Cl)cccc3C2)c(O)c1 ZINC001171022252 1042336697 /nfs/dbraw/zinc/33/66/97/1042336697.db2.gz LIGJOINVHHVDCN-OAHLLOKOSA-N 1 0 315.844 4.310 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)c1O ZINC000279895066 1042349408 /nfs/dbraw/zinc/34/94/08/1042349408.db2.gz VMPHPIQMXZRLBJ-QGZVFWFLSA-N 1 0 315.388 4.097 20 10 DICDRO CSc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000178591074 1042351108 /nfs/dbraw/zinc/35/11/08/1042351108.db2.gz UKKOCNJUXZTUCU-AWEZNQCLSA-N 1 0 300.471 4.325 20 10 DICDRO CCOc1cccc(C[NH2+]C(C)(C)c2ccc(CC)cc2)c1O ZINC000236920089 1042411933 /nfs/dbraw/zinc/41/19/33/1042411933.db2.gz XTXFDSIODUMTSC-UHFFFAOYSA-N 1 0 313.441 4.378 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(C)o2)cc1F ZINC000236935774 1042414868 /nfs/dbraw/zinc/41/48/68/1042414868.db2.gz VXSIIAPDVUAGEW-CQSZACIVSA-N 1 0 304.409 4.424 20 10 DICDRO CC[C@@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc(OC)cc3)CC2)C1 ZINC000236963205 1042430065 /nfs/dbraw/zinc/43/00/65/1042430065.db2.gz GULRZCPFEFDLEP-SJLPKXTDSA-N 1 0 316.489 4.222 20 10 DICDRO CCc1ccc([C@H]([NH2+]Cc2cc(OC)ccc2O)C(C)C)cc1 ZINC000236986666 1042448032 /nfs/dbraw/zinc/44/80/32/1042448032.db2.gz YYONQGGXSLJHNR-HXUWFJFHSA-N 1 0 313.441 4.450 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2ncccc2c1)c1ccc(C)cc1O ZINC000280077224 1042564654 /nfs/dbraw/zinc/56/46/54/1042564654.db2.gz LLWYZGRCPXUZPS-GOSISDBHSA-N 1 0 306.409 4.490 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCOC)c1ccc(C)o1)c1ccc(C)cc1O ZINC000280272581 1042569310 /nfs/dbraw/zinc/56/93/10/1042569310.db2.gz YACQZRAZGCDAQV-IRXDYDNUSA-N 1 0 317.429 4.421 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(C)cc1O ZINC000280272596 1042569372 /nfs/dbraw/zinc/56/93/72/1042569372.db2.gz YAKYTMNENCXERN-LRDDRELGSA-N 1 0 302.418 4.150 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2OC(C)C)c1 ZINC000271790329 1042668461 /nfs/dbraw/zinc/66/84/61/1042668461.db2.gz HSVMICCLURKQKN-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(N(C)C)cc1 ZINC000271847902 1042669990 /nfs/dbraw/zinc/66/99/90/1042669990.db2.gz WYQLNCNGORWSEP-ZIAGYGMSSA-N 1 0 313.401 4.073 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C)cc(OC)c1O)c1ccc(F)cc1F ZINC000894282714 1042718236 /nfs/dbraw/zinc/71/82/36/1042718236.db2.gz CLDYOKMPKYTGHJ-MRXNPFEDSA-N 1 0 321.367 4.228 20 10 DICDRO COc1cc(C)cc(C[NH2+]C2(c3cccc(Cl)c3)CC2)c1O ZINC000894285570 1042721029 /nfs/dbraw/zinc/72/10/29/1042721029.db2.gz UYIBIJBLKZBLQB-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(OC(F)F)cc1 ZINC000295861759 1042914786 /nfs/dbraw/zinc/91/47/86/1042914786.db2.gz GPVCJTSOFVTQIV-XHDPSFHLSA-N 1 0 319.351 4.332 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](CC)c2ccc(C)cc2O)cc1F ZINC000794805032 1043049022 /nfs/dbraw/zinc/04/90/22/1043049022.db2.gz FHIYTRWMEQYEHO-KRWDZBQOSA-N 1 0 317.404 4.479 20 10 DICDRO Cc1ccc(C)n1-c1ccc(N(C(N)=[NH2+])c2ccc(F)cc2)cc1 ZINC001167990911 1043051870 /nfs/dbraw/zinc/05/18/70/1043051870.db2.gz BLWGPKIDFGOXEP-UHFFFAOYSA-N 1 0 322.387 4.265 20 10 DICDRO CC[C@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1ccc(C)cc1O ZINC000794805785 1043054152 /nfs/dbraw/zinc/05/41/52/1043054152.db2.gz YGZVNNMFZLNOOG-INIZCTEOSA-N 1 0 323.440 4.250 20 10 DICDRO CC[C@H]([NH2+][C@H](C)C[C@@H](O)c1ccccc1)c1ccc(C)cc1O ZINC000794809626 1043055490 /nfs/dbraw/zinc/05/54/90/1043055490.db2.gz HAHHVQBXIKWPNM-AYOQOUSVSA-N 1 0 313.441 4.254 20 10 DICDRO CC[C@H]([NH2+][C@H](C)C[C@H](O)c1ccccc1)c1ccc(C)cc1O ZINC000794809628 1043055599 /nfs/dbraw/zinc/05/55/99/1043055599.db2.gz HAHHVQBXIKWPNM-MNEFBYGVSA-N 1 0 313.441 4.254 20 10 DICDRO CC[C@@H]([NH2+]CCOc1ccc(F)c(F)c1)c1ccc(C)cc1O ZINC000794810100 1043055927 /nfs/dbraw/zinc/05/59/27/1043055927.db2.gz IYSKLSVYWBMRDF-QGZVFWFLSA-N 1 0 321.367 4.099 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(C)cc1O ZINC000794815209 1043059037 /nfs/dbraw/zinc/05/90/37/1043059037.db2.gz JLCXTJNGRPXZBU-ZJOUEHCJSA-N 1 0 324.468 4.187 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H](O)c1cccc(F)c1)c1ccc(C)cc1O ZINC000794816618 1043062073 /nfs/dbraw/zinc/06/20/73/1043062073.db2.gz NYZPYXBHMPTMJV-XVGQJIODSA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1ccc(C)cc1O ZINC000794818582 1043062258 /nfs/dbraw/zinc/06/22/58/1043062258.db2.gz VKCXLHLDYZPQKO-INIZCTEOSA-N 1 0 321.461 4.253 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H](O)c1cccc(F)c1)c1ccc(C)cc1O ZINC000794816605 1043062753 /nfs/dbraw/zinc/06/27/53/1043062753.db2.gz NYZPYXBHMPTMJV-FMEYXAORSA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCO)C1CCCCC1)c1ccc(C)cc1O ZINC000794811629 1043062887 /nfs/dbraw/zinc/06/28/87/1043062887.db2.gz SQHKKFSJIPPBQI-QZTJIDSGSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@H]([NH2+][C@H](CCO)C1CCCCC1)c1ccc(C)cc1O ZINC000794811631 1043063063 /nfs/dbraw/zinc/06/30/63/1043063063.db2.gz SQHKKFSJIPPBQI-ZWKOTPCHSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12)c1ccc(C)cc1O ZINC000794817736 1043063152 /nfs/dbraw/zinc/06/31/52/1043063152.db2.gz PUCGUVBWPWZPET-ABFRBSLYSA-N 1 0 323.527 4.121 20 10 DICDRO CC[C@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)c1c(C)noc1C ZINC000794820209 1043064766 /nfs/dbraw/zinc/06/47/66/1043064766.db2.gz YYXMCPASPJXFKW-HOTGVXAUSA-N 1 0 302.418 4.497 20 10 DICDRO C[C@@H]([NH2+]CCC1(C)CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000794828505 1043065554 /nfs/dbraw/zinc/06/55/54/1043065554.db2.gz PWULZVYPRVSZPI-CQSZACIVSA-N 1 0 322.880 4.017 20 10 DICDRO CC[C@H]([NH2+]C1CCC(OC(C)C)CC1)c1ccc(C)cc1O ZINC000794819661 1043065826 /nfs/dbraw/zinc/06/58/26/1043065826.db2.gz XBETWAUSPUHTMN-HTWSVDAQSA-N 1 0 305.462 4.478 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000777288320 1043075901 /nfs/dbraw/zinc/07/59/01/1043075901.db2.gz RVERNJJGSPHJSM-INIZCTEOSA-N 1 0 311.473 4.296 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(CO)c1)c1ccc(N2CCCCC2)cc1 ZINC000177838249 1043115157 /nfs/dbraw/zinc/11/51/57/1043115157.db2.gz RJLXQFUNJZHIFC-QGZVFWFLSA-N 1 0 324.468 4.020 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)nc2)cc1 ZINC000178247326 1043123847 /nfs/dbraw/zinc/12/38/47/1043123847.db2.gz PBJOZKZBPFQDGB-CYBMUJFWSA-N 1 0 303.837 4.042 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2ccccc2n1 ZINC000178377879 1043127227 /nfs/dbraw/zinc/12/72/27/1043127227.db2.gz PTMSLLJKTMHQDV-HNNXBMFYSA-N 1 0 305.425 4.152 20 10 DICDRO C[C@H]([NH2+]Cc1ccoc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000178474616 1043131744 /nfs/dbraw/zinc/13/17/44/1043131744.db2.gz VRCLLYZJYPEMCW-AWEZNQCLSA-N 1 0 302.393 4.260 20 10 DICDRO CCOCc1cc(C[NH2+]CC(C)(C)C(C)(F)F)ccc1OC ZINC000865789934 1043134956 /nfs/dbraw/zinc/13/49/56/1043134956.db2.gz AUVGHBIEKNNVPR-UHFFFAOYSA-N 1 0 315.404 4.003 20 10 DICDRO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cc2cnccc2o1 ZINC000865854561 1043141519 /nfs/dbraw/zinc/14/15/19/1043141519.db2.gz QEMZNOZTBAXGQW-MBVDDHJVSA-N 1 0 321.424 4.258 20 10 DICDRO COc1cc(C)c([C@@H](C)[NH2+][C@H](C)c2ccccc2O)cc1OC ZINC000183418665 1043162216 /nfs/dbraw/zinc/16/22/16/1043162216.db2.gz DSWRJVVBWXMSIA-ZIAGYGMSSA-N 1 0 315.413 4.130 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(NC(=O)C2CC2)cc1 ZINC000183397127 1043162615 /nfs/dbraw/zinc/16/26/15/1043162615.db2.gz PGXJGZUYLPEUBB-KBPBESRZSA-N 1 0 324.424 4.153 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(NC(=O)C2CC2)cc1 ZINC000183397178 1043163021 /nfs/dbraw/zinc/16/30/21/1043163021.db2.gz PGXJGZUYLPEUBB-ZIAGYGMSSA-N 1 0 324.424 4.153 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOc2c(Cl)cccc21)c1ccccc1O ZINC000183459023 1043165130 /nfs/dbraw/zinc/16/51/30/1043165130.db2.gz NQZQSYHVDZBABZ-XHDPSFHLSA-N 1 0 303.789 4.220 20 10 DICDRO Cc1ccccc1CN1CCC([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000183427802 1043165291 /nfs/dbraw/zinc/16/52/91/1043165291.db2.gz PAHCPAUTDSFEPT-KRWDZBQOSA-N 1 0 324.468 4.016 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cccc(N2CCCC2)c1 ZINC000183553209 1043166831 /nfs/dbraw/zinc/16/68/31/1043166831.db2.gz UJFGLDQFXIIXHY-HZPDHXFCSA-N 1 0 310.441 4.404 20 10 DICDRO C[C@H]([NH2+]CCc1csc(C(C)(C)C)n1)c1ccccc1O ZINC000183633970 1043168123 /nfs/dbraw/zinc/16/81/23/1043168123.db2.gz SOKBMBPCEANHIS-LBPRGKRZSA-N 1 0 304.459 4.040 20 10 DICDRO CCCOCc1ccccc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185062968 1043194435 /nfs/dbraw/zinc/19/44/35/1043194435.db2.gz FMQTXQHIBRBNLQ-INIZCTEOSA-N 1 0 313.441 4.478 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2csc(C(C)C)n2)c1 ZINC000185310166 1043198067 /nfs/dbraw/zinc/19/80/67/1043198067.db2.gz FSAMJUPLXVIFIU-ZDUSSCGKSA-N 1 0 304.459 4.174 20 10 DICDRO COc1cc(C)cc(C[NH2+]C2(c3ccccc3Cl)CC2)c1O ZINC000895076470 1043199369 /nfs/dbraw/zinc/19/93/69/1043199369.db2.gz QRJBXQQVDZDYAL-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2oc3ccccc3c2C)c1 ZINC000185456898 1043201416 /nfs/dbraw/zinc/20/14/16/1043201416.db2.gz NEZNPLJZYUZIML-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc2c(cc1O)CCCC2)c1ccncc1 ZINC000185541452 1043202366 /nfs/dbraw/zinc/20/23/66/1043202366.db2.gz UKJNQNKKQNMUJO-KUHUBIRLSA-N 1 0 310.441 4.468 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCC(OC(C)(C)C)CC2)c1 ZINC000866451388 1043203194 /nfs/dbraw/zinc/20/31/94/1043203194.db2.gz SKRQMBLNZXMVCZ-NFOMZHRRSA-N 1 0 321.461 4.178 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(-n3cccn3)cc2)c(O)c1 ZINC000185611962 1043204068 /nfs/dbraw/zinc/20/40/68/1043204068.db2.gz ZHKVUQLURSVGIV-CVEARBPZSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C2CCC(OC(C)(C)C)CC2)c1 ZINC000866451758 1043204544 /nfs/dbraw/zinc/20/45/44/1043204544.db2.gz XTXXULKMAANJMV-FHERZECASA-N 1 0 305.462 4.478 20 10 DICDRO COc1cc(C[NH2+][C@H](C)c2cc(C)ccc2O)c2ccccc2n1 ZINC000185573733 1043205561 /nfs/dbraw/zinc/20/55/61/1043205561.db2.gz ZCXSJPPIKAEXJU-CQSZACIVSA-N 1 0 322.408 4.108 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC2([C@H]3CCCCO3)CCC2)c(O)c1 ZINC000866480173 1043208837 /nfs/dbraw/zinc/20/88/37/1043208837.db2.gz AFKQENVZLXVAMF-CRAIPNDOSA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866480599 1043208880 /nfs/dbraw/zinc/20/88/80/1043208880.db2.gz FVZMEAHXDBMEIC-FUHWJXTLSA-N 1 0 303.446 4.172 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2([C@@H]3CCCCO3)CCC2)c1 ZINC000866480814 1043209509 /nfs/dbraw/zinc/20/95/09/1043209509.db2.gz ISOHUCJTKRTRTL-YJBOKZPZSA-N 1 0 303.446 4.091 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(OCC(F)F)c2)c1 ZINC000185982412 1043211216 /nfs/dbraw/zinc/21/12/16/1043211216.db2.gz WCCMHKCMDCQSSO-CYBMUJFWSA-N 1 0 321.367 4.195 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c(O)c1 ZINC000186010120 1043211804 /nfs/dbraw/zinc/21/18/04/1043211804.db2.gz PIFMLGSSTXIVLK-WBMJQRKESA-N 1 0 301.361 4.014 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1cc(Cl)ccc1O ZINC000186009170 1043212671 /nfs/dbraw/zinc/21/26/71/1043212671.db2.gz LXEVBYWFHJVBPL-BMIGLBTASA-N 1 0 321.779 4.359 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1Cl ZINC000186120610 1043214007 /nfs/dbraw/zinc/21/40/07/1043214007.db2.gz FTYMSGLFZJLHBQ-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1[N+](=O)[O-] ZINC000186093174 1043214076 /nfs/dbraw/zinc/21/40/76/1043214076.db2.gz LZBFWFJXPFMRPU-RYUDHWBXSA-N 1 0 318.348 4.160 20 10 DICDRO CC[C@@H]([NH2+]Cc1noc2ccc(F)cc21)c1ccc(C)cc1O ZINC000866510527 1043214446 /nfs/dbraw/zinc/21/44/46/1043214446.db2.gz DRRABPNXHOMPLV-OAHLLOKOSA-N 1 0 314.360 4.222 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cccc(OC)c1OC ZINC000866509026 1043214564 /nfs/dbraw/zinc/21/45/64/1043214564.db2.gz UJURQXQNYRDRKS-CZUORRHYSA-N 1 0 315.413 4.211 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1cc(Cl)ccc1O ZINC000186128971 1043215310 /nfs/dbraw/zinc/21/53/10/1043215310.db2.gz PWICMWLACAJEQN-GXTWGEPZSA-N 1 0 309.837 4.188 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000186092678 1043215363 /nfs/dbraw/zinc/21/53/63/1043215363.db2.gz WOXHKRKFXJDYRN-KGLIPLIRSA-N 1 0 314.385 4.329 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000186216475 1043216282 /nfs/dbraw/zinc/21/62/82/1043216282.db2.gz OCNXTCOBAXGNMX-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000186155429 1043216517 /nfs/dbraw/zinc/21/65/17/1043216517.db2.gz OCDRLHCIOLVJST-OAHLLOKOSA-N 1 0 313.441 4.403 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(F)c(F)c1 ZINC000186225637 1043216658 /nfs/dbraw/zinc/21/66/58/1043216658.db2.gz HAFNICKTGVWEPC-YVEFUNNKSA-N 1 0 321.367 4.017 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2F)c1 ZINC000186207965 1043217354 /nfs/dbraw/zinc/21/73/54/1043217354.db2.gz PESKDXUAAIWQGL-GHMZBOCLSA-N 1 0 307.340 4.091 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccccc1O ZINC000186268795 1043219396 /nfs/dbraw/zinc/21/93/96/1043219396.db2.gz JMLQXURCIVIYSM-CVEARBPZSA-N 1 0 301.361 4.096 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccc(C)cc1O ZINC000866540359 1043219856 /nfs/dbraw/zinc/21/98/56/1043219856.db2.gz MQZUHLROYTYLQY-INIZCTEOSA-N 1 0 314.385 4.158 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(O)c1 ZINC000866540961 1043220089 /nfs/dbraw/zinc/22/00/89/1043220089.db2.gz VKUDCVFCWUWYNQ-AWEZNQCLSA-N 1 0 314.385 4.076 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(O)c1 ZINC000866540962 1043220358 /nfs/dbraw/zinc/22/03/58/1043220358.db2.gz VKUDCVFCWUWYNQ-CQSZACIVSA-N 1 0 314.385 4.076 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2noc3cc(F)ccc32)c(O)c1C ZINC000866612785 1043235502 /nfs/dbraw/zinc/23/55/02/1043235502.db2.gz OBFFOJLNVPGENB-GFCCVEGCSA-N 1 0 314.360 4.140 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc2ccccc2c1O ZINC000121991655 1043273247 /nfs/dbraw/zinc/27/32/47/1043273247.db2.gz IVVKIAVJRFWVMX-SCLBCKFNSA-N 1 0 301.455 4.482 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000194257083 1043290879 /nfs/dbraw/zinc/29/08/79/1043290879.db2.gz XJPOKOZLBGRYAJ-BLLLJJGKSA-N 1 0 305.805 4.084 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCSc2ccccc21 ZINC000122686787 1043322076 /nfs/dbraw/zinc/32/20/76/1043322076.db2.gz RVBNBUJUFVVPIJ-SFHVURJKSA-N 1 0 312.482 4.388 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(CCOC)CCC2)cc1 ZINC000122977763 1043338510 /nfs/dbraw/zinc/33/85/10/1043338510.db2.gz DMXZZAXASNLNSM-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000271580701 1043439057 /nfs/dbraw/zinc/43/90/57/1043439057.db2.gz QWJWFFDZEVGUAW-FGTMMUONSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)s1)c1cc(F)ccc1O ZINC000872107324 1043461304 /nfs/dbraw/zinc/46/13/04/1043461304.db2.gz LLOSMYHRRAPKPP-MRVPVSSYSA-N 1 0 319.323 4.462 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc3ncccc23)c(O)c1C ZINC000872124935 1043471143 /nfs/dbraw/zinc/47/11/43/1043471143.db2.gz VPXCRDUPSSUZEL-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2cnc(C)s2)cc1C ZINC000873150873 1043519105 /nfs/dbraw/zinc/51/91/05/1043519105.db2.gz RIXVSQWYLVKDBW-CYBMUJFWSA-N 1 0 304.459 4.400 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2(c3cccc(Cl)c3)CC2)c1 ZINC000124417497 1043520366 /nfs/dbraw/zinc/52/03/66/1043520366.db2.gz CITRLOSHZDCQEH-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC000124408691 1043522441 /nfs/dbraw/zinc/52/24/41/1043522441.db2.gz RDJVBSXIWNCJKI-QWHCGFSZSA-N 1 0 304.384 4.443 20 10 DICDRO Oc1ccccc1C[NH2+]C1(c2ccc(F)cc2F)CCCC1 ZINC000124703635 1043561859 /nfs/dbraw/zinc/56/18/59/1043561859.db2.gz RCFPQBWRAWHMEJ-UHFFFAOYSA-N 1 0 303.352 4.230 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1F ZINC000124818895 1043571231 /nfs/dbraw/zinc/57/12/31/1043571231.db2.gz VTGXUNSORFCAIP-UONOGXRCSA-N 1 0 316.420 4.312 20 10 DICDRO C[C@@H]([NH2+]Cc1ccco1)c1ccc(N2CCCCC2)c(F)c1 ZINC000020550975 1043596883 /nfs/dbraw/zinc/59/68/83/1043596883.db2.gz NRAMWDUZZFTLKC-CQSZACIVSA-N 1 0 302.393 4.260 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2cc[nH]c(=O)c2)c(C)n1-c1ccccc1 ZINC000926764711 1043628181 /nfs/dbraw/zinc/62/81/81/1043628181.db2.gz KYPIEPCFDFURAN-OAHLLOKOSA-N 1 0 321.424 4.046 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2C)c1O ZINC000926897049 1043650211 /nfs/dbraw/zinc/65/02/11/1043650211.db2.gz COLRFLKBUGRAIZ-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cc(Cl)ccc1O ZINC000926921573 1043657959 /nfs/dbraw/zinc/65/79/59/1043657959.db2.gz VPPXHLQRNCNMKJ-JTQLQIEISA-N 1 0 322.861 4.232 20 10 DICDRO Cc1nc2c(cccc2CC[NH2+][C@H](C)c2ccc(C)cc2O)o1 ZINC000926976486 1043665359 /nfs/dbraw/zinc/66/53/59/1043665359.db2.gz VXKBOBRMLXRGSH-CYBMUJFWSA-N 1 0 310.397 4.044 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccc(N(C)C)cc1 ZINC000927059375 1043676239 /nfs/dbraw/zinc/67/62/39/1043676239.db2.gz DPRCVFHKODGDTK-RTBURBONSA-N 1 0 309.457 4.266 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCCc3cccnc32)cc1 ZINC000927062513 1043678009 /nfs/dbraw/zinc/67/80/09/1043678009.db2.gz IGEBPKAUJSZFEK-BEFAXECRSA-N 1 0 309.457 4.266 20 10 DICDRO CCc1onc(C)c1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000927135767 1043696385 /nfs/dbraw/zinc/69/63/85/1043696385.db2.gz UOLDADUBOPCDLT-GFCCVEGCSA-N 1 0 310.397 4.255 20 10 DICDRO Cc1cccc(O)c1C[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000876912651 1043723417 /nfs/dbraw/zinc/72/34/17/1043723417.db2.gz XIJSYSVICHRTAU-OAHLLOKOSA-N 1 0 303.402 4.166 20 10 DICDRO Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000877110584 1043745637 /nfs/dbraw/zinc/74/56/37/1043745637.db2.gz ZIWLVSPFVYTYOY-HNNXBMFYSA-N 1 0 321.424 4.046 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc3c(cccc3C)[nH]2)c1 ZINC000825935398 1043747028 /nfs/dbraw/zinc/74/70/28/1043747028.db2.gz SHZITMWWKMSQES-ZDUSSCGKSA-N 1 0 310.397 4.041 20 10 DICDRO Cc1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)c(O)c1 ZINC000877590252 1043778997 /nfs/dbraw/zinc/77/89/97/1043778997.db2.gz XMLWBOLCOOKYNH-FQEVSTJZSA-N 1 0 323.436 4.054 20 10 DICDRO Cc1cccc(O)c1C[NH2+]Cc1csc(C(F)(F)F)c1 ZINC000877658950 1043785896 /nfs/dbraw/zinc/78/58/96/1043785896.db2.gz ZBCMYZCADJSIDJ-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO Cc1nn(-c2ccc(C)cc2)cc1C[NH2+][C@@H](C)c1ccccc1O ZINC000877758043 1043791980 /nfs/dbraw/zinc/79/19/80/1043791980.db2.gz GNSRQIUKPRQIGE-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccc1O ZINC000877756332 1043792265 /nfs/dbraw/zinc/79/22/65/1043792265.db2.gz HTTKMJHTTSAVOM-MRXNPFEDSA-N 1 0 310.441 4.233 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(OC(F)(F)F)c1)c1ccccc1O ZINC000877756490 1043792988 /nfs/dbraw/zinc/79/29/88/1043792988.db2.gz MDAPBCRFUSFBSA-LLVKDONJSA-N 1 0 311.303 4.142 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1F)c1ccccc1O ZINC000877756538 1043793456 /nfs/dbraw/zinc/79/34/56/1043793456.db2.gz QBECHBBYHAWFOH-SNVBAGLBSA-N 1 0 313.294 4.401 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(OC)cc1OC)c1ccccc1O ZINC000319560388 1043798868 /nfs/dbraw/zinc/79/88/68/1043798868.db2.gz KSJRLMAMISEBAD-SUMWQHHRSA-N 1 0 315.413 4.211 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)n1 ZINC000127010242 1043799258 /nfs/dbraw/zinc/79/92/58/1043799258.db2.gz ZTVYTMLYWDDYPM-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)c2cccs2)c1 ZINC000127056249 1043872502 /nfs/dbraw/zinc/87/25/02/1043872502.db2.gz OKAUMHQMTFACFR-LBPRGKRZSA-N 1 0 305.443 4.091 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@H](c3cccnc3)C3CCC3)ccc21 ZINC000280984829 1044088462 /nfs/dbraw/zinc/08/84/62/1044088462.db2.gz WLXAVNPXESDVNT-NRFANRHFSA-N 1 0 321.468 4.095 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c(O)c1 ZINC000281127693 1044099708 /nfs/dbraw/zinc/09/97/08/1044099708.db2.gz NCOQECDLIFDXRB-SECBINFHSA-N 1 0 313.294 4.108 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2OCCc3sccc32)c(O)c1 ZINC000291953379 1044119863 /nfs/dbraw/zinc/11/98/63/1044119863.db2.gz RBRGXTNNZLXNFO-LXIYXOSZSA-N 1 0 317.454 4.115 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000359004619 1044120652 /nfs/dbraw/zinc/12/06/52/1044120652.db2.gz ULJGPXYAABAOCX-GOSISDBHSA-N 1 0 320.436 4.490 20 10 DICDRO CCC(CC)[C@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000778119713 1044158722 /nfs/dbraw/zinc/15/87/22/1044158722.db2.gz XWBGVTRLWVCJIU-SUMWQHHRSA-N 1 0 311.853 4.119 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2CCCc3sc(Cl)cc32)c1 ZINC000292691926 1044198873 /nfs/dbraw/zinc/19/88/73/1044198873.db2.gz BOBYHWGJSZXSQX-CYBMUJFWSA-N 1 0 323.845 4.283 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1c(O)cccc1Cl ZINC000883258213 1044247830 /nfs/dbraw/zinc/24/78/30/1044247830.db2.gz UJYYCJVCVPEERQ-UHFFFAOYSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c(Cl)n1 ZINC000883302520 1044263863 /nfs/dbraw/zinc/26/38/63/1044263863.db2.gz ZYULDXFLSUAEMV-ZANVPECISA-N 1 0 320.795 4.226 20 10 DICDRO COC[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000883321242 1044273641 /nfs/dbraw/zinc/27/36/41/1044273641.db2.gz VKAIOMWNWXWKHG-LMMKCTJWSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@@H]([NH2+][C@H](Cn1ccnc1)c1ccccc1)c1ccccc1O ZINC000883387813 1044304003 /nfs/dbraw/zinc/30/40/03/1044304003.db2.gz FNWOEXIUXMRTBI-RTBURBONSA-N 1 0 321.424 4.071 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccc(OC)cc1 ZINC000192786255 1044309395 /nfs/dbraw/zinc/30/93/95/1044309395.db2.gz QFKDMEHUQLOPDM-SCLBCKFNSA-N 1 0 315.413 4.211 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccc(N(C)C)cc1 ZINC000132193409 1044317672 /nfs/dbraw/zinc/31/76/72/1044317672.db2.gz NRYNCJGAGFPNCO-CYBMUJFWSA-N 1 0 321.515 4.042 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2cccc(C(F)(F)F)n2)c1 ZINC000293720600 1044320252 /nfs/dbraw/zinc/32/02/52/1044320252.db2.gz NOAWKYDWKRJZLV-GFCCVEGCSA-N 1 0 324.346 4.008 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2cc(C(F)(F)F)ccn2)c1 ZINC000293723983 1044320489 /nfs/dbraw/zinc/32/04/89/1044320489.db2.gz NWTVWBSKIDLWSI-LBPRGKRZSA-N 1 0 324.346 4.008 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2OC(F)F)c(O)c1 ZINC000192931933 1044405132 /nfs/dbraw/zinc/40/51/32/1044405132.db2.gz ZUXZMOSGUDLHTH-GFCCVEGCSA-N 1 0 307.340 4.153 20 10 DICDRO C[C@@H]([NH2+]CCc1cccnc1)c1ccc(N2CCCCCC2)cc1 ZINC000133524640 1044411430 /nfs/dbraw/zinc/41/14/30/1044411430.db2.gz GOXLMQCFGDYQCQ-GOSISDBHSA-N 1 0 323.484 4.355 20 10 DICDRO C[C@H]([NH2+]CCc1cccnc1)c1ccc(N2CCCCCC2)cc1 ZINC000133524466 1044411667 /nfs/dbraw/zinc/41/16/67/1044411667.db2.gz GOXLMQCFGDYQCQ-SFHVURJKSA-N 1 0 323.484 4.355 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1nc(C)cs1 ZINC000294373445 1044413375 /nfs/dbraw/zinc/41/33/75/1044413375.db2.gz BCTYGOOBYSNEGL-HNNXBMFYSA-N 1 0 303.475 4.067 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000294827925 1044463223 /nfs/dbraw/zinc/46/32/23/1044463223.db2.gz QUSFVNZGFRZLNW-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(O)c1 ZINC000294870497 1044468120 /nfs/dbraw/zinc/46/81/20/1044468120.db2.gz UGWRXNQDAUTEIQ-ZDUSSCGKSA-N 1 0 304.459 4.440 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)ccc1OC ZINC000215919537 1044541941 /nfs/dbraw/zinc/54/19/41/1044541941.db2.gz SPUSKLWFTXIYDZ-RVKKMQEKSA-N 1 0 305.462 4.146 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]CCC1CC(OC(C)(C)C)C1 ZINC000840941640 1044543773 /nfs/dbraw/zinc/54/37/73/1044543773.db2.gz FWRMPHOCYJQBTM-UHFFFAOYSA-N 1 0 318.505 4.134 20 10 DICDRO Oc1ccc2cc(Br)ccc2c1C[N@H+]1CC=CCC1 ZINC000778576231 1044552351 /nfs/dbraw/zinc/55/23/51/1044552351.db2.gz IKKNNGKSMXOJOS-UHFFFAOYSA-N 1 0 318.214 4.070 20 10 DICDRO CC(C)OCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000216484326 1044558574 /nfs/dbraw/zinc/55/85/74/1044558574.db2.gz UQTGCWLEBTYUOF-QGZVFWFLSA-N 1 0 313.441 4.380 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCCO[C@H]1c1ccccc1)CC2 ZINC000296170463 1044596408 /nfs/dbraw/zinc/59/64/08/1044596408.db2.gz XQIDVCXPHWDWSK-OPYAIIAOSA-N 1 0 323.436 4.137 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)cc1 ZINC000136681701 1044609846 /nfs/dbraw/zinc/60/98/46/1044609846.db2.gz WIOKHLFXXVTKSW-SFHVURJKSA-N 1 0 316.489 4.114 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc3cccc(Cl)c3n1)CC2 ZINC001137228299 1044633345 /nfs/dbraw/zinc/63/33/45/1044633345.db2.gz MYTBUMQONWFPGF-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCCOc3cc(F)ccc31)CC2 ZINC000296714222 1044643961 /nfs/dbraw/zinc/64/39/61/1044643961.db2.gz IJKLIHFWGZSHBE-HZPDHXFCSA-N 1 0 313.372 4.022 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCCOc3cc(F)ccc31)CC2 ZINC000296714206 1044644492 /nfs/dbraw/zinc/64/44/92/1044644492.db2.gz IJKLIHFWGZSHBE-CVEARBPZSA-N 1 0 313.372 4.022 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1cc(Cl)ccc1O ZINC000886684802 1044679065 /nfs/dbraw/zinc/67/90/65/1044679065.db2.gz SRDCSSIMGLMGHX-CQSZACIVSA-N 1 0 306.793 4.152 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c(O)c1 ZINC000886774475 1044697170 /nfs/dbraw/zinc/69/71/70/1044697170.db2.gz ODHYYYQKMQEGKO-YJBOKZPZSA-N 1 0 303.446 4.091 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c1 ZINC000886774796 1044697355 /nfs/dbraw/zinc/69/73/55/1044697355.db2.gz VVMUIGUQXVAEBG-YJBOKZPZSA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](c1ccco1)N(CC)CC)c1ccccc1O ZINC000155455372 1044698840 /nfs/dbraw/zinc/69/88/40/1044698840.db2.gz HERCDQLZKJDHFS-IRXDYDNUSA-N 1 0 316.445 4.109 20 10 DICDRO CC[C@H]([NH2+]CCCCOCc1ccccc1)c1ccccc1O ZINC000155501026 1044702117 /nfs/dbraw/zinc/70/21/17/1044702117.db2.gz ZFIQSSWKRSJDPT-IBGZPJMESA-N 1 0 313.441 4.430 20 10 DICDRO CC[C@@H]([NH2+]CCCSc1nccs1)c1ccccc1O ZINC000155890591 1044738479 /nfs/dbraw/zinc/73/84/79/1044738479.db2.gz VCHCSHKXQYWPHU-CYBMUJFWSA-N 1 0 308.472 4.072 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)c2c(C)noc2C)cc1 ZINC000090764625 1044751014 /nfs/dbraw/zinc/75/10/14/1044751014.db2.gz VRYLZTYISZUDDA-ZIAGYGMSSA-N 1 0 315.461 4.202 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCCS1)c1ccc2ccccc2c1O ZINC000156318204 1044789882 /nfs/dbraw/zinc/78/98/82/1044789882.db2.gz HZFQHYAWYQNPHN-ZFWWWQNUSA-N 1 0 301.455 4.482 20 10 DICDRO C[C@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)C1CCC1 ZINC000370636069 1044846641 /nfs/dbraw/zinc/84/66/41/1044846641.db2.gz FEEISBOIQDVNSX-ZDUSSCGKSA-N 1 0 324.415 4.035 20 10 DICDRO C[N@H+](Cc1ccc(Cl)s1)Cc1c(O)ccc2ccncc21 ZINC000021969844 1044857685 /nfs/dbraw/zinc/85/76/85/1044857685.db2.gz XZMRAUBSPOMSGZ-UHFFFAOYSA-N 1 0 318.829 4.287 20 10 DICDRO Cc1cc(C[N@H+](C)CCc2nccs2)c(O)c(C(C)(C)C)c1 ZINC000157142912 1044882511 /nfs/dbraw/zinc/88/25/11/1044882511.db2.gz CNBSFGSSXKCNKW-UHFFFAOYSA-N 1 0 318.486 4.129 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCc2cnn(C(C)C)c21)c1ccccc1O ZINC000373456158 1044978523 /nfs/dbraw/zinc/97/85/23/1044978523.db2.gz YNLVAAKTKRBVTP-SJORKVTESA-N 1 0 313.445 4.288 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ccc(N2CCCCC2)cc1 ZINC000152401521 1045040987 /nfs/dbraw/zinc/04/09/87/1045040987.db2.gz OWOHQNNOIFVZAW-SJORKVTESA-N 1 0 309.457 4.484 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccn1 ZINC000158885161 1045080787 /nfs/dbraw/zinc/08/07/87/1045080787.db2.gz CGAQIMCPWSKNQL-SFHVURJKSA-N 1 0 309.457 4.095 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000778995298 1045110731 /nfs/dbraw/zinc/11/07/31/1045110731.db2.gz QUSVWCJTYFCWFW-HNNXBMFYSA-N 1 0 324.449 4.382 20 10 DICDRO Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H]2CC=CCC2)c1O ZINC000779032274 1045177074 /nfs/dbraw/zinc/17/70/74/1045177074.db2.gz OHDSVHSLAQZSAG-DGCLKSJQSA-N 1 0 310.235 4.222 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1F ZINC000779044519 1045199250 /nfs/dbraw/zinc/19/92/50/1045199250.db2.gz XENMDLPGPKQCDX-QGZVFWFLSA-N 1 0 304.384 4.272 20 10 DICDRO Cc1cc(Br)cc([C@H](C)[NH2+]C2(C3CC3)CC2)c1O ZINC000779045672 1045201372 /nfs/dbraw/zinc/20/13/72/1045201372.db2.gz NAYDSKZOHNSOHV-JTQLQIEISA-N 1 0 310.235 4.056 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1ccc(N2CCCCC2)cc1 ZINC000779079023 1045254895 /nfs/dbraw/zinc/25/48/95/1045254895.db2.gz JVHQVOXCSOSPJA-LPHOPBHVSA-N 1 0 316.489 4.285 20 10 DICDRO COCCC1CC[NH+]([C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000527933124 1045287173 /nfs/dbraw/zinc/28/71/73/1045287173.db2.gz HQZNBXAIIFTXSX-OAHLLOKOSA-N 1 0 313.441 4.355 20 10 DICDRO CCOc1cccc(C[NH+]2CCC(c3ccsc3)CC2)c1O ZINC000188693835 1045338399 /nfs/dbraw/zinc/33/83/99/1045338399.db2.gz XFJJPTJBRMGILP-UHFFFAOYSA-N 1 0 317.454 4.232 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(CSC)c2)c1 ZINC000188725577 1045339862 /nfs/dbraw/zinc/33/98/62/1045339862.db2.gz BAMFLFPUEKZRFZ-CYBMUJFWSA-N 1 0 317.454 4.115 20 10 DICDRO Nc1ccc(C[N@@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)cc1 ZINC001120264030 1045536782 /nfs/dbraw/zinc/53/67/82/1045536782.db2.gz ZZFBGDDFNJLUGP-KRWDZBQOSA-N 1 0 305.425 4.130 20 10 DICDRO Nc1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)cc1 ZINC001120269572 1045538062 /nfs/dbraw/zinc/53/80/62/1045538062.db2.gz UBENRJIDVDFKGD-UHFFFAOYSA-N 1 0 302.368 4.106 20 10 DICDRO Nc1ccc(C[NH2+][C@H](c2ccccc2)C2(CO)CCCCC2)cc1 ZINC001120269631 1045538085 /nfs/dbraw/zinc/53/80/85/1045538085.db2.gz WKMDLPAKWTZCCA-HXUWFJFHSA-N 1 0 324.468 4.043 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(Br)cc2C)c1 ZINC000113340870 1045561055 /nfs/dbraw/zinc/56/10/55/1045561055.db2.gz HOZWYVMHPUKAEJ-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)[C@@H]2CC3CCC2CC3)c1O ZINC000381911007 1045584757 /nfs/dbraw/zinc/58/47/57/1045584757.db2.gz NIBJYOMSDAFEIC-GIOUXUJVSA-N 1 0 303.446 4.095 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@H]2CC3CCC2CC3)c1 ZINC000381908445 1045584933 /nfs/dbraw/zinc/58/49/33/1045584933.db2.gz NDMNVOMUHFSJMS-HYRMGMASSA-N 1 0 303.446 4.266 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)[C@H]2CC3CCC2CC3)c1O ZINC000381911001 1045585473 /nfs/dbraw/zinc/58/54/73/1045585473.db2.gz NIBJYOMSDAFEIC-ARAOSMHQSA-N 1 0 303.446 4.095 20 10 DICDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)cc1F ZINC000751148523 1045585425 /nfs/dbraw/zinc/58/54/25/1045585425.db2.gz WCIIJLGNEAPBIH-UHFFFAOYSA-N 1 0 322.374 4.195 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)cc(Cl)n2)cc1 ZINC000800283398 1045603951 /nfs/dbraw/zinc/60/39/51/1045603951.db2.gz PEUGILAAKRSVJS-UHFFFAOYSA-N 1 0 317.864 4.179 20 10 DICDRO Cc1ccc(O)c(C[NH2+]CCCc2c[nH]c3ccc(F)cc23)c1 ZINC000800302549 1045608004 /nfs/dbraw/zinc/60/80/04/1045608004.db2.gz YNKPAOXAJHCIJK-UHFFFAOYSA-N 1 0 312.388 4.043 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2O)ccc1Br ZINC000800368989 1045611659 /nfs/dbraw/zinc/61/16/59/1045611659.db2.gz HNKFLMRSSYEATP-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)c2c1c(F)ccc2O ZINC000800494528 1045632185 /nfs/dbraw/zinc/63/21/85/1045632185.db2.gz XETVRVPVUXPUMG-WZRBSPASSA-N 1 0 313.363 4.495 20 10 DICDRO C[C@H]1CCCN(c2ccc(C[NH2+][C@@H]3CCSC3)cc2Cl)C1 ZINC000800494647 1045633469 /nfs/dbraw/zinc/63/34/69/1045633469.db2.gz YEIKKPJPCFJFAW-DZGCQCFKSA-N 1 0 324.921 4.171 20 10 DICDRO C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)c1cc(Cl)ccc1O ZINC000800501445 1045634814 /nfs/dbraw/zinc/63/48/14/1045634814.db2.gz QDAKAFRJPKSQFR-GFCCVEGCSA-N 1 0 314.816 4.420 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCCC23CCOCC3)cc1 ZINC000800498422 1045635445 /nfs/dbraw/zinc/63/54/45/1045635445.db2.gz JRGGQGGFDCIHKF-QFBILLFUSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCc2cccc3[nH]ccc32)c2c1c(F)ccc2O ZINC000800499976 1045635595 /nfs/dbraw/zinc/63/55/95/1045635595.db2.gz LVJOOSSHPZAKQG-PXAZEXFGSA-N 1 0 324.399 4.393 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCC12CCOCC2)c1cc(Cl)ccc1O ZINC000800498483 1045635692 /nfs/dbraw/zinc/63/56/92/1045635692.db2.gz LCOLAJUTHTUITC-WBVHZDCISA-N 1 0 323.864 4.436 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000800857196 1045659695 /nfs/dbraw/zinc/65/96/95/1045659695.db2.gz IRNWQNSUNFWHQY-HXUWFJFHSA-N 1 0 322.383 4.011 20 10 DICDRO CCC(CC)(CCO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000800894666 1045664360 /nfs/dbraw/zinc/66/43/60/1045664360.db2.gz FWDAJOZKYVBFJE-UHFFFAOYSA-N 1 0 313.441 4.090 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3ccccc3OC2)c(O)c1C ZINC000800987452 1045677461 /nfs/dbraw/zinc/67/74/61/1045677461.db2.gz XVQCBLHWTWSDQJ-WBVHZDCISA-N 1 0 311.425 4.053 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](O)c1cc(C)cc(C)c1)c1ccc(C)cc1O ZINC000800991364 1045678551 /nfs/dbraw/zinc/67/85/51/1045678551.db2.gz FXQPQDFRSUVTEA-UYAOXDASSA-N 1 0 313.441 4.092 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000078379002 1045695652 /nfs/dbraw/zinc/69/56/52/1045695652.db2.gz UQLVHFBOQIMLIK-OAQYLSRUSA-N 1 0 324.468 4.154 20 10 DICDRO Oc1ccc2ccncc2c1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000753108851 1045725930 /nfs/dbraw/zinc/72/59/30/1045725930.db2.gz KDXDTIPUZAEDLR-UHFFFAOYSA-N 1 0 324.346 4.105 20 10 DICDRO Oc1cc2c(cc1C[N@H+](CCC(F)(F)F)CC1CC1)CCC2 ZINC000753104839 1045726265 /nfs/dbraw/zinc/72/62/65/1045726265.db2.gz HGCPRCSGTQFBHE-UHFFFAOYSA-N 1 0 313.363 4.045 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](c3cc(C)cc(C)c3)C2)c1O ZINC000753587959 1045771148 /nfs/dbraw/zinc/77/11/48/1045771148.db2.gz FLCBUOVFVPUYOL-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO COc1cc(C)c([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1C ZINC000753613698 1045778126 /nfs/dbraw/zinc/77/81/26/1045778126.db2.gz ZCUAKXCJZOZODR-INIZCTEOSA-N 1 0 312.457 4.229 20 10 DICDRO C[C@H]([NH2+]CCCNc1cccc(F)c1)c1ccc(N(C)C)cc1 ZINC000753767592 1045801776 /nfs/dbraw/zinc/80/17/76/1045801776.db2.gz KVDLLMPJGCGEJK-HNNXBMFYSA-N 1 0 315.436 4.045 20 10 DICDRO Oc1ccc2ccccc2c1C[NH+]1CCC(c2ccccn2)CC1 ZINC000753972555 1045826124 /nfs/dbraw/zinc/82/61/24/1045826124.db2.gz PTCPNEXNDWGDCP-UHFFFAOYSA-N 1 0 318.420 4.320 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](C)c2ccc(C)s2)c1O ZINC000754677832 1045910763 /nfs/dbraw/zinc/91/07/63/1045910763.db2.gz XEDYXFBVJKKVNP-JTQLQIEISA-N 1 0 323.845 4.469 20 10 DICDRO Cc1cc(C[N@H+](C)CCc2ccccn2)ccc1N1CCCCC1 ZINC000828511134 1045912943 /nfs/dbraw/zinc/91/29/43/1045912943.db2.gz JZULLZGSBMTMGO-UHFFFAOYSA-N 1 0 323.484 4.055 20 10 DICDRO C[C@H](O)CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000828564688 1045917238 /nfs/dbraw/zinc/91/72/38/1045917238.db2.gz VESXRMAORBUTAX-IRXDYDNUSA-N 1 0 313.441 4.116 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)c1O ZINC000754729532 1045921095 /nfs/dbraw/zinc/92/10/95/1045921095.db2.gz AKUXFIPLQAQNEZ-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000828614541 1045921803 /nfs/dbraw/zinc/92/18/03/1045921803.db2.gz QCDSHJHMYHYWJB-SJLPKXTDSA-N 1 0 316.489 4.065 20 10 DICDRO Cc1cc(C)c(O)c(C[NH+]2CCC3(CC2)OCc2ccccc23)c1 ZINC000754740495 1045922750 /nfs/dbraw/zinc/92/27/50/1045922750.db2.gz UCIUGTQSOZBJMY-UHFFFAOYSA-N 1 0 323.436 4.031 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(C)cccc2Cl)c1 ZINC000828681280 1045925358 /nfs/dbraw/zinc/92/53/58/1045925358.db2.gz CCFQMMROSHTFHT-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2CC(c3ccccc3)C2)c1 ZINC000802309416 1045952870 /nfs/dbraw/zinc/95/28/70/1045952870.db2.gz RQNOOFBEVIOSDW-HPUBIQBYSA-N 1 0 311.425 4.245 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2ccccc2c1O ZINC000192936314 1045955354 /nfs/dbraw/zinc/95/53/54/1045955354.db2.gz UMGWSOGFZIZQPL-OAHLLOKOSA-N 1 0 320.436 4.462 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)CCCC(F)(F)F)c1O ZINC000755222367 1045964637 /nfs/dbraw/zinc/96/46/37/1045964637.db2.gz FQKVELIICNPMOB-NSHDSACASA-N 1 0 305.340 4.002 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(c3ccccc3Cl)CC2)cc1 ZINC000829484738 1045980953 /nfs/dbraw/zinc/98/09/53/1045980953.db2.gz XKUXKKJPKYDYKY-UHFFFAOYSA-N 1 0 300.833 4.185 20 10 DICDRO Cc1cc(C[N@H+](C)CCc2ccccn2)c(C)n1-c1ccccc1 ZINC001137854263 1045984884 /nfs/dbraw/zinc/98/48/84/1045984884.db2.gz ORVUULBKELYXCK-UHFFFAOYSA-N 1 0 319.452 4.164 20 10 DICDRO Cc1cc(C[NH+]2CCC3(CCOC3)CC2)c(C)n1-c1ccccc1 ZINC001137854126 1045986255 /nfs/dbraw/zinc/98/62/55/1045986255.db2.gz JJCFOSAJIPANDO-UHFFFAOYSA-N 1 0 324.468 4.097 20 10 DICDRO CO[C@H]1CC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)[C@@H](C)C1 ZINC001137859169 1045988172 /nfs/dbraw/zinc/98/81/72/1045988172.db2.gz LZICBKNXKIASCA-YWZLYKJASA-N 1 0 312.457 4.093 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2ccc(C)s2)c1 ZINC000080241011 1046011098 /nfs/dbraw/zinc/01/10/98/1046011098.db2.gz VUHPUALNOLTXBC-WCQYABFASA-N 1 0 305.443 4.053 20 10 DICDRO CCCC[N@H+](Cc1cnn(C(C)(C)C)c1)Cc1ccccc1O ZINC000802657575 1046028163 /nfs/dbraw/zinc/02/81/63/1046028163.db2.gz JGQFPWSVVUEDDO-UHFFFAOYSA-N 1 0 315.461 4.146 20 10 DICDRO CCCC[N@H+](Cc1ccc2c[nH]nc2c1)Cc1ccccc1O ZINC000802657754 1046029646 /nfs/dbraw/zinc/02/96/46/1046029646.db2.gz QIKWBBPWZJFRFJ-UHFFFAOYSA-N 1 0 309.413 4.071 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(C(F)(F)F)cn1 ZINC000902728408 1046050959 /nfs/dbraw/zinc/05/09/59/1046050959.db2.gz SHLMHIFYFRGHDW-LBPRGKRZSA-N 1 0 323.362 4.017 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCc2c[nH]c3ccccc23)c2c1c(F)ccc2O ZINC000756343495 1046066958 /nfs/dbraw/zinc/06/69/58/1046066958.db2.gz MXTZRXJIYXWJTA-SJCJKPOMSA-N 1 0 324.399 4.393 20 10 DICDRO C[C@H]([NH2+]CCc1c[nH]c2ccccc12)c1cc(Cl)ccc1O ZINC000756342965 1046068173 /nfs/dbraw/zinc/06/81/73/1046068173.db2.gz MACYQQSHEBVDSJ-LBPRGKRZSA-N 1 0 314.816 4.420 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1F ZINC000756362738 1046069424 /nfs/dbraw/zinc/06/94/24/1046069424.db2.gz CKAGAJBZNZNALG-ABAIWWIYSA-N 1 0 303.352 4.317 20 10 DICDRO Cc1nc2ccccc2n1CC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000756361989 1046069933 /nfs/dbraw/zinc/06/99/33/1046069933.db2.gz MBKGDYPQMYBGEL-OAHLLOKOSA-N 1 0 323.440 4.018 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(OC(F)F)cc2)c1 ZINC000756359944 1046070791 /nfs/dbraw/zinc/07/07/91/1046070791.db2.gz CNWSATSHUFZOND-CYBMUJFWSA-N 1 0 321.367 4.195 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc(Cl)cc2)c(O)c1C ZINC000756365561 1046071862 /nfs/dbraw/zinc/07/18/62/1046071862.db2.gz BAOGHJFUWIAKHX-SUMWQHHRSA-N 1 0 319.832 4.047 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2ccsc2)N(C)C)c(O)c1C ZINC000756371872 1046072230 /nfs/dbraw/zinc/07/22/30/1046072230.db2.gz OUJDFDOARQHXTR-WMLDXEAASA-N 1 0 318.486 4.024 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CC=CCC1)c1cc(Br)ccc1O ZINC000756474406 1046086043 /nfs/dbraw/zinc/08/60/43/1046086043.db2.gz IGGZZWMLVIQLRW-NEPJUHHUSA-N 1 0 310.235 4.162 20 10 DICDRO C[C@H](Cc1cccs1)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756379749 1046074538 /nfs/dbraw/zinc/07/45/38/1046074538.db2.gz QBLQDFWHMSHUGD-WDMOLILDSA-N 1 0 305.418 4.362 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCN(c3ccccc3)C2)c(O)c1C ZINC000756400788 1046075509 /nfs/dbraw/zinc/07/55/09/1046075509.db2.gz FFLXCISNYHKZTH-ZWKOTPCHSA-N 1 0 324.468 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c(O)c1C ZINC000756396878 1046076358 /nfs/dbraw/zinc/07/63/58/1046076358.db2.gz MWKASRMDMFAJLC-KBPBESRZSA-N 1 0 313.397 4.150 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193902919 1046079879 /nfs/dbraw/zinc/07/98/79/1046079879.db2.gz HAWIMXKNKSLFSH-STQMWFEESA-N 1 0 300.358 4.021 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193902946 1046080646 /nfs/dbraw/zinc/08/06/46/1046080646.db2.gz HAWIMXKNKSLFSH-OLZOCXBDSA-N 1 0 300.358 4.021 20 10 DICDRO C[C@H]([NH2+]CCCCN(C)c1ccccc1)c1cc(F)ccc1O ZINC000756443696 1046082910 /nfs/dbraw/zinc/08/29/10/1046082910.db2.gz IASYOUVDEFBCEW-HNNXBMFYSA-N 1 0 316.420 4.099 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)COc2ccc(F)cc2F)c1 ZINC000756454756 1046083449 /nfs/dbraw/zinc/08/34/49/1046083449.db2.gz NUCJUWAOSWGXIX-OLZOCXBDSA-N 1 0 321.367 4.097 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3ccccc3n2)c(O)c1C ZINC000756458400 1046083892 /nfs/dbraw/zinc/08/38/92/1046083892.db2.gz VYBOHMCEQLZBFJ-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1 ZINC000756454238 1046084159 /nfs/dbraw/zinc/08/41/59/1046084159.db2.gz BPBXVRONJUYOJV-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO C[C@H](Cc1ccsc1)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756457984 1046084258 /nfs/dbraw/zinc/08/42/58/1046084258.db2.gz ITAGEDFZBUYRPY-GYSYKLTISA-N 1 0 305.418 4.362 20 10 DICDRO Cc1ccsc1C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756465050 1046084485 /nfs/dbraw/zinc/08/44/85/1046084485.db2.gz IXGFXWTYGQDBDP-ZDUSSCGKSA-N 1 0 301.455 4.492 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1 ZINC000756455697 1046085487 /nfs/dbraw/zinc/08/54/87/1046085487.db2.gz KMHVEVWKEPIZII-WBMJQRKESA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)COc2ccc(F)cc2F)c(O)c1 ZINC000756453368 1046085669 /nfs/dbraw/zinc/08/56/69/1046085669.db2.gz GDCVOAVCPPWNHZ-OLZOCXBDSA-N 1 0 321.367 4.097 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)c(O)c1 ZINC000756481086 1046086235 /nfs/dbraw/zinc/08/62/35/1046086235.db2.gz BMQHHJVVGRQECA-CXAGYDPISA-N 1 0 315.388 4.404 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)c(O)c1 ZINC000756481087 1046086939 /nfs/dbraw/zinc/08/69/39/1046086939.db2.gz BMQHHJVVGRQECA-DYVFJYSZSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(-c3ccccc3)n2)c(O)c1C ZINC000756491076 1046088301 /nfs/dbraw/zinc/08/83/01/1046088301.db2.gz SLZRMGYBBUWVII-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CSCc3ccccc32)c1 ZINC000756491314 1046089209 /nfs/dbraw/zinc/08/92/09/1046089209.db2.gz ZNXIJSDDFVVXOG-SJCJKPOMSA-N 1 0 315.438 4.040 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCOC2CCCCC2)c2c1c(F)ccc2O ZINC000756490694 1046089252 /nfs/dbraw/zinc/08/92/52/1046089252.db2.gz RHLZLGYGYVUBKD-DOMZBBRYSA-N 1 0 307.409 4.019 20 10 DICDRO COc1ccccc1C(C)(C)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000756493997 1046089611 /nfs/dbraw/zinc/08/96/11/1046089611.db2.gz CIIYQBRXHGTENB-OAHLLOKOSA-N 1 0 313.441 4.338 20 10 DICDRO C[C@H]([NH2+][C@H]1CSCc2ccccc21)c1cc(F)ccc1O ZINC000756490057 1046089800 /nfs/dbraw/zinc/08/98/00/1046089800.db2.gz SMTPPOZNDLZRQV-ZBEGNZNMSA-N 1 0 303.402 4.170 20 10 DICDRO COc1ccc(CC[C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756503075 1046092792 /nfs/dbraw/zinc/09/27/92/1046092792.db2.gz JJKIJIFVAXNGCK-UONOGXRCSA-N 1 0 317.404 4.212 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2c[nH]c3cc(F)ccc23)c1 ZINC000756510722 1046093870 /nfs/dbraw/zinc/09/38/70/1046093870.db2.gz UONRMMKUJZGYCJ-ZDUSSCGKSA-N 1 0 312.388 4.214 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc2c(cc1O)CCCC2 ZINC000756515045 1046094467 /nfs/dbraw/zinc/09/44/67/1046094467.db2.gz LBWMAVIKWWTHMA-AWEZNQCLSA-N 1 0 323.436 4.057 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCc2c[nH]c3ccccc23)c(O)c1 ZINC000756554185 1046097604 /nfs/dbraw/zinc/09/76/04/1046097604.db2.gz OIHLACQSOOPEAG-HNNXBMFYSA-N 1 0 308.425 4.465 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCOc2ccccc21)c1cc(Cl)ccc1O ZINC000756554273 1046098446 /nfs/dbraw/zinc/09/84/46/1046098446.db2.gz ORIJQTBEPUZFBH-CHWSQXEVSA-N 1 0 317.816 4.263 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCc2c[nH]c3ccccc23)c1 ZINC000756549727 1046098987 /nfs/dbraw/zinc/09/89/87/1046098987.db2.gz GWFMRXXQMYMJDW-OAHLLOKOSA-N 1 0 308.425 4.465 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)C(C)(C)c2ccccc2)c1 ZINC000756539533 1046099198 /nfs/dbraw/zinc/09/91/98/1046099198.db2.gz PTXUGEXCSYEIML-HUUCEWRRSA-N 1 0 313.441 4.418 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000756582347 1046102144 /nfs/dbraw/zinc/10/21/44/1046102144.db2.gz HOETUUYZHXAQPD-IRXDYDNUSA-N 1 0 310.441 4.020 20 10 DICDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756571939 1046102339 /nfs/dbraw/zinc/10/23/39/1046102339.db2.gz HPVKADLEQWWHLG-NWDGAFQWSA-N 1 0 314.429 4.288 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(F)cc2F)c(O)c1C ZINC000756578888 1046102468 /nfs/dbraw/zinc/10/24/68/1046102468.db2.gz XNZNETOAZGCRGM-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756571941 1046102825 /nfs/dbraw/zinc/10/28/25/1046102825.db2.gz HPVKADLEQWWHLG-VXGBXAGGSA-N 1 0 314.429 4.288 20 10 DICDRO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cn1 ZINC000756572554 1046102958 /nfs/dbraw/zinc/10/29/58/1046102958.db2.gz GPHVHWBQWUOETD-NWDGAFQWSA-N 1 0 307.825 4.235 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756581200 1046103238 /nfs/dbraw/zinc/10/32/38/1046103238.db2.gz AZYWGWRZZGPYSO-CYBMUJFWSA-N 1 0 318.848 4.271 20 10 DICDRO C[C@@H]([NH2+]CCCNc1ccccc1)c1cc(Cl)ccc1O ZINC000756590029 1046104840 /nfs/dbraw/zinc/10/48/40/1046104840.db2.gz NPQXVXYOFXXFFE-CYBMUJFWSA-N 1 0 304.821 4.198 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCCNc2ccccc2)c2c1c(F)ccc2O ZINC000756589815 1046104850 /nfs/dbraw/zinc/10/48/50/1046104850.db2.gz NCUVFKMDDAQHOM-CJNGLKHVSA-N 1 0 314.404 4.171 20 10 DICDRO C[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1ccc2ccccc2c1O ZINC000756603769 1046108833 /nfs/dbraw/zinc/10/88/33/1046108833.db2.gz KTNYEGSPPOUFFL-FOIQADDNSA-N 1 0 321.420 4.320 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)Sc1ccccc1 ZINC000756611393 1046109458 /nfs/dbraw/zinc/10/94/58/1046109458.db2.gz SKYFFPLAOUPVOU-CHWSQXEVSA-N 1 0 305.418 4.363 20 10 DICDRO COc1ccc([C@@H](C)CC[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756613061 1046109929 /nfs/dbraw/zinc/10/99/29/1046109929.db2.gz NMKAWLNKXQINPE-UONOGXRCSA-N 1 0 317.404 4.384 20 10 DICDRO COc1ccc([C@@H](C)CC[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756613057 1046110242 /nfs/dbraw/zinc/11/02/42/1046110242.db2.gz NMKAWLNKXQINPE-KBPBESRZSA-N 1 0 317.404 4.384 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)C1CCOCC1 ZINC000756628499 1046112355 /nfs/dbraw/zinc/11/23/55/1046112355.db2.gz MRVJCHLUDVKMDY-KUHUBIRLSA-N 1 0 313.441 4.401 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](C)c1ccc(F)cc1F)c1cc(F)ccc1O ZINC000756620797 1046112969 /nfs/dbraw/zinc/11/29/69/1046112969.db2.gz NCLIRUYSFPEPQJ-GHMZBOCLSA-N 1 0 309.331 4.264 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H](C)c1cc(C)ccc1O)C1CCCC1 ZINC000756634675 1046114299 /nfs/dbraw/zinc/11/42/99/1046114299.db2.gz CCYSBTHTRPVMAK-HNAYVOBHSA-N 1 0 305.462 4.337 20 10 DICDRO C[C@@H](Cc1ccncc1)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756632984 1046114302 /nfs/dbraw/zinc/11/43/02/1046114302.db2.gz GJSQJJXJNLMZQC-GJZGRUSLSA-N 1 0 306.409 4.222 20 10 DICDRO CC[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)Oc1ccccc1F ZINC000756637291 1046114501 /nfs/dbraw/zinc/11/45/01/1046114501.db2.gz IWUZRVFBNDYUGV-LSDHHAIUSA-N 1 0 317.404 4.348 20 10 DICDRO COC1CCC(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000756641424 1046115821 /nfs/dbraw/zinc/11/58/21/1046115821.db2.gz HBFCJCCIJXULAK-SYJJWHGVSA-N 1 0 317.473 4.127 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000756645709 1046116467 /nfs/dbraw/zinc/11/64/67/1046116467.db2.gz JGSPPLRZKCTFKL-KSSFIOAISA-N 1 0 311.425 4.356 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(O)c1C ZINC000756658247 1046118371 /nfs/dbraw/zinc/11/83/71/1046118371.db2.gz IIRZMPPOPIFIJL-CYBMUJFWSA-N 1 0 304.459 4.440 20 10 DICDRO COc1ccc(C(C)(C)C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000756683579 1046119846 /nfs/dbraw/zinc/11/98/46/1046119846.db2.gz SHDKDEIXMAWCCB-HNNXBMFYSA-N 1 0 313.441 4.338 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756675981 1046120410 /nfs/dbraw/zinc/12/04/10/1046120410.db2.gz KDKFKYYZPAORPO-TYNCELHUSA-N 1 0 300.377 4.134 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756683106 1046120486 /nfs/dbraw/zinc/12/04/86/1046120486.db2.gz FQDHUFRVARNVMP-SJCJKPOMSA-N 1 0 315.388 4.268 20 10 DICDRO c1cc([C@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)ccn1 ZINC001138220057 1046120542 /nfs/dbraw/zinc/12/05/42/1046120542.db2.gz YJZXTLXEICIMCT-FQEVSTJZSA-N 1 0 321.468 4.061 20 10 DICDRO CCC1(O)CCC([NH2+][C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000756675431 1046120529 /nfs/dbraw/zinc/12/05/29/1046120529.db2.gz GJKNUDJLKXMWLS-PCVOSPCESA-N 1 0 313.441 4.280 20 10 DICDRO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001138219615 1046121106 /nfs/dbraw/zinc/12/11/06/1046121106.db2.gz KDMWEHUFNFITPA-LJQANCHMSA-N 1 0 316.489 4.066 20 10 DICDRO C[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)Oc1ccccc1 ZINC000756706511 1046122299 /nfs/dbraw/zinc/12/22/99/1046122299.db2.gz SNRLYDCKGBRNFY-XJKCOSOUSA-N 1 0 315.388 4.137 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)Oc2ccccc2Cl)c1 ZINC000756733883 1046124219 /nfs/dbraw/zinc/12/42/19/1046124219.db2.gz SZIAKQKSGMRGBR-UONOGXRCSA-N 1 0 319.832 4.472 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)c1 ZINC000756744672 1046126080 /nfs/dbraw/zinc/12/60/80/1046126080.db2.gz BMUSGZOWCIRPEY-IGMJJTELSA-N 1 0 311.425 4.304 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)c1 ZINC000756744661 1046126483 /nfs/dbraw/zinc/12/64/83/1046126483.db2.gz BMUSGZOWCIRPEY-CJXDPKRBSA-N 1 0 311.425 4.304 20 10 DICDRO Cc1ncc(CC[NH2+][C@@H](C)c2ccc3ccccc3c2O)s1 ZINC000756762083 1046128391 /nfs/dbraw/zinc/12/83/91/1046128391.db2.gz SQTVZTILTPNGQO-LBPRGKRZSA-N 1 0 312.438 4.204 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccc2ccccc2c1O ZINC000756759532 1046128450 /nfs/dbraw/zinc/12/84/50/1046128450.db2.gz MFVNBPSQNNEGMX-AWEZNQCLSA-N 1 0 319.404 4.426 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1O)c1ccccc1Cl ZINC000756760947 1046128584 /nfs/dbraw/zinc/12/85/84/1046128584.db2.gz QDIHONJJXMZJMD-ACJLOTCBSA-N 1 0 319.832 4.392 20 10 DICDRO Cc1c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c2ccccc2n1C ZINC001138252568 1046129370 /nfs/dbraw/zinc/12/93/70/1046129370.db2.gz LZTRBMJMADCPGT-UHFFFAOYSA-N 1 0 306.400 4.354 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000756766167 1046129907 /nfs/dbraw/zinc/12/99/07/1046129907.db2.gz WAFVBJXARLRCGY-WFASDCNBSA-N 1 0 309.400 4.500 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@H]2c2ccncc2)c2ccccc2n1C ZINC001138257173 1046131155 /nfs/dbraw/zinc/13/11/55/1046131155.db2.gz ZCSNWKGAWOJFJT-IBGZPJMESA-N 1 0 305.425 4.219 20 10 DICDRO COc1cccc(CC[N@H+](C)Cc2c3ccccc3n(C)c2C)c1 ZINC001138257942 1046131709 /nfs/dbraw/zinc/13/17/09/1046131709.db2.gz DZYSQPBXICHBLI-UHFFFAOYSA-N 1 0 322.452 4.170 20 10 DICDRO CCC[N@H+](CCc1ccccn1)Cc1c2ccccc2n(C)c1C ZINC001138258690 1046131858 /nfs/dbraw/zinc/13/18/58/1046131858.db2.gz YQJOLUJABWSZOP-UHFFFAOYSA-N 1 0 321.468 4.336 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1c(C)noc1C ZINC000756776326 1046131791 /nfs/dbraw/zinc/13/17/91/1046131791.db2.gz OIMNHWHKWFCXRO-WBMJQRKESA-N 1 0 302.418 4.416 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)c1 ZINC000756774594 1046132532 /nfs/dbraw/zinc/13/25/32/1046132532.db2.gz KFHQMQIMKMPDEF-CQSZACIVSA-N 1 0 314.429 4.124 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)c2c1c(F)ccc2O ZINC000756779218 1046132569 /nfs/dbraw/zinc/13/25/69/1046132569.db2.gz RLGYESLJALBBKU-DSPQJCBJSA-N 1 0 321.436 4.263 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)c2ccccc2C)c1O ZINC000228669380 1046132878 /nfs/dbraw/zinc/13/28/78/1046132878.db2.gz YBTYSFHJRQZUFH-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756785303 1046133368 /nfs/dbraw/zinc/13/33/68/1046133368.db2.gz CRDVMXUHJVFGIV-WQGACYEGSA-N 1 0 314.404 4.388 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756782449 1046133646 /nfs/dbraw/zinc/13/36/46/1046133646.db2.gz RBHBOXPYWLYMOO-SOZUMNATSA-N 1 0 321.367 4.097 20 10 DICDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000756790689 1046135648 /nfs/dbraw/zinc/13/56/48/1046135648.db2.gz NYLAOWXMRCMXQM-LPMFXHHGSA-N 1 0 317.404 4.267 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CC(C)(c3ccccc3)C2)c1 ZINC000756819110 1046140736 /nfs/dbraw/zinc/14/07/36/1046140736.db2.gz TYHZSVYDEGAUPM-PCVOSPCESA-N 1 0 311.425 4.172 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CC(c3ccccc3F)C2)c1 ZINC000756818703 1046140851 /nfs/dbraw/zinc/14/08/51/1046140851.db2.gz QXFAGUNNGDSGMN-HSBZDZAISA-N 1 0 315.388 4.137 20 10 DICDRO CC(C)(C)OCCC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000756860711 1046146026 /nfs/dbraw/zinc/14/60/26/1046146026.db2.gz MOZYMPFNKIQJMD-UHFFFAOYSA-N 1 0 317.429 4.193 20 10 DICDRO CN1CCCc2cc(C[N@@H+]3CCC[C@H]3c3cccs3)ccc21 ZINC001138358690 1046154903 /nfs/dbraw/zinc/15/49/03/1046154903.db2.gz XRHJDUDBSDLEJF-SFHVURJKSA-N 1 0 312.482 4.468 20 10 DICDRO CCc1cccc2c(C[N@H+](C)Cc3ccc(N(C)C)cc3)c[nH]c21 ZINC001138364071 1046157856 /nfs/dbraw/zinc/15/78/56/1046157856.db2.gz PZBSZEXNDHYJEV-UHFFFAOYSA-N 1 0 321.468 4.428 20 10 DICDRO C[C@H](c1ccccc1)[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000757277507 1046172840 /nfs/dbraw/zinc/17/28/40/1046172840.db2.gz QGVOFBWPYMPOBR-APWZRJJASA-N 1 0 311.425 4.134 20 10 DICDRO C[C@@H](c1ccccc1)[N@H+](Cc1ccno1)Cc1ccccc1O ZINC000757273792 1046173003 /nfs/dbraw/zinc/17/30/03/1046173003.db2.gz GFKQRSDMLVFNJO-HNNXBMFYSA-N 1 0 308.381 4.144 20 10 DICDRO Cc1ccc([C@H](C)Nc2ccc(C[NH+](C)C)c(F)c2)c(O)c1C ZINC000757612262 1046192768 /nfs/dbraw/zinc/19/27/68/1046192768.db2.gz JPAODHXDLQRYDK-AWEZNQCLSA-N 1 0 316.420 4.383 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(Cl)ccc1OC ZINC001138482521 1046196505 /nfs/dbraw/zinc/19/65/05/1046196505.db2.gz CDPXDDUBKCIAIS-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(F)c(F)c2F)c(O)c1 ZINC000757657152 1046196818 /nfs/dbraw/zinc/19/68/18/1046196818.db2.gz MFXQLQUJYRCCRG-LLVKDONJSA-N 1 0 309.331 4.011 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3cc(F)cc(F)c32)c(O)c1C ZINC000757663095 1046199329 /nfs/dbraw/zinc/19/93/29/1046199329.db2.gz HTBFDRFMYWMKTH-IAQYHMDHSA-N 1 0 319.351 4.072 20 10 DICDRO COC1CCC(CC[NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000757680211 1046201318 /nfs/dbraw/zinc/20/13/18/1046201318.db2.gz NORZWPARCONTGY-OPFPJEHXSA-N 1 0 311.853 4.292 20 10 DICDRO CC(C)OCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000757686588 1046201340 /nfs/dbraw/zinc/20/13/40/1046201340.db2.gz JCABSWYIVMGFPM-QGZVFWFLSA-N 1 0 304.478 4.143 20 10 DICDRO COc1c(Cl)cccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000903245301 1046206786 /nfs/dbraw/zinc/20/67/86/1046206786.db2.gz DEDKATYWIRTZGL-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO COc1c(Cl)cccc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000903248048 1046208788 /nfs/dbraw/zinc/20/87/88/1046208788.db2.gz ZXHXHLWZBLABMW-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1ccc2ccccc2c1O ZINC000903284042 1046222766 /nfs/dbraw/zinc/22/27/66/1046222766.db2.gz VBOGWKOFMRETAA-VNCCEEBVSA-N 1 0 311.425 4.154 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H](C)Cc2ccc(Cl)cc2)c(O)c1 ZINC001168167605 1046232612 /nfs/dbraw/zinc/23/26/12/1046232612.db2.gz PZCBPXHOLIUUOA-CQSZACIVSA-N 1 0 303.833 4.383 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C2CC3(C2)COC(C)(C)C3)c(O)c1 ZINC000903325147 1046239931 /nfs/dbraw/zinc/23/99/31/1046239931.db2.gz SUNCXAYTQCVYLJ-TZGCNFNXSA-N 1 0 303.446 4.007 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ncccn1)C1CC1)c1cc(Cl)ccc1O ZINC000903325509 1046240231 /nfs/dbraw/zinc/24/02/31/1046240231.db2.gz IECOXSZCNZXUGR-HOCLYGCPSA-N 1 0 317.820 4.028 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccc3cccnc32)c(O)c1 ZINC000321589645 1046241184 /nfs/dbraw/zinc/24/11/84/1046241184.db2.gz RLKQGMSMLPAOFR-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO C[C@@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)c1nccs1 ZINC000758043967 1046242160 /nfs/dbraw/zinc/24/21/60/1046242160.db2.gz BAETUPSOHBXQTQ-AWEZNQCLSA-N 1 0 324.449 4.409 20 10 DICDRO CC[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903338186 1046250673 /nfs/dbraw/zinc/25/06/73/1046250673.db2.gz GKNUHJUNBGONSX-UYAOXDASSA-N 1 0 309.457 4.340 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1c(Cl)[nH]c3ccccc31)CC2 ZINC001138688825 1046271194 /nfs/dbraw/zinc/27/11/94/1046271194.db2.gz KCZAEIWVJFYKQW-UHFFFAOYSA-N 1 0 312.800 4.085 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000903430366 1046278954 /nfs/dbraw/zinc/27/89/54/1046278954.db2.gz ZBWQZTLUUZMSFM-SZNDQCEHSA-N 1 0 322.452 4.468 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001202859010 1046280128 /nfs/dbraw/zinc/28/01/28/1046280128.db2.gz ATLZKFNQNJHJNG-OAHLLOKOSA-N 1 0 316.876 4.435 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1c[nH]c3c1cccc3Cl)CC2 ZINC001138836121 1046307082 /nfs/dbraw/zinc/30/70/82/1046307082.db2.gz DENDPUFHRMREDJ-UHFFFAOYSA-N 1 0 312.800 4.085 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cnc(C)s2)cc1F ZINC000090409037 1046365530 /nfs/dbraw/zinc/36/55/30/1046365530.db2.gz LJUKUHCZAOJRBV-GFCCVEGCSA-N 1 0 321.465 4.288 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCC1 ZINC000090457243 1046372598 /nfs/dbraw/zinc/37/25/98/1046372598.db2.gz HXTQQXQRPKJAKZ-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO CCn1ccc2ccc(C[N@H+](CC)Cc3ccccc3O)cc21 ZINC001139124180 1046391592 /nfs/dbraw/zinc/39/15/92/1046391592.db2.gz JQIJNZDHYJUDDP-UHFFFAOYSA-N 1 0 308.425 4.389 20 10 DICDRO CC[C@H]1C[C@H](C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)CCO1 ZINC000780754401 1046403329 /nfs/dbraw/zinc/40/33/29/1046403329.db2.gz OKZWIUQHHFHWSS-QUCCMNQESA-N 1 0 318.505 4.168 20 10 DICDRO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000780793433 1046407014 /nfs/dbraw/zinc/40/70/14/1046407014.db2.gz NPFKZNQKRRQSDD-DGCLKSJQSA-N 1 0 318.358 4.055 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)[C@@H](C)c2ccccn2)cc1F ZINC000780894093 1046409918 /nfs/dbraw/zinc/40/99/18/1046409918.db2.gz WXFORTWLNFMXAL-HNNXBMFYSA-N 1 0 315.436 4.260 20 10 DICDRO CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCN(c3ccc(OC)cc3)C2)C1 ZINC001202913401 1046419226 /nfs/dbraw/zinc/41/92/26/1046419226.db2.gz KDRRUSRONVYBCS-KZNAEPCWSA-N 1 0 316.489 4.080 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C)cs2)cc1 ZINC000246861768 1046432299 /nfs/dbraw/zinc/43/22/99/1046432299.db2.gz CBYWZVPCEITVFM-ZIAGYGMSSA-N 1 0 303.475 4.319 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(OC)ccc1Cl ZINC001137265550 1046440938 /nfs/dbraw/zinc/44/09/38/1046440938.db2.gz LKYGZYZSKZSYDB-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CCN(Cc1ccccc1O)Cc1c(Cl)ccnc1Cl ZINC001139480533 1046454745 /nfs/dbraw/zinc/45/47/45/1046454745.db2.gz HGSAXUSKOOISHA-UHFFFAOYSA-N 1 0 311.212 4.116 20 10 DICDRO C[N@H+](Cc1cccc(-c2ccccn2)c1)Cc1ccccc1O ZINC000091974479 1046490429 /nfs/dbraw/zinc/49/04/29/1046490429.db2.gz MSDWLRDXHKTTOK-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO C[N@H+](Cc1ccc(CSC(F)F)o1)Cc1ccccc1O ZINC000091974587 1046490466 /nfs/dbraw/zinc/49/04/66/1046490466.db2.gz KYWRDQJZJCWGHE-UHFFFAOYSA-N 1 0 313.369 4.073 20 10 DICDRO CC[N@H+](Cc1cccc(OC)c1O)[C@H](C)c1ccc(F)cc1 ZINC000092123850 1046495326 /nfs/dbraw/zinc/49/53/26/1046495326.db2.gz FKOUDKCOPKINQD-CYBMUJFWSA-N 1 0 303.377 4.123 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2CC(F)(c3cccc(Cl)c3)C2)c1 ZINC000795606016 1046495571 /nfs/dbraw/zinc/49/55/71/1046495571.db2.gz GWDQTCLAEBWCAK-UHFFFAOYSA-N 1 0 319.807 4.471 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(N(C)C)c(C)c2)cc1 ZINC001139672692 1046497164 /nfs/dbraw/zinc/49/71/64/1046497164.db2.gz BNINQRKSCPGGLU-INIZCTEOSA-N 1 0 312.457 4.263 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H](c3ccccc3F)C2)ccc1N(C)C ZINC001139671825 1046497757 /nfs/dbraw/zinc/49/77/57/1046497757.db2.gz NPFOCOZZLFAFCK-KRWDZBQOSA-N 1 0 312.432 4.190 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)ccc1N(C)C ZINC001139672742 1046497831 /nfs/dbraw/zinc/49/78/31/1046497831.db2.gz DRELOOIVVJPEGC-SFHVURJKSA-N 1 0 312.432 4.190 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccc(Cl)nc1 ZINC000179128838 1046528047 /nfs/dbraw/zinc/52/80/47/1046528047.db2.gz WEQORUISQVQYMH-JTQLQIEISA-N 1 0 313.879 4.025 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)ccc1Cl)c1ccc(N(C)C)cc1 ZINC000782543241 1046535200 /nfs/dbraw/zinc/53/52/00/1046535200.db2.gz GSJIOWHXNOSZQI-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO CCOC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000783312044 1046579348 /nfs/dbraw/zinc/57/93/48/1046579348.db2.gz BJVVVADHBCZLBN-HNNXBMFYSA-N 1 0 322.468 4.282 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@@H](C)c3ccccc3O)cn(C)c2c1 ZINC000783313051 1046581176 /nfs/dbraw/zinc/58/11/76/1046581176.db2.gz LSWYYGJLHCRBSN-HNNXBMFYSA-N 1 0 308.425 4.086 20 10 DICDRO CCc1cccc(Cl)c1C[NH2+][C@H](C)c1cc(OC)ccc1O ZINC001203000151 1046583926 /nfs/dbraw/zinc/58/39/26/1046583926.db2.gz IVSWWWOSQOCRDK-GFCCVEGCSA-N 1 0 319.832 4.467 20 10 DICDRO C[C@H]1CC[C@H]([N@H+](C)Cc2c(O)cccc2Br)CC1 ZINC001140102816 1046588638 /nfs/dbraw/zinc/58/86/38/1046588638.db2.gz ZVCNLERORXZVHR-HAQNSBGRSA-N 1 0 312.251 4.165 20 10 DICDRO Cc1ccc(O)c(C[N@H+](Cc2ccco2)Cc2ccc(O)cc2)c1 ZINC000093015578 1046601127 /nfs/dbraw/zinc/60/11/27/1046601127.db2.gz FTJVDSRZXNGICS-UHFFFAOYSA-N 1 0 323.392 4.202 20 10 DICDRO Cc1ccc(N2CCC[C@@H]([NH2+][C@@H](C)c3ccccc3O)C2)cc1 ZINC000783516770 1046603400 /nfs/dbraw/zinc/60/34/00/1046603400.db2.gz IXBMMUHBTJFMNH-DLBZAZTESA-N 1 0 310.441 4.020 20 10 DICDRO Cc1ccc(N2CCC[C@@H]([NH2+][C@H](C)c3ccccc3O)C2)cc1 ZINC000783516771 1046603616 /nfs/dbraw/zinc/60/36/16/1046603616.db2.gz IXBMMUHBTJFMNH-IAGOWNOFSA-N 1 0 310.441 4.020 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)Oc1cccc(Cl)c1)c1ccccc1O ZINC000783518640 1046604179 /nfs/dbraw/zinc/60/41/79/1046604179.db2.gz MOWWRTLWLLIQQW-QWHCGFSZSA-N 1 0 305.805 4.164 20 10 DICDRO COc1ccccc1C[C@H]([NH2+][C@@H](C)c1ccccc1O)C(C)C ZINC000783517404 1046604332 /nfs/dbraw/zinc/60/43/32/1046604332.db2.gz JHTXSAUXFCYZLZ-YJBOKZPZSA-N 1 0 313.441 4.319 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841746839 1046607943 /nfs/dbraw/zinc/60/79/43/1046607943.db2.gz LOPVZAYMXYFYDX-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000841750712 1046616960 /nfs/dbraw/zinc/61/69/60/1046616960.db2.gz INVBQZOXDQQEEG-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000248497451 1046618866 /nfs/dbraw/zinc/61/88/66/1046618866.db2.gz LURPTSDJDHSTAZ-ISTRZQFTSA-N 1 0 309.475 4.116 20 10 DICDRO Oc1ccc2ccccc2c1C[N@H+](Cc1cc[nH]n1)C1CCCC1 ZINC000093315160 1046622364 /nfs/dbraw/zinc/62/23/64/1046622364.db2.gz QOKILXFQHYKWCQ-UHFFFAOYSA-N 1 0 321.424 4.213 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1OC(F)(F)F)CC2 ZINC000834496588 1046622519 /nfs/dbraw/zinc/62/25/19/1046622519.db2.gz NIGUTBJEVNQKME-ZDUSSCGKSA-N 1 0 323.314 4.068 20 10 DICDRO COc1ccc([C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)C(C)C)cc1 ZINC000834496985 1046623118 /nfs/dbraw/zinc/62/31/18/1046623118.db2.gz UUUJCVXWAWDUDW-XLIONFOSSA-N 1 0 311.425 4.375 20 10 DICDRO C[C@H](OCCC[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834496616 1046623609 /nfs/dbraw/zinc/62/36/09/1046623609.db2.gz NYFSFLQNMKGRAG-YJBOKZPZSA-N 1 0 311.425 4.137 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)CC2 ZINC000834487796 1046623696 /nfs/dbraw/zinc/62/36/96/1046623696.db2.gz MRYOVWILVOWHSC-AWEZNQCLSA-N 1 0 308.208 4.476 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccsc1 ZINC000834549204 1046628325 /nfs/dbraw/zinc/62/83/25/1046628325.db2.gz YHJLKRMVJSBUKY-QGZVFWFLSA-N 1 0 300.471 4.371 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCCOc3ccc(F)cc31)CC2 ZINC000834540512 1046629151 /nfs/dbraw/zinc/62/91/51/1046629151.db2.gz BMZPOEDYFRSNLJ-HZPDHXFCSA-N 1 0 313.372 4.022 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000248624755 1046629531 /nfs/dbraw/zinc/62/95/31/1046629531.db2.gz CRGHQOCEIWJYIY-RZQQEMMASA-N 1 0 312.457 4.043 20 10 DICDRO Cc1cccc2c(CC[NH2+][C@@H]3CCc4cccc(O)c43)c[nH]c21 ZINC000834598546 1046635180 /nfs/dbraw/zinc/63/51/80/1046635180.db2.gz QNVOIAWTONJZAK-QGZVFWFLSA-N 1 0 306.409 4.002 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc(F)cc1F ZINC000834594135 1046636412 /nfs/dbraw/zinc/63/64/12/1046636412.db2.gz PXADERPNAFUSNF-HOTGVXAUSA-N 1 0 303.352 4.399 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CC3(CCC3)Oc3ccccc31)CC2 ZINC000834619079 1046639719 /nfs/dbraw/zinc/63/97/19/1046639719.db2.gz AWFQHPQEBHPMMZ-SJORKVTESA-N 1 0 321.420 4.416 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC[C@H]2CCCCO2)cc1 ZINC000248886347 1046645148 /nfs/dbraw/zinc/64/51/48/1046645148.db2.gz QGZPPLMWBSDOTK-QFBILLFUSA-N 1 0 304.478 4.143 20 10 DICDRO CO[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1cccc(Cl)c1 ZINC000834673053 1046648103 /nfs/dbraw/zinc/64/81/03/1046648103.db2.gz MARWVERIRGXHAJ-RDJZCZTQSA-N 1 0 317.816 4.010 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1ccccc1-c1cccnc1 ZINC001140319532 1046653041 /nfs/dbraw/zinc/65/30/41/1046653041.db2.gz AOLUMCRYOYSNHO-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1c(O)cccc1Cl ZINC001140341213 1046666617 /nfs/dbraw/zinc/66/66/17/1046666617.db2.gz DJCNYJYMBGIQDH-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001140344020 1046667491 /nfs/dbraw/zinc/66/74/91/1046667491.db2.gz DMPYYKFJKAWFIT-OAHLLOKOSA-N 1 0 317.816 4.089 20 10 DICDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)c1 ZINC001140341595 1046668858 /nfs/dbraw/zinc/66/88/58/1046668858.db2.gz YLJVRZMUZZBLJC-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCCc3c(F)cc(F)cc31)CC2 ZINC000834814165 1046674013 /nfs/dbraw/zinc/67/40/13/1046674013.db2.gz FZHSPAMZTJXKIK-DLBZAZTESA-N 1 0 315.363 4.325 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2c(F)cccc21)c1cc(F)ccc1O ZINC000834813999 1046674166 /nfs/dbraw/zinc/67/41/66/1046674166.db2.gz CCJUHLFILPMTEW-GTNSWQLSSA-N 1 0 303.352 4.399 20 10 DICDRO C[C@H]([NH2+]CCCC1CCOCC1)c1ccc2ccccc2c1O ZINC000834818414 1046675837 /nfs/dbraw/zinc/67/58/37/1046675837.db2.gz LHXKTDHSMPRQEU-HNNXBMFYSA-N 1 0 313.441 4.403 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCC2CCOCC2)c1O ZINC000834819013 1046676183 /nfs/dbraw/zinc/67/61/83/1046676183.db2.gz RKQWMVSFVNTZRL-CYBMUJFWSA-N 1 0 311.853 4.211 20 10 DICDRO CC[C@@H]([NH2+]CCCC1CCOCC1)c1cc(Cl)ccc1O ZINC000834818552 1046676424 /nfs/dbraw/zinc/67/64/24/1046676424.db2.gz NEBTYXGSNKHLPP-MRXNPFEDSA-N 1 0 311.853 4.293 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CC(C)(C)c2ccccn2)c2c1c(F)ccc2O ZINC000834849296 1046686139 /nfs/dbraw/zinc/68/61/39/1046686139.db2.gz ACORYTQCGSNTPE-JSGCOSHPSA-N 1 0 314.404 4.042 20 10 DICDRO C[C@@H]([NH2+][C@@H]1C[C@@H](C)Oc2ccccc21)c1ccc(N(C)C)cc1 ZINC000834876424 1046693513 /nfs/dbraw/zinc/69/35/13/1046693513.db2.gz CBWGRVGZZIWCPL-SPYBWZPUSA-N 1 0 310.441 4.316 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCc2ncccc2C)cc1 ZINC000834882658 1046695560 /nfs/dbraw/zinc/69/55/60/1046695560.db2.gz CBTWDFNHKZIXEA-KRWDZBQOSA-N 1 0 311.473 4.130 20 10 DICDRO Cc1csc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)c1 ZINC000834883636 1046696253 /nfs/dbraw/zinc/69/62/53/1046696253.db2.gz SIFDXULXANDINU-CYBMUJFWSA-N 1 0 301.455 4.492 20 10 DICDRO Cc1cccnc1CCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000834883306 1046696339 /nfs/dbraw/zinc/69/63/39/1046696339.db2.gz IRVIVTORBGQEHI-BBRMVZONSA-N 1 0 314.404 4.005 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000834882268 1046696588 /nfs/dbraw/zinc/69/65/88/1046696588.db2.gz IFVYJXKNNGHSSV-XJKSGUPXSA-N 1 0 323.864 4.436 20 10 DICDRO Cc1csc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)c1 ZINC000834883639 1046697045 /nfs/dbraw/zinc/69/70/45/1046697045.db2.gz SIFDXULXANDINU-ZDUSSCGKSA-N 1 0 301.455 4.492 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCOC3(CCC3)C2)c2c1c(F)ccc2O ZINC000834883525 1046697438 /nfs/dbraw/zinc/69/74/38/1046697438.db2.gz QPCOOWZFKVHBPD-VNHYZAJKSA-N 1 0 319.420 4.019 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)CC2(Cl)Cl)c2c1c(F)ccc2O ZINC000834885752 1046698517 /nfs/dbraw/zinc/69/85/17/1046698517.db2.gz XSTADHQXNVPXOW-PWZJLYFZSA-N 1 0 318.219 4.253 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000834883952 1046698556 /nfs/dbraw/zinc/69/85/56/1046698556.db2.gz VHDGSCYNESNFKI-STQMWFEESA-N 1 0 309.837 4.046 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000834883913 1046698570 /nfs/dbraw/zinc/69/85/70/1046698570.db2.gz UYZVOYXBHGMEOR-LPHOPBHVSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCO[C@H](C(C)C)C2)c(O)c1C ZINC000834887111 1046700395 /nfs/dbraw/zinc/70/03/95/1046700395.db2.gz YHGSJLOVRBBNDK-JZXOWHBKSA-N 1 0 305.462 4.111 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc2ccccc2c1O ZINC000834892651 1046702863 /nfs/dbraw/zinc/70/28/63/1046702863.db2.gz CEEQGGHASXPYPX-IGCXYCKISA-N 1 0 307.397 4.099 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1nccn1CC)c1cc(Cl)ccc1O ZINC000834894915 1046703948 /nfs/dbraw/zinc/70/39/48/1046703948.db2.gz MZEIYJPMINWMEX-BXUZGUMPSA-N 1 0 307.825 4.064 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c(O)c1 ZINC000834897239 1046707311 /nfs/dbraw/zinc/70/73/11/1046707311.db2.gz RPUIHAOFNRTNMK-IINYFYTJSA-N 1 0 321.342 4.456 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000834897599 1046707902 /nfs/dbraw/zinc/70/79/02/1046707902.db2.gz UYCNPDNFTWVPSM-IINYFYTJSA-N 1 0 321.342 4.456 20 10 DICDRO C[C@@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO[C@H]1C1CC1 ZINC000784688765 1046708682 /nfs/dbraw/zinc/70/86/82/1046708682.db2.gz YHNOGJJOEIRUQA-LEWJYISDSA-N 1 0 323.436 4.106 20 10 DICDRO C[C@@H]([NH2+]CCC[C@H]1CCOC1)c1ccc(N2CCCCC2)cc1 ZINC000834903551 1046714600 /nfs/dbraw/zinc/71/46/00/1046714600.db2.gz KTOJEDFQENJTAO-MSOLQXFVSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1cc2c(cc1O)CCCC2 ZINC000834907986 1046718577 /nfs/dbraw/zinc/71/85/77/1046718577.db2.gz BLAONLUIRGQOLI-GJZGRUSLSA-N 1 0 317.473 4.127 20 10 DICDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)nc1 ZINC000834910047 1046719101 /nfs/dbraw/zinc/71/91/01/1046719101.db2.gz RALJQJKSLAGRPI-SFHVURJKSA-N 1 0 323.484 4.274 20 10 DICDRO C[C@H]1CN(Cc2ccc(Cl)cc2O)[C@@H](c2ccccc2)CO1 ZINC001140464518 1046736237 /nfs/dbraw/zinc/73/62/37/1046736237.db2.gz SRFJBWSNULDTGE-SUMWQHHRSA-N 1 0 317.816 4.008 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001140466627 1046739213 /nfs/dbraw/zinc/73/92/13/1046739213.db2.gz INSUKAPFFJZBHK-KRWDZBQOSA-N 1 0 317.816 4.089 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH+]2CCC(c3ccccn3)CC2)cc1 ZINC000835029267 1046744481 /nfs/dbraw/zinc/74/44/81/1046744481.db2.gz WARXKUCIAUGDPN-AATRIKPKSA-N 1 0 321.468 4.040 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835042389 1046746796 /nfs/dbraw/zinc/74/67/96/1046746796.db2.gz HKJWNLRKYYFITA-FYCOFBDGSA-N 1 0 309.457 4.074 20 10 DICDRO CC(C)[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cccnc1 ZINC000835043570 1046747345 /nfs/dbraw/zinc/74/73/45/1046747345.db2.gz SCMGUCFYSGOJLP-JKTFDMFLSA-N 1 0 323.484 4.190 20 10 DICDRO C[C@@H](CCCC(F)(F)F)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835048929 1046749414 /nfs/dbraw/zinc/74/94/14/1046749414.db2.gz NBBUOXWCISEMRH-DYLGSBMWSA-N 1 0 314.395 4.477 20 10 DICDRO CC[C@H](CC(F)(F)F)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835047319 1046749497 /nfs/dbraw/zinc/74/94/97/1046749497.db2.gz QTIDULUENSJYNW-GEXIGZQTSA-N 1 0 300.368 4.086 20 10 DICDRO FC1(F)CC(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000835060856 1046751101 /nfs/dbraw/zinc/75/11/01/1046751101.db2.gz OLWCFAIXYTUORK-UHFFFAOYSA-N 1 0 308.416 4.202 20 10 DICDRO CC[C@H](Nc1cc(C[NH+](C)C)ccc1C)c1ccc(F)cc1O ZINC000796925602 1046759678 /nfs/dbraw/zinc/75/96/78/1046759678.db2.gz YJRPGMMGCDSULV-KRWDZBQOSA-N 1 0 316.420 4.465 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)Oc1cc(F)cc(F)c1)c1ccccc1O ZINC000797009003 1046770819 /nfs/dbraw/zinc/77/08/19/1046770819.db2.gz KZQQAILXOXHZCY-LBPRGKRZSA-N 1 0 321.367 4.179 20 10 DICDRO C[C@H]([NH2+][C@H]1CSC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000797065905 1046785051 /nfs/dbraw/zinc/78/50/51/1046785051.db2.gz NUKXYWURRCARFI-MPGHIAIKSA-N 1 0 304.503 4.079 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC2(C(F)(F)F)CC2)c2c1c(F)ccc2O ZINC000797072131 1046786092 /nfs/dbraw/zinc/78/60/92/1046786092.db2.gz WYXZMGIXFAETFH-PSASIEDQSA-N 1 0 303.299 4.012 20 10 DICDRO CC[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccc(N(C)C)cc1 ZINC000797072266 1046786185 /nfs/dbraw/zinc/78/61/85/1046786185.db2.gz YATSZRJSGIHIOG-CQSZACIVSA-N 1 0 300.368 4.136 20 10 DICDRO CSCc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000797097335 1046789552 /nfs/dbraw/zinc/78/95/52/1046789552.db2.gz CWDWZKCYMYAMIV-AWEZNQCLSA-N 1 0 301.455 4.414 20 10 DICDRO [O-]c1cc(F)cc(F)c1C[N@@H+]1CCC[C@@H]1c1ccccc1F ZINC001140583904 1046792378 /nfs/dbraw/zinc/79/23/78/1046792378.db2.gz XZOCLMSRQJEYRN-MRXNPFEDSA-N 1 0 307.315 4.147 20 10 DICDRO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C)ccc2O)cc1 ZINC001140620979 1046814882 /nfs/dbraw/zinc/81/48/82/1046814882.db2.gz JNXJXKYOOSWBPV-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)c1 ZINC001140622827 1046815224 /nfs/dbraw/zinc/81/52/24/1046815224.db2.gz AQUWEARLGVAFIU-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC(n3ccc4ccccc43)CC2)c1 ZINC001140623197 1046815868 /nfs/dbraw/zinc/81/58/68/1046815868.db2.gz KHNXJKDLRSOKIE-UHFFFAOYSA-N 1 0 320.436 4.492 20 10 DICDRO COc1cccc([C@@H]2CCCC[N@@H+]2Cc2cc(C)ccc2O)c1 ZINC001140621211 1046816176 /nfs/dbraw/zinc/81/61/76/1046816176.db2.gz RIFJCEYIVXYYNR-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000797586631 1046854931 /nfs/dbraw/zinc/85/49/31/1046854931.db2.gz JDCQERABVSJRLL-QWHCGFSZSA-N 1 0 309.400 4.357 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000797586632 1046855095 /nfs/dbraw/zinc/85/50/95/1046855095.db2.gz JDCQERABVSJRLL-STQMWFEESA-N 1 0 309.400 4.357 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1c(Cl)ncc3ccccc31)CC2 ZINC001140725043 1046878727 /nfs/dbraw/zinc/87/87/27/1046878727.db2.gz VIYSIRHWAMMNOA-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO Cc1c(O)ccc(C[N@@H+](C)Cc2cccc3ccccc32)c1O ZINC001140745335 1046882314 /nfs/dbraw/zinc/88/23/14/1046882314.db2.gz GCOMVQFTZICIOG-UHFFFAOYSA-N 1 0 307.393 4.191 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c1O ZINC001140748804 1046884619 /nfs/dbraw/zinc/88/46/19/1046884619.db2.gz KEYCCBFROBEEGA-AWEZNQCLSA-N 1 0 317.816 4.049 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1)Cc1ccc(O)c(C)c1O ZINC001140747414 1046885045 /nfs/dbraw/zinc/88/50/45/1046885045.db2.gz CBTVCQVTTNBRLE-UHFFFAOYSA-N 1 0 305.805 4.082 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3F)C2)cc1F ZINC000797877326 1046899691 /nfs/dbraw/zinc/89/96/91/1046899691.db2.gz ZHXZHGTXXYCORE-SHTZXODSSA-N 1 0 316.395 4.067 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)cc1F ZINC000797880349 1046900480 /nfs/dbraw/zinc/90/04/80/1046900480.db2.gz QKDNQYJKZUYNTK-JCNLHEQBSA-N 1 0 316.395 4.067 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCCN1C1CCCCC1)c1ccccc1O ZINC000798002304 1046919205 /nfs/dbraw/zinc/91/92/05/1046919205.db2.gz CVKWPZYNQOQGJG-PKOBYXMFSA-N 1 0 316.489 4.230 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCN2C2CCCCC2)c(O)c1 ZINC000798002298 1046920263 /nfs/dbraw/zinc/92/02/63/1046920263.db2.gz CTCSEUMOALKHKS-SJLPKXTDSA-N 1 0 316.489 4.148 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2Cc3cccc(C)c3C2)c(O)c1 ZINC001140850299 1046928950 /nfs/dbraw/zinc/92/89/50/1046928950.db2.gz IOBYGLOXPXFUHL-UHFFFAOYSA-N 1 0 310.441 4.063 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccc(F)c2)c(O)c1 ZINC001140850997 1046929447 /nfs/dbraw/zinc/92/94/47/1046929447.db2.gz XTKYRNWLGKUOMJ-UHFFFAOYSA-N 1 0 316.420 4.010 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CC3(C2)CCCCC3)c(O)c1 ZINC001140855772 1046930387 /nfs/dbraw/zinc/93/03/87/1046930387.db2.gz JXWRDCLJOSMIJP-UHFFFAOYSA-N 1 0 302.462 4.005 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(C)cc2)c(O)c1 ZINC001140854796 1046931620 /nfs/dbraw/zinc/93/16/20/1046931620.db2.gz BJLBJOBKLGQMJQ-UHFFFAOYSA-N 1 0 312.457 4.179 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c(O)c1 ZINC000798502132 1046957940 /nfs/dbraw/zinc/95/79/40/1046957940.db2.gz VNIZUWDMFAGWPY-QAQDUYKDSA-N 1 0 311.425 4.135 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c(O)c1 ZINC001140950743 1046960057 /nfs/dbraw/zinc/96/00/57/1046960057.db2.gz GJHRLGZKUMQRCI-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cccnc1[C@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000798925378 1046986741 /nfs/dbraw/zinc/98/67/41/1046986741.db2.gz ACPLOQWNWBBMNR-OALUTQOASA-N 1 0 323.484 4.272 20 10 DICDRO Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000798925381 1046987250 /nfs/dbraw/zinc/98/72/50/1046987250.db2.gz ACPLOQWNWBBMNR-RTBURBONSA-N 1 0 323.484 4.272 20 10 DICDRO CCC[N@H+](CCCCC1CCOCC1)Cc1ccccc1O ZINC000799125046 1047002544 /nfs/dbraw/zinc/00/25/44/1047002544.db2.gz DCBRNIGVVYOTGA-UHFFFAOYSA-N 1 0 305.462 4.201 20 10 DICDRO C[N@H+](Cc1cccc(-c2ccc(F)cc2)n1)Cc1ccccc1O ZINC001141208758 1047047670 /nfs/dbraw/zinc/04/76/70/1047047670.db2.gz JNYWNPYOEYMNAM-UHFFFAOYSA-N 1 0 322.383 4.225 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)c2c1c(F)ccc2O ZINC000799729985 1047058873 /nfs/dbraw/zinc/05/88/73/1047058873.db2.gz XFQTUBBTMRPNJF-SJCJKPOMSA-N 1 0 324.399 4.393 20 10 DICDRO COc1ccccc1C(C)(C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001116018646 1047101507 /nfs/dbraw/zinc/10/15/07/1047101507.db2.gz HADDOLUNEZVZQX-UHFFFAOYSA-N 1 0 324.468 4.320 20 10 DICDRO Cc1ccccc1O[C@H](C)C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001116139701 1047112156 /nfs/dbraw/zinc/11/21/56/1047112156.db2.gz SRUHSQYECBVHIV-GOSISDBHSA-N 1 0 324.468 4.152 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001116489172 1047148104 /nfs/dbraw/zinc/14/81/04/1047148104.db2.gz CVZMBCHBBBAPKV-MRXNPFEDSA-N 1 0 309.457 4.095 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c1 ZINC001116484441 1047148918 /nfs/dbraw/zinc/14/89/18/1047148918.db2.gz UVYCAUMHPPJUQD-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccccc1C1([NH2+][C@H](C)c2cc(F)ccc2O)CCC1 ZINC001116568434 1047158150 /nfs/dbraw/zinc/15/81/50/1047158150.db2.gz QHIABYJQMOBQJX-CYBMUJFWSA-N 1 0 315.388 4.270 20 10 DICDRO Fc1ccccc1[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001116904363 1047188754 /nfs/dbraw/zinc/18/87/54/1047188754.db2.gz LVWBRNVALWCNRZ-IYARVYRRSA-N 1 0 324.443 4.462 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(Br)c(C)c2)c1 ZINC000839148756 1047198427 /nfs/dbraw/zinc/19/84/27/1047198427.db2.gz MADCNCQKFPKOMG-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc2cccnc2cc1F ZINC001141634709 1047240746 /nfs/dbraw/zinc/24/07/46/1047240746.db2.gz OISOKAJOPSSZQS-UHFFFAOYSA-N 1 0 310.372 4.102 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC(C)(C)c1ccccn1 ZINC001117779566 1047244421 /nfs/dbraw/zinc/24/44/21/1047244421.db2.gz QJJCKUMDFRVXAW-HUUCEWRRSA-N 1 0 310.441 4.211 20 10 DICDRO CC(C)(COCc1ccccc1)[NH2+]Cc1cc(Cl)ccc1O ZINC000389967027 1047292661 /nfs/dbraw/zinc/29/26/61/1047292661.db2.gz WWFBLALXOKJAAB-UHFFFAOYSA-N 1 0 319.832 4.131 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CCOCc1ccccc1)c1cc(F)ccc1O ZINC000389927844 1047293174 /nfs/dbraw/zinc/29/31/74/1047293174.db2.gz FQZTYRSRLVFCEN-LSDHHAIUSA-N 1 0 317.404 4.177 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)COCc2ccccc2)c1 ZINC000389900072 1047293676 /nfs/dbraw/zinc/29/36/76/1047293676.db2.gz BIJMNIPICJXIKH-DLBZAZTESA-N 1 0 313.441 4.204 20 10 DICDRO C[C@H]([NH2+]CCCOCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000390242616 1047294512 /nfs/dbraw/zinc/29/45/12/1047294512.db2.gz OWKAUSYOCSPSNV-KRWDZBQOSA-N 1 0 312.457 4.010 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN2Cc2ccccc2)c(O)c1 ZINC000390577304 1047300891 /nfs/dbraw/zinc/30/08/91/1047300891.db2.gz XFZZFTJJTBOSIJ-HKUYNNGSSA-N 1 0 324.468 4.016 20 10 DICDRO COc1cccc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)c1 ZINC000725841753 1047319433 /nfs/dbraw/zinc/31/94/33/1047319433.db2.gz MPARXMFVMAUXBH-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c(C)c1 ZINC000840722415 1047320544 /nfs/dbraw/zinc/32/05/44/1047320544.db2.gz HPXFPALBKLVYLT-MRXNPFEDSA-N 1 0 312.457 4.229 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2csc3ccccc23)c1 ZINC000725846810 1047321104 /nfs/dbraw/zinc/32/11/04/1047321104.db2.gz SSVDFPYWXOARBZ-UHFFFAOYSA-N 1 0 313.422 4.295 20 10 DICDRO Cc1ccc(CC[NH2+]Cc2cc(-c3ccccc3)ccc2O)o1 ZINC000725847873 1047322292 /nfs/dbraw/zinc/32/22/92/1047322292.db2.gz VKNLDZQRDMVTCJ-UHFFFAOYSA-N 1 0 307.393 4.293 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000398235214 1047328297 /nfs/dbraw/zinc/32/82/97/1047328297.db2.gz YMIIBIGUCGYBRO-LNLFQRSKSA-N 1 0 324.468 4.014 20 10 DICDRO FC(F)(F)C1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000796488692 1047334610 /nfs/dbraw/zinc/33/46/10/1047334610.db2.gz IFHZFFLYSAIKQJ-UHFFFAOYSA-N 1 0 312.379 4.109 20 10 DICDRO Cc1ncc(C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)o1 ZINC000840795426 1047335468 /nfs/dbraw/zinc/33/54/68/1047335468.db2.gz ZPELBSVZGNGDJO-LJQANCHMSA-N 1 0 322.408 4.152 20 10 DICDRO CC[C@H]([NH2+]C1CCC(C(F)F)CC1)c1ccc(F)cc1[O-] ZINC000840806782 1047336918 /nfs/dbraw/zinc/33/69/18/1047336918.db2.gz LRVLOZPZFILBHQ-OVGLSYRBSA-N 1 0 301.352 4.396 20 10 DICDRO C[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)CC(F)(F)F ZINC000840874360 1047350384 /nfs/dbraw/zinc/35/03/84/1047350384.db2.gz YPHWBEABRZEPEI-NGZCFLSTSA-N 1 0 305.315 4.258 20 10 DICDRO CC[C@@H]([NH2+]C1CCC(COC)CC1)c1cc(Cl)ccc1O ZINC000840875635 1047351951 /nfs/dbraw/zinc/35/19/51/1047351951.db2.gz HZKXHWVYSDRGNM-LDZOIKDWSA-N 1 0 311.853 4.292 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2cccnc2)c2c1c(F)ccc2O ZINC000840890569 1047355642 /nfs/dbraw/zinc/35/56/42/1047355642.db2.gz ATPJWKYBAVPPJQ-SWLSCSKDSA-N 1 0 314.404 4.042 20 10 DICDRO CC[C@H]([NH2+][C@H](C)Cc1ccc(N(C)C)cc1C)c1ccncc1 ZINC000840895473 1047356261 /nfs/dbraw/zinc/35/62/61/1047356261.db2.gz YLPLOPFVGGOGIG-UZLBHIALSA-N 1 0 311.473 4.128 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)s1 ZINC000840892915 1047356934 /nfs/dbraw/zinc/35/69/34/1047356934.db2.gz DXCBUIHRBCIHQO-KBPBESRZSA-N 1 0 317.502 4.108 20 10 DICDRO Cc1nc([C@H](C)[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)cs1 ZINC000840894401 1047357376 /nfs/dbraw/zinc/35/73/76/1047357376.db2.gz RBGQIQSUDZJYFA-KBPBESRZSA-N 1 0 317.502 4.108 20 10 DICDRO Cc1csc([C@H](C)C[NH2+]Cc2c(O)cc(C)cc2Cl)n1 ZINC000840939231 1047363395 /nfs/dbraw/zinc/36/33/95/1047363395.db2.gz KKUFVVMLHCQITO-SNVBAGLBSA-N 1 0 310.850 4.012 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2(c3ccccn3)CCC2)cc1 ZINC000796514988 1047366529 /nfs/dbraw/zinc/36/65/29/1047366529.db2.gz LOUYZPLKLWUEGI-UHFFFAOYSA-N 1 0 323.484 4.139 20 10 DICDRO CSCc1ccc(C[NH2+]Cc2cc(C)c(C)cc2O)cc1 ZINC000796514819 1047367201 /nfs/dbraw/zinc/36/72/01/1047367201.db2.gz SKGKOWFMZLDGJB-UHFFFAOYSA-N 1 0 301.455 4.162 20 10 DICDRO [NH3+]C[C@H]1CCCN1C(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000841004362 1047368511 /nfs/dbraw/zinc/36/85/11/1047368511.db2.gz HVXMLVATNDYVNU-QGZVFWFLSA-N 1 0 323.400 4.057 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@H]2c2ccccc2Cl)cc1 ZINC000841033849 1047372779 /nfs/dbraw/zinc/37/27/79/1047372779.db2.gz BYBSEPUTXQEDNK-PKOBYXMFSA-N 1 0 314.860 4.391 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2c2ccccc2Cl)cc1 ZINC000841033847 1047373354 /nfs/dbraw/zinc/37/33/54/1047373354.db2.gz BYBSEPUTXQEDNK-IEBWSBKVSA-N 1 0 314.860 4.391 20 10 DICDRO C[C@H](C[NH2+]CCc1ccc(N)cc1)c1ccc(C(F)(F)F)cc1 ZINC000841038798 1047373904 /nfs/dbraw/zinc/37/39/04/1047373904.db2.gz QPSZLPWXZYRTEL-CYBMUJFWSA-N 1 0 322.374 4.223 20 10 DICDRO C[C@@H](CC(F)(F)F)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001255659433 1047400549 /nfs/dbraw/zinc/40/05/49/1047400549.db2.gz YHBQNOONXXZGNU-ZDUSSCGKSA-N 1 0 300.368 4.060 20 10 DICDRO Cc1cc(C(=O)Cn2cnc(C)c2C)c(C)n1-c1ccc(C)cc1 ZINC000749333016 1047410436 /nfs/dbraw/zinc/41/04/36/1047410436.db2.gz ACZYNDSUHLZPBW-UHFFFAOYSA-N 1 0 321.424 4.099 20 10 DICDRO Cc1ccc2ccccc2c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001142383869 1047439160 /nfs/dbraw/zinc/43/91/60/1047439160.db2.gz SCULPGXWLCXUDY-UHFFFAOYSA-N 1 0 303.405 4.412 20 10 DICDRO C[C@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1ccc(Cl)cc1O ZINC000841743651 1047446781 /nfs/dbraw/zinc/44/67/81/1047446781.db2.gz JDSQLVUAKXYRLX-SMDDNHRTSA-N 1 0 324.877 4.061 20 10 DICDRO C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(Cl)cc1[O-] ZINC000841743488 1047447079 /nfs/dbraw/zinc/44/70/79/1047447079.db2.gz HTPQRQCRWLLIBI-LLVKDONJSA-N 1 0 310.869 4.005 20 10 DICDRO COCc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841745498 1047448176 /nfs/dbraw/zinc/44/81/76/1047448176.db2.gz YZDUZFJZRPBWRQ-GFCCVEGCSA-N 1 0 305.805 4.043 20 10 DICDRO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841744190 1047448590 /nfs/dbraw/zinc/44/85/90/1047448590.db2.gz MSJBCFCDSKSZKP-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccc(Cl)cc1O ZINC000841750241 1047449827 /nfs/dbraw/zinc/44/98/27/1047449827.db2.gz WEPOQWRZRHZPCZ-KZULUSFZSA-N 1 0 317.816 4.010 20 10 DICDRO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc(Cl)cc2O)o1 ZINC000841748909 1047450365 /nfs/dbraw/zinc/45/03/65/1047450365.db2.gz BVWLECJJSFZAKP-IAQYHMDHSA-N 1 0 323.820 4.239 20 10 DICDRO COc1cccc(C2([NH2+][C@@H](C)c3ccc(Cl)cc3O)CC2)c1 ZINC000841750522 1047450795 /nfs/dbraw/zinc/45/07/95/1047450795.db2.gz RLAURUWAVQDUKN-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO C[C@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccc(Cl)cc1O ZINC000841755258 1047451561 /nfs/dbraw/zinc/45/15/61/1047451561.db2.gz YKRYONTYFFCBAJ-NSHDSACASA-N 1 0 322.811 4.419 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccc(C)o1 ZINC000841753831 1047452140 /nfs/dbraw/zinc/45/21/40/1047452140.db2.gz NQZUHZXAWPACLP-IUODEOHRSA-N 1 0 323.820 4.375 20 10 DICDRO CCSc1cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)ccn1 ZINC000841751783 1047452207 /nfs/dbraw/zinc/45/22/07/1047452207.db2.gz JNZJEIFJTCFAGH-NSHDSACASA-N 1 0 322.861 4.403 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(Cl)cc1O ZINC000841757788 1047453124 /nfs/dbraw/zinc/45/31/24/1047453124.db2.gz QEIFDUIUHRVSOK-BDAKNGLRSA-N 1 0 312.747 4.131 20 10 DICDRO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841757287 1047453521 /nfs/dbraw/zinc/45/35/21/1047453521.db2.gz NCLWZBAMKHKDKT-ZJNRKIDTSA-N 1 0 319.832 4.127 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2COCc3ccccc32)c1O ZINC000841762066 1047455543 /nfs/dbraw/zinc/45/55/43/1047455543.db2.gz USQLQKMKIIPREZ-PXAZEXFGSA-N 1 0 317.816 4.276 20 10 DICDRO COc1ccccc1C1([NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000842900052 1047512167 /nfs/dbraw/zinc/51/21/67/1047512167.db2.gz DJNJCLZQAGMKGR-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO CC[C@@H]([NH2+]C1(c2ccccc2OC)CC1)c1ccc(C)cc1O ZINC000842904216 1047513369 /nfs/dbraw/zinc/51/33/69/1047513369.db2.gz SUNWJIAFHRWENH-QGZVFWFLSA-N 1 0 311.425 4.439 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCO)c1ccccc1F)c1ccc(C)cc1O ZINC000842924662 1047513760 /nfs/dbraw/zinc/51/37/60/1047513760.db2.gz RQMKCOWDSFEDAN-ROUUACIJSA-N 1 0 317.404 4.004 20 10 DICDRO COc1ccccc1C1([NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000842902959 1047513901 /nfs/dbraw/zinc/51/39/01/1047513901.db2.gz PDOUWECHCKWQLR-HNNXBMFYSA-N 1 0 311.425 4.358 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c1O ZINC001143111068 1047531787 /nfs/dbraw/zinc/53/17/87/1047531787.db2.gz WHZFRJBMDXCOHI-GFCCVEGCSA-N 1 0 301.352 4.074 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCOC3(CCCCC3)C2)c1O ZINC001143112503 1047531831 /nfs/dbraw/zinc/53/18/31/1047531831.db2.gz UDYDQALQPMOEGV-UHFFFAOYSA-N 1 0 317.473 4.225 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CCC(c3ccncc3)CC2)c1O ZINC001143110571 1047532349 /nfs/dbraw/zinc/53/23/49/1047532349.db2.gz JQRLOMMWPUAMJB-UHFFFAOYSA-N 1 0 324.468 4.464 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@H](c3ccccn3)C2)c1O ZINC001143110622 1047532492 /nfs/dbraw/zinc/53/24/92/1047532492.db2.gz LUJDGDAWPQBPRJ-HNNXBMFYSA-N 1 0 310.441 4.074 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CCC(c3cccnc3)CC2)c1O ZINC001143112119 1047532641 /nfs/dbraw/zinc/53/26/41/1047532641.db2.gz LGNOATXXHDQLEY-UHFFFAOYSA-N 1 0 324.468 4.464 20 10 DICDRO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143110804 1047532684 /nfs/dbraw/zinc/53/26/84/1047532684.db2.gz PQWDCETVCHAUQT-INIZCTEOSA-N 1 0 305.462 4.079 20 10 DICDRO CC(C)O[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000843413979 1047548424 /nfs/dbraw/zinc/54/84/24/1047548424.db2.gz QPBJHHLTTBKFBH-LJQANCHMSA-N 1 0 311.425 4.059 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)[C@@H]1CCc2ncsc2C1 ZINC000843435961 1047551749 /nfs/dbraw/zinc/55/17/49/1047551749.db2.gz XCXWUJISTPNDBO-OAHLLOKOSA-N 1 0 316.470 4.008 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)cc1 ZINC001203199455 1047590407 /nfs/dbraw/zinc/59/04/07/1047590407.db2.gz GFXWNHRJPJQCMK-QHAWAJNXSA-N 1 0 324.443 4.100 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C(C)(C)c2ccnc(Cl)c2)cc1 ZINC001156928512 1047728110 /nfs/dbraw/zinc/72/81/10/1047728110.db2.gz SCQWHUGMSXJCQR-UHFFFAOYSA-N 1 0 317.864 4.168 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)c1ccc2ccccc2c1O ZINC000927035076 1047764782 /nfs/dbraw/zinc/76/47/82/1047764782.db2.gz ZYUUVIWTHYTHJX-VNHYZAJKSA-N 1 0 301.455 4.480 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1ccc(Cl)cc1O ZINC000927064122 1047787919 /nfs/dbraw/zinc/78/79/19/1047787919.db2.gz PANAKLUUWULAPI-NHYWBVRUSA-N 1 0 302.805 4.169 20 10 DICDRO Cc1cc(O)c(C[NH+]2CC(Cc3ccsc3)C2)cc1Cl ZINC001183053587 1047883931 /nfs/dbraw/zinc/88/39/31/1047883931.db2.gz OQCZUGBXTLWDMT-UHFFFAOYSA-N 1 0 307.846 4.090 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1cnn(C(C)C)c1C ZINC000479452087 1047894840 /nfs/dbraw/zinc/89/48/40/1047894840.db2.gz HXRAMGFVBQHHIO-HNNXBMFYSA-N 1 0 324.472 4.423 20 10 DICDRO Cc1cc(CC[NH2+][C@@H]2CC[C@H]2C2CC2)c(C)n1-c1ccccc1 ZINC001183180578 1047901589 /nfs/dbraw/zinc/90/15/89/1047901589.db2.gz PFPLKCVLNJSMJS-LEWJYISDSA-N 1 0 308.469 4.415 20 10 DICDRO CC[C@@](C)([NH2+]Cc1cc(C)cc(OC)c1O)c1ccc(F)cc1 ZINC001183267977 1047913208 /nfs/dbraw/zinc/91/32/08/1047913208.db2.gz CWSLSPUWXCNNAE-LJQANCHMSA-N 1 0 317.404 4.263 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC001183363242 1047918829 /nfs/dbraw/zinc/91/88/29/1047918829.db2.gz IAFZNARWGNDRNL-UJAVWCLSSA-N 1 0 312.379 4.040 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)c(O)c1 ZINC000775822058 1047930508 /nfs/dbraw/zinc/93/05/08/1047930508.db2.gz LMFHGXGQWZWAQQ-IBGZPJMESA-N 1 0 317.404 4.417 20 10 DICDRO FC[C@@H]1CC[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC001183519967 1047933165 /nfs/dbraw/zinc/93/31/65/1047933165.db2.gz IIXNSXRWKKZUFM-IBGZPJMESA-N 1 0 324.443 4.041 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)cc1Cl ZINC001183492686 1047936674 /nfs/dbraw/zinc/93/66/74/1047936674.db2.gz XXRPENYKGLSSOG-WMZOPIPTSA-N 1 0 319.807 4.469 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)cc1Cl ZINC001183492684 1047936983 /nfs/dbraw/zinc/93/69/83/1047936983.db2.gz XXRPENYKGLSSOG-SJLPKXTDSA-N 1 0 319.807 4.469 20 10 DICDRO C[C@H]([NH2+]Cc1cc(Cl)nc(Cl)c1)c1ccc(N(C)C)cc1 ZINC000775834243 1047943115 /nfs/dbraw/zinc/94/31/15/1047943115.db2.gz MLOPUHALXXACJS-NSHDSACASA-N 1 0 324.255 4.305 20 10 DICDRO CN(C)c1ccc(N=Nc2ccc(NC3=CC[NH2+]C3)cc2)cc1 ZINC001159971221 1047961649 /nfs/dbraw/zinc/96/16/49/1047961649.db2.gz YKRLULPTYGMQIU-UHFFFAOYSA-N 1 0 307.401 4.067 20 10 DICDRO CC(C)Nc1ccc(Nc2ccccc2N2CCC[C@@H]([NH3+])C2)cc1 ZINC001159978853 1047963193 /nfs/dbraw/zinc/96/31/93/1047963193.db2.gz ZMKCLOIRXLPUGP-MRXNPFEDSA-N 1 0 324.472 4.178 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c(O)cc1Br ZINC001250129110 1047963183 /nfs/dbraw/zinc/96/31/83/1047963183.db2.gz XWMAPTLQAMBEEN-IUODEOHRSA-N 1 0 324.262 4.228 20 10 DICDRO c1ccc(C2=CC[NH2+]CC2)c(Nc2ccc3c(c2)CCCN3)c1 ZINC001160021919 1047971030 /nfs/dbraw/zinc/97/10/30/1047971030.db2.gz MCLDRMCWEUNPIQ-UHFFFAOYSA-N 1 0 305.425 4.165 20 10 DICDRO CC1(C)C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCS1 ZINC001184023708 1047989500 /nfs/dbraw/zinc/98/95/00/1047989500.db2.gz PDPBJYZHKXRZHR-HNNXBMFYSA-N 1 0 301.455 4.309 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2C[C@H]3[C@H]4CC[C@H](C4)[C@@]3(C)C2)c(Cl)c1 ZINC001184053520 1047995316 /nfs/dbraw/zinc/99/53/16/1047995316.db2.gz AXNDCSYAGLZLGV-SCGCMHLBSA-N 1 0 305.849 4.222 20 10 DICDRO COC[C@@H]([NH2+]Cc1cc(C(C)C)ccc1O)c1ccc(F)cc1 ZINC001184278590 1048024181 /nfs/dbraw/zinc/02/41/81/1048024181.db2.gz UEQWINAGGLCDKH-GOSISDBHSA-N 1 0 317.404 4.132 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)cc1 ZINC001203934289 1048065013 /nfs/dbraw/zinc/06/50/13/1048065013.db2.gz OYBOOTNHKLKWDM-IBGZPJMESA-N 1 0 312.482 4.043 20 10 DICDRO CCC[N@H+](Cc1cccc(C)c1O)[C@H]1CCCc2cccnc21 ZINC000775995048 1048080800 /nfs/dbraw/zinc/08/08/00/1048080800.db2.gz PNRPNVNSTPIDGP-SFHVURJKSA-N 1 0 310.441 4.385 20 10 DICDRO CCC[N@H+](Cc1cc(C)ccc1O)[C@@H]1CCCc2cccnc21 ZINC000775995673 1048080894 /nfs/dbraw/zinc/08/08/94/1048080894.db2.gz PBBXOKAXYKTBBM-GOSISDBHSA-N 1 0 310.441 4.385 20 10 DICDRO COc1ccc(CCC[NH2+]Cc2c(C)c3ccccc3n2C)cc1 ZINC001199658443 1048085092 /nfs/dbraw/zinc/08/50/92/1048085092.db2.gz OPMSEEPEYFBVRV-UHFFFAOYSA-N 1 0 322.452 4.218 20 10 DICDRO CCN(CC)c1ccc(CN2CCC[C@@H]2c2nccs2)cc1 ZINC001203941909 1048105931 /nfs/dbraw/zinc/10/59/31/1048105931.db2.gz GNAPCZBPZDLXTD-QGZVFWFLSA-N 1 0 315.486 4.326 20 10 DICDRO CC[C@H]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC001199830341 1048106998 /nfs/dbraw/zinc/10/69/98/1048106998.db2.gz JAOIRNWSBCJWKG-IRXDYDNUSA-N 1 0 300.490 4.375 20 10 DICDRO COC1(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)CCC1 ZINC000780740676 1048141537 /nfs/dbraw/zinc/14/15/37/1048141537.db2.gz RPNBFIPZKQNMRW-QGZVFWFLSA-N 1 0 316.489 4.287 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccccc2C)cc1F ZINC001200978790 1048165008 /nfs/dbraw/zinc/16/50/08/1048165008.db2.gz GOEIPOQBIKSYQF-UHFFFAOYSA-N 1 0 314.448 4.313 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C2(c3ccc(F)cc3)CC2)cc1 ZINC001200952549 1048168155 /nfs/dbraw/zinc/16/81/55/1048168155.db2.gz RXRBVLKHUAFLBL-ONEGZZNKSA-N 1 0 310.416 4.184 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)c(Cl)c1 ZINC001201380571 1048255325 /nfs/dbraw/zinc/25/53/25/1048255325.db2.gz RPAAZOQGBKDZRP-SPYBWZPUSA-N 1 0 313.828 4.030 20 10 DICDRO Fc1ccc2c(c1)[C@@H]([NH2+]CCCSc1nccs1)CCC2 ZINC000776162754 1048259249 /nfs/dbraw/zinc/25/92/49/1048259249.db2.gz KOHPBDKZXPGOAI-HNNXBMFYSA-N 1 0 322.474 4.432 20 10 DICDRO CC(C)=CCC[C@H](C)C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001201495747 1048284664 /nfs/dbraw/zinc/28/46/64/1048284664.db2.gz FUHYHCZQGFNPMK-HNNXBMFYSA-N 1 0 303.446 4.229 20 10 DICDRO C[C@@H](CC[NH2+]CCCSc1nccs1)c1ccccc1 ZINC000775025655 1048313583 /nfs/dbraw/zinc/31/35/83/1048313583.db2.gz WCWQSSQKRFRAKP-AWEZNQCLSA-N 1 0 306.500 4.409 20 10 DICDRO Cc1cccc(C[NH2+]C[C@@H]2CCC[C@H](C(F)(F)F)C2)c1O ZINC000776230790 1048413511 /nfs/dbraw/zinc/41/35/11/1048413511.db2.gz MHTTZOJVOVTULY-OCCSQVGLSA-N 1 0 301.352 4.159 20 10 DICDRO Cc1cccc(C[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000776230791 1048413627 /nfs/dbraw/zinc/41/36/27/1048413627.db2.gz MHTTZOJVOVTULY-TZMCWYRMSA-N 1 0 301.352 4.159 20 10 DICDRO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccccc3O)co2)cc1 ZINC000775135027 1048422477 /nfs/dbraw/zinc/42/24/77/1048422477.db2.gz BURLNMXZLHLADX-AWEZNQCLSA-N 1 0 308.381 4.206 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)CCCC(F)(F)F ZINC000775140965 1048434135 /nfs/dbraw/zinc/43/41/35/1048434135.db2.gz QXEKCVFIDFTWRD-ZDUSSCGKSA-N 1 0 302.384 4.483 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC001202066163 1048437531 /nfs/dbraw/zinc/43/75/31/1048437531.db2.gz NSCHVKWDAJLRAO-OXJNMPFZSA-N 1 0 308.469 4.351 20 10 DICDRO CCCOc1ccc(C[NH2+]CCC2CC(OCC)C2)cc1C ZINC001202066454 1048437569 /nfs/dbraw/zinc/43/75/69/1048437569.db2.gz ZHKPLXXJOMQODX-UHFFFAOYSA-N 1 0 305.462 4.079 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC001202066162 1048437599 /nfs/dbraw/zinc/43/75/99/1048437599.db2.gz NSCHVKWDAJLRAO-JXFKEZNVSA-N 1 0 308.469 4.351 20 10 DICDRO [NH3+]Cc1ccc(Nc2cccc3c2C(=O)c2ccccc2-3)cc1 ZINC001175972029 1048512424 /nfs/dbraw/zinc/51/24/24/1048512424.db2.gz TWUSBYCFIGYMFK-UHFFFAOYSA-N 1 0 300.361 4.100 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@]2(C)CC2(Cl)Cl)cc1C ZINC001202458094 1048556897 /nfs/dbraw/zinc/55/68/97/1048556897.db2.gz ZXKZAMDAWAEJKV-HNNXBMFYSA-N 1 0 316.272 4.457 20 10 DICDRO c1csc(SCCC[NH2+]Cc2cc3ccncc3s2)n1 ZINC000850144634 1048620300 /nfs/dbraw/zinc/62/03/00/1048620300.db2.gz LBSRKSZCZRYXGY-UHFFFAOYSA-N 1 0 321.496 4.025 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(F)c(F)c1F)c1ccc(N(C)C)cc1 ZINC000850252363 1048628918 /nfs/dbraw/zinc/62/89/18/1048628918.db2.gz QSZAGYNVAVWPKH-NSHDSACASA-N 1 0 308.347 4.021 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2CCCc3c(C)cccc32)c1O ZINC000850411769 1048650192 /nfs/dbraw/zinc/65/01/92/1048650192.db2.gz KDZVQXBVSUBWSB-SFHVURJKSA-N 1 0 311.425 4.267 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cc2cnccc2o1 ZINC000850430652 1048653315 /nfs/dbraw/zinc/65/33/15/1048653315.db2.gz NNWKNYSHZSNMSO-CQSZACIVSA-N 1 0 321.424 4.061 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)c1ccccn1 ZINC000850481326 1048668424 /nfs/dbraw/zinc/66/84/24/1048668424.db2.gz GKIGGLZMKUENJM-GJZGRUSLSA-N 1 0 306.409 4.395 20 10 DICDRO COC1CC(CC[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000850481265 1048669415 /nfs/dbraw/zinc/66/94/15/1048669415.db2.gz IKGSIZDQMJBSPC-ZRZPHAQCSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ccc2ccccc2c1O ZINC000850481074 1048669785 /nfs/dbraw/zinc/66/97/85/1048669785.db2.gz HEHBPUGJNUEYOD-ZBFHGGJFSA-N 1 0 312.457 4.069 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2noc3ccccc23)c(O)c1 ZINC000850482795 1048670393 /nfs/dbraw/zinc/67/03/93/1048670393.db2.gz LTDKZLHQSDBYHT-AWEZNQCLSA-N 1 0 310.397 4.044 20 10 DICDRO C[C@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1ccc2ccccc2c1O ZINC000850491887 1048671196 /nfs/dbraw/zinc/67/11/96/1048671196.db2.gz BBCZSSGOKFTYBF-HOCLYGCPSA-N 1 0 312.457 4.069 20 10 DICDRO Cc1ccncc1CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000850505947 1048673206 /nfs/dbraw/zinc/67/32/06/1048673206.db2.gz DPMSNFPGUWIYKH-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)COc2c(F)cccc2F)c1 ZINC000850522998 1048676232 /nfs/dbraw/zinc/67/62/32/1048676232.db2.gz VEPCNCWKIBGRJN-QWHCGFSZSA-N 1 0 321.367 4.097 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)COc2c(F)cccc2F)c1 ZINC000850522999 1048677579 /nfs/dbraw/zinc/67/75/79/1048677579.db2.gz VEPCNCWKIBGRJN-STQMWFEESA-N 1 0 321.367 4.097 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2C[C@H](O)c3ccccc32)c1O ZINC000850527754 1048680099 /nfs/dbraw/zinc/68/00/99/1048680099.db2.gz YNJUPIWHUKTCHS-JECHBYEQSA-N 1 0 317.816 4.183 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C[C@@H](O)c3ccccc32)c1O ZINC000850527755 1048680216 /nfs/dbraw/zinc/68/02/16/1048680216.db2.gz YNJUPIWHUKTCHS-MZPVMMEZSA-N 1 0 317.816 4.183 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@H](O)c2ccccc21)c1cc(Cl)ccc1O ZINC000850527544 1048680444 /nfs/dbraw/zinc/68/04/44/1048680444.db2.gz GUQCHYDSZQSAHG-JZXOWHBKSA-N 1 0 317.816 4.265 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1ccccc1O ZINC000850530744 1048682681 /nfs/dbraw/zinc/68/26/81/1048682681.db2.gz BUYIHRIASUAKNN-JENIJYKNSA-N 1 0 311.425 4.006 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cc(Cl)ccc1O ZINC000850543542 1048687324 /nfs/dbraw/zinc/68/73/24/1048687324.db2.gz LTNLZIWUMVUJAZ-QLJPJBMISA-N 1 0 303.789 4.089 20 10 DICDRO CC[C@@H]([NH2+]CCc1nsc2ccccc12)c1ccccc1O ZINC000850559352 1048690746 /nfs/dbraw/zinc/69/07/46/1048690746.db2.gz AVIRAFZEZBUSGX-OAHLLOKOSA-N 1 0 312.438 4.285 20 10 DICDRO CCCC[C@@H](CCC)[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000850566140 1048694104 /nfs/dbraw/zinc/69/41/04/1048694104.db2.gz JXXNZNYFCLQUGT-GOSISDBHSA-N 1 0 318.505 4.096 20 10 DICDRO C[C@H]([NH2+]CCCc1ccco1)c1cc(Br)ccc1O ZINC000850569399 1048695658 /nfs/dbraw/zinc/69/56/58/1048695658.db2.gz CNUWAYJLEHURFG-NSHDSACASA-N 1 0 324.218 4.031 20 10 DICDRO COc1cccc(C2([NH2+][C@@H]3CCc4cccc(O)c43)CCC2)c1 ZINC000850566807 1048696314 /nfs/dbraw/zinc/69/63/14/1048696314.db2.gz RAGYOQGMGOERGE-QGZVFWFLSA-N 1 0 309.409 4.057 20 10 DICDRO COc1cccc(C2([NH2+][C@H]3CCc4cccc(O)c43)CCC2)c1 ZINC000850566805 1048696365 /nfs/dbraw/zinc/69/63/65/1048696365.db2.gz RAGYOQGMGOERGE-KRWDZBQOSA-N 1 0 309.409 4.057 20 10 DICDRO CCCCCC[C@H](C)[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000850567306 1048696791 /nfs/dbraw/zinc/69/67/91/1048696791.db2.gz ZDSAGMFMSZSBRO-KRWDZBQOSA-N 1 0 318.505 4.096 20 10 DICDRO C[C@H]([NH2+]CCC1SCCS1)c1ccc2ccccc2c1O ZINC000850570840 1048698259 /nfs/dbraw/zinc/69/82/59/1048698259.db2.gz MRBXIEZQCHRQEM-LBPRGKRZSA-N 1 0 319.495 4.392 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3c(C)cccc32)c1 ZINC000850573439 1048699498 /nfs/dbraw/zinc/69/94/98/1048699498.db2.gz LXPJWXNLXBRUFK-KUHUBIRLSA-N 1 0 311.425 4.437 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@H](C)O)c1cc(Cl)ccc1O ZINC000850585522 1048701899 /nfs/dbraw/zinc/70/18/99/1048701899.db2.gz YXQMBXPQORTMNW-IWEFOYFVSA-N 1 0 319.832 4.208 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c(Cl)c1 ZINC000775363143 1048704431 /nfs/dbraw/zinc/70/44/31/1048704431.db2.gz KOLODVDVJSJMHZ-ZDUSSCGKSA-N 1 0 318.848 4.265 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCSc2ccc(C)cc2)c1 ZINC000775371423 1048713207 /nfs/dbraw/zinc/71/32/07/1048713207.db2.gz OFERFPWFMWMCDJ-AWEZNQCLSA-N 1 0 317.454 4.152 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CCCOCC2)c(C)n1-c1cccc(C)c1 ZINC000776498337 1048722020 /nfs/dbraw/zinc/72/20/20/1048722020.db2.gz SFACFXAKWHDGPL-LJQANCHMSA-N 1 0 312.457 4.061 20 10 DICDRO CO[C@@H](c1ccccc1F)[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000776498586 1048722884 /nfs/dbraw/zinc/72/28/84/1048722884.db2.gz OQCSGXDNVFCKGJ-APPDUMDISA-N 1 0 323.795 4.051 20 10 DICDRO Fc1ccc2c(c1)CCC[C@H]2[NH2+]CCCSc1nccs1 ZINC000775392561 1048749099 /nfs/dbraw/zinc/74/90/99/1048749099.db2.gz GGZKJVQXFKJNAB-OAHLLOKOSA-N 1 0 322.474 4.432 20 10 DICDRO C[C@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001191003722 1048818164 /nfs/dbraw/zinc/81/81/64/1048818164.db2.gz JMBNHPLXBGMKQM-OAHLLOKOSA-N 1 0 316.876 4.469 20 10 DICDRO Cc1cc(C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001191003925 1048818975 /nfs/dbraw/zinc/81/89/75/1048818975.db2.gz MEBZZALPFATAHD-PXNSSMCTSA-N 1 0 308.469 4.439 20 10 DICDRO CCCC[N@H+](Cc1cc(C2CC2)no1)Cc1ccccc1O ZINC000852017533 1048820052 /nfs/dbraw/zinc/82/00/52/1048820052.db2.gz AZWYLTVUPANHMP-UHFFFAOYSA-N 1 0 300.402 4.060 20 10 DICDRO CCOCc1cc(C[NH2+]CC2CCC3(CC3)CC2)ccc1OC ZINC001203289733 1048857886 /nfs/dbraw/zinc/85/78/86/1048857886.db2.gz SQIIFQANXTZGAW-UHFFFAOYSA-N 1 0 317.473 4.292 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC001191194452 1048880344 /nfs/dbraw/zinc/88/03/44/1048880344.db2.gz SEIHSAQKZZGHMJ-FQEVSTJZSA-N 1 0 308.469 4.207 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc2c(c1)CCCO2 ZINC000853239727 1048887893 /nfs/dbraw/zinc/88/78/93/1048887893.db2.gz CTFQSXUVSYKIII-DYVFJYSZSA-N 1 0 309.409 4.055 20 10 DICDRO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(C)c(C)cc1O)CCC2 ZINC000111172735 1048888229 /nfs/dbraw/zinc/88/82/29/1048888229.db2.gz SGLDIRRLIMMHDZ-INIZCTEOSA-N 1 0 316.470 4.283 20 10 DICDRO CC[C@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccc(C)cc1O ZINC000853240167 1048892220 /nfs/dbraw/zinc/89/22/20/1048892220.db2.gz HCEVQBNWBLNBEZ-HNNXBMFYSA-N 1 0 324.346 4.355 20 10 DICDRO Cc1cc(C[N@H+](C)CC2=CCSC2)c(O)c(C(C)(C)C)c1 ZINC000853618866 1048911958 /nfs/dbraw/zinc/91/19/58/1048911958.db2.gz OTLVXLDFDBHTRK-UHFFFAOYSA-N 1 0 305.487 4.103 20 10 DICDRO C[C@H](CCc1ccccc1)C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001177548239 1048914245 /nfs/dbraw/zinc/91/42/45/1048914245.db2.gz CNEKUECUBSAYLF-MRXNPFEDSA-N 1 0 314.448 4.250 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1C ZINC001177587102 1048920689 /nfs/dbraw/zinc/92/06/89/1048920689.db2.gz XHCGBKCADJLXCH-UHFFFAOYSA-N 1 0 311.425 4.009 20 10 DICDRO Clc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177651097 1048930193 /nfs/dbraw/zinc/93/01/93/1048930193.db2.gz ULBSSPBUKBJWPD-SFHVURJKSA-N 1 0 313.828 4.442 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c1O ZINC001203595992 1048936692 /nfs/dbraw/zinc/93/66/92/1048936692.db2.gz WXDNVOQUQDWZLU-ZDUSSCGKSA-N 1 0 317.816 4.044 20 10 DICDRO COc1ccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)c(O)c1 ZINC001203634416 1048943219 /nfs/dbraw/zinc/94/32/19/1048943219.db2.gz DZKITGBFMQTALR-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c(O)c1 ZINC001203634775 1048943436 /nfs/dbraw/zinc/94/34/36/1048943436.db2.gz UUKWTWMIBKWXFO-INIZCTEOSA-N 1 0 319.351 4.016 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c(O)c1 ZINC001203630548 1048944553 /nfs/dbraw/zinc/94/45/53/1048944553.db2.gz UPTQYRDJXNAZQU-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCc3ccccc32)cc1 ZINC001177855082 1048953149 /nfs/dbraw/zinc/95/31/49/1048953149.db2.gz KKMSGGRBJGEPQP-UEKDZROGSA-N 1 0 306.453 4.085 20 10 DICDRO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1cc(Cl)ccc1O ZINC001203664245 1048954088 /nfs/dbraw/zinc/95/40/88/1048954088.db2.gz SRSDFUZDSDBQPG-UHFFFAOYSA-N 1 0 317.816 4.139 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1nccc2c1CCCC2 ZINC001203664908 1048954142 /nfs/dbraw/zinc/95/41/42/1048954142.db2.gz BVOFOCJOHSWPON-UHFFFAOYSA-N 1 0 319.452 4.050 20 10 DICDRO Cc1cc(C[N@@H+]2CCSC(C)(C)C2)ccc1N1CCCCC1 ZINC001191508361 1048954547 /nfs/dbraw/zinc/95/45/47/1048954547.db2.gz BGNLRCURSSAWKL-UHFFFAOYSA-N 1 0 318.530 4.313 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCc3ccccc32)cc1 ZINC001177855084 1048954591 /nfs/dbraw/zinc/95/45/91/1048954591.db2.gz KKMSGGRBJGEPQP-ZMBJWTFHSA-N 1 0 306.453 4.085 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(N)c1)c1ccc(N2CCCCC2)cc1 ZINC000854216750 1048955204 /nfs/dbraw/zinc/95/52/04/1048955204.db2.gz DFAJOCGPCCCIQF-INIZCTEOSA-N 1 0 309.457 4.110 20 10 DICDRO CC[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccccc1O ZINC000775487109 1049003677 /nfs/dbraw/zinc/00/36/77/1049003677.db2.gz ICWFLPWZODDGFE-LMMKCTJWSA-N 1 0 318.505 4.191 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)COc1cccc(F)c1)c1ccccc1O ZINC000775491265 1049012863 /nfs/dbraw/zinc/01/28/63/1049012863.db2.gz HAGYLFRUYCNGRN-SUMWQHHRSA-N 1 0 303.377 4.040 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccccc1O ZINC000775489618 1049014525 /nfs/dbraw/zinc/01/45/25/1049014525.db2.gz VVVMOFPFFBIUET-DYVFJYSZSA-N 1 0 324.424 4.079 20 10 DICDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000775492750 1049022038 /nfs/dbraw/zinc/02/20/38/1049022038.db2.gz QFIQMZJVRGYRFM-CQSZACIVSA-N 1 0 314.395 4.498 20 10 DICDRO CC[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775496214 1049023684 /nfs/dbraw/zinc/02/36/84/1049023684.db2.gz HLKFXDWEQWZKPK-CYBMUJFWSA-N 1 0 319.276 4.082 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2ncsc2c1 ZINC000776806799 1049027136 /nfs/dbraw/zinc/02/71/36/1049027136.db2.gz CMWFGKFBPMXOCE-GFCCVEGCSA-N 1 0 310.422 4.082 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1C[C@@H](OC(C)C)C1(C)C ZINC001178430138 1049028718 /nfs/dbraw/zinc/02/87/18/1049028718.db2.gz AAMGDNSRIFNXFY-RBUKOAKNSA-N 1 0 314.473 4.168 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000113315417 1049031927 /nfs/dbraw/zinc/03/19/27/1049031927.db2.gz ZFYKTRBXHYZUNI-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000775496594 1049031982 /nfs/dbraw/zinc/03/19/82/1049031982.db2.gz JVVVETUZTCMUBI-ZDUSSCGKSA-N 1 0 314.395 4.280 20 10 DICDRO CCc1nc(CC[NH2+][C@H](CC)c2cc(Cl)ccc2O)cs1 ZINC000775499916 1049033215 /nfs/dbraw/zinc/03/32/15/1049033215.db2.gz HBZRHSHWRBUBLE-CQSZACIVSA-N 1 0 324.877 4.348 20 10 DICDRO CC[C@@H]([NH2+]CCc1c[nH]c2cc(C)ccc12)c1ccccc1O ZINC000775500037 1049033582 /nfs/dbraw/zinc/03/35/82/1049033582.db2.gz MKYRNENPEFWOIP-GOSISDBHSA-N 1 0 308.425 4.465 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)C(F)(F)CC2)cc1 ZINC001203937455 1049034217 /nfs/dbraw/zinc/03/42/17/1049034217.db2.gz ZDPLEGJWYKATPD-OAHLLOKOSA-N 1 0 310.432 4.400 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(Cl)ccc1O ZINC000775499906 1049034704 /nfs/dbraw/zinc/03/47/04/1049034704.db2.gz GXAHIOYKLUUCQQ-MRXNPFEDSA-N 1 0 317.816 4.221 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(COc3ccccc3)CC2)cc1 ZINC001203934369 1049036047 /nfs/dbraw/zinc/03/60/47/1049036047.db2.gz SPWJWDCDWLBQJZ-UHFFFAOYSA-N 1 0 324.468 4.044 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(F)c1F ZINC001203937166 1049036155 /nfs/dbraw/zinc/03/61/55/1049036155.db2.gz OJRPIMLBEJOFGD-UHFFFAOYSA-N 1 0 304.384 4.053 20 10 DICDRO CC[C@H]([NH2+]Cc1c(C)nn(CC)c1C)c1cc(Cl)ccc1O ZINC000775498832 1049037792 /nfs/dbraw/zinc/03/77/92/1049037792.db2.gz OKCZNXUTDAOYJL-INIZCTEOSA-N 1 0 321.852 4.120 20 10 DICDRO CCN(CC)c1ccc(C[N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)cc1 ZINC001203940233 1049037927 /nfs/dbraw/zinc/03/79/27/1049037927.db2.gz JLPIIWSKNMRRBH-IYBDPMFKSA-N 1 0 308.416 4.010 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)c1cc(Cl)ccc1O ZINC000775498765 1049038580 /nfs/dbraw/zinc/03/85/80/1049038580.db2.gz NSTDNOYXLAITST-SJCJKPOMSA-N 1 0 319.832 4.423 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1cc(Cl)ccc1O ZINC000775501570 1049040523 /nfs/dbraw/zinc/04/05/23/1049040523.db2.gz IAOLOMQRLUADNZ-CVEARBPZSA-N 1 0 317.816 4.479 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@@H](c2ccccc2)C(F)(F)F)cc1 ZINC000776817362 1049043483 /nfs/dbraw/zinc/04/34/83/1049043483.db2.gz VEYYEHMMVSOSQT-KRWDZBQOSA-N 1 0 322.374 4.188 20 10 DICDRO C[C@H](CCCC(F)(F)F)[NH2+]CCCSc1nccs1 ZINC000775506825 1049046589 /nfs/dbraw/zinc/04/65/89/1049046589.db2.gz FHQVQGSHXVFNAW-SNVBAGLBSA-N 1 0 312.426 4.336 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccccc1C)c1cc(Cl)ccc1O ZINC000775503915 1049047326 /nfs/dbraw/zinc/04/73/26/1049047326.db2.gz PRQNUSZLJZQDOI-SJLPKXTDSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](OC)c1ccc(Cl)cc1)c1ccccc1O ZINC000775508016 1049047650 /nfs/dbraw/zinc/04/76/50/1049047650.db2.gz GTOGXABPZAPMEF-FUHWJXTLSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1ccccc1O ZINC000775507562 1049049856 /nfs/dbraw/zinc/04/98/56/1049049856.db2.gz NFKJZGNELQGHKG-QGZVFWFLSA-N 1 0 312.388 4.296 20 10 DICDRO Oc1cc2c(cc1O)C[N@H+](Cc1cccc3ccccc31)CCC2 ZINC001203988461 1049051914 /nfs/dbraw/zinc/05/19/14/1049051914.db2.gz JHJJQZQUUOMYPX-UHFFFAOYSA-N 1 0 319.404 4.199 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)Cc1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775509405 1049052943 /nfs/dbraw/zinc/05/29/43/1049052943.db2.gz LREXEUVQOQVAPX-QFYYESIMSA-N 1 0 322.836 4.322 20 10 DICDRO C[C@@H](CC[NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1 ZINC001178583925 1049057536 /nfs/dbraw/zinc/05/75/36/1049057536.db2.gz BDHBAIRNHWXBTR-AWEZNQCLSA-N 1 0 318.411 4.314 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H](CC)c1ccccc1O)C1CCCC1 ZINC000775513711 1049057586 /nfs/dbraw/zinc/05/75/86/1049057586.db2.gz SODVUOAKDDXUHS-PKOBYXMFSA-N 1 0 305.462 4.418 20 10 DICDRO CC[C@H]([NH2+]C[C@]1(C)CCCC[C@H]1O)c1cc(Cl)ccc1O ZINC000775512452 1049057777 /nfs/dbraw/zinc/05/77/77/1049057777.db2.gz PRNFZSZMDKRQFI-UAGQMJEPSA-N 1 0 311.853 4.028 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc2c(n1)CCCC2 ZINC001178581670 1049058013 /nfs/dbraw/zinc/05/80/13/1049058013.db2.gz VFVUCWHBRLECEW-UHFFFAOYSA-N 1 0 319.452 4.050 20 10 DICDRO COc1cc(C[NH2+][C@@H]2CC=CC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001204011771 1049060267 /nfs/dbraw/zinc/06/02/67/1049060267.db2.gz JLCIJEVZLLPCNQ-CXAGYDPISA-N 1 0 303.446 4.143 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@H](C)[C@@H]2C)ccc1OC ZINC001178595865 1049060307 /nfs/dbraw/zinc/06/03/07/1049060307.db2.gz VQVVFCATCLFVBY-BQFCYCMXSA-N 1 0 319.489 4.394 20 10 DICDRO Cc1cc2cc(C[NH2+]Cc3c(O)cc(C)cc3Cl)ccc2[nH]1 ZINC001178654289 1049069987 /nfs/dbraw/zinc/06/99/87/1049069987.db2.gz ITXIWYUJWVZLIX-UHFFFAOYSA-N 1 0 314.816 4.434 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)c1ccc(OC)cc1)c1ccccc1O ZINC000775518901 1049073730 /nfs/dbraw/zinc/07/37/30/1049073730.db2.gz IHQAQUFPLSDHEV-SFHVURJKSA-N 1 0 313.441 4.419 20 10 DICDRO CC[C@H]([NH2+]CCCc1nccs1)c1cc(Cl)ccc1O ZINC000775522868 1049081631 /nfs/dbraw/zinc/08/16/31/1049081631.db2.gz COFJIVZKFZNMGM-ZDUSSCGKSA-N 1 0 310.850 4.176 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)[C@H](O)C(C)C)c1cc(Cl)ccc1O ZINC000775524978 1049089113 /nfs/dbraw/zinc/08/91/13/1049089113.db2.gz XEPFMVKUQOPFFZ-GOEBONIOSA-N 1 0 313.869 4.129 20 10 DICDRO C[C@@H]([NH2+][C@H](C)C1(C)CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000776882914 1049090927 /nfs/dbraw/zinc/09/09/27/1049090927.db2.gz KFBBQVICDXGECA-ZIAGYGMSSA-N 1 0 322.880 4.016 20 10 DICDRO C[C@H]([NH2+][C@@H](C)C1(C)CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000776882911 1049091816 /nfs/dbraw/zinc/09/18/16/1049091816.db2.gz KFBBQVICDXGECA-KBPBESRZSA-N 1 0 322.880 4.016 20 10 DICDRO Cc1ccc(C2(C[NH2+]Cc3ccc4c(c3)CCCO4)CC2)c(C)c1 ZINC001178807023 1049092627 /nfs/dbraw/zinc/09/26/27/1049092627.db2.gz WBFUAJOYBCHMRC-UHFFFAOYSA-N 1 0 321.464 4.450 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1cc(Cl)ccc1O ZINC000775527035 1049093755 /nfs/dbraw/zinc/09/37/55/1049093755.db2.gz VTLHXHMYZWVUQS-JWZBEHFJSA-N 1 0 321.848 4.044 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H](OC)c1ccc(F)cc1)c1ccccc1O ZINC000775526700 1049093864 /nfs/dbraw/zinc/09/38/64/1049093864.db2.gz TXWIJGUYXOWQRZ-XVGQJIODSA-N 1 0 317.404 4.348 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)cc1F)c1cc(Cl)ccc1O ZINC000775527698 1049096742 /nfs/dbraw/zinc/09/67/42/1049096742.db2.gz SPKWKJOKZABLEU-INIZCTEOSA-N 1 0 323.795 4.434 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)c2ccccc21 ZINC001204233148 1049115623 /nfs/dbraw/zinc/11/56/23/1049115623.db2.gz OLGVYMBEBPWBLG-MOPGFXCFSA-N 1 0 318.411 4.178 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c2ccccc21 ZINC001204235157 1049115700 /nfs/dbraw/zinc/11/57/00/1049115700.db2.gz IFEMREGKTBFLPW-OAQYLSRUSA-N 1 0 324.468 4.051 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C[C@H]1F ZINC001204232911 1049116116 /nfs/dbraw/zinc/11/61/16/1049116116.db2.gz LQCKXMZQYJHVRJ-RDTXWAMCSA-N 1 0 300.421 4.086 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c2ccccc21 ZINC001204242174 1049117976 /nfs/dbraw/zinc/11/79/76/1049117976.db2.gz LUVGDXVMPSTFDF-CQSZACIVSA-N 1 0 322.374 4.290 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](CF)C2)c2ccccc21 ZINC001204241374 1049118198 /nfs/dbraw/zinc/11/81/98/1049118198.db2.gz FXPDGWACWOGLHT-OAHLLOKOSA-N 1 0 300.421 4.087 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)CC2CC(F)(F)C2)c2ccccc21 ZINC001204240731 1049118586 /nfs/dbraw/zinc/11/85/86/1049118586.db2.gz CDCDJQSUISFLBY-UHFFFAOYSA-N 1 0 318.411 4.383 20 10 DICDRO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001178998958 1049120800 /nfs/dbraw/zinc/12/08/00/1049120800.db2.gz VBYRBCSUIXAPGI-VQTJNVASSA-N 1 0 310.416 4.014 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c2ccccc21 ZINC001204243385 1049121253 /nfs/dbraw/zinc/12/12/53/1049121253.db2.gz YUOZASNAFCVTLV-SFHVURJKSA-N 1 0 316.395 4.137 20 10 DICDRO CC[N@H+](Cc1cccnc1)Cc1ccc(N(C)C)c2ccccc12 ZINC001204243393 1049121394 /nfs/dbraw/zinc/12/13/94/1049121394.db2.gz ZDWGWACRXOKOHR-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](Cc2ccccc2)C2CC2)cc1 ZINC001192606156 1049121939 /nfs/dbraw/zinc/12/19/39/1049121939.db2.gz ZTOBMTDYYLPQSP-OAQYLSRUSA-N 1 0 308.469 4.254 20 10 DICDRO Oc1ccc(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)c(O)c1 ZINC001204276838 1049124920 /nfs/dbraw/zinc/12/49/20/1049124920.db2.gz SBPSZSOAURJMMR-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO C[N@H+](Cc1ccc(O)cc1O)C(c1ccccc1)c1ccccc1 ZINC001204273176 1049125623 /nfs/dbraw/zinc/12/56/23/1049125623.db2.gz ZRXBMLDSGKHDTG-UHFFFAOYSA-N 1 0 319.404 4.319 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000857081685 1049125695 /nfs/dbraw/zinc/12/56/95/1049125695.db2.gz QDEVYFLGCGXMJK-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO C[C@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(N2CCCCC2)cc1 ZINC000857081507 1049125846 /nfs/dbraw/zinc/12/58/46/1049125846.db2.gz POIRJHMYNQUKTR-HOCLYGCPSA-N 1 0 308.416 4.373 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(OC)ccc2F)cc1 ZINC000857080132 1049126020 /nfs/dbraw/zinc/12/60/20/1049126020.db2.gz DODGDUFVRZIZQD-AWEZNQCLSA-N 1 0 316.420 4.141 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)c(O)c1 ZINC000857082903 1049127639 /nfs/dbraw/zinc/12/76/39/1049127639.db2.gz RSLVTIJIJTXKMX-NWDGAFQWSA-N 1 0 302.245 4.244 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CC2(Cl)Cl)c2c1c(F)ccc2O ZINC000857082346 1049127808 /nfs/dbraw/zinc/12/78/08/1049127808.db2.gz MUFDWPFUIYNKLZ-KKZNHRDASA-N 1 0 318.219 4.253 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@@H]1CCc2ccccc21 ZINC001204329055 1049142033 /nfs/dbraw/zinc/14/20/33/1049142033.db2.gz DJZQROZUTDNLQJ-OAQYLSRUSA-N 1 0 306.453 4.406 20 10 DICDRO C[N@H+](CCc1ccc(F)cc1)Cc1ccc(N2CCCC2)cc1 ZINC001204320920 1049142191 /nfs/dbraw/zinc/14/21/91/1049142191.db2.gz DQFLCOAHPVSUPN-UHFFFAOYSA-N 1 0 312.432 4.100 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CC[C@@H]2CCCC2(C)C)cc1F ZINC001179217064 1049142648 /nfs/dbraw/zinc/14/26/48/1049142648.db2.gz VSJQOYOEGKAWQN-AWEZNQCLSA-N 1 0 310.432 4.337 20 10 DICDRO COc1cc(C[NH+](CCC(C)C)CCC(C)C)cc(O)c1O ZINC001204349863 1049146870 /nfs/dbraw/zinc/14/68/70/1049146870.db2.gz YGVCFIIUDRLFNN-UHFFFAOYSA-N 1 0 309.450 4.001 20 10 DICDRO COc1cc(C[NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)c(O)c(C(C)(C)C)c1 ZINC001179316438 1049156080 /nfs/dbraw/zinc/15/60/80/1049156080.db2.gz VTDCDVPNEUFUBO-VTEUUUEMSA-N 1 0 317.473 4.224 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)cc1 ZINC000773815128 1049166985 /nfs/dbraw/zinc/16/69/85/1049166985.db2.gz ZCOSJHUHSBEQSP-TZIWHRDSSA-N 1 0 324.468 4.010 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1ccc(C(F)(F)F)cc1F ZINC001204468504 1049168911 /nfs/dbraw/zinc/16/89/11/1049168911.db2.gz FUDKMGNISJTGCP-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ccc(OC)c(F)c2)cc1 ZINC000773816309 1049176288 /nfs/dbraw/zinc/17/62/88/1049176288.db2.gz FVKWRCMKEHGWCA-AWEZNQCLSA-N 1 0 316.420 4.141 20 10 DICDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001179598082 1049182229 /nfs/dbraw/zinc/18/22/29/1049182229.db2.gz KLBURLWGTQYISQ-YPMHNXCESA-N 1 0 300.368 4.050 20 10 DICDRO COc1cc(C[NH2+]CC[C@@H]2CC[C@@H]3C[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC001179603104 1049184107 /nfs/dbraw/zinc/18/41/07/1049184107.db2.gz UBAOKJQCNLFRAS-JJRVBVJISA-N 1 0 317.473 4.224 20 10 DICDRO COc1cc(C[NH2+]CC[C@@H]2CC[C@H]3C[C@H]32)c(O)c(C(C)(C)C)c1 ZINC001179603106 1049184284 /nfs/dbraw/zinc/18/42/84/1049184284.db2.gz UBAOKJQCNLFRAS-ZQIUZPCESA-N 1 0 317.473 4.224 20 10 DICDRO c1ccc(C2(CC[NH2+]Cc3ccc(N4CCCC4)cc3)CC2)cc1 ZINC001179621255 1049189328 /nfs/dbraw/zinc/18/93/28/1049189328.db2.gz NOIMHJJZHJMNPV-UHFFFAOYSA-N 1 0 320.480 4.498 20 10 DICDRO CC[C@H]([NH2+]CC1(CCOC)CCCCC1)c1ccccc1O ZINC000775589110 1049193866 /nfs/dbraw/zinc/19/38/66/1049193866.db2.gz OPSIACYFNJRCDK-KRWDZBQOSA-N 1 0 305.462 4.420 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cc1 ZINC001193430735 1049211122 /nfs/dbraw/zinc/21/11/22/1049211122.db2.gz PIZRUVSHVAIZCU-OAHLLOKOSA-N 1 0 314.395 4.306 20 10 DICDRO COc1cc(C)cc(C[NH+]2CCC(C3CCCC3)CC2)c1O ZINC001179850280 1049215441 /nfs/dbraw/zinc/21/54/41/1049215441.db2.gz UOBLKMOIUPFNLB-UHFFFAOYSA-N 1 0 303.446 4.111 20 10 DICDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001179850174 1049216533 /nfs/dbraw/zinc/21/65/33/1049216533.db2.gz SJBZFVPFYDAQBK-DYVFJYSZSA-N 1 0 310.432 4.431 20 10 DICDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001204673693 1049218288 /nfs/dbraw/zinc/21/82/88/1049218288.db2.gz OGRDNERPXTXBKW-CXAGYDPISA-N 1 0 310.432 4.431 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]C(C)(C)c2cccs2)cc1F ZINC000858141207 1049222164 /nfs/dbraw/zinc/22/21/64/1049222164.db2.gz NXHYFQBVXBUFPO-UHFFFAOYSA-N 1 0 310.413 4.117 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)c1 ZINC000858237798 1049230177 /nfs/dbraw/zinc/23/01/77/1049230177.db2.gz PVXAGWDUUWLTPH-UHFFFAOYSA-N 1 0 311.425 4.094 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2C[C@H](C(C)C)c3ccccc32)c1O ZINC000858275673 1049235389 /nfs/dbraw/zinc/23/53/89/1049235389.db2.gz KOWOPPDJINHEPM-QZTJIDSGSA-N 1 0 311.425 4.375 20 10 DICDRO COc1cc(C)c(C[N@H+](CC2CCCCC2)C2CC2)c(O)c1 ZINC001204714227 1049238521 /nfs/dbraw/zinc/23/85/21/1049238521.db2.gz NRPVCZSYCPBRMT-UHFFFAOYSA-N 1 0 303.446 4.254 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccccc2CC(F)(F)F)cc1C ZINC000858330421 1049243591 /nfs/dbraw/zinc/24/35/91/1049243591.db2.gz UNQVIDHYUSECER-UHFFFAOYSA-N 1 0 323.358 4.404 20 10 DICDRO Cc1csc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)n1 ZINC000858426834 1049256953 /nfs/dbraw/zinc/25/69/53/1049256953.db2.gz UFMASLXOKZBGFI-DZGCQCFKSA-N 1 0 317.502 4.108 20 10 DICDRO Cc1ccc(C[NH+]2CCC(Cc3ccccc3F)CC2)c(O)c1 ZINC001204796853 1049267327 /nfs/dbraw/zinc/26/73/27/1049267327.db2.gz SPBIYTCBNIZOGW-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@@H](C)Cc1cccs1 ZINC001180064904 1049271507 /nfs/dbraw/zinc/27/15/07/1049271507.db2.gz ZJTOGIIGPZHNSU-HNNXBMFYSA-N 1 0 302.487 4.186 20 10 DICDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001180125107 1049291861 /nfs/dbraw/zinc/29/18/61/1049291861.db2.gz RHVATTKPTJMFSV-TZMCWYRMSA-N 1 0 303.352 4.048 20 10 DICDRO CC[C@H](C)[C@@H](C)[N@H+](Cc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC001180188227 1049297740 /nfs/dbraw/zinc/29/77/40/1049297740.db2.gz CEWHUUKKMRPUEK-QWHCGFSZSA-N 1 0 310.432 4.430 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC001204898922 1049303894 /nfs/dbraw/zinc/30/38/94/1049303894.db2.gz NFCZKJQLSUWOQE-UWJYYQICSA-N 1 0 324.468 4.023 20 10 DICDRO COc1ccc(O)c(C[N@@H+](Cc2ccccc2)CC2CCC2)c1 ZINC001204907816 1049305681 /nfs/dbraw/zinc/30/56/81/1049305681.db2.gz LABQDZLBYVQULS-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccnc(F)c1)C1CCCCC1 ZINC000859140464 1049314115 /nfs/dbraw/zinc/31/41/15/1049314115.db2.gz WKOJJCULBKYHSI-UHFFFAOYSA-N 1 0 314.404 4.261 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC001180275222 1049316621 /nfs/dbraw/zinc/31/66/21/1049316621.db2.gz JYDSPOLWCIKWNM-RYGJVYDSSA-N 1 0 300.490 4.462 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)C[C@@H](C)c2nccs2)c1 ZINC001180304759 1049326853 /nfs/dbraw/zinc/32/68/53/1049326853.db2.gz AQTIDNHFLYFSRC-CYBMUJFWSA-N 1 0 304.459 4.208 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1c2ccccc2CC[C@@H]1C ZINC001180326742 1049344382 /nfs/dbraw/zinc/34/43/82/1049344382.db2.gz PWZHKGDQKQZMDZ-YCRPNKLZSA-N 1 0 308.469 4.474 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCCCC[C@@H]2C(C)C)c1O ZINC001180332226 1049346341 /nfs/dbraw/zinc/34/63/41/1049346341.db2.gz OXHZKLQHALLJAV-OAHLLOKOSA-N 1 0 311.853 4.455 20 10 DICDRO C[C@@H]1CCC[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC001180372301 1049354551 /nfs/dbraw/zinc/35/45/51/1049354551.db2.gz PBXUKXVFDXIWLP-GOSISDBHSA-N 1 0 320.480 4.481 20 10 DICDRO CCc1cccc(C[N@H+](C)Cc2ccc(OC(F)F)cc2)c1O ZINC001180521180 1049371809 /nfs/dbraw/zinc/37/18/09/1049371809.db2.gz JTTLFIBOPORBII-UHFFFAOYSA-N 1 0 321.367 4.188 20 10 DICDRO COc1ccc(C[N@H+](Cc2ccccc2O)C2CCCCC2)o1 ZINC001205143160 1049391886 /nfs/dbraw/zinc/39/18/86/1049391886.db2.gz DWNBRFRUOKDBFL-UHFFFAOYSA-N 1 0 315.413 4.329 20 10 DICDRO CCc1cccc(C[N@H+](Cc2ccccc2OC)C2CC2)c1O ZINC001205208896 1049411528 /nfs/dbraw/zinc/41/15/28/1049411528.db2.gz PZILUMOQOOPXQK-UHFFFAOYSA-N 1 0 311.425 4.128 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2CCOc3ccc(F)cc32)c1 ZINC001180896638 1049421098 /nfs/dbraw/zinc/42/10/98/1049421098.db2.gz IXKXJDQNIXUXGH-QGZVFWFLSA-N 1 0 315.388 4.268 20 10 DICDRO Oc1ccc(F)cc1C[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001205359769 1049448609 /nfs/dbraw/zinc/44/86/09/1049448609.db2.gz GAFCDPXBSIXJEM-UHFFFAOYSA-N 1 0 317.791 4.474 20 10 DICDRO C[C@H]1COc2ccccc2C[N@@H+]1Cc1ccc2ccccc2c1O ZINC001205391152 1049457612 /nfs/dbraw/zinc/45/76/12/1049457612.db2.gz JUBSLIRVKUNXJS-HNNXBMFYSA-N 1 0 319.404 4.329 20 10 DICDRO Cc1ccc(F)c(C[N@@H+](C)C/C=C/c2ccc(N(C)C)cc2)c1 ZINC001181276302 1049459710 /nfs/dbraw/zinc/45/97/10/1049459710.db2.gz LUGOVVACTADVMC-AATRIKPKSA-N 1 0 312.432 4.345 20 10 DICDRO CC1=CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001181255555 1049461448 /nfs/dbraw/zinc/46/14/48/1049461448.db2.gz MCPAWOPHIVRNBV-UHFFFAOYSA-N 1 0 309.409 4.123 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cc(F)c(Cl)cc1F ZINC001181336708 1049463248 /nfs/dbraw/zinc/46/32/48/1049463248.db2.gz MGFJOZIXMYCLBT-UHFFFAOYSA-N 1 0 324.802 4.282 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@H]2CCOc3c(F)cccc32)c1 ZINC001205414403 1049463295 /nfs/dbraw/zinc/46/32/95/1049463295.db2.gz GLESJIBMGWGGAW-KRWDZBQOSA-N 1 0 315.388 4.268 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2CCC[C@H](C(C)(C)C)CC2)c1 ZINC001205427749 1049467768 /nfs/dbraw/zinc/46/77/68/1049467768.db2.gz WEXUNMMHEDZKKO-JKSUJKDBSA-N 1 0 305.462 4.485 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](CC(F)(F)F)C(C)C ZINC001205434846 1049469626 /nfs/dbraw/zinc/46/96/26/1049469626.db2.gz RIPAFJYVTDBAQJ-OAHLLOKOSA-N 1 0 302.384 4.128 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H](C(F)(F)F)[C@H]1C ZINC001205437816 1049470697 /nfs/dbraw/zinc/47/06/97/1049470697.db2.gz KTXOVZPWOQIPDT-CZUORRHYSA-N 1 0 314.395 4.224 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H](C(F)(F)F)[C@@H]1C ZINC001205437817 1049470868 /nfs/dbraw/zinc/47/08/68/1049470868.db2.gz KTXOVZPWOQIPDT-XJKSGUPXSA-N 1 0 314.395 4.224 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c1O ZINC000775634006 1049471036 /nfs/dbraw/zinc/47/10/36/1049471036.db2.gz NOJZPHIGJFCGGI-UHFFFAOYSA-N 1 0 324.468 4.323 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)Cc1cccc(F)c1 ZINC001181444678 1049477376 /nfs/dbraw/zinc/47/73/76/1049477376.db2.gz FCJQJJVQSVTCFQ-OAHLLOKOSA-N 1 0 300.421 4.132 20 10 DICDRO CCCCO[C@H]1C[C@@H](N(CCC)c2ccc(C[NH3+])cc2)C1(C)C ZINC001181457069 1049479214 /nfs/dbraw/zinc/47/92/14/1049479214.db2.gz NRZJUKWOOIOQTR-MOPGFXCFSA-N 1 0 318.505 4.346 20 10 DICDRO Cc1nc(C[N@H+](Cc2ccccc2O)C2CCCCC2)[nH]c1C ZINC000862212728 1049479279 /nfs/dbraw/zinc/47/92/79/1049479279.db2.gz VPCKCLDCGGTSMS-UHFFFAOYSA-N 1 0 313.445 4.067 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCC[C@@H](c3ncccc3C)C2)c1 ZINC000862478767 1049495632 /nfs/dbraw/zinc/49/56/32/1049495632.db2.gz PSYYZBHHYNXSTO-SJLPKXTDSA-N 1 0 310.441 4.220 20 10 DICDRO FC1(F)CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000862466350 1049495705 /nfs/dbraw/zinc/49/57/05/1049495705.db2.gz GPXUBCJZYSMSPC-UHFFFAOYSA-N 1 0 308.416 4.298 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2CCC[C@@H](c3ncccc3C)C2)c1 ZINC000862478765 1049496150 /nfs/dbraw/zinc/49/61/50/1049496150.db2.gz PSYYZBHHYNXSTO-AEFFLSMTSA-N 1 0 310.441 4.220 20 10 DICDRO CCc1cccc(C[NH2+]C(C)(C)c2ccc(OC)c(F)c2)c1O ZINC000862485732 1049497285 /nfs/dbraw/zinc/49/72/85/1049497285.db2.gz DEGLVJLYZXCFBQ-UHFFFAOYSA-N 1 0 317.404 4.127 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CCC(C)=C(C)C2)c1O ZINC001205562409 1049499089 /nfs/dbraw/zinc/49/90/89/1049499089.db2.gz QBHZNWSYUUDFJT-UHFFFAOYSA-N 1 0 310.235 4.005 20 10 DICDRO Cc1cccc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c1O ZINC000862549655 1049502827 /nfs/dbraw/zinc/50/28/27/1049502827.db2.gz FQXVGZZYEHYSFB-UHFFFAOYSA-N 1 0 303.352 4.148 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+](C)[C@H](C)c2ccco2)c1O ZINC000775648710 1049510342 /nfs/dbraw/zinc/51/03/42/1049510342.db2.gz IMOKDJFYSSHEFN-LLVKDONJSA-N 1 0 324.218 4.249 20 10 DICDRO Cc1cccc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)c1O ZINC000775648613 1049511320 /nfs/dbraw/zinc/51/13/20/1049511320.db2.gz DWXKLAWBHJKDQH-FQEVSTJZSA-N 1 0 318.420 4.107 20 10 DICDRO CC[N@H+](Cc1ccccc1Cl)Cc1cc(OC)ccc1O ZINC000775652743 1049525333 /nfs/dbraw/zinc/52/53/33/1049525333.db2.gz QMNVEGOSJBABGL-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C2CCC(OC(F)F)CC2)c1 ZINC001181828897 1049527704 /nfs/dbraw/zinc/52/77/04/1049527704.db2.gz WRMYTYZQRMVASR-UHFFFAOYSA-N 1 0 313.388 4.156 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H]([C@@H]3CCCC3(C)C)C2)cc1 ZINC001195427369 1049531714 /nfs/dbraw/zinc/53/17/14/1049531714.db2.gz RPIWOTJVDSDCLJ-MJGOQNOKSA-N 1 0 300.490 4.401 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CSc3ccccc32)cc1Cl ZINC001181970214 1049559849 /nfs/dbraw/zinc/55/98/49/1049559849.db2.gz BBNXFFCLAATBAI-CYBMUJFWSA-N 1 0 319.857 4.333 20 10 DICDRO CC(C)[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)[C@@H]1C(C)C ZINC001205788745 1049564625 /nfs/dbraw/zinc/56/46/25/1049564625.db2.gz GBQLCFKCKPFZHB-OYQYDDJWSA-N 1 0 300.490 4.378 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CSc2ccccc21 ZINC001205952961 1049609905 /nfs/dbraw/zinc/60/99/05/1049609905.db2.gz YFLUKIQBKHEHAJ-INIZCTEOSA-N 1 0 312.482 4.040 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1cccs1 ZINC000163600371 1049620815 /nfs/dbraw/zinc/62/08/15/1049620815.db2.gz LZEOONMWSUHNTN-AWEZNQCLSA-N 1 0 318.511 4.152 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCNc2ccccc21 ZINC000774193063 1049621923 /nfs/dbraw/zinc/62/19/23/1049621923.db2.gz RWYGSVHSCKFCQE-HXUWFJFHSA-N 1 0 309.457 4.098 20 10 DICDRO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001206016895 1049630623 /nfs/dbraw/zinc/63/06/23/1049630623.db2.gz SKNPLKBACQVPPE-DLBZAZTESA-N 1 0 306.453 4.090 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)c1 ZINC000775706357 1049636607 /nfs/dbraw/zinc/63/66/07/1049636607.db2.gz OVCWAKCEDXWENZ-UGSOOPFHSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1ccc(CC[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)cc1C ZINC001182423552 1049642304 /nfs/dbraw/zinc/64/23/04/1049642304.db2.gz GENHVORBPVDROS-LJQANCHMSA-N 1 0 324.512 4.441 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc(N(C)C)c2)cc1 ZINC000119852628 1049643352 /nfs/dbraw/zinc/64/33/52/1049643352.db2.gz CPRCKGAGXZGJMG-MRXNPFEDSA-N 1 0 311.473 4.060 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C[C@H]1CCc2ccccc21 ZINC001182424403 1049643725 /nfs/dbraw/zinc/64/37/25/1049643725.db2.gz SQUWSAMWNFWPHT-YLJYHZDGSA-N 1 0 322.496 4.312 20 10 DICDRO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000794660062 1049652829 /nfs/dbraw/zinc/65/28/29/1049652829.db2.gz NDCMMRZNLCBBBW-IAQYHMDHSA-N 1 0 313.363 4.044 20 10 DICDRO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000794660057 1049652969 /nfs/dbraw/zinc/65/29/69/1049652969.db2.gz NDCMMRZNLCBBBW-ABAIWWIYSA-N 1 0 313.363 4.044 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@@H]2CCC[C@@H]2C(C)(C)C)c1O ZINC001182444469 1049653867 /nfs/dbraw/zinc/65/38/67/1049653867.db2.gz RRVHDWVEANLLLR-JKSUJKDBSA-N 1 0 305.462 4.356 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@@H](C(C)(C)C)C[C@@H]2C)c(O)c1OC ZINC001206116392 1049657583 /nfs/dbraw/zinc/65/75/83/1049657583.db2.gz OEHLKAGZVHPEAK-DZGCQCFKSA-N 1 0 321.461 4.056 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H](C)C2)c1 ZINC000775721248 1049662218 /nfs/dbraw/zinc/66/22/18/1049662218.db2.gz UTCKFACMAQGNHP-KXBFYZLASA-N 1 0 311.425 4.026 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)c1 ZINC000775721245 1049662560 /nfs/dbraw/zinc/66/25/60/1049662560.db2.gz UTCKFACMAQGNHP-BEFAXECRSA-N 1 0 311.425 4.026 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2ccc(N(C)C)c(C)c2)C2CC2)cc1 ZINC000774451296 1049666004 /nfs/dbraw/zinc/66/60/04/1049666004.db2.gz XMYVHSVQPNBBDZ-NRFANRHFSA-N 1 0 324.468 4.311 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)c1 ZINC000775724916 1049668746 /nfs/dbraw/zinc/66/87/46/1049668746.db2.gz LHTFBSSHQMCRRD-ORAYPTAESA-N 1 0 315.388 4.123 20 10 DICDRO C[C@H](CCc1ccccc1F)[NH2+]Cc1cc(Cl)ccc1O ZINC001206517102 1049676033 /nfs/dbraw/zinc/67/60/33/1049676033.db2.gz LXQQLIPTNVWMFQ-GFCCVEGCSA-N 1 0 307.796 4.296 20 10 DICDRO CCO[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccccc1 ZINC000774494899 1049676640 /nfs/dbraw/zinc/67/66/40/1049676640.db2.gz GSBJWOALCUHOJF-UGSOOPFHSA-N 1 0 319.832 4.474 20 10 DICDRO CCO[C@@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000774496353 1049678104 /nfs/dbraw/zinc/67/81/04/1049678104.db2.gz KHBCXYPRERLPLM-UZLBHIALSA-N 1 0 312.457 4.181 20 10 DICDRO CCC1(c2ccccc2)C[NH+](Cc2ccc(Cl)cc2O)C1 ZINC001206223981 1049685044 /nfs/dbraw/zinc/68/50/44/1049685044.db2.gz INFCHUBZQPAOQG-UHFFFAOYSA-N 1 0 301.817 4.209 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)Oc1ccccc1F)c1ccc(C)cc1O ZINC000794799957 1049696269 /nfs/dbraw/zinc/69/62/69/1049696269.db2.gz APWPCVUIXNDNKD-YOEHRIQHSA-N 1 0 317.404 4.348 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(C)cc1O ZINC000794800570 1049696899 /nfs/dbraw/zinc/69/68/99/1049696899.db2.gz DTUWGWVACREORQ-AEFFLSMTSA-N 1 0 306.494 4.108 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)CCc1ccco1 ZINC001206320834 1049712161 /nfs/dbraw/zinc/71/21/61/1049712161.db2.gz MJXUIJNWXNGXAA-DLBZAZTESA-N 1 0 314.473 4.196 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2Cc2cc(F)ccc2F)c(O)c1 ZINC001206335306 1049715484 /nfs/dbraw/zinc/71/54/84/1049715484.db2.gz GCSLKFLTZDEJSU-QGZVFWFLSA-N 1 0 317.379 4.186 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+]C[C@H](C)C3CCCCC3)C2)cc1 ZINC001206645109 1049774563 /nfs/dbraw/zinc/77/45/63/1049774563.db2.gz LVVZUISHYKTZEW-WMZOPIPTSA-N 1 0 316.489 4.080 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+]C[C@H](C)C3CCCCC3)C2)cc1 ZINC001206645107 1049774907 /nfs/dbraw/zinc/77/49/07/1049774907.db2.gz LVVZUISHYKTZEW-FUHWJXTLSA-N 1 0 316.489 4.080 20 10 DICDRO CCCCCC[C@@H](C)[NH2+][C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206645087 1049775209 /nfs/dbraw/zinc/77/52/09/1049775209.db2.gz LPHIFSKRALUZPT-SJORKVTESA-N 1 0 304.478 4.222 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC([C@H]3CCCCO3)CC2)cc1Cl ZINC001206691710 1049779455 /nfs/dbraw/zinc/77/94/55/1049779455.db2.gz NNZRHFNFZFVLBR-GOSISDBHSA-N 1 0 323.864 4.135 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CC2(Cl)Cl)cc1Cl ZINC001206761796 1049793897 /nfs/dbraw/zinc/79/38/97/1049793897.db2.gz HLGFAEAHQHQKPG-SNVBAGLBSA-N 1 0 308.636 4.028 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2cc(-c3ccccc3)on2)cc1 ZINC001206848394 1049813018 /nfs/dbraw/zinc/81/30/18/1049813018.db2.gz XVZFBTZUEALKEK-UHFFFAOYSA-N 1 0 321.424 4.040 20 10 DICDRO CC1=CC[C@H](CC[N@@H+]2CCCc3cc(O)c(O)cc3C2)C1(C)C ZINC001207276975 1049874171 /nfs/dbraw/zinc/87/41/71/1049874171.db2.gz PHTIIVDJMXKWIU-QGZVFWFLSA-N 1 0 315.457 4.229 20 10 DICDRO c1cc(N2CCCCC2)ccc1C[NH2+]C[C@@H]1CCCCS1 ZINC000156386083 1049920401 /nfs/dbraw/zinc/92/04/01/1049920401.db2.gz CMCLGOOFHRUPPE-SFHVURJKSA-N 1 0 304.503 4.052 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](CC)CC(F)(F)F)ccc1OC ZINC000760663610 1049923871 /nfs/dbraw/zinc/92/38/71/1049923871.db2.gz YPYOYTPLCBBGMR-CQSZACIVSA-N 1 0 319.367 4.052 20 10 DICDRO Oc1cccc2c1C[N@H+](CCc1c(Cl)cccc1Cl)CC2 ZINC001209108509 1050036510 /nfs/dbraw/zinc/03/65/10/1050036510.db2.gz KRVYVPKHPMJREP-UHFFFAOYSA-N 1 0 322.235 4.300 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[NH+]2CCC3(CCCO3)CC2)cc1 ZINC001209517841 1050066108 /nfs/dbraw/zinc/06/61/08/1050066108.db2.gz KRBWBQLVCYVBNS-UHFFFAOYSA-N 1 0 324.468 4.239 20 10 DICDRO Cc1ccc(C)n1-c1ccc(CN2Cc3ccncc3C2)cc1 ZINC001209519143 1050066478 /nfs/dbraw/zinc/06/64/78/1050066478.db2.gz XGCGTNCCQVYWRE-UHFFFAOYSA-N 1 0 303.409 4.005 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)CC(C)(C)C)CC2)cc1 ZINC000823757457 1050152886 /nfs/dbraw/zinc/15/28/86/1050152886.db2.gz LEXZDIVXRACNIS-OAHLLOKOSA-N 1 0 304.478 4.078 20 10 DICDRO COc1ccc(C[N@H+](Cc2ccccc2O)[C@H](C)C2CC2)cc1 ZINC000770509265 1050162109 /nfs/dbraw/zinc/16/21/09/1050162109.db2.gz JVFZLJCCEUWHSD-OAHLLOKOSA-N 1 0 311.425 4.202 20 10 DICDRO Cc1ccc(C)c(OC2CC[NH+](Cc3ccccc3O)CC2)c1 ZINC000770510001 1050162177 /nfs/dbraw/zinc/16/21/77/1050162177.db2.gz URXWHWBRNSQWDL-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2ccc(F)c(F)c2)CC1 ZINC000770510502 1050163243 /nfs/dbraw/zinc/16/32/43/1050163243.db2.gz MRUBVMZZZGKLFM-UHFFFAOYSA-N 1 0 303.352 4.050 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ncc(Cl)s1)C1CCCC1 ZINC000770642668 1050178981 /nfs/dbraw/zinc/17/89/81/1050178981.db2.gz WINPCDZLXNZHRB-UHFFFAOYSA-N 1 0 322.861 4.447 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccccc2OC(F)F)cc1C ZINC000378883315 1050191539 /nfs/dbraw/zinc/19/15/39/1050191539.db2.gz GIFRZPZIAVFOAW-CYBMUJFWSA-N 1 0 321.367 4.456 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000166942671 1050225456 /nfs/dbraw/zinc/22/54/56/1050225456.db2.gz UAWYLXGHPKZDLY-AWEZNQCLSA-N 1 0 315.461 4.106 20 10 DICDRO CCCOc1ncccc1C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000788564424 1050226657 /nfs/dbraw/zinc/22/66/57/1050226657.db2.gz RMJWGPFHVPEXOA-HNNXBMFYSA-N 1 0 314.429 4.044 20 10 DICDRO Cc1cc(O)c(CNc2ccc(C[NH+](C)C)cc2)cc1Cl ZINC000824962446 1050261066 /nfs/dbraw/zinc/26/10/66/1050261066.db2.gz CLUSFJROOGHPJD-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)c2nccn21 ZINC000825017100 1050268225 /nfs/dbraw/zinc/26/82/25/1050268225.db2.gz LLXYNXKOMTUXQI-KSSFIOAISA-N 1 0 319.408 4.051 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000825104053 1050271489 /nfs/dbraw/zinc/27/14/89/1050271489.db2.gz LLNGHIRABPYSCW-SFHVURJKSA-N 1 0 313.397 4.111 20 10 DICDRO CC[C@@H]([NH2+][C@H]1C[C@H](c2cccc(OC)c2)C1)c1ccccc1O ZINC000825090851 1050276479 /nfs/dbraw/zinc/27/64/79/1050276479.db2.gz KLSIBOQAMFNIQO-GPMSIDNRSA-N 1 0 311.425 4.388 20 10 DICDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000734476042 1050276708 /nfs/dbraw/zinc/27/67/08/1050276708.db2.gz BRVSOVLRPJSWPO-MAUKXSAKSA-N 1 0 318.420 4.318 20 10 DICDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000734476043 1050277012 /nfs/dbraw/zinc/27/70/12/1050277012.db2.gz BRVSOVLRPJSWPO-QAPCUYQASA-N 1 0 318.420 4.318 20 10 DICDRO Nc1ccc(C[NH+]2CCC(c3cccc(Cl)c3)CC2)cc1 ZINC001210518679 1050278401 /nfs/dbraw/zinc/27/84/01/1050278401.db2.gz IEOHNDAWVGUBCY-UHFFFAOYSA-N 1 0 300.833 4.302 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1ccc(-c2c(F)cccc2F)o1 ZINC000734511059 1050280607 /nfs/dbraw/zinc/28/06/07/1050280607.db2.gz VMJAYAMWKJSRNF-UHFFFAOYSA-N 1 0 315.319 4.220 20 10 DICDRO c1csc(SCCC[NH2+]C[C@H]2C[C@H]2c2ccccc2)n1 ZINC000760955643 1050284810 /nfs/dbraw/zinc/28/48/10/1050284810.db2.gz UOGFRBYNNHNGHD-CABCVRRESA-N 1 0 304.484 4.019 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCOc3ccc(F)cc32)cc1Cl ZINC000825222277 1050285181 /nfs/dbraw/zinc/28/51/81/1050285181.db2.gz CDIBIGROOMAAEZ-HNNXBMFYSA-N 1 0 321.779 4.107 20 10 DICDRO CCC[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1ccccn1 ZINC000825233363 1050286254 /nfs/dbraw/zinc/28/62/54/1050286254.db2.gz BZRMZFNDGDBTGJ-OAHLLOKOSA-N 1 0 304.821 4.380 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1nc(C)cs1 ZINC000825253278 1050287270 /nfs/dbraw/zinc/28/72/70/1050287270.db2.gz GJYHVFOJMUDUOE-CYBMUJFWSA-N 1 0 310.850 4.360 20 10 DICDRO Cc1ccc(O)c(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c1 ZINC000771935139 1050300827 /nfs/dbraw/zinc/30/08/27/1050300827.db2.gz JXBSSORCLVHWCJ-UHFFFAOYSA-N 1 0 324.468 4.323 20 10 DICDRO CCOc1cccc(C[NH2+][C@]2(C)CCCc3ccccc32)c1O ZINC000734843501 1050325171 /nfs/dbraw/zinc/32/51/71/1050325171.db2.gz MENDPHIYSFAYHX-HXUWFJFHSA-N 1 0 311.425 4.132 20 10 DICDRO C[C@@]1([NH2+]Cc2cc(Cl)ccc2O)CCCc2ccccc21 ZINC000734843496 1050325292 /nfs/dbraw/zinc/32/52/92/1050325292.db2.gz LXWSHXASDIZTDH-GOSISDBHSA-N 1 0 301.817 4.387 20 10 DICDRO CC[C@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1 ZINC000157754453 1050379077 /nfs/dbraw/zinc/37/90/77/1050379077.db2.gz OJMAPIGMBAMDNE-KRWDZBQOSA-N 1 0 324.415 4.035 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)CC1)c1ccc(N2CCOCC2)cc1 ZINC000785571341 1050395928 /nfs/dbraw/zinc/39/59/28/1050395928.db2.gz YFHYGNUMJRMDMF-ZHALLVOQSA-N 1 0 316.489 4.143 20 10 DICDRO CC(C)CCCC[NH2+]Cc1cc(Br)ccc1O ZINC000226160339 1050400426 /nfs/dbraw/zinc/40/04/26/1050400426.db2.gz JTODPOBCBPQDTQ-UHFFFAOYSA-N 1 0 300.240 4.071 20 10 DICDRO CC(C)[C@H](C[NH2+]Cc1c(O)cccc1Cl)Nc1ccccc1 ZINC000735676619 1050421030 /nfs/dbraw/zinc/42/10/30/1050421030.db2.gz WKVLCLMPXGPXMD-KRWDZBQOSA-N 1 0 318.848 4.272 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1F)c1ccc(N(C)C)cc1 ZINC000766215915 1050464948 /nfs/dbraw/zinc/46/49/48/1050464948.db2.gz IFCBCDFQXZIONJ-LSDHHAIUSA-N 1 0 316.420 4.010 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2c(C)cccc2F)cc1 ZINC000766216147 1050465318 /nfs/dbraw/zinc/46/53/18/1050465318.db2.gz LUAUSRJEAPTZGV-HNNXBMFYSA-N 1 0 300.421 4.441 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)ccc1O)c1ccc(Br)cc1 ZINC000226582287 1050490263 /nfs/dbraw/zinc/49/02/63/1050490263.db2.gz PKNRPZWAMYDEQG-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO CCn1cc(C[N@H+](Cc2c(O)ccc3ccccc32)C(C)C)cn1 ZINC000844738070 1050494467 /nfs/dbraw/zinc/49/44/67/1050494467.db2.gz LABHCWMNZWIAPN-UHFFFAOYSA-N 1 0 323.440 4.172 20 10 DICDRO COc1cccc(C[NH2+]C[C@@H](Cc2ccccc2)C(C)C)c1O ZINC000786836508 1050520524 /nfs/dbraw/zinc/52/05/24/1050520524.db2.gz ZIAIRYXZANNVBZ-GOSISDBHSA-N 1 0 313.441 4.005 20 10 DICDRO Cc1cscc1C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000786927771 1050532191 /nfs/dbraw/zinc/53/21/91/1050532191.db2.gz RCXITGXGVBRNRE-CYBMUJFWSA-N 1 0 301.455 4.492 20 10 DICDRO CC(C)n1ccc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)n1 ZINC000738440771 1050535510 /nfs/dbraw/zinc/53/55/10/1050535510.db2.gz XUDWIDJSWAJJSA-UHFFFAOYSA-N 1 0 321.424 4.126 20 10 DICDRO C[C@H](CC1CC1)[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766236717 1050546507 /nfs/dbraw/zinc/54/65/07/1050546507.db2.gz GMYJDLDYYTVFHQ-HIFRSBDPSA-N 1 0 324.415 4.035 20 10 DICDRO Oc1ccc(Br)cc1CNc1cc[nH+]c(C2CC2)c1 ZINC001171176588 1050566054 /nfs/dbraw/zinc/56/60/54/1050566054.db2.gz RWJWEVYJMCAGSV-UHFFFAOYSA-N 1 0 319.202 4.039 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC1 ZINC000766238092 1050585552 /nfs/dbraw/zinc/58/55/52/1050585552.db2.gz PEVCUJHFELWZEQ-YOEHRIQHSA-N 1 0 324.415 4.035 20 10 DICDRO CC[C@@H](CCO)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000740899208 1050638666 /nfs/dbraw/zinc/63/86/66/1050638666.db2.gz XNWTUMDXNDTBLB-INIZCTEOSA-N 1 0 321.505 4.238 20 10 DICDRO CC[C@H](Cc1cccs1)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000845970852 1050638983 /nfs/dbraw/zinc/63/89/83/1050638983.db2.gz DHKUABNBDCQBER-CHWSQXEVSA-N 1 0 305.443 4.134 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(c3cccc(Cl)c3)CC2)cc1F ZINC000740900177 1050639036 /nfs/dbraw/zinc/63/90/36/1050639036.db2.gz HNDJOOJYCPMSJI-UHFFFAOYSA-N 1 0 318.823 4.324 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)c(Cl)c2)c1 ZINC000845971383 1050639263 /nfs/dbraw/zinc/63/92/63/1050639263.db2.gz JISUQXYNFGTMMB-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc3cc(C)ccc3o2)c1 ZINC000845972588 1050640153 /nfs/dbraw/zinc/64/01/53/1050640153.db2.gz PCGWGULVILSKDJ-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](CC)c2ccccc2F)c1O ZINC000846043778 1050657370 /nfs/dbraw/zinc/65/73/70/1050657370.db2.gz CIWNJRYBCNQTKV-INIZCTEOSA-N 1 0 303.377 4.171 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](CC)c2ccccc2F)c1 ZINC000846044731 1050658140 /nfs/dbraw/zinc/65/81/40/1050658140.db2.gz JNVBPKSIFHFEEA-KRWDZBQOSA-N 1 0 303.377 4.171 20 10 DICDRO CC1(C)C[C@@H]([NH2+]Cc2cc(F)ccc2O)c2cc(F)ccc2O1 ZINC000846053703 1050659052 /nfs/dbraw/zinc/65/90/52/1050659052.db2.gz WRXVNSISWPNGNQ-OAHLLOKOSA-N 1 0 319.351 4.062 20 10 DICDRO CC[C@@H]([NH2+]CCC[C@@H]1CC1(Cl)Cl)c1ccccc1O ZINC000846109399 1050664724 /nfs/dbraw/zinc/66/47/24/1050664724.db2.gz ILCLLTWAKUGORZ-DGCLKSJQSA-N 1 0 302.245 4.407 20 10 DICDRO CC[NH+](CC)Cc1cccc(N[C@H]2CCc3cccc(O)c32)c1 ZINC000323874211 1050665128 /nfs/dbraw/zinc/66/51/28/1050665128.db2.gz MCEJOFDNNTYZQH-SFHVURJKSA-N 1 0 310.441 4.333 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H](C)c1cccc(OC)c1O)C1CCCC1 ZINC000846148882 1050672365 /nfs/dbraw/zinc/67/23/65/1050672365.db2.gz UGMCBNMIFQOZBN-WMLDXEAASA-N 1 0 321.461 4.037 20 10 DICDRO CC1(C)CC[N@H+](Cc2c(O)ccc3ccccc32)CCS1 ZINC000788379458 1050673930 /nfs/dbraw/zinc/67/39/30/1050673930.db2.gz YRXXWIPMZMNGRD-UHFFFAOYSA-N 1 0 301.455 4.263 20 10 DICDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCSC(C)(C)CC2)c1 ZINC000788377602 1050674798 /nfs/dbraw/zinc/67/47/98/1050674798.db2.gz XYFLHDDTYUARBH-UHFFFAOYSA-N 1 0 323.502 4.113 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2c3ccccc3CC[C@H]2C)c1O ZINC000846155654 1050675130 /nfs/dbraw/zinc/67/51/30/1050675130.db2.gz BMMBNXIQCNXYGW-TYILLQQXSA-N 1 0 311.425 4.375 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(Cl)c(C)c2)c1O ZINC000846162688 1050675809 /nfs/dbraw/zinc/67/58/09/1050675809.db2.gz IZNGUOGFEYNXND-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(Cl)c(C)c2)c1O ZINC000846162693 1050676719 /nfs/dbraw/zinc/67/67/19/1050676719.db2.gz IZNGUOGFEYNXND-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCc3sccc32)c1O ZINC000846163249 1050678308 /nfs/dbraw/zinc/67/83/08/1050678308.db2.gz GYYPVOWSXCVISN-SMDDNHRTSA-N 1 0 303.427 4.191 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(OC)c2O)CCO1 ZINC000846163929 1050678389 /nfs/dbraw/zinc/67/83/89/1050678389.db2.gz SYRISSYLMHTFCH-SIIHOXLZSA-N 1 0 321.461 4.035 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c1O ZINC000846169720 1050679977 /nfs/dbraw/zinc/67/99/77/1050679977.db2.gz SENLMBPLIDRAMI-YGRLFVJLSA-N 1 0 318.244 4.025 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(OC)c2O)cc1 ZINC000846136733 1050681692 /nfs/dbraw/zinc/68/16/92/1050681692.db2.gz OBCJRMANTAPGPW-KGLIPLIRSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2cccc(OC(C)C)c2)c1O ZINC000846140738 1050681926 /nfs/dbraw/zinc/68/19/26/1050681926.db2.gz DCZXAXILGGJXDU-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)c1O ZINC000846136619 1050682370 /nfs/dbraw/zinc/68/23/70/1050682370.db2.gz IHWVJCBEUAHKIF-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C[C@H](c2ccccc2)C2CC2)c1O ZINC000846172585 1050682472 /nfs/dbraw/zinc/68/24/72/1050682472.db2.gz ZIKCHBFVLZHBRS-RDTXWAMCSA-N 1 0 311.425 4.245 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2cccc(OC)c2O)cc1 ZINC000846140574 1050682500 /nfs/dbraw/zinc/68/25/00/1050682500.db2.gz AUCRTOBPTFGHJW-AWEZNQCLSA-N 1 0 315.413 4.040 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2cccc(OC(C)C)c2)c1O ZINC000846140739 1050682757 /nfs/dbraw/zinc/68/27/57/1050682757.db2.gz DCZXAXILGGJXDU-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CSCc3ccccc32)c1O ZINC000846141501 1050684494 /nfs/dbraw/zinc/68/44/94/1050684494.db2.gz KKVBWCMPQAEEIT-MLGOLLRUSA-N 1 0 315.438 4.040 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccc(F)cc1F ZINC000846145275 1050684633 /nfs/dbraw/zinc/68/46/33/1050684633.db2.gz NQARCVVQGWBSDC-BDJLRTHQSA-N 1 0 321.367 4.481 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](c2ncccc2C)C(C)C)c1O ZINC000846145179 1050685773 /nfs/dbraw/zinc/68/57/73/1050685773.db2.gz NDNLDHFVVHLTQI-YOEHRIQHSA-N 1 0 314.429 4.152 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](c2ncccc2C)C(C)C)c1O ZINC000846145175 1050685886 /nfs/dbraw/zinc/68/58/86/1050685886.db2.gz NDNLDHFVVHLTQI-WMLDXEAASA-N 1 0 314.429 4.152 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](c2cccs2)N(C)C)c(O)c1 ZINC000788506782 1050694202 /nfs/dbraw/zinc/69/42/02/1050694202.db2.gz XXEPZMMSRFNOSP-GJZGRUSLSA-N 1 0 318.486 4.024 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](c2cccs2)N(C)C)c(O)c1 ZINC000788506772 1050694447 /nfs/dbraw/zinc/69/44/47/1050694447.db2.gz XXEPZMMSRFNOSP-CABCVRRESA-N 1 0 318.486 4.024 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](O)c2ccc(Cl)cc2)c(O)c1 ZINC000788503574 1050694747 /nfs/dbraw/zinc/69/47/47/1050694747.db2.gz DIHYDGHWSJCPKV-SUMWQHHRSA-N 1 0 319.832 4.047 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC(C)(C)Oc2ccc(F)cc21)c1ccccc1O ZINC000846197686 1050695293 /nfs/dbraw/zinc/69/52/93/1050695293.db2.gz VODUHPJIFJDBAQ-BLLLJJGKSA-N 1 0 315.388 4.484 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCc3ccc(O)cc32)cc1 ZINC000788543987 1050701323 /nfs/dbraw/zinc/70/13/23/1050701323.db2.gz AYTDZIKXFUQORZ-NRFANRHFSA-N 1 0 324.468 4.406 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)cc1C ZINC000788531974 1050702886 /nfs/dbraw/zinc/70/28/86/1050702886.db2.gz JNLRCTCVBJMWGQ-SFHVURJKSA-N 1 0 324.468 4.015 20 10 DICDRO CC1(C)CC([NH2+][C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 ZINC000788582445 1050708171 /nfs/dbraw/zinc/70/81/71/1050708171.db2.gz JUUCYHFFJCXNGM-ZDUSSCGKSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1csc(CCCC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)n1 ZINC000788591128 1050710117 /nfs/dbraw/zinc/71/01/17/1050710117.db2.gz YBVDRPDDHGVXGU-HNNXBMFYSA-N 1 0 318.486 4.447 20 10 DICDRO CSC1(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CCC1 ZINC000788606829 1050714712 /nfs/dbraw/zinc/71/47/12/1050714712.db2.gz QZKBCSRAWJONTN-CYBMUJFWSA-N 1 0 305.487 4.207 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2O)C12CCC2 ZINC000788615097 1050715482 /nfs/dbraw/zinc/71/54/82/1050715482.db2.gz UZRLHXILQICNQR-BHYGNILZSA-N 1 0 303.446 4.007 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000788614016 1050716529 /nfs/dbraw/zinc/71/65/29/1050716529.db2.gz PPMKBYTZVCDMHB-YLJYHZDGSA-N 1 0 324.468 4.350 20 10 DICDRO CC[C@H]([NH2+][C@@H](C(C)C)[C@@H](O)c1ccccc1)c1ccccc1O ZINC000788618485 1050718104 /nfs/dbraw/zinc/71/81/04/1050718104.db2.gz ARAPRACEKLOJLT-IHPCNDPISA-N 1 0 313.441 4.191 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(F)c(Cl)cc2F)c1 ZINC000788621422 1050720577 /nfs/dbraw/zinc/72/05/77/1050720577.db2.gz XPDFHFKEUGVGDY-SNVBAGLBSA-N 1 0 311.759 4.483 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)c(O)c1 ZINC000788708980 1050730788 /nfs/dbraw/zinc/73/07/88/1050730788.db2.gz CATFWQGICZTGAJ-ULQDDVLXSA-N 1 0 305.462 4.253 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCOc3c(C)cccc32)c(O)c1 ZINC000788774987 1050752751 /nfs/dbraw/zinc/75/27/51/1050752751.db2.gz HBGKBKOSVJIHDN-NVXWUHKLSA-N 1 0 311.425 4.492 20 10 DICDRO CCOC[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C(C)C ZINC000788985195 1050771652 /nfs/dbraw/zinc/77/16/52/1050771652.db2.gz ONTDWRUXBFGECY-YLJYHZDGSA-N 1 0 318.505 4.389 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c1O ZINC000761198539 1050775582 /nfs/dbraw/zinc/77/55/82/1050775582.db2.gz QGLAXXHTIJXAPD-IINYFYTJSA-N 1 0 321.804 4.060 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1O ZINC000761202372 1050778319 /nfs/dbraw/zinc/77/83/19/1050778319.db2.gz DOFPPIFGJRACQC-PXAZEXFGSA-N 1 0 317.816 4.247 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(Cl)c1F)c1ccc(N(C)C)cc1 ZINC000766281032 1050781394 /nfs/dbraw/zinc/78/13/94/1050781394.db2.gz WJUOITKAGFPYDK-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1)CCC2 ZINC000742173900 1050806912 /nfs/dbraw/zinc/80/69/12/1050806912.db2.gz MNLWINXMZWJJBA-GOSISDBHSA-N 1 0 313.828 4.481 20 10 DICDRO Cc1[nH]c2ccc(C[NH2+]Cc3cc(C)c(C)cc3O)cc2c1C ZINC000742368001 1050822098 /nfs/dbraw/zinc/82/20/98/1050822098.db2.gz PEMAARYOPANBCU-UHFFFAOYSA-N 1 0 308.425 4.397 20 10 DICDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)C1 ZINC000742367566 1050822952 /nfs/dbraw/zinc/82/29/52/1050822952.db2.gz ZBXPERFDWYFOAT-AEFFLSMTSA-N 1 0 318.530 4.298 20 10 DICDRO FC(F)Oc1ccc(N2CCC[C@@H]([NH2+]C3CCCCC3)C2)cc1 ZINC000742385246 1050827958 /nfs/dbraw/zinc/82/79/58/1050827958.db2.gz UWAIUXVDUGWLHU-OAHLLOKOSA-N 1 0 324.415 4.179 20 10 DICDRO COc1ccc(C[NH2+]C[C@H](C)c2ccc(F)cc2F)cc1C ZINC000742391001 1050829272 /nfs/dbraw/zinc/82/92/72/1050829272.db2.gz YSTAKBCDRZHEOJ-ZDUSSCGKSA-N 1 0 305.368 4.175 20 10 DICDRO C[C@@H](C[NH2+]Cc1c(O)cccc1Cl)c1ccc(F)cc1F ZINC000742390721 1050830653 /nfs/dbraw/zinc/83/06/53/1050830653.db2.gz MGCINOPHARFNBR-JTQLQIEISA-N 1 0 311.759 4.217 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cccc(-n3ccnc3)c2)cc1C ZINC000742392599 1050830910 /nfs/dbraw/zinc/83/09/10/1050830910.db2.gz ROUNNPLLPUELEI-MRXNPFEDSA-N 1 0 321.424 4.040 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(c3ccc(Cl)cc3)CC2)cc1C ZINC000742370806 1050833096 /nfs/dbraw/zinc/83/30/96/1050833096.db2.gz ONTJEEULYKEQCG-UHFFFAOYSA-N 1 0 301.817 4.441 20 10 DICDRO c1ccc(C[C@@H]2C[C@@H]2[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000742375021 1050833939 /nfs/dbraw/zinc/83/39/39/1050833939.db2.gz KXZHAYWRFFTIKI-IRLDBZIGSA-N 1 0 320.480 4.398 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](CC2CC2)c2ccccc2)c1 ZINC000742377431 1050836680 /nfs/dbraw/zinc/83/66/80/1050836680.db2.gz CSSFOQVGSZHUNU-IBGZPJMESA-N 1 0 311.425 4.422 20 10 DICDRO COC(C)(C)C[C@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000742377711 1050837245 /nfs/dbraw/zinc/83/72/45/1050837245.db2.gz QEKKHUFPQOZRHO-HNNXBMFYSA-N 1 0 313.441 4.352 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2C[C@@H]2C2CCCCC2)ccc1OC ZINC000742375425 1050838296 /nfs/dbraw/zinc/83/82/96/1050838296.db2.gz MYRVIGYNFKQCFM-MOPGFXCFSA-N 1 0 317.473 4.290 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@]3(C2)CCCOC3)c(O)c(C(C)(C)C)c1 ZINC000789565103 1050851118 /nfs/dbraw/zinc/85/11/18/1050851118.db2.gz JXBLPIXCZIWSRR-FQEVSTJZSA-N 1 0 317.473 4.001 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000772981329 1050888175 /nfs/dbraw/zinc/88/81/75/1050888175.db2.gz ZRFBGEKEMQZNGD-RTWAWAEBSA-N 1 0 324.468 4.107 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC000790441544 1050960926 /nfs/dbraw/zinc/96/09/26/1050960926.db2.gz LEIIIQNSRMJUHL-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO COc1cc(C[N@@H+]2CCSCC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000790481454 1050963330 /nfs/dbraw/zinc/96/33/30/1050963330.db2.gz FQAMDYNDDCFKCF-CYBMUJFWSA-N 1 0 323.502 4.026 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCSC1)c1ccc(N2CCCCCC2)cc1 ZINC000790494906 1050965170 /nfs/dbraw/zinc/96/51/70/1050965170.db2.gz GIEPWBFVLQNACN-IAGOWNOFSA-N 1 0 318.530 4.471 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC3(CCCCC3)O2)c1 ZINC000790716577 1050988144 /nfs/dbraw/zinc/98/81/44/1050988144.db2.gz WGCQOLFDLIBXEH-HZPDHXFCSA-N 1 0 303.446 4.233 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000790964964 1051011720 /nfs/dbraw/zinc/01/17/20/1051011720.db2.gz UPQAMLMEYWUKEX-UHFFFAOYSA-N 1 0 324.468 4.140 20 10 DICDRO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000773001411 1051014831 /nfs/dbraw/zinc/01/48/31/1051014831.db2.gz RXKPGRSAROKLGF-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C[C@H]1CCC2(CCCCC2)O1 ZINC000790995382 1051015794 /nfs/dbraw/zinc/01/57/94/1051015794.db2.gz OEPMHZYOIVIPOC-CYBMUJFWSA-N 1 0 309.837 4.017 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCSC1)c1ccc(N2CCCCCC2)cc1 ZINC000773030569 1051030542 /nfs/dbraw/zinc/03/05/42/1051030542.db2.gz TUZYSWUECKHNAO-WBVHZDCISA-N 1 0 304.503 4.223 20 10 DICDRO Cc1cc(CC[NH2+][C@H](C)c2ccncc2)c(C)n1-c1ccccc1 ZINC000743464709 1051034474 /nfs/dbraw/zinc/03/44/74/1051034474.db2.gz NSQAHRXJWUJYJC-QGZVFWFLSA-N 1 0 319.452 4.382 20 10 DICDRO CC[C@H]([NH2+][C@H]1COc2ccc(C)cc21)c1ccc(N(C)C)cc1 ZINC000773058676 1051042545 /nfs/dbraw/zinc/04/25/45/1051042545.db2.gz IRXJZYOOHXRCTE-OALUTQOASA-N 1 0 310.441 4.235 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C)cc(OC)c1)c1ccc(N(C)C)cc1 ZINC000773092905 1051059975 /nfs/dbraw/zinc/05/99/75/1051059975.db2.gz NSIGONLRODGUKK-HXUWFJFHSA-N 1 0 312.457 4.311 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](c2cccnc2)C2CC2)cc1 ZINC000773117562 1051066960 /nfs/dbraw/zinc/06/69/60/1051066960.db2.gz IZUNCFCTEPTLRS-FOIQADDNSA-N 1 0 309.457 4.340 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@H](C(C)(C)C)C1)c1ccc(N(C)C)cc1 ZINC000773128970 1051071215 /nfs/dbraw/zinc/07/12/15/1051071215.db2.gz JARNNEZVYVRFOB-WDSOQIARSA-N 1 0 318.505 4.387 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000037142051 1051113604 /nfs/dbraw/zinc/11/36/04/1051113604.db2.gz GPWTYVPGBBZKIX-ZYHUDNBSSA-N 1 0 307.743 4.256 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1F ZINC000037074648 1051109318 /nfs/dbraw/zinc/10/93/18/1051109318.db2.gz KJKQJRMBZALLFH-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000037089957 1051109460 /nfs/dbraw/zinc/10/94/60/1051109460.db2.gz SNZQPMNPIJIHRF-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COCC1(C)CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000773270771 1051121785 /nfs/dbraw/zinc/12/17/85/1051121785.db2.gz WLPNWOKHOXSNBT-UHFFFAOYSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@@H]1C[C@@H]([NH2+][C@H]2c3c(c(C)cc(C)c3O)CC2(C)C)CCO1 ZINC001170201536 1051155986 /nfs/dbraw/zinc/15/59/86/1051155986.db2.gz DBGMPKGLJLVSCX-KHYOSLBOSA-N 1 0 317.473 4.180 20 10 DICDRO Cc1cccc2c1CC[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)C2 ZINC001171551551 1051163140 /nfs/dbraw/zinc/16/31/40/1051163140.db2.gz QDVLNEKMPPKGBG-FQEVSTJZSA-N 1 0 320.480 4.242 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H](C)Cc2ccccc2Cl)c(O)c1 ZINC001170259064 1051165529 /nfs/dbraw/zinc/16/55/29/1051165529.db2.gz AVUUKFVWJZJLEP-AWEZNQCLSA-N 1 0 303.833 4.383 20 10 DICDRO Cc1ccc(CCC[N@H+](Cc2ccccc2O)C2CCCC2)cn1 ZINC000792821578 1051215437 /nfs/dbraw/zinc/21/54/37/1051215437.db2.gz XVWYWMKDMKPKHL-UHFFFAOYSA-N 1 0 324.468 4.473 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccc(C(F)F)cc3)ccc21 ZINC000792942777 1051227118 /nfs/dbraw/zinc/22/71/18/1051227118.db2.gz OZLFRQGYFPFBRJ-UHFFFAOYSA-N 1 0 316.395 4.296 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC(F)(F)C2)c(C(F)(F)F)c1 ZINC000793018251 1051239607 /nfs/dbraw/zinc/23/96/07/1051239607.db2.gz XXSFUWVFIYCNKY-LLVKDONJSA-N 1 0 322.321 4.049 20 10 DICDRO COc1ccc2c(c1)CCC[C@@H]2C[NH2+][C@H](C)c1ccccc1O ZINC000766331226 1051257043 /nfs/dbraw/zinc/25/70/43/1051257043.db2.gz NDBOHVUDXRKADV-GDBMZVCRSA-N 1 0 311.425 4.172 20 10 DICDRO COCCCC[C@H]([NH2+]Cc1cc(C)ccc1O)c1ccccc1 ZINC000793238768 1051268622 /nfs/dbraw/zinc/26/86/22/1051268622.db2.gz GFADRKXVSAIBQK-IBGZPJMESA-N 1 0 313.441 4.348 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000793270676 1051276567 /nfs/dbraw/zinc/27/65/67/1051276567.db2.gz XZOSLXPWDGYONZ-GUYCJALGSA-N 1 0 303.352 4.096 20 10 DICDRO Cc1cc(O)c(CNc2ccc(C[NH+](C)C)c(Cl)c2)cc1C ZINC000793345115 1051281217 /nfs/dbraw/zinc/28/12/17/1051281217.db2.gz XYJRNUQLWPWDHM-UHFFFAOYSA-N 1 0 318.848 4.336 20 10 DICDRO COc1ccc(C[NH2+]Cc2cc3cc(C)c(C)cc3o2)c(O)c1 ZINC000793385619 1051294667 /nfs/dbraw/zinc/29/46/67/1051294667.db2.gz DEBSZDKOCPSLOV-UHFFFAOYSA-N 1 0 311.381 4.054 20 10 DICDRO CC1(C)CC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000793528165 1051310074 /nfs/dbraw/zinc/31/00/74/1051310074.db2.gz SDTZIDKYZSCPJD-INIZCTEOSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)cc1C(C)C ZINC000793531168 1051321438 /nfs/dbraw/zinc/32/14/38/1051321438.db2.gz PGUQGXQZOSBGNF-DLBZAZTESA-N 1 0 309.400 4.301 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000793607670 1051324837 /nfs/dbraw/zinc/32/48/37/1051324837.db2.gz BOEDXYIASGGSKY-PZJWPPBQSA-N 1 0 323.436 4.203 20 10 DICDRO CCCOc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000746197149 1051334559 /nfs/dbraw/zinc/33/45/59/1051334559.db2.gz VLHZIMUIFOYYKL-HNNXBMFYSA-N 1 0 311.425 4.261 20 10 DICDRO CSC[C@@H]1CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000793790147 1051337786 /nfs/dbraw/zinc/33/77/86/1051337786.db2.gz JZUZDORUNPJMKF-OAHLLOKOSA-N 1 0 307.503 4.399 20 10 DICDRO CCCCCC[C@H](CCC)[NH2+]CCc1cc(O)c(O)cc1O ZINC001172379281 1051354877 /nfs/dbraw/zinc/35/48/77/1051354877.db2.gz SRCLXOWLZGLCPJ-HNNXBMFYSA-N 1 0 309.450 4.075 20 10 DICDRO CC[C@@H](CC(C)C)[NH2+]Cc1ccc(Br)cc1O ZINC001172394681 1051396510 /nfs/dbraw/zinc/39/65/10/1051396510.db2.gz XWODDSJLRMHTPZ-ZDUSSCGKSA-N 1 0 300.240 4.069 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)C ZINC000766364874 1051409177 /nfs/dbraw/zinc/40/91/77/1051409177.db2.gz BHNUGRORKUXNGH-DNVCBOLYSA-N 1 0 322.468 4.138 20 10 DICDRO CC[C@H](C[C@H](C)CO)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766360788 1051409488 /nfs/dbraw/zinc/40/94/88/1051409488.db2.gz NXFBWJJMDXCLOH-YQVWRLOYSA-N 1 0 318.505 4.125 20 10 DICDRO CC[C@H]([NH2+]CC1(CC)CCOCC1)c1ccc(N(C)C)cc1 ZINC000766381050 1051409769 /nfs/dbraw/zinc/40/97/69/1051409769.db2.gz FYRBEVBYVOVJTD-SFHVURJKSA-N 1 0 304.478 4.000 20 10 DICDRO CSC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766362581 1051409971 /nfs/dbraw/zinc/40/99/71/1051409971.db2.gz WTLUWLUXNXRHOP-HNNXBMFYSA-N 1 0 306.519 4.469 20 10 DICDRO CC(C)COCC[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001172456623 1051411755 /nfs/dbraw/zinc/41/17/55/1051411755.db2.gz GNBXFDAMTNKYSX-GOSISDBHSA-N 1 0 318.505 4.218 20 10 DICDRO C[C@@H](CC(F)(F)F)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000766477644 1051434195 /nfs/dbraw/zinc/43/41/95/1051434195.db2.gz DKGZMIYVTXGNAD-LBPRGKRZSA-N 1 0 309.331 4.490 20 10 DICDRO C[C@H]([NH2+]CCNc1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000766514482 1051454112 /nfs/dbraw/zinc/45/41/12/1051454112.db2.gz GTRYSEPQMDVWEM-SFHVURJKSA-N 1 0 323.484 4.440 20 10 DICDRO C[C@@H]([NH2+]C[C@@]1(C)CCCO1)c1ccc(N2CCCCCC2)cc1 ZINC000766561786 1051484846 /nfs/dbraw/zinc/48/48/46/1051484846.db2.gz XMXNIKIFIIXHLK-YLJYHZDGSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CCCO1)c1ccc(N2CCCCCC2)cc1 ZINC000766561781 1051485642 /nfs/dbraw/zinc/48/56/42/1051485642.db2.gz XMXNIKIFIIXHLK-PXNSSMCTSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@H](Cc1c(F)cccc1Cl)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001172839234 1051529176 /nfs/dbraw/zinc/52/91/76/1051529176.db2.gz CPFSHTNUHIBLDN-GFCCVEGCSA-N 1 0 319.807 4.135 20 10 DICDRO C[C@H](CSc1ccc(Cl)cc1)[NH2+]Cc1ccc(O)cc1O ZINC001172883849 1051566960 /nfs/dbraw/zinc/56/69/60/1051566960.db2.gz UXDURVRQRBOMGT-LLVKDONJSA-N 1 0 323.845 4.022 20 10 DICDRO Cc1cc(CC[NH2+]C2CCSCC2)c(C)n1-c1ccccc1 ZINC000761572329 1051600869 /nfs/dbraw/zinc/60/08/69/1051600869.db2.gz NOXYDMIPGOJFQV-UHFFFAOYSA-N 1 0 314.498 4.122 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2CCC(Oc3ccccc3)CC2)cc1 ZINC001173199463 1051630463 /nfs/dbraw/zinc/63/04/63/1051630463.db2.gz FCJQIXIKROCDPV-UHFFFAOYSA-N 1 0 324.468 4.232 20 10 DICDRO Cc1ccc2oc(C[NH2+]Cc3ccc(N(C)C)c(F)c3)cc2c1 ZINC000740004848 1051655342 /nfs/dbraw/zinc/65/53/42/1051655342.db2.gz XIOXFEAYYNQWGO-UHFFFAOYSA-N 1 0 312.388 4.236 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCC1(C)C)c1ccc(N2CCOCC2)cc1Cl ZINC000806169353 1051746277 /nfs/dbraw/zinc/74/62/77/1051746277.db2.gz KQJOCWJTOBVOKD-CXAGYDPISA-N 1 0 322.880 4.016 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c(O)c1 ZINC000806176569 1051747547 /nfs/dbraw/zinc/74/75/47/1051747547.db2.gz MROQQWMLHORROF-DYVFJYSZSA-N 1 0 319.832 4.128 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c(O)c1 ZINC000806176570 1051748993 /nfs/dbraw/zinc/74/89/93/1051748993.db2.gz MROQQWMLHORROF-GUYCJALGSA-N 1 0 319.832 4.128 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000806176116 1051749161 /nfs/dbraw/zinc/74/91/61/1051749161.db2.gz LFQZIAGGAYJDGK-OCCSQVGLSA-N 1 0 309.425 4.122 20 10 DICDRO CC[C@H](Nc1ccc2c(c1)ncn2C)c1cccc(Cl)c1O ZINC000806156851 1051758665 /nfs/dbraw/zinc/75/86/65/1051758665.db2.gz LERGAFQKKYDRNI-AWEZNQCLSA-N 1 0 315.804 4.496 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCSC1)c1ccc(N2CCCCC2)cc1 ZINC000806178355 1051772787 /nfs/dbraw/zinc/77/27/87/1051772787.db2.gz FTDCOSNAXOSSOF-DLBZAZTESA-N 1 0 318.530 4.471 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)Cc2ccccc2Cl)c1 ZINC000768170933 1051891307 /nfs/dbraw/zinc/89/13/07/1051891307.db2.gz ZFOGBAQYCARACK-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)Cc2ccc(Cl)cc2)c1 ZINC000768170658 1051892079 /nfs/dbraw/zinc/89/20/79/1051892079.db2.gz SLVRPAJGSXNDDR-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CCOc1ccc(C[N@H+](Cc2ccccc2F)C2CC2)c(O)c1 ZINC000768202853 1051893924 /nfs/dbraw/zinc/89/39/24/1051893924.db2.gz BNSFPNWBDDSDNH-UHFFFAOYSA-N 1 0 315.388 4.095 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000768231070 1051906278 /nfs/dbraw/zinc/90/62/78/1051906278.db2.gz UKENJDCDDCBTLT-GFCCVEGCSA-N 1 0 321.367 4.262 20 10 DICDRO Oc1ccc(Br)cc1C[N@H+](C1CC1)C1CCCC1 ZINC000768252823 1051909109 /nfs/dbraw/zinc/90/91/09/1051909109.db2.gz RQMKETHIDIYZJH-UHFFFAOYSA-N 1 0 310.235 4.062 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1O ZINC000768329887 1051917846 /nfs/dbraw/zinc/91/78/46/1051917846.db2.gz JUBOQKXESPTRQQ-KRWDZBQOSA-N 1 0 315.388 4.267 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)cc1F ZINC000768329894 1051919548 /nfs/dbraw/zinc/91/95/48/1051919548.db2.gz JXXNUCONQBGXDI-MRXNPFEDSA-N 1 0 304.434 4.290 20 10 DICDRO COc1cc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c(O)cc1C ZINC000768467133 1051934023 /nfs/dbraw/zinc/93/40/23/1051934023.db2.gz ZTLPCMYROYLIGS-MRXNPFEDSA-N 1 0 317.816 4.310 20 10 DICDRO CCC[N@H+](Cc1cccc(OC)c1O)[C@H]1CCc2ccccc21 ZINC000768483267 1051934311 /nfs/dbraw/zinc/93/43/11/1051934311.db2.gz FVQRGNWWVMJWHO-SFHVURJKSA-N 1 0 311.425 4.300 20 10 DICDRO Cc1ccc(OC2CC[NH+](Cc3cc(C)ccc3O)CC2)cc1 ZINC000768528783 1051939282 /nfs/dbraw/zinc/93/92/82/1051939282.db2.gz XNRDYUYDOMVORO-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO Oc1ccccc1C[N@@H+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000768531508 1051940956 /nfs/dbraw/zinc/94/09/56/1051940956.db2.gz YCPQIQYXSBDOIX-CQSZACIVSA-N 1 0 321.342 4.401 20 10 DICDRO CCOc1cccc(C[N@H+](C)CCc2ccc(Cl)cc2)c1O ZINC000769192860 1052001775 /nfs/dbraw/zinc/00/17/75/1052001775.db2.gz QWNFFAZBJUHJMV-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO CCC[N@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1ccccc1O ZINC000769201407 1052008298 /nfs/dbraw/zinc/00/82/98/1052008298.db2.gz TVGHKBFMJFNRSH-UHFFFAOYSA-N 1 0 321.424 4.195 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Cl)cc2C)c1 ZINC000769218621 1052008489 /nfs/dbraw/zinc/00/84/89/1052008489.db2.gz WCGZVQYJCNSHDQ-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO CCC[N@H+](Cc1nc2ccccc2n1CC)Cc1ccccc1O ZINC000769201386 1052009273 /nfs/dbraw/zinc/00/92/73/1052009273.db2.gz SMVLYBZSGURSRX-UHFFFAOYSA-N 1 0 323.440 4.174 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cc(Cl)ccc1O ZINC000769201301 1052009607 /nfs/dbraw/zinc/00/96/07/1052009607.db2.gz RGMSMPIERPTZOK-UHFFFAOYSA-N 1 0 305.805 4.163 20 10 DICDRO CCC[N@H+](Cc1cnc(CC(C)C)s1)Cc1ccccc1O ZINC000769201430 1052009680 /nfs/dbraw/zinc/00/96/80/1052009680.db2.gz UETCBSHOFQXJBL-UHFFFAOYSA-N 1 0 318.486 4.459 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCOc2ccccc21 ZINC000769201609 1052009738 /nfs/dbraw/zinc/00/97/38/1052009738.db2.gz XXDONSLZGHNKFW-MRXNPFEDSA-N 1 0 311.425 4.171 20 10 DICDRO COc1cccc(C2CC[NH+](Cc3cc(C)ccc3O)CC2)c1 ZINC000769224914 1052009790 /nfs/dbraw/zinc/00/97/90/1052009790.db2.gz FHPZYYRTLJESAU-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO COC[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)c1cccc(Cl)c1 ZINC000808454792 1052026340 /nfs/dbraw/zinc/02/63/40/1052026340.db2.gz SVNNPISCKAGBSN-QGZVFWFLSA-N 1 0 319.832 4.134 20 10 DICDRO c1coc([C@@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)c1 ZINC000769389708 1052037341 /nfs/dbraw/zinc/03/73/41/1052037341.db2.gz NWYDHJZOKWJRHW-GOSISDBHSA-N 1 0 310.441 4.259 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)c1O ZINC000769425536 1052043432 /nfs/dbraw/zinc/04/34/32/1052043432.db2.gz QMVXGTVRHGBNSN-CYBMUJFWSA-N 1 0 315.388 4.049 20 10 DICDRO COc1ccc(C2CC[NH+](Cc3cc(C)ccc3O)CC2)cc1 ZINC000769394662 1052049409 /nfs/dbraw/zinc/04/94/09/1052049409.db2.gz BCXILYILJUSPQY-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)c2ccccc21 ZINC000808687378 1052061250 /nfs/dbraw/zinc/06/12/50/1052061250.db2.gz QKYCEMIQLIIIPV-MGPUTAFESA-N 1 0 306.453 4.407 20 10 DICDRO CCc1nc(CC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cs1 ZINC000808690786 1052061502 /nfs/dbraw/zinc/06/15/02/1052061502.db2.gz ORUIELBYNSBBAT-NSHDSACASA-N 1 0 324.877 4.266 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808672198 1052064310 /nfs/dbraw/zinc/06/43/10/1052064310.db2.gz GIIGIMZKWWQAJW-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCCSc2nccs2)c2ccccc21 ZINC000808694167 1052064390 /nfs/dbraw/zinc/06/43/90/1052064390.db2.gz DNQDYULBYSHVKE-WFASDCNBSA-N 1 0 304.484 4.463 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccoc2)C2CCCCC2)c1O ZINC000769468784 1052064413 /nfs/dbraw/zinc/06/44/13/1052064413.db2.gz PLYKKIFJRODBKD-UHFFFAOYSA-N 1 0 315.413 4.329 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cc1F ZINC000808673288 1052065174 /nfs/dbraw/zinc/06/51/74/1052065174.db2.gz AAVCWKYBZYHKFO-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCCSc2nccs2)c2ccccc21 ZINC000808694165 1052065275 /nfs/dbraw/zinc/06/52/75/1052065275.db2.gz DNQDYULBYSHVKE-IUODEOHRSA-N 1 0 304.484 4.463 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000769492447 1052065736 /nfs/dbraw/zinc/06/57/36/1052065736.db2.gz KARNTHWXYRPMKF-NVXWUHKLSA-N 1 0 311.425 4.026 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000769492444 1052067092 /nfs/dbraw/zinc/06/70/92/1052067092.db2.gz KARNTHWXYRPMKF-DOTOQJQBSA-N 1 0 311.425 4.026 20 10 DICDRO Cc1cccc([C@H](O)C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808706205 1052068326 /nfs/dbraw/zinc/06/83/26/1052068326.db2.gz FDWQZQXLCXMFGV-SUMWQHHRSA-N 1 0 319.832 4.047 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)CO2 ZINC000808706678 1052069458 /nfs/dbraw/zinc/06/94/58/1052069458.db2.gz QTLAXGWQDPYUJV-WBMJQRKESA-N 1 0 317.816 4.447 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCCc2ccccn2)c1O ZINC000808707880 1052070036 /nfs/dbraw/zinc/07/00/36/1052070036.db2.gz BOIDFZMGSCLNAH-ZDUSSCGKSA-N 1 0 304.821 4.032 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808708251 1052070426 /nfs/dbraw/zinc/07/04/26/1052070426.db2.gz KCACUMDURNOTNA-QWRGUYRKSA-N 1 0 322.836 4.413 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c(F)c1 ZINC000808706727 1052070453 /nfs/dbraw/zinc/07/04/53/1052070453.db2.gz RXBPMJBINSEFDX-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO CCOC1CC(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000808716573 1052076380 /nfs/dbraw/zinc/07/63/80/1052076380.db2.gz ZMEFIJXGPDYBOM-DNOWBOINSA-N 1 0 311.853 4.210 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c1O ZINC000808716937 1052076521 /nfs/dbraw/zinc/07/65/21/1052076521.db2.gz AADWMGOSFCSSGY-CZUORRHYSA-N 1 0 323.864 4.354 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808717392 1052076697 /nfs/dbraw/zinc/07/66/97/1052076697.db2.gz CVTVMPVBTRRWHJ-ZDUSSCGKSA-N 1 0 313.869 4.457 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c1O ZINC000808719489 1052078094 /nfs/dbraw/zinc/07/80/94/1052078094.db2.gz XDOGWXCVAXRUIS-QWRGUYRKSA-N 1 0 303.780 4.440 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2COc3ccccc32)c1O ZINC000808728641 1052084430 /nfs/dbraw/zinc/08/44/30/1052084430.db2.gz UAQXSWKLXAYARN-CHWSQXEVSA-N 1 0 317.816 4.181 20 10 DICDRO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000769870559 1052122275 /nfs/dbraw/zinc/12/22/75/1052122275.db2.gz AQCNIESACYAPTN-CQSZACIVSA-N 1 0 315.461 4.242 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2Cl)c1O ZINC000130331715 1052167987 /nfs/dbraw/zinc/16/79/87/1052167987.db2.gz YXYQXEKJVFAOKR-LLVKDONJSA-N 1 0 323.795 4.434 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@H]1C[NH2+]C[C@H]1C ZINC001217968645 1052178165 /nfs/dbraw/zinc/17/81/65/1052178165.db2.gz RQQTXEOLZWODOF-KUHUBIRLSA-N 1 0 324.428 4.436 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CCC[NH2+]CC2)=C1 ZINC001217997132 1052182877 /nfs/dbraw/zinc/18/28/77/1052182877.db2.gz PVGOTVICWYQTBR-FVGNFYTDSA-N 1 0 311.385 4.329 20 10 DICDRO C[C@H]1C[C@@H](OC2=CC(=O)C=CC2=NNc2ccccc2)CC[NH2+]1 ZINC001218052307 1052189381 /nfs/dbraw/zinc/18/93/81/1052189381.db2.gz APTMYXYVSAJGFL-XLLGOIQHSA-N 1 0 311.385 4.327 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@H]3CC[C@@H]4[NH2+]CCO[C@@H]43)cc2)cc1 ZINC001218120277 1052198843 /nfs/dbraw/zinc/19/88/43/1052198843.db2.gz ONQNLSBQXLTKGK-CQSSKZMZSA-N 1 0 323.396 4.000 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@H]3CC[C@]34CC[NH2+]C4)cc2)C=C1 ZINC001218113987 1052199282 /nfs/dbraw/zinc/19/92/82/1052199282.db2.gz APZXDSNIWDFQKW-RBUKOAKNSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2C[C@H]3C[NH2+]C[C@H]3C2)=C1 ZINC001218136634 1052201240 /nfs/dbraw/zinc/20/12/40/1052201240.db2.gz XYFKFVUJBTXPAM-MJGOYXFGSA-N 1 0 323.396 4.184 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1C[C@H]2[NH2+]CC[C@H]2C1 ZINC001218253117 1052212553 /nfs/dbraw/zinc/21/25/53/1052212553.db2.gz WWBDZUKFDXCXTO-KGXUYHBOSA-N 1 0 323.396 4.327 20 10 DICDRO CCC[C@H](Oc1ccc(N2CC[NH2+]CC2)cc1)c1ccccc1 ZINC001218356495 1052230521 /nfs/dbraw/zinc/23/05/21/1052230521.db2.gz MUHRPTQNDQNSJA-FQEVSTJZSA-N 1 0 310.441 4.016 20 10 DICDRO CCC[C@@H](Oc1ccc(N2CC[NH2+]CC2)cc1)c1ccccc1 ZINC001218356496 1052230529 /nfs/dbraw/zinc/23/05/29/1052230529.db2.gz MUHRPTQNDQNSJA-HXUWFJFHSA-N 1 0 310.441 4.016 20 10 DICDRO C[C@H]1[NH2+]C[C@@H]1Oc1ccc2ccccc2c1/N=N/c1ccccn1 ZINC001218388039 1052233397 /nfs/dbraw/zinc/23/33/97/1052233397.db2.gz QVGYOYXUVWAJGQ-KRVVVINISA-N 1 0 318.380 4.389 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CC[C@H]2C[NH2+]C[C@H]21 ZINC001218462330 1052242555 /nfs/dbraw/zinc/24/25/55/1052242555.db2.gz WQFKLVPILNSOGN-RNJOPXQQSA-N 1 0 323.396 4.184 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CC[C@@H]2C[NH2+]C[C@@H]12 ZINC001218462326 1052242605 /nfs/dbraw/zinc/24/26/05/1052242605.db2.gz WQFKLVPILNSOGN-BFAYYOFPSA-N 1 0 323.396 4.184 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)c1O ZINC000762123487 1052310052 /nfs/dbraw/zinc/31/00/52/1052310052.db2.gz ZVLZSMALESQAMP-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2ccccc2Cl)c1 ZINC000315376560 1052336469 /nfs/dbraw/zinc/33/64/69/1052336469.db2.gz FYCCKABTLDTARV-CHWSQXEVSA-N 1 0 319.832 4.336 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2ccccc2Cl)c1 ZINC000315376564 1052336848 /nfs/dbraw/zinc/33/68/48/1052336848.db2.gz FYCCKABTLDTARV-OLZOCXBDSA-N 1 0 319.832 4.336 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCC2CC(OC(C)(C)C)C2)c(O)c1 ZINC000762621500 1052408212 /nfs/dbraw/zinc/40/82/12/1052408212.db2.gz KHNYSERULCWPTN-FHERZECASA-N 1 0 305.462 4.335 20 10 DICDRO COc1ccc(C[NH2+]CC2(c3ccc(F)cc3)CCC2)cc1C ZINC001649015703 1052450048 /nfs/dbraw/zinc/45/00/48/1052450048.db2.gz WOICYOYXIJVUPZ-UHFFFAOYSA-N 1 0 313.416 4.354 20 10 DICDRO CCOC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CCCC1 ZINC000320289607 1052498325 /nfs/dbraw/zinc/49/83/25/1052498325.db2.gz BGERBBVFELPMRM-CABCVRRESA-N 1 0 303.446 4.188 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000324574732 1052554169 /nfs/dbraw/zinc/55/41/69/1052554169.db2.gz XVAXKKJQLBFBEV-INIZCTEOSA-N 1 0 324.468 4.237 20 10 DICDRO COc1cc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)ccc1F ZINC000153819327 1052587423 /nfs/dbraw/zinc/58/74/23/1052587423.db2.gz HVNTXYHJTCTLPJ-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(F)c1 ZINC000917075532 1052691093 /nfs/dbraw/zinc/69/10/93/1052691093.db2.gz YUTZMPVRRORNPJ-UHFFFAOYSA-N 1 0 300.421 4.302 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OCC(C)C)CC2)cc1C(C)C ZINC000917488677 1052732062 /nfs/dbraw/zinc/73/20/62/1052732062.db2.gz QSPHZSKPLPKAQT-UHFFFAOYSA-N 1 0 319.489 4.461 20 10 DICDRO COCCCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179642518 1053020057 /nfs/dbraw/zinc/02/00/57/1053020057.db2.gz YJDQADROLSHYHL-KRWDZBQOSA-N 1 0 313.441 4.382 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)cc1Br)c1ccccc1O ZINC000179889603 1053034812 /nfs/dbraw/zinc/03/48/12/1053034812.db2.gz JCWLDRIYIFJGHI-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO C[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(N2CCCCC2)cc1 ZINC000180258385 1053052520 /nfs/dbraw/zinc/05/25/20/1053052520.db2.gz RIDYYBFNYYIWDU-XLIONFOSSA-N 1 0 316.489 4.287 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1c(F)cc(F)cc1F ZINC001350944250 1053121076 /nfs/dbraw/zinc/12/10/76/1053121076.db2.gz OJWQXGLVYHFYDS-BONVTDFDSA-N 1 0 321.342 4.456 20 10 DICDRO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(N3CCCC3)cc2)o1 ZINC001318339330 1053162400 /nfs/dbraw/zinc/16/24/00/1053162400.db2.gz NNHKMVSUZCNZAJ-KXBFYZLASA-N 1 0 310.441 4.293 20 10 DICDRO Cc1cccc(OCCC[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001318419259 1053166567 /nfs/dbraw/zinc/16/65/67/1053166567.db2.gz XYGSVEWTBKCPLH-UHFFFAOYSA-N 1 0 324.468 4.154 20 10 DICDRO C[C@@H]([NH2+]CCCc1ccccn1)c1ccc(N2CCCCC2)cc1 ZINC000181491066 1053221924 /nfs/dbraw/zinc/22/19/24/1053221924.db2.gz KKLNROHNRZGJAC-GOSISDBHSA-N 1 0 323.484 4.355 20 10 DICDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC001319828918 1053277492 /nfs/dbraw/zinc/27/74/92/1053277492.db2.gz ORNGVCUQYPZICV-OALUTQOASA-N 1 0 316.514 4.147 20 10 DICDRO COc1ccccc1C1([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCC1 ZINC001319857418 1053281265 /nfs/dbraw/zinc/28/12/65/1053281265.db2.gz VNTFYOBJUXZPEV-INIZCTEOSA-N 1 0 324.468 4.491 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)cc1Cl ZINC001474744459 1053295976 /nfs/dbraw/zinc/29/59/76/1053295976.db2.gz KCVTVYFVQXMRJD-OAHLLOKOSA-N 1 0 322.235 4.264 20 10 DICDRO CSc1cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)ccn1 ZINC001320119063 1053307470 /nfs/dbraw/zinc/30/74/70/1053307470.db2.gz VWTUZBWRUKURHT-TZMCWYRMSA-N 1 0 314.454 4.156 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2coc(-c3ccccc3)n2)c1 ZINC001320125006 1053308504 /nfs/dbraw/zinc/30/85/04/1053308504.db2.gz PHQSOWBLXNQUFA-HNNXBMFYSA-N 1 0 322.408 4.249 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCO[C@H](CC(C)C)C1 ZINC001320133891 1053309354 /nfs/dbraw/zinc/30/93/54/1053309354.db2.gz RQRPEXJSJRKGFH-VQHPVUNQSA-N 1 0 317.473 4.432 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC1(CCO)CCCCC1 ZINC001320410429 1053331683 /nfs/dbraw/zinc/33/16/83/1053331683.db2.gz BFGMZKPBEUXLGT-HZPDHXFCSA-N 1 0 317.473 4.171 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+][C@H]1CCCc2nc(C)ncc21 ZINC001320410975 1053332118 /nfs/dbraw/zinc/33/21/18/1053332118.db2.gz JFWWYYCJWRCWRA-AFAVFJNCSA-N 1 0 323.440 4.015 20 10 DICDRO CC[C@@H]([NH2+]CCCc1nc(C)cs1)c1cc(Cl)ccc1O ZINC001320399187 1053332133 /nfs/dbraw/zinc/33/21/33/1053332133.db2.gz XCWPDSNYLNIZJX-CQSZACIVSA-N 1 0 324.877 4.484 20 10 DICDRO CCc1nc(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)cs1 ZINC001320411283 1053332462 /nfs/dbraw/zinc/33/24/62/1053332462.db2.gz LIYZKSFRVGOGJF-OCCSQVGLSA-N 1 0 316.470 4.100 20 10 DICDRO COCCC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC001320411543 1053333280 /nfs/dbraw/zinc/33/32/80/1053333280.db2.gz PPFXZDHWTJARKE-GJZGRUSLSA-N 1 0 303.446 4.045 20 10 DICDRO CCc1nc(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)cs1 ZINC001320411284 1053333835 /nfs/dbraw/zinc/33/38/35/1053333835.db2.gz LIYZKSFRVGOGJF-TZMCWYRMSA-N 1 0 316.470 4.100 20 10 DICDRO Fc1cccc([C@@H]2CC[N@@H+]2Cc2ccc(N3CCCC3)cc2)c1 ZINC001320508572 1053339197 /nfs/dbraw/zinc/33/91/97/1053339197.db2.gz BLJIMFOCDCVFRG-FQEVSTJZSA-N 1 0 310.416 4.373 20 10 DICDRO CCOC1CC(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)C1 ZINC001320793844 1053361835 /nfs/dbraw/zinc/36/18/35/1053361835.db2.gz ZRIUVXZSQVOZOI-PRLABOORSA-N 1 0 303.446 4.044 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](c2nc(C)cs2)C2CC2)cc1 ZINC001320859887 1053368796 /nfs/dbraw/zinc/36/87/96/1053368796.db2.gz YVYGRSHJGZYPMX-QGZVFWFLSA-N 1 0 315.486 4.149 20 10 DICDRO COc1ccccc1C1([NH2+][C@@H](C)c2ccc(C)cc2O)CCC1 ZINC001321037284 1053385648 /nfs/dbraw/zinc/38/56/48/1053385648.db2.gz JOMVPXCZMPSVIV-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC001321038623 1053385713 /nfs/dbraw/zinc/38/57/13/1053385713.db2.gz YZKZVFAKTCYDOE-GTFRVERFSA-N 1 0 319.448 4.424 20 10 DICDRO CC[C@H]([NH2+]CCCOCc1ccccc1)c1ccc(C)cc1O ZINC001321072433 1053387001 /nfs/dbraw/zinc/38/70/01/1053387001.db2.gz JAWCZVNWIPNHCE-IBGZPJMESA-N 1 0 313.441 4.348 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCc1nc(C(C)(C)C)co1 ZINC001352774090 1053402632 /nfs/dbraw/zinc/40/26/32/1053402632.db2.gz GUEJERODKQVXOM-STQMWFEESA-N 1 0 314.429 4.324 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCCC12CCOCC2 ZINC001321239370 1053403565 /nfs/dbraw/zinc/40/35/65/1053403565.db2.gz KHLKITNNYRELKF-HLLBOEOZSA-N 1 0 315.457 4.188 20 10 DICDRO c1cc2cc(CC[NH2+]Cc3ccc(N4CCCC4)cc3)ccc2[nH]1 ZINC001321346439 1053408914 /nfs/dbraw/zinc/40/89/14/1053408914.db2.gz GPQKCUPDHGAUAQ-UHFFFAOYSA-N 1 0 319.452 4.100 20 10 DICDRO C[NH+]1CCC(OC2=CC(=O)C=CC2=NNc2ccccc2)CC1 ZINC001229812727 1053409264 /nfs/dbraw/zinc/40/92/64/1053409264.db2.gz BGYSFKWTZRWKFF-FMQUCBEESA-N 1 0 311.385 4.281 20 10 DICDRO CCN(C)c1ccccc1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001200142374 1053412173 /nfs/dbraw/zinc/41/21/73/1053412173.db2.gz VOTMYAWICPTNSK-HJWRWDBZSA-N 1 0 323.484 4.012 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3ccccc3c2)c1 ZINC000182337961 1053414871 /nfs/dbraw/zinc/41/48/71/1053414871.db2.gz HZWYVTZQSFWVMI-CQSZACIVSA-N 1 0 307.393 4.405 20 10 DICDRO CCCCc1nc(C[NH2+][C@H](C)c2cc(OC)ccc2O)cs1 ZINC000182386593 1053426546 /nfs/dbraw/zinc/42/65/46/1053426546.db2.gz PAFOYRIJSOKWRV-GFCCVEGCSA-N 1 0 320.458 4.051 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCCc2ccc(Cl)cc2)cc1F ZINC001200267678 1053512748 /nfs/dbraw/zinc/51/27/48/1053512748.db2.gz JBNQASKXUHWVNA-UHFFFAOYSA-N 1 0 320.839 4.268 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1 ZINC001323829227 1053603019 /nfs/dbraw/zinc/60/30/19/1053603019.db2.gz IOZKCBPPGVMTHY-AESZEHBQSA-N 1 0 317.473 4.432 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1cccc(F)c1F ZINC000183267361 1053619807 /nfs/dbraw/zinc/61/98/07/1053619807.db2.gz HJHKGRVVVVIMCY-JTQLQIEISA-N 1 0 314.426 4.254 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)c1ccc(F)cc1 ZINC001324239523 1053636824 /nfs/dbraw/zinc/63/68/24/1053636824.db2.gz IBCDPSXOJRPGPY-RDTXWAMCSA-N 1 0 317.404 4.186 20 10 DICDRO C[C@H]([NH2+]CCSCc1ccccc1F)c1ccccc1O ZINC000183384866 1053650391 /nfs/dbraw/zinc/65/03/91/1053650391.db2.gz IOHADHZONQIOJH-ZDUSSCGKSA-N 1 0 305.418 4.115 20 10 DICDRO COc1ccccc1C1([NH2+]Cc2ccc(N(C)C)c(C)c2)CCC1 ZINC001324487834 1053656988 /nfs/dbraw/zinc/65/69/88/1053656988.db2.gz HILROXLYFCPAKY-UHFFFAOYSA-N 1 0 324.468 4.239 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1F ZINC000183505190 1053665500 /nfs/dbraw/zinc/66/55/00/1053665500.db2.gz PLHZUUNCGZSJPW-AWEZNQCLSA-N 1 0 316.420 4.228 20 10 DICDRO C[C@@H]([NH2+]CCCc1nc2c(s1)CCCC2)c1ccccc1O ZINC000183485475 1053665986 /nfs/dbraw/zinc/66/59/86/1053665986.db2.gz WWICXENUBSVPFZ-CYBMUJFWSA-N 1 0 316.470 4.011 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](OC(F)F)C2)cc1C(C)C ZINC000781149666 1053673088 /nfs/dbraw/zinc/67/30/88/1053673088.db2.gz OXWZYCUNAAXTDV-CQSZACIVSA-N 1 0 313.388 4.028 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(Br)cc2)c1 ZINC000071408441 1053674933 /nfs/dbraw/zinc/67/49/33/1053674933.db2.gz QKGCTCYDCWGFKB-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO CS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001324749110 1053678239 /nfs/dbraw/zinc/67/82/39/1053678239.db2.gz DJYLSJPXVQJKIJ-QZTJIDSGSA-N 1 0 304.503 4.003 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1CCOC(C)(C)C1 ZINC001325315730 1053713078 /nfs/dbraw/zinc/71/30/78/1053713078.db2.gz PDDHIUSBUDVIOS-QLFBSQMISA-N 1 0 303.446 4.044 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1cc(C(C)C)no1 ZINC001325341321 1053714108 /nfs/dbraw/zinc/71/41/08/1053714108.db2.gz VCQZOFKVEVVYQB-DOMZBBRYSA-N 1 0 300.402 4.150 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCCNc1ccccc1 ZINC001325339922 1053715126 /nfs/dbraw/zinc/71/51/26/1053715126.db2.gz LZBXWMMVDCRLBE-RDJZCZTQSA-N 1 0 310.441 4.341 20 10 DICDRO Cc1noc(C)c1CCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001325341672 1053715478 /nfs/dbraw/zinc/71/54/78/1053715478.db2.gz XXMADCUHIBCMBH-BLLLJJGKSA-N 1 0 314.429 4.076 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2cccc(C)c2C)c1O ZINC000183738909 1053745290 /nfs/dbraw/zinc/74/52/90/1053745290.db2.gz GOOJPKNJFNOUNW-ZDUSSCGKSA-N 1 0 315.388 4.202 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH+]1CCC2(CC2)CC1 ZINC001231468269 1053756781 /nfs/dbraw/zinc/75/67/81/1053756781.db2.gz VICRMJJRPCYVBI-UHFFFAOYSA-N 1 0 323.436 4.347 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CC2CCC1CC2 ZINC001231470384 1053756930 /nfs/dbraw/zinc/75/69/30/1053756930.db2.gz WTXWZENFQWISGY-UHFFFAOYSA-N 1 0 323.436 4.346 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH+]1CCCCCC1 ZINC001231466117 1053759153 /nfs/dbraw/zinc/75/91/53/1053759153.db2.gz MLABSNSWKUTFRB-UHFFFAOYSA-N 1 0 311.425 4.347 20 10 DICDRO C[N@H+](Cc1ccc(OCc2ccccc2)cc1O)CC(C)(C)C ZINC001231469004 1053759454 /nfs/dbraw/zinc/75/94/54/1053759454.db2.gz LWJPVTPASNBJFX-UHFFFAOYSA-N 1 0 313.441 4.449 20 10 DICDRO Cc1cccnc1[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C(C)C ZINC001200582419 1053787376 /nfs/dbraw/zinc/78/73/76/1053787376.db2.gz ZILJJEXNYTUNAZ-HXUWFJFHSA-N 1 0 323.484 4.477 20 10 DICDRO Oc1ccc2ccccc2c1C[N@H+]1C[C@@H]2CC(F)(F)C[C@@H]2C1 ZINC001231586527 1053789027 /nfs/dbraw/zinc/78/90/27/1053789027.db2.gz IZNZQQPPLJTVAP-OKILXGFUSA-N 1 0 303.352 4.023 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c1O ZINC001231592026 1053791154 /nfs/dbraw/zinc/79/11/54/1053791154.db2.gz FLYLRSALIBIIMN-CQSZACIVSA-N 1 0 301.817 4.344 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC001231590138 1053792071 /nfs/dbraw/zinc/79/20/71/1053792071.db2.gz LWDDWADZGDIRSJ-KRWDZBQOSA-N 1 0 318.420 4.320 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1O ZINC001231591865 1053792104 /nfs/dbraw/zinc/79/21/04/1053792104.db2.gz BOUSVVRXFSKMCG-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cccc(C[N@@H+]2CCSC[C@H]2c2ccc(F)cc2)c1O ZINC001231593188 1053792274 /nfs/dbraw/zinc/79/22/74/1053792274.db2.gz QMLFXYWCVSHIAB-KRWDZBQOSA-N 1 0 317.429 4.130 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC001231589341 1053792317 /nfs/dbraw/zinc/79/23/17/1053792317.db2.gz CDICIEDYQGHFCR-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO Cc1ccc2c(c1)CC[N@@H+](Cc1c(O)ccc3ccccc31)C2 ZINC001231589597 1053793043 /nfs/dbraw/zinc/79/30/43/1053793043.db2.gz MGUHAUYMCLJLPI-UHFFFAOYSA-N 1 0 303.405 4.412 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001231588275 1053793591 /nfs/dbraw/zinc/79/35/91/1053793591.db2.gz KGWMYZJEOJVJNS-SFHVURJKSA-N 1 0 319.404 4.199 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1cc(F)cnc1Cl ZINC001326621988 1053795820 /nfs/dbraw/zinc/79/58/20/1053795820.db2.gz BSDJKLUZRYJFAP-GWCFXTLKSA-N 1 0 320.795 4.226 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC001200591437 1053796088 /nfs/dbraw/zinc/79/60/88/1053796088.db2.gz YHMQIKRLRWIMID-PKOBYXMFSA-N 1 0 304.437 4.208 20 10 DICDRO COCC1(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC001327835692 1053882425 /nfs/dbraw/zinc/88/24/25/1053882425.db2.gz XUAOASPONHXWSG-CABCVRRESA-N 1 0 303.446 4.045 20 10 DICDRO Cc1cc(C)c(C[N@@H+]2CCc3c4ccccc4oc3C2)c(O)c1 ZINC001231848045 1053891007 /nfs/dbraw/zinc/89/10/07/1053891007.db2.gz HDRDTMHXVDAZSS-UHFFFAOYSA-N 1 0 307.393 4.314 20 10 DICDRO CCCc1ccc(C[NH2+]CCCSc2nccs2)s1 ZINC001200691808 1053896264 /nfs/dbraw/zinc/89/62/64/1053896264.db2.gz HSZZFCXDPOHWLX-UHFFFAOYSA-N 1 0 312.529 4.429 20 10 DICDRO CC[C@@H](C[NH2+]CCCSc1nccs1)c1ccccc1 ZINC001200692752 1053897719 /nfs/dbraw/zinc/89/77/19/1053897719.db2.gz UWJPMMQGKGONIK-AWEZNQCLSA-N 1 0 306.500 4.409 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC[C@@H]2CCCCO2)cc1 ZINC000183996919 1053901393 /nfs/dbraw/zinc/90/13/93/1053901393.db2.gz QGZPPLMWBSDOTK-LPHOPBHVSA-N 1 0 304.478 4.143 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@H]2Cc2ccccn2)ccc2ccccc21 ZINC001231880719 1053904888 /nfs/dbraw/zinc/90/48/88/1053904888.db2.gz FONHFFZZRXJTCZ-IBGZPJMESA-N 1 0 318.420 4.148 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCc2c(F)cccc2Cl)c1O ZINC001328726005 1053952332 /nfs/dbraw/zinc/95/23/32/1053952332.db2.gz FYGGDDVJUNHKLY-NSHDSACASA-N 1 0 323.795 4.087 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)cc1 ZINC001329575437 1053997024 /nfs/dbraw/zinc/99/70/24/1053997024.db2.gz ZDSJDPNXUSCYSB-JFOHDYCDSA-N 1 0 308.416 4.227 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC001329589917 1053998364 /nfs/dbraw/zinc/99/83/64/1053998364.db2.gz WICLFYJAQLZFPK-JLZZUVOBSA-N 1 0 309.409 4.232 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)cc1Cl ZINC001232261399 1054004714 /nfs/dbraw/zinc/00/47/14/1054004714.db2.gz GWCQGHCNSLDEHL-CQSZACIVSA-N 1 0 317.816 4.131 20 10 DICDRO CC[N@H+](Cc1cc(Cl)cs1)Cc1ccc(N(C)C)cc1 ZINC001232283311 1054013178 /nfs/dbraw/zinc/01/31/78/1054013178.db2.gz XETNYXLBQGLCEN-UHFFFAOYSA-N 1 0 308.878 4.490 20 10 DICDRO c1csc(CC2C[NH+](Cc3ccc(N4CCCC4)cc3)C2)c1 ZINC001330114571 1054025253 /nfs/dbraw/zinc/02/52/53/1054025253.db2.gz LIXYDAXARSGESM-UHFFFAOYSA-N 1 0 312.482 4.023 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cc2ccoc2cn1 ZINC001232553459 1054068532 /nfs/dbraw/zinc/06/85/32/1054068532.db2.gz UMPMIODSBSWPQP-UHFFFAOYSA-N 1 0 321.424 4.060 20 10 DICDRO C[C@]1([NH2+]Cc2ccc(N3CCCC3)cc2)CCOc2ccccc21 ZINC001332796891 1054126963 /nfs/dbraw/zinc/12/69/63/1054126963.db2.gz GGNOLGWJROILBM-NRFANRHFSA-N 1 0 322.452 4.074 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001332947078 1054133949 /nfs/dbraw/zinc/13/39/49/1054133949.db2.gz RQMGDGAOEXHUDL-HOCLYGCPSA-N 1 0 311.425 4.356 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001332947079 1054134034 /nfs/dbraw/zinc/13/40/34/1054134034.db2.gz RQMGDGAOEXHUDL-ZBFHGGJFSA-N 1 0 311.425 4.356 20 10 DICDRO C[C@H]([NH2+][C@@H](C1CC1)[C@@H]1CCCCO1)c1ccc(Cl)cc1O ZINC000848557795 1054149154 /nfs/dbraw/zinc/14/91/54/1054149154.db2.gz HOERGIOUSRIVDX-GOPGUHFVSA-N 1 0 309.837 4.044 20 10 DICDRO C[C@H]([NH2+][C@H](C1CC1)[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000848558829 1054149378 /nfs/dbraw/zinc/14/93/78/1054149378.db2.gz OBXUNZVUYRIHJF-MZPVMMEZSA-N 1 0 309.837 4.044 20 10 DICDRO CC[C@H]([NH2+][C@@H](C1CC1)[C@H]1CCCCO1)c1ccc(C)cc1O ZINC000848557539 1054149591 /nfs/dbraw/zinc/14/95/91/1054149591.db2.gz FOGIAGDJKWMOOI-UHOSZYNNSA-N 1 0 303.446 4.089 20 10 DICDRO C[C@H](Cc1ccccn1)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000848565348 1054151060 /nfs/dbraw/zinc/15/10/60/1054151060.db2.gz NOXFPGLZDNBCHX-HUUCEWRRSA-N 1 0 306.409 4.222 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](C)C2CCC(F)(F)CC2)c1 ZINC000848575246 1054157129 /nfs/dbraw/zinc/15/71/29/1054157129.db2.gz MZUWWAYYCQJLSJ-GFCCVEGCSA-N 1 0 313.388 4.095 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)c1O ZINC001233109394 1054186261 /nfs/dbraw/zinc/18/62/61/1054186261.db2.gz VEFLSHKEALUQTI-QWHCGFSZSA-N 1 0 324.262 4.085 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(C)cc1O)c1cc(F)ccc1OC ZINC001334319916 1054187150 /nfs/dbraw/zinc/18/71/50/1054187150.db2.gz RJZGJMRZGXDVST-INIZCTEOSA-N 1 0 303.377 4.089 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(SC)cc2)c1O ZINC001334366681 1054188769 /nfs/dbraw/zinc/18/87/69/1054188769.db2.gz GVYGHZJGIIKEHK-ZDUSSCGKSA-N 1 0 317.454 4.282 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(F)cccc1OC)c1ccc(C)cc1O ZINC001334727621 1054195757 /nfs/dbraw/zinc/19/57/57/1054195757.db2.gz BXUWGAGEEFPKTA-MRXNPFEDSA-N 1 0 303.377 4.089 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccn3)C2)c1 ZINC001233286382 1054224617 /nfs/dbraw/zinc/22/46/17/1054224617.db2.gz RGCBIUCANVUDJF-OAHLLOKOSA-N 1 0 310.441 4.074 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(C(C)(C)C)ccc1O ZINC001233287163 1054225865 /nfs/dbraw/zinc/22/58/65/1054225865.db2.gz ZCHXZMUTOCHZEZ-UHFFFAOYSA-N 1 0 313.441 4.417 20 10 DICDRO C[N@H+](Cc1ccc(Cl)nc1)Cc1cc(C(C)(C)C)ccc1O ZINC001233287174 1054226798 /nfs/dbraw/zinc/22/67/98/1054226798.db2.gz ZHELGHBXLJPVLH-UHFFFAOYSA-N 1 0 318.848 4.370 20 10 DICDRO [O-]c1ccc(F)c(F)c1C[N@@H+]1CCCC[C@H]1c1ccccc1 ZINC001233331832 1054234505 /nfs/dbraw/zinc/23/45/05/1054234505.db2.gz MSZZOHTXPGOPJP-INIZCTEOSA-N 1 0 303.352 4.398 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](CN2CCCC2)c2ccccc2)c1 ZINC000184919545 1054266378 /nfs/dbraw/zinc/26/63/78/1054266378.db2.gz ZQWYPLGOTLRQDQ-FXAWDEMLSA-N 1 0 324.468 4.188 20 10 DICDRO C[N@H+](Cc1ccc(F)cc1)Cc1ccc(C(F)(F)F)cc1O ZINC001233451652 1054277491 /nfs/dbraw/zinc/27/74/91/1054277491.db2.gz UGUBOXKLPUFJQE-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1CCC2(CC(F)C2)CC1 ZINC001233451843 1054277645 /nfs/dbraw/zinc/27/76/45/1054277645.db2.gz BEZYMFHVLBDKMC-UHFFFAOYSA-N 1 0 317.326 4.125 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](C)c2ccccc2OC(F)F)c1O ZINC000848892569 1054285481 /nfs/dbraw/zinc/28/54/81/1054285481.db2.gz ARMCTVWUOLLNNK-LBPRGKRZSA-N 1 0 321.367 4.407 20 10 DICDRO Cc1csc(CCC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC001337784705 1054285690 /nfs/dbraw/zinc/28/56/90/1054285690.db2.gz DHDSEIPOFCIUGQ-GXTWGEPZSA-N 1 0 316.470 4.236 20 10 DICDRO COC1CCC(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001337785446 1054285946 /nfs/dbraw/zinc/28/59/46/1054285946.db2.gz NCOVCSOQVFTEDF-LBDPXKHJSA-N 1 0 303.446 4.044 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCO[C@H](C(C)C)C1 ZINC001337785560 1054286034 /nfs/dbraw/zinc/28/60/34/1054286034.db2.gz OEWZYBGYZIODTN-AIANPOQGSA-N 1 0 303.446 4.042 20 10 DICDRO CCc1cnc(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC001337785438 1054286298 /nfs/dbraw/zinc/28/62/98/1054286298.db2.gz MWFQMQVLMNLWBL-JSGCOSHPSA-N 1 0 316.470 4.100 20 10 DICDRO C[C@H]([NH2+]C1CCC2(CCOCC2)CC1)c1cc(Cl)ccc1O ZINC001337800979 1054286626 /nfs/dbraw/zinc/28/66/26/1054286626.db2.gz OWLJXBMSTHEVOJ-ZDUSSCGKSA-N 1 0 323.864 4.436 20 10 DICDRO Cc1ccsc1CC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001337800330 1054286669 /nfs/dbraw/zinc/28/66/69/1054286669.db2.gz MWEGLDSIIPVUOL-KGLIPLIRSA-N 1 0 301.455 4.451 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C2CCC3(CCOCC3)CC2)c(O)c1C ZINC001337801004 1054287175 /nfs/dbraw/zinc/28/71/75/1054287175.db2.gz PJSNYKWLEVVJMJ-MRXNPFEDSA-N 1 0 317.473 4.399 20 10 DICDRO CCc1cccc(C[NH2+][C@H](c2ccc(OC)cc2)C2CC2)c1O ZINC000848893549 1054287581 /nfs/dbraw/zinc/28/75/81/1054287581.db2.gz XFJJCTHXBIKYQE-IBGZPJMESA-N 1 0 311.425 4.204 20 10 DICDRO CCc1cccc(C[NH2+]C2(c3cccc(Cl)c3)CC2)c1O ZINC000848896661 1054287923 /nfs/dbraw/zinc/28/79/23/1054287923.db2.gz GHQTVXYCYGYAEP-UHFFFAOYSA-N 1 0 301.817 4.387 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCOc3c(CC)cccc32)c1O ZINC000848896241 1054288211 /nfs/dbraw/zinc/28/82/11/1054288211.db2.gz WCBHEFADDPMZOM-SFHVURJKSA-N 1 0 311.425 4.130 20 10 DICDRO CC(C)([NH2+]Cc1ccc(N)cc1)c1ccccc1Br ZINC001337838982 1054290077 /nfs/dbraw/zinc/29/00/77/1054290077.db2.gz XYEDPMZYOMQBJW-UHFFFAOYSA-N 1 0 319.246 4.056 20 10 DICDRO CCc1cccc(C[NH2+]Cc2cccc(CSC)c2)c1O ZINC000848906673 1054293412 /nfs/dbraw/zinc/29/34/12/1054293412.db2.gz XWARCRAFHORPDZ-UHFFFAOYSA-N 1 0 301.455 4.107 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c1O ZINC000848916927 1054297993 /nfs/dbraw/zinc/29/79/93/1054297993.db2.gz AWZMMBMIDZEZGK-LBPRGKRZSA-N 1 0 301.352 4.119 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c1O ZINC000848916926 1054298250 /nfs/dbraw/zinc/29/82/50/1054298250.db2.gz AWZMMBMIDZEZGK-GFCCVEGCSA-N 1 0 301.352 4.119 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000185068204 1054344889 /nfs/dbraw/zinc/34/48/89/1054344889.db2.gz CNDYTXIHKBRLFN-CQSZACIVSA-N 1 0 316.420 4.228 20 10 DICDRO Cc1cccc2c1C[N@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001233727275 1054346291 /nfs/dbraw/zinc/34/62/91/1054346291.db2.gz LOXDCZKTHKRMBA-UHFFFAOYSA-N 1 0 323.314 4.115 20 10 DICDRO Oc1c(C[N@@H+]2CCC23CCCCC3)cccc1OC(F)(F)F ZINC001233736104 1054347065 /nfs/dbraw/zinc/34/70/65/1054347065.db2.gz CLNQPQAWMWZLFY-UHFFFAOYSA-N 1 0 315.335 4.199 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@H]3CCC[C@H]32)cccc1OC(F)(F)F ZINC001233761117 1054353211 /nfs/dbraw/zinc/35/32/11/1054353211.db2.gz QBFWVSUVCFCYKA-DGCLKSJQSA-N 1 0 315.335 4.055 20 10 DICDRO CCCCOc1ncccc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185143555 1054411740 /nfs/dbraw/zinc/41/17/40/1054411740.db2.gz WYZMAXGVKBQFGD-HNNXBMFYSA-N 1 0 314.429 4.125 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)C1CCOCC1 ZINC001342407406 1054420512 /nfs/dbraw/zinc/42/05/12/1054420512.db2.gz QDKLNYNZIMSKTD-CWRNSKLLSA-N 1 0 303.446 4.044 20 10 DICDRO CCOc1ccccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001342390454 1054420835 /nfs/dbraw/zinc/42/08/35/1054420835.db2.gz PWXBGNHOJKGZRS-HOCLYGCPSA-N 1 0 311.425 4.437 20 10 DICDRO CC1(C)C[N@H+](Cc2ccc(N3CCCC3)cc2)[C@@H]1c1cccnc1 ZINC001343799636 1054454045 /nfs/dbraw/zinc/45/40/45/1054454045.db2.gz IPKXVEIOGZKGML-HXUWFJFHSA-N 1 0 321.468 4.265 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCCOCc2ccccc2)c1 ZINC000185246784 1054488641 /nfs/dbraw/zinc/48/86/41/1054488641.db2.gz JCEDVOYDOGHTLP-QGZVFWFLSA-N 1 0 313.441 4.348 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2c[nH]c3cccc(C)c23)c1 ZINC000185337155 1054523406 /nfs/dbraw/zinc/52/34/06/1054523406.db2.gz GKZVEEZIRZFRCY-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000185323871 1054524002 /nfs/dbraw/zinc/52/40/02/1054524002.db2.gz ZKZPBADMWKDZJA-CHWSQXEVSA-N 1 0 316.470 4.448 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](O)c2ccc3ccccc3c2)c1 ZINC000185406583 1054538854 /nfs/dbraw/zinc/53/88/54/1054538854.db2.gz FZWWIUGDONNKGE-QVKFZJNVSA-N 1 0 321.420 4.238 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCc2c[nH]c3ccccc23)c1 ZINC000185396666 1054539334 /nfs/dbraw/zinc/53/93/34/1054539334.db2.gz LFRSNKYKLXAMMK-CQSZACIVSA-N 1 0 324.424 4.166 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc3ccccc3c2)c(O)c1 ZINC000185406855 1054539693 /nfs/dbraw/zinc/53/96/93/1054539693.db2.gz ZVDBCBUOUCIOKL-QVKFZJNVSA-N 1 0 321.420 4.238 20 10 DICDRO COc1ccc2ccc(O)c(C[N@H+](Cc3ccco3)C3CC3)c2c1 ZINC001234562420 1054546484 /nfs/dbraw/zinc/54/64/84/1054546484.db2.gz NIEUSIJCIZNYKP-UHFFFAOYSA-N 1 0 323.392 4.312 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@@H]4CCC[C@H]43)c2c1 ZINC001234562933 1054547974 /nfs/dbraw/zinc/54/79/74/1054547974.db2.gz XTINPRGPOAXDGR-HNAYVOBHSA-N 1 0 311.425 4.319 20 10 DICDRO C[C@H]([NH2+]C1CC2(CC2(F)F)C1)c1ccc2ccccc2c1O ZINC001346867260 1054551825 /nfs/dbraw/zinc/55/18/25/1054551825.db2.gz HCVBSWGMTKTMPE-BLQFLSLASA-N 1 0 303.352 4.384 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H](C)c1cc(OC)ccc1O)C1CCCC1 ZINC000185634989 1054604098 /nfs/dbraw/zinc/60/40/98/1054604098.db2.gz GFCKZFPVDYTUBQ-IFXJQAMLSA-N 1 0 321.461 4.037 20 10 DICDRO CCOc1cc(C)ccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185706863 1054627139 /nfs/dbraw/zinc/62/71/39/1054627139.db2.gz DXLLSKXRLLXWFD-ZDUSSCGKSA-N 1 0 303.377 4.089 20 10 DICDRO Oc1c(C[NH+]2CC3(C2)CC(F)(F)C3)cccc1-c1ccccc1 ZINC001234991219 1054637332 /nfs/dbraw/zinc/63/73/32/1054637332.db2.gz LDJLLFHRBQASMZ-UHFFFAOYSA-N 1 0 315.363 4.290 20 10 DICDRO CCO[C@@H]1CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234996202 1054637808 /nfs/dbraw/zinc/63/78/08/1054637808.db2.gz WHAILMFUEBGTOC-GOSISDBHSA-N 1 0 311.425 4.060 20 10 DICDRO CCCO[C@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234993448 1054638407 /nfs/dbraw/zinc/63/84/07/1054638407.db2.gz CRIJSQBPBNLBFV-SFHVURJKSA-N 1 0 311.425 4.060 20 10 DICDRO CC(C)O[C@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234999280 1054639756 /nfs/dbraw/zinc/63/97/56/1054639756.db2.gz RIKCFFHARKTRHO-SFHVURJKSA-N 1 0 311.425 4.059 20 10 DICDRO CC[N@H+](Cc1cccnc1)Cc1cccc(-c2ccccc2)c1O ZINC001234997138 1054640544 /nfs/dbraw/zinc/64/05/44/1054640544.db2.gz UIXYJCBYDSPFBF-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@]3(CCOC3)C2)cccc1-c1ccccc1 ZINC001235003860 1054641618 /nfs/dbraw/zinc/64/16/18/1054641618.db2.gz YCYCQDNDISNHGM-OAQYLSRUSA-N 1 0 323.436 4.062 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2csc(-c3ccco3)n2)c1 ZINC000185803643 1054665445 /nfs/dbraw/zinc/66/54/45/1054665445.db2.gz HESFHMASJCPEEL-LBPRGKRZSA-N 1 0 314.410 4.268 20 10 DICDRO C[N@H+](Cc1nc2ccccc2o1)Cc1ccc(C(C)(C)C)cc1O ZINC001235677166 1054770027 /nfs/dbraw/zinc/77/00/27/1054770027.db2.gz CBNCWHIGHUNQGN-UHFFFAOYSA-N 1 0 324.424 4.463 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2ccc(C(C)(C)C)cc2O)c1 ZINC001235685598 1054779082 /nfs/dbraw/zinc/77/90/82/1054779082.db2.gz RTACOPATNIPTAG-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO COCC[C@@H]1CCCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235685268 1054779216 /nfs/dbraw/zinc/77/92/16/1054779216.db2.gz OCHADYCNCJKSDY-KRWDZBQOSA-N 1 0 305.462 4.081 20 10 DICDRO Nc1ccc(C[N@@H+]2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1 ZINC001235712905 1054784882 /nfs/dbraw/zinc/78/48/82/1054784882.db2.gz SETQAICCQOGAIL-HNNXBMFYSA-N 1 0 320.358 4.277 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCCO[C@H]2CC(C)C)cc1C ZINC001474121500 1054785718 /nfs/dbraw/zinc/78/57/18/1054785718.db2.gz XAGKHJCPXGXIMT-QUCCMNQESA-N 1 0 319.489 4.467 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCc2ccc3[nH]ccc3c2)cc1 ZINC001474123149 1054787554 /nfs/dbraw/zinc/78/75/54/1054787554.db2.gz LDVMEJYYEGEBRT-ARJAWSKDSA-N 1 0 319.452 4.079 20 10 DICDRO Oc1cc(Br)ccc1C[NH2+]CC1(C2CCC2)CCC1 ZINC001474565730 1054823927 /nfs/dbraw/zinc/82/39/27/1054823927.db2.gz AWHCQPWKPBKSNK-UHFFFAOYSA-N 1 0 324.262 4.215 20 10 DICDRO Cc1ccn(-c2ccccc2C[NH2+][C@@H](C)c2cc(C)ccc2O)n1 ZINC000186122854 1054929683 /nfs/dbraw/zinc/92/96/83/1054929683.db2.gz GBBCRDBIFVOEOK-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1ccn(-c2ccccc2C[NH2+][C@@H](C)c2ccc(C)cc2O)n1 ZINC000186123022 1054929924 /nfs/dbraw/zinc/92/99/24/1054929924.db2.gz UWDHXBJDZXAYAH-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccc3ccccc3c2O)c1 ZINC000186124690 1054955258 /nfs/dbraw/zinc/95/52/58/1054955258.db2.gz UQAUXJJXZDBCFQ-YWZLYKJASA-N 1 0 321.420 4.238 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CC(C)(C)c3ccccc32)c1 ZINC000186138703 1054988053 /nfs/dbraw/zinc/98/80/53/1054988053.db2.gz IZCWAXQLOBVICG-ACJLOTCBSA-N 1 0 311.425 4.474 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)NCCC2 ZINC001236280210 1055047350 /nfs/dbraw/zinc/04/73/50/1055047350.db2.gz UUWZSMFUNCNYBM-UHFFFAOYSA-N 1 0 323.484 4.133 20 10 DICDRO CCC(CC)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000764490641 1055195262 /nfs/dbraw/zinc/19/52/62/1055195262.db2.gz RAEFMRDFZFDEAG-CYBMUJFWSA-N 1 0 310.869 4.016 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@@H](C)c3ccccc3)CC2)cc1 ZINC000764569323 1055211146 /nfs/dbraw/zinc/21/11/46/1055211146.db2.gz RQFUPRZCECHMFA-QGZVFWFLSA-N 1 0 324.468 4.057 20 10 DICDRO Oc1ccc2ccccc2c1CN([C@@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236652475 1055212665 /nfs/dbraw/zinc/21/26/65/1055212665.db2.gz IBTSTIONVWKQTJ-GOSISDBHSA-N 1 0 324.468 4.042 20 10 DICDRO C[C@H]([NH2+]CCC1CCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000764768479 1055247776 /nfs/dbraw/zinc/24/77/76/1055247776.db2.gz QGXKTZJFUDDPOF-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(OC)c2)c(O)c1 ZINC001236795530 1055263979 /nfs/dbraw/zinc/26/39/79/1055263979.db2.gz WBMYRTNBWRBLBJ-LJQANCHMSA-N 1 0 311.425 4.300 20 10 DICDRO COc1cc(O)c(C[N@H+]2Cc3ccccc3[C@H](C)C2)c(Cl)c1 ZINC001236799638 1055265592 /nfs/dbraw/zinc/26/55/92/1055265592.db2.gz UESXUCHPASJTBH-GFCCVEGCSA-N 1 0 317.816 4.174 20 10 DICDRO CC[C@@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000764810588 1055266065 /nfs/dbraw/zinc/26/60/65/1055266065.db2.gz NSWFMYBXJGATIO-OXQOHEQNSA-N 1 0 316.489 4.222 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)c([O-])c1Cl ZINC001236805960 1055267157 /nfs/dbraw/zinc/26/71/57/1055267157.db2.gz ICWYNFATEYOEBQ-AWEZNQCLSA-N 1 0 323.864 4.456 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCC[C@H]2c2cccs2)c(Cl)c1 ZINC001236799767 1055268761 /nfs/dbraw/zinc/26/87/61/1055268761.db2.gz QICXDDNFXFBZHB-AWEZNQCLSA-N 1 0 323.845 4.453 20 10 DICDRO CC[N@H+](Cc1ccccc1)Cc1ccc(OC)c(Cl)c1[O-] ZINC001236806424 1055269733 /nfs/dbraw/zinc/26/97/33/1055269733.db2.gz WAIFTCZOVSYEHL-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO COc1ccc(C[N@H+](C)CCCc2ccccc2)c([O-])c1Cl ZINC001236813162 1055272588 /nfs/dbraw/zinc/27/25/88/1055272588.db2.gz KNQMQUIPQUQOME-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO COc1cc(C)c(C[N@H+](C)Cc2ccc3ccccc3c2)c(O)c1 ZINC001236820826 1055275292 /nfs/dbraw/zinc/27/52/92/1055275292.db2.gz MUNSLQLTQMXOFB-UHFFFAOYSA-N 1 0 321.420 4.494 20 10 DICDRO Cc1cccc2c1CC[N@H+](Cc1cc3ccccc3cc1O)C2 ZINC001236827983 1055281346 /nfs/dbraw/zinc/28/13/46/1055281346.db2.gz YIAVTZGKANDFHU-UHFFFAOYSA-N 1 0 303.405 4.412 20 10 DICDRO COc1cccc(CC[N@H+](C)Cc2cc3ccccc3cc2O)c1 ZINC001236832742 1055283527 /nfs/dbraw/zinc/28/35/27/1055283527.db2.gz KMGRTDLYUHVXEK-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO Oc1cc2ccccc2cc1C[N@H+](C1CCC1)C1CCOCC1 ZINC001236835463 1055283675 /nfs/dbraw/zinc/28/36/75/1055283675.db2.gz MNZXMSHMESGKJB-UHFFFAOYSA-N 1 0 311.425 4.079 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cc3ccccc3cc2O)cc1 ZINC001236834579 1055283779 /nfs/dbraw/zinc/28/37/79/1055283779.db2.gz AKLBNNJWJAVKQV-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO COc1cccc2c1CC[N@H+](Cc1cc3ccccc3cc1O)C2 ZINC001236836400 1055284635 /nfs/dbraw/zinc/28/46/35/1055284635.db2.gz IEBPCLPOZHNFAM-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCc2c(F)cccc2C1 ZINC001236837029 1055287938 /nfs/dbraw/zinc/28/79/38/1055287938.db2.gz MCWKENWCWNIEKR-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC001236842832 1055289066 /nfs/dbraw/zinc/28/90/66/1055289066.db2.gz YUBXRORCEOMVAB-OAHLLOKOSA-N 1 0 309.331 4.320 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)c1 ZINC000764989809 1055306546 /nfs/dbraw/zinc/30/65/46/1055306546.db2.gz LZFYJOPQBPONFY-FQEVSTJZSA-N 1 0 312.457 4.392 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000765035176 1055316269 /nfs/dbraw/zinc/31/62/69/1055316269.db2.gz AOFZWVQWSUYKPR-INIZCTEOSA-N 1 0 312.457 4.392 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(O)c1 ZINC001237041395 1055345655 /nfs/dbraw/zinc/34/56/55/1055345655.db2.gz HYBZCCPLPFGPPE-SFHVURJKSA-N 1 0 315.388 4.267 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)Cc2ccc(F)cc2F)c(O)c1 ZINC001237056404 1055354036 /nfs/dbraw/zinc/35/40/36/1055354036.db2.gz YPBMRMHJLXBCHU-UHFFFAOYSA-N 1 0 305.368 4.426 20 10 DICDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001237052459 1055355718 /nfs/dbraw/zinc/35/57/18/1055355718.db2.gz ZWCFJWSERNPQIM-TXEJJXNPSA-N 1 0 317.351 4.096 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c(O)c1 ZINC001237053548 1055356124 /nfs/dbraw/zinc/35/61/24/1055356124.db2.gz MMVQKRMZWXJNDS-QGZVFWFLSA-N 1 0 310.441 4.290 20 10 DICDRO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001237052460 1055356549 /nfs/dbraw/zinc/35/65/49/1055356549.db2.gz ZWCFJWSERNPQIM-VXGBXAGGSA-N 1 0 317.351 4.096 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCOC3(CCCCC3)C2)c(O)c1 ZINC001237056275 1055356666 /nfs/dbraw/zinc/35/66/66/1055356666.db2.gz WGMWPAQNXALBSY-UHFFFAOYSA-N 1 0 303.446 4.051 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)cc1 ZINC000765332087 1055364643 /nfs/dbraw/zinc/36/46/43/1055364643.db2.gz PEDLKAWWMNXWIK-HXUWFJFHSA-N 1 0 312.457 4.392 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)cc1 ZINC000765332084 1055364738 /nfs/dbraw/zinc/36/47/38/1055364738.db2.gz PEDLKAWWMNXWIK-FQEVSTJZSA-N 1 0 312.457 4.392 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@H]3CCCC[C@H]3C)CC2)cc1 ZINC000765342422 1055365894 /nfs/dbraw/zinc/36/58/94/1055365894.db2.gz DDAPJWBWZNGIPV-IAGOWNOFSA-N 1 0 316.489 4.080 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@@H]3CCCC[C@@H]3C)CC2)cc1 ZINC000765342423 1055367271 /nfs/dbraw/zinc/36/72/71/1055367271.db2.gz DDAPJWBWZNGIPV-IRXDYDNUSA-N 1 0 316.489 4.080 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2ccccc2n1)c1ccc(N(C)C)cc1 ZINC000765348043 1055369645 /nfs/dbraw/zinc/36/96/45/1055369645.db2.gz IIOCWZXZMPHZPR-HNNXBMFYSA-N 1 0 305.425 4.152 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[NH+]1CC2(C1)CCCCC2 ZINC001237115447 1055376102 /nfs/dbraw/zinc/37/61/02/1055376102.db2.gz SWSDUAIEFDQPRB-UHFFFAOYSA-N 1 0 315.335 4.057 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(C)c(OC)c1)c1ccc(N(C)C)cc1 ZINC000765401619 1055378568 /nfs/dbraw/zinc/37/85/68/1055378568.db2.gz HHPOFDLLDILMIG-IBGZPJMESA-N 1 0 312.457 4.311 20 10 DICDRO Cc1cccc(C[N@@H+](C)Cc2cc(C(F)(F)F)ccc2O)c1 ZINC001237137956 1055380839 /nfs/dbraw/zinc/38/08/39/1055380839.db2.gz SVFVPDAUDBRJFI-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[NH+]1CCC2(CC[C@H](F)C2)CC1 ZINC001237131835 1055381856 /nfs/dbraw/zinc/38/18/56/1055381856.db2.gz XONGQZISERNNIF-NSHDSACASA-N 1 0 315.791 4.289 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CSCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000765423918 1055385061 /nfs/dbraw/zinc/38/50/61/1055385061.db2.gz JPZYMLIWCDRXPW-AUUYWEPGSA-N 1 0 312.482 4.391 20 10 DICDRO CCCCOCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765455686 1055395943 /nfs/dbraw/zinc/39/59/43/1055395943.db2.gz ZRTSAACGKHAMPL-KRWDZBQOSA-N 1 0 304.478 4.144 20 10 DICDRO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000765474875 1055398603 /nfs/dbraw/zinc/39/86/03/1055398603.db2.gz QZHDICFXDORZST-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ccc(N(C)C)cc1 ZINC000765462663 1055399548 /nfs/dbraw/zinc/39/95/48/1055399548.db2.gz DWFLTOHUJVEMGV-GOSISDBHSA-N 1 0 304.384 4.272 20 10 DICDRO C[C@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765482862 1055403638 /nfs/dbraw/zinc/40/36/38/1055403638.db2.gz WHKUNZSMDJJVBX-BTYIYWSLSA-N 1 0 306.453 4.092 20 10 DICDRO Cc1cccc(O)c1C[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC001237487119 1055458824 /nfs/dbraw/zinc/45/88/24/1055458824.db2.gz GRAAVDCSSZXIMX-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001237492421 1055461394 /nfs/dbraw/zinc/46/13/94/1055461394.db2.gz PBUABOGTWHOYRH-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC001237491650 1055461530 /nfs/dbraw/zinc/46/15/30/1055461530.db2.gz LNABKTRVJPTVCS-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cccc(-c3ccccc3)n1)CC2 ZINC001237553405 1055475033 /nfs/dbraw/zinc/47/50/33/1055475033.db2.gz ZBKCTUVRXDNUGT-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001237641025 1055490341 /nfs/dbraw/zinc/49/03/41/1055490341.db2.gz KPXUOQICNBEEIJ-IAGOWNOFSA-N 1 0 311.400 4.430 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001237641026 1055491556 /nfs/dbraw/zinc/49/15/56/1055491556.db2.gz KPXUOQICNBEEIJ-IRXDYDNUSA-N 1 0 311.400 4.430 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C[C@H]1F ZINC001237641702 1055491596 /nfs/dbraw/zinc/49/15/96/1055491596.db2.gz VTEGNRNIDUDAIO-FZKQIMNGSA-N 1 0 317.379 4.378 20 10 DICDRO CC1([NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)CCC1 ZINC001620865141 1055491757 /nfs/dbraw/zinc/49/17/57/1055491757.db2.gz BVBNOAKGALXTNZ-UHFFFAOYSA-N 1 0 306.453 4.282 20 10 DICDRO Cc1cc(O)c(C[NH+]2C3CCCC2CCC3)cc1Br ZINC001237686717 1055501746 /nfs/dbraw/zinc/50/17/46/1055501746.db2.gz XFDILUMYVLLVKC-UHFFFAOYSA-N 1 0 324.262 4.370 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+](C)CCC(=O)c2cccs2)c1O ZINC001237687495 1055501782 /nfs/dbraw/zinc/50/17/82/1055501782.db2.gz DVEISMSSIGBALT-UHFFFAOYSA-N 1 0 323.845 4.120 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)c1O ZINC001237690517 1055502524 /nfs/dbraw/zinc/50/25/24/1055502524.db2.gz YTKJQFSCUBGLGW-OKILXGFUSA-N 1 0 313.828 4.441 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC3(CCC(C)(C)O3)CC2)c1O ZINC001237687488 1055503679 /nfs/dbraw/zinc/50/36/79/1055503679.db2.gz DRFDPYUCEZOMOT-UHFFFAOYSA-N 1 0 323.864 4.278 20 10 DICDRO CCN(CC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C(C)C ZINC000765629141 1055527547 /nfs/dbraw/zinc/52/75/47/1055527547.db2.gz VSGPCNYQPMLVLU-GOSISDBHSA-N 1 0 317.521 4.058 20 10 DICDRO COc1cc(C[NH2+]CC2C(C)(C)C2(C)C)c(O)c(C(C)(C)C)c1 ZINC001620911048 1055535082 /nfs/dbraw/zinc/53/50/82/1055535082.db2.gz SWQNEMUEGQVZNC-UHFFFAOYSA-N 1 0 319.489 4.470 20 10 DICDRO COc1cc(C[NH2+]C(C)(C)C2CCC2)c(O)c(C(C)(C)C)c1 ZINC001620943010 1055557174 /nfs/dbraw/zinc/55/71/74/1055557174.db2.gz FQYORCPGAXIHJG-UHFFFAOYSA-N 1 0 305.462 4.367 20 10 DICDRO CCC[N@H+](CCc1ccccn1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237948329 1055562767 /nfs/dbraw/zinc/56/27/67/1055562767.db2.gz CREXTXRIQNLTTK-UHFFFAOYSA-N 1 0 322.811 4.034 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCCO3)CCC2 ZINC001620955283 1055576980 /nfs/dbraw/zinc/57/69/80/1055576980.db2.gz ZDDVVNBGWJQYOC-HXUWFJFHSA-N 1 0 307.437 4.487 20 10 DICDRO Cc1cc(F)cc(C[N@@H+](C)C(C)(C)Cc2ccccc2)c1O ZINC001238067909 1055601804 /nfs/dbraw/zinc/60/18/04/1055601804.db2.gz RRVCMVWSJMPHLE-UHFFFAOYSA-N 1 0 301.405 4.293 20 10 DICDRO Cc1c(C)c(C[N@@H+]2CCc3cccc(O)c3C2)ccc1Cl ZINC001238225259 1055625218 /nfs/dbraw/zinc/62/52/18/1055625218.db2.gz WLOPGYMUDUNGJQ-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)cnc1-c1ccccc1 ZINC001238613704 1055697852 /nfs/dbraw/zinc/69/78/52/1055697852.db2.gz AZPHKTDPOMNLTR-UHFFFAOYSA-N 1 0 318.420 4.395 20 10 DICDRO CC[C@@H](C[NH2+]Cc1cc(F)c(N(C)C)cc1F)CC(F)(F)F ZINC001620972650 1055784014 /nfs/dbraw/zinc/78/40/14/1055784014.db2.gz FXKYUDVZQWDBAW-SNVBAGLBSA-N 1 0 324.337 4.099 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H](C)CC(F)(F)F)cc1F ZINC001620973891 1055804901 /nfs/dbraw/zinc/80/49/01/1055804901.db2.gz USFCHLSLAAWIDO-GFCCVEGCSA-N 1 0 320.374 4.350 20 10 DICDRO Cc1ccc(F)cc1C[NH2+][C@H](C)Cc1ccc(N(C)C)cc1C ZINC001620974188 1055811764 /nfs/dbraw/zinc/81/17/64/1055811764.db2.gz DRFWCBPKLZHKAD-MRXNPFEDSA-N 1 0 314.448 4.229 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)cc1F ZINC001620974608 1055817016 /nfs/dbraw/zinc/81/70/16/1055817016.db2.gz RPIQIBQPPAQHSH-INIZCTEOSA-N 1 0 314.448 4.229 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1ccccc1Cl ZINC001620974679 1055817080 /nfs/dbraw/zinc/81/70/80/1055817080.db2.gz TXWHYUHSWGNSNX-OAHLLOKOSA-N 1 0 316.876 4.435 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc(O)cc1)c1ccc(N(C)C)cc1 ZINC000765770039 1055914609 /nfs/dbraw/zinc/91/46/09/1055914609.db2.gz VMMDBUJKNZTSTF-FOIQADDNSA-N 1 0 312.457 4.130 20 10 DICDRO C[C@H](CCc1ccccc1)C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001620751722 1055926436 /nfs/dbraw/zinc/92/64/36/1055926436.db2.gz BBCZZJBJOVAGLI-GOSISDBHSA-N 1 0 322.496 4.428 20 10 DICDRO Fc1ccccc1-c1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)o1 ZINC001620760707 1055931292 /nfs/dbraw/zinc/93/12/92/1055931292.db2.gz OUBVHGRZBAOONG-UHFFFAOYSA-N 1 0 323.367 4.310 20 10 DICDRO C[C@H]([NH2+]CCc1csc(C(C)(C)C)n1)c1cc(F)ccc1O ZINC000186202194 1055935329 /nfs/dbraw/zinc/93/53/29/1055935329.db2.gz MZJJHUNHGAFBHL-NSHDSACASA-N 1 0 322.449 4.179 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cccc(N(C)C)c2)cc1C ZINC001620776209 1055943303 /nfs/dbraw/zinc/94/33/03/1055943303.db2.gz LQRRYFHDKCVNGE-UHFFFAOYSA-N 1 0 312.457 4.140 20 10 DICDRO C[C@@H]([NH2+]Cc1c(Cl)ccc2cccnc21)c1ccccc1O ZINC001620504414 1055959452 /nfs/dbraw/zinc/95/94/52/1055959452.db2.gz QWGKQUFYHURMFW-GFCCVEGCSA-N 1 0 312.800 4.445 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@@H]3CCC[C@H](C(C)C)C3)C2)cc1 ZINC001621001527 1055969579 /nfs/dbraw/zinc/96/95/79/1055969579.db2.gz PLQFXAFAZMYXCX-KSZLIROESA-N 1 0 316.489 4.078 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C1CCC(OC(C)C)CC1 ZINC001621013770 1055979709 /nfs/dbraw/zinc/97/97/09/1055979709.db2.gz RKPYPGVUQZTKGJ-UHFFFAOYSA-N 1 0 314.473 4.313 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CC(C2CCC2)C2CCC2)cc1F ZINC001621016937 1055982840 /nfs/dbraw/zinc/98/28/40/1055982840.db2.gz DAXOZQLUUWELAC-UHFFFAOYSA-N 1 0 322.443 4.337 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCCO[C@@H]1C(C)C ZINC001620818768 1056100813 /nfs/dbraw/zinc/10/08/13/1056100813.db2.gz FJSSCGUYVUCOIX-OXJNMPFZSA-N 1 0 314.473 4.028 20 10 DICDRO C[C@@H]([NH2+]CCOCC1CCC1)c1ccc(N2CCCCC2)cc1 ZINC000765810122 1056148547 /nfs/dbraw/zinc/14/85/47/1056148547.db2.gz QFTKJOUCRFZBDO-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)CCC2 ZINC000765817519 1056178568 /nfs/dbraw/zinc/17/85/68/1056178568.db2.gz LWJKUBQABYKNFI-LRDDRELGSA-N 1 0 317.408 4.037 20 10 DICDRO CN(c1ccc(C[NH2+]C[C@H]2CCSC2)cc1)C1CCCCC1 ZINC000785442778 1056187332 /nfs/dbraw/zinc/18/73/32/1056187332.db2.gz VFDOMGUIYIULJL-QGZVFWFLSA-N 1 0 318.530 4.298 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000186423239 1056200355 /nfs/dbraw/zinc/20/03/55/1056200355.db2.gz TXSFGOGCSSJSIC-QSFXBCCZSA-N 1 0 312.457 4.124 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)c(O)c1 ZINC000765824674 1056275562 /nfs/dbraw/zinc/27/55/62/1056275562.db2.gz VVOCFCGBODEKCV-WMLDXEAASA-N 1 0 313.445 4.206 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000765851350 1056327270 /nfs/dbraw/zinc/32/72/70/1056327270.db2.gz ZORJQNLZCMTIFA-MRXNPFEDSA-N 1 0 311.473 4.060 20 10 DICDRO CN(C)c1ccc(C[N@H+](C[C@H]2CCC(F)(F)C2)C2CC2)cc1 ZINC001615219670 1056478032 /nfs/dbraw/zinc/47/80/32/1056478032.db2.gz PHFYKYLAWOQPIT-HNNXBMFYSA-N 1 0 308.416 4.152 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(F)cc1F ZINC001615219646 1056478316 /nfs/dbraw/zinc/47/83/16/1056478316.db2.gz OHLBQSLKODMRNK-UHFFFAOYSA-N 1 0 318.411 4.441 20 10 DICDRO Cc1csc([C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)n1 ZINC000921782026 1056488188 /nfs/dbraw/zinc/48/81/88/1056488188.db2.gz CHVLGEIIZUNANG-KRWDZBQOSA-N 1 0 314.454 4.017 20 10 DICDRO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001615363828 1056499008 /nfs/dbraw/zinc/49/90/08/1056499008.db2.gz XKTYJDULTWMBKU-LJQANCHMSA-N 1 0 308.469 4.359 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@@H]1CC[C@@H](C2CC2)O1)C1CCCC1 ZINC001615466348 1056514353 /nfs/dbraw/zinc/51/43/53/1056514353.db2.gz XNCGVSHEYWNKHV-ICSRJNTNSA-N 1 0 315.457 4.094 20 10 DICDRO CC[C@H](C)[C@@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765943212 1056538148 /nfs/dbraw/zinc/53/81/48/1056538148.db2.gz ACXZSOAKMJKBCV-ZWOKBUDYSA-N 1 0 318.505 4.125 20 10 DICDRO CC[C@H](C)[C@@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765943206 1056538159 /nfs/dbraw/zinc/53/81/59/1056538159.db2.gz ACXZSOAKMJKBCV-QKLQHJQFSA-N 1 0 318.505 4.125 20 10 DICDRO CC[C@H](C)[C@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765943203 1056538301 /nfs/dbraw/zinc/53/83/01/1056538301.db2.gz ACXZSOAKMJKBCV-ABSDTBQOSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccnc(Cl)c1 ZINC000132244160 1056827381 /nfs/dbraw/zinc/82/73/81/1056827381.db2.gz XGQXPGIBNGWYLL-JTQLQIEISA-N 1 0 313.879 4.025 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](c2ccccn2)C2CC2)cc1C ZINC000922583615 1057034933 /nfs/dbraw/zinc/03/49/33/1057034933.db2.gz ZBGSROMUPYHZQC-HXUWFJFHSA-N 1 0 310.441 4.420 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)c1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000186568485 1057051318 /nfs/dbraw/zinc/05/13/18/1057051318.db2.gz AWHHJRZPHAHDGL-GUYCJALGSA-N 1 0 317.502 4.362 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1Cc2cccc(Cl)c2C1 ZINC001168739756 1057103960 /nfs/dbraw/zinc/10/39/60/1057103960.db2.gz PKQHAZJVBHPLSF-HNNXBMFYSA-N 1 0 301.817 4.035 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CSCc2ccccc21 ZINC000766030966 1057134958 /nfs/dbraw/zinc/13/49/58/1057134958.db2.gz YHCDHMLKEQTFDK-LJQANCHMSA-N 1 0 312.482 4.139 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CSCc2ccccc21 ZINC000766030951 1057135044 /nfs/dbraw/zinc/13/50/44/1057135044.db2.gz YHCDHMLKEQTFDK-IBGZPJMESA-N 1 0 312.482 4.139 20 10 DICDRO COc1cc(C)ccc1[C@H](C)[NH2+]CCCSc1nccs1 ZINC000766073649 1057285948 /nfs/dbraw/zinc/28/59/48/1057285948.db2.gz SBSXOWFFRXNWSO-ZDUSSCGKSA-N 1 0 322.499 4.293 20 10 DICDRO CSCC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766083883 1057302045 /nfs/dbraw/zinc/30/20/45/1057302045.db2.gz QMXFFFAZHLGYTE-HOTGVXAUSA-N 1 0 306.519 4.469 20 10 DICDRO Oc1ccc(Br)cc1C[NH+]1C2CCCC1CCC2 ZINC000707154076 1057490816 /nfs/dbraw/zinc/49/08/16/1057490816.db2.gz CFOXXILIQBRGQP-UHFFFAOYSA-N 1 0 310.235 4.062 20 10 DICDRO Cc1cc(C)cc(C[NH2+]Cc2cc(Br)ccc2O)c1 ZINC000710481275 1057502283 /nfs/dbraw/zinc/50/22/83/1057502283.db2.gz IJCYBNLZDMKMPM-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)C3CCCCC3)CC2)cc1 ZINC000766153139 1057514424 /nfs/dbraw/zinc/51/44/24/1057514424.db2.gz DODZBCALJGISHO-INIZCTEOSA-N 1 0 316.489 4.222 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)cc1C ZINC000074230624 1057553956 /nfs/dbraw/zinc/55/39/56/1057553956.db2.gz CVYXQYBNRGIBFD-CYBMUJFWSA-N 1 0 321.367 4.456 20 10 DICDRO CCOc1ccc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)c(O)c1 ZINC000727471869 1057653832 /nfs/dbraw/zinc/65/38/32/1057653832.db2.gz PANDAOLLTHZOLH-UHFFFAOYSA-N 1 0 319.832 4.469 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000727825929 1057675589 /nfs/dbraw/zinc/67/55/89/1057675589.db2.gz CUCPATVBIJVHIF-IBGZPJMESA-N 1 0 323.436 4.227 20 10 DICDRO CCC[N@H+](CCOc1ccccc1Cl)Cc1ccccc1O ZINC000727831175 1057676920 /nfs/dbraw/zinc/67/69/20/1057676920.db2.gz MCCYWRSLVKXDBO-UHFFFAOYSA-N 1 0 319.832 4.337 20 10 DICDRO CCC[N@@H+](Cc1c(O)ccc2ccccc21)C[C@H]1CCCCO1 ZINC000730255395 1057709819 /nfs/dbraw/zinc/70/98/19/1057709819.db2.gz GLKCFKUEDIKMSA-QGZVFWFLSA-N 1 0 313.441 4.327 20 10 DICDRO Fc1cccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)c1F ZINC000731450132 1057743725 /nfs/dbraw/zinc/74/37/25/1057743725.db2.gz FLABNLATQABADU-UHFFFAOYSA-N 1 0 316.395 4.245 20 10 DICDRO C[N@H+](CCc1ccccc1F)Cc1c(O)ccc2ccccc21 ZINC000731661690 1057750818 /nfs/dbraw/zinc/75/08/18/1057750818.db2.gz VHVNPGOVNLJSSX-UHFFFAOYSA-N 1 0 309.384 4.359 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1CC(c2cccc(F)c2)C1 ZINC000731679084 1057752057 /nfs/dbraw/zinc/75/20/57/1057752057.db2.gz YJOYTMPZZJFBGO-UHFFFAOYSA-N 1 0 305.780 4.221 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1nc2ccccc2o1)C1CCCC1 ZINC000731847220 1057755826 /nfs/dbraw/zinc/75/58/26/1057755826.db2.gz GZLGHFADVBYSAT-UHFFFAOYSA-N 1 0 322.408 4.478 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CC[C@@H](c4ccco4)C3)c2c1 ZINC000732181093 1057769780 /nfs/dbraw/zinc/76/97/80/1057769780.db2.gz GOJOBTWRRCFCKJ-OAHLLOKOSA-N 1 0 323.392 4.137 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1Cl ZINC000732919426 1057791023 /nfs/dbraw/zinc/79/10/23/1057791023.db2.gz GCHZWQLMOVJYJO-GFCCVEGCSA-N 1 0 317.816 4.134 20 10 DICDRO CN(C)c1ccc(CNc2cc[nH+]c3cc(F)ccc23)cc1F ZINC000733300128 1057811144 /nfs/dbraw/zinc/81/11/44/1057811144.db2.gz NNNQUQVZTIRDLG-UHFFFAOYSA-N 1 0 313.351 4.191 20 10 DICDRO Cc1ccc(O)c(C[NH2+]CCc2cc(Cl)cc(Cl)c2)c1 ZINC000733325935 1057813252 /nfs/dbraw/zinc/81/32/52/1057813252.db2.gz ZJVHFECWEVVSOU-UHFFFAOYSA-N 1 0 310.224 4.340 20 10 DICDRO CC(C)(C[NH2+]Cc1c(O)cccc1Cl)c1ccccc1F ZINC000733327499 1057813918 /nfs/dbraw/zinc/81/39/18/1057813918.db2.gz SFGTVWRQYXHJHV-UHFFFAOYSA-N 1 0 307.796 4.252 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000733326281 1057814065 /nfs/dbraw/zinc/81/40/65/1057814065.db2.gz UHDNLIMTXNSJHK-CYBMUJFWSA-N 1 0 323.358 4.440 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCCc1cccc(Cl)c1 ZINC000733328655 1057814152 /nfs/dbraw/zinc/81/41/52/1057814152.db2.gz YPWQFXTVNQBCDT-UHFFFAOYSA-N 1 0 310.224 4.421 20 10 DICDRO Nc1ccc(C[NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)cc1 ZINC001246168017 1058711885 /nfs/dbraw/zinc/71/18/85/1058711885.db2.gz CHSBDOWVJZYQIN-HNNXBMFYSA-N 1 0 321.251 4.223 20 10 DICDRO C[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCc1ccc(N)cc1 ZINC001246462524 1058949229 /nfs/dbraw/zinc/94/92/29/1058949229.db2.gz APOBJXDXIDOFCJ-ZDUSSCGKSA-N 1 0 320.889 4.235 20 10 DICDRO CN(C)c1ccc(C[N@H+](C[C@H]2C[C@@H]3[C@H](C2)C3(F)F)C2CC2)cc1 ZINC001559492169 1059270980 /nfs/dbraw/zinc/27/09/80/1059270980.db2.gz HEMCBOZMCMQMRI-GBEXYDAJSA-N 1 0 320.427 4.008 20 10 DICDRO CC[N@H+](CCC(C)(C)C)Cc1cc(Br)ccc1O ZINC001559568971 1059398679 /nfs/dbraw/zinc/39/86/79/1059398679.db2.gz LEBPFPCLKJAVLV-UHFFFAOYSA-N 1 0 314.267 4.413 20 10 DICDRO COc1ccc(N(C)C[C@@H]2CCCC[N@@H+]2C(C)C)cc1Cl ZINC001559624289 1059452585 /nfs/dbraw/zinc/45/25/85/1059452585.db2.gz DWTZYWDAFQTYPP-HNNXBMFYSA-N 1 0 310.869 4.048 20 10 DICDRO CCCOc1ccc2c(c1)CC[N@@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001559664333 1059492595 /nfs/dbraw/zinc/49/25/95/1059492595.db2.gz CMPWRWJBFPMVOG-UHFFFAOYSA-N 1 0 324.468 4.100 20 10 DICDRO Cc1cc(C[N@H+](C)CCc2ccc(Cl)cc2)ccc1N(C)C ZINC001559706480 1059536092 /nfs/dbraw/zinc/53/60/92/1059536092.db2.gz QRRQNJPWKVUGSJ-UHFFFAOYSA-N 1 0 316.876 4.389 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)c(C)c1)[C@H]1CCCO1 ZINC001559738034 1059569406 /nfs/dbraw/zinc/56/94/06/1059569406.db2.gz UHDOAVMJQSDPGY-UYAOXDASSA-N 1 0 316.489 4.033 20 10 DICDRO CCC(CC)(CCO)[NH2+]Cc1ccc(N2CCCCC2)c(C)c1 ZINC001559782482 1059619151 /nfs/dbraw/zinc/61/91/51/1059619151.db2.gz PKVYFVUJLKVKNL-UHFFFAOYSA-N 1 0 318.505 4.016 20 10 DICDRO CCc1ccc([C@H]2CC[N@H+](Cc3ccc(N(C)C)cc3)C2)cc1 ZINC001559871641 1059693275 /nfs/dbraw/zinc/69/32/75/1059693275.db2.gz ZZHPDYHOXCXQQO-FQEVSTJZSA-N 1 0 308.469 4.305 20 10 DICDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001560129573 1059929986 /nfs/dbraw/zinc/92/99/86/1059929986.db2.gz YEIVMRMCFMHOSS-OAHLLOKOSA-N 1 0 300.421 4.359 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2Cc3ccccc3OC3(CCC3)C2)cc1 ZINC001560134394 1059939652 /nfs/dbraw/zinc/93/96/52/1059939652.db2.gz DMBIFVCRPDIYDB-UHFFFAOYSA-N 1 0 322.452 4.070 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(O)cc(Cl)c2)cc1 ZINC001560274187 1060050284 /nfs/dbraw/zinc/05/02/84/1060050284.db2.gz GIKKRAKGLXPLED-UHFFFAOYSA-N 1 0 318.848 4.182 20 10 DICDRO CC(C)Oc1ccccc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001560284230 1060059927 /nfs/dbraw/zinc/05/99/27/1060059927.db2.gz JGGRWSAAYLYSJP-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2c(F)cccc2Cl)cc1 ZINC001560297387 1060080378 /nfs/dbraw/zinc/08/03/78/1060080378.db2.gz BNUWWPRPKAAXHU-PLNGDYQASA-N 1 0 318.823 4.348 20 10 DICDRO CCN(C)c1ccccc1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001560315060 1060102537 /nfs/dbraw/zinc/10/25/37/1060102537.db2.gz SWURCSPBFNRZCK-UHFFFAOYSA-N 1 0 323.484 4.033 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001560321958 1060109218 /nfs/dbraw/zinc/10/92/18/1060109218.db2.gz JQOFFFZMMPLVIS-IBGZPJMESA-N 1 0 323.436 4.187 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccccc2N(C)C)cc1C ZINC001560347591 1060133096 /nfs/dbraw/zinc/13/30/96/1060133096.db2.gz QLCBVGYFSFJNEQ-UHFFFAOYSA-N 1 0 312.457 4.140 20 10 DICDRO Cc1cccc([C@@H](C)C[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC001560348240 1060135961 /nfs/dbraw/zinc/13/59/61/1060135961.db2.gz QSSIODRINQELDV-AWEZNQCLSA-N 1 0 318.411 4.233 20 10 DICDRO Oc1cccc(Br)c1C[NH2+][C@@H]1C[C@@H]1C1CCCCC1 ZINC001560359350 1060145712 /nfs/dbraw/zinc/14/57/12/1060145712.db2.gz JDQLEFYLYGHFRG-IUODEOHRSA-N 1 0 324.262 4.213 20 10 DICDRO CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001560370132 1060157512 /nfs/dbraw/zinc/15/75/12/1060157512.db2.gz WZEFTZJAHTVDRN-RTBURBONSA-N 1 0 318.530 4.441 20 10 DICDRO Cc1cnc(C(C)(C)[NH2+]Cc2c(C)c3ccccc3n2C)s1 ZINC001560370277 1060158210 /nfs/dbraw/zinc/15/82/10/1060158210.db2.gz CGNXTRPIJFOWEZ-UHFFFAOYSA-N 1 0 313.470 4.277 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@]2(C)CCCS2)cc1F ZINC001560394571 1060181600 /nfs/dbraw/zinc/18/16/00/1060181600.db2.gz DRNXJCGJMJWKPX-QGZVFWFLSA-N 1 0 310.482 4.047 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCCC(F)(F)CC3)ccc2O1 ZINC001249223441 1060192817 /nfs/dbraw/zinc/19/28/17/1060192817.db2.gz GMAMKXVKAHCFIA-UHFFFAOYSA-N 1 0 323.383 4.198 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCC[C@@](C)(F)CC3)ccc2O1 ZINC001249223138 1060193187 /nfs/dbraw/zinc/19/31/87/1060193187.db2.gz AFJFUTFQFRPCIG-LJQANCHMSA-N 1 0 319.420 4.291 20 10 DICDRO CC(C)Cc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cn1 ZINC001560445309 1060237324 /nfs/dbraw/zinc/23/73/24/1060237324.db2.gz RADOFMHZQNQWQF-MRXNPFEDSA-N 1 0 311.473 4.197 20 10 DICDRO C[C@H]1CC[C@H]1[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560466077 1060258540 /nfs/dbraw/zinc/25/85/40/1060258540.db2.gz SKYNBSJTWGBTAF-OXJNMPFZSA-N 1 0 306.453 4.137 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2C[C@H](C)O[C@@H]2C)cc1 ZINC001560508002 1060303922 /nfs/dbraw/zinc/30/39/22/1060303922.db2.gz IGHOOXJSOOIYMF-SCTDSRPQSA-N 1 0 318.505 4.216 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1ccc(F)cc1F ZINC001560508532 1060307219 /nfs/dbraw/zinc/30/72/19/1060307219.db2.gz ZRBRDGQBWCRFNM-AWEZNQCLSA-N 1 0 318.411 4.060 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](COC)CC(C)(C)C)cc1F ZINC001560517352 1060316466 /nfs/dbraw/zinc/31/64/66/1060316466.db2.gz JTJKYLYRFJELIY-MRXNPFEDSA-N 1 0 324.484 4.213 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1c(O)cc(C)cc1Cl)CC2 ZINC001560521345 1060320322 /nfs/dbraw/zinc/32/03/22/1060320322.db2.gz BSCJYXCFRSGDOA-QGZVFWFLSA-N 1 0 301.817 4.440 20 10 DICDRO CC[C@@H]1CCC[C@@H](C[NH2+][C@H]2CCN(c3ccc(OC)cc3)C2)C1 ZINC001560529135 1060329788 /nfs/dbraw/zinc/32/97/88/1060329788.db2.gz SSJDGGAPLUNVCS-KURKYZTESA-N 1 0 316.489 4.080 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C2CCC2)[C@H]2CCCO2)cc1C ZINC001560547842 1060357664 /nfs/dbraw/zinc/35/76/64/1060357664.db2.gz STNUCPUCBSKVTE-UXHICEINSA-N 1 0 317.473 4.221 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cccc(F)c2F)cc1C ZINC001560550446 1060360691 /nfs/dbraw/zinc/36/06/91/1060360691.db2.gz RCAJIEBYPLKZLO-UHFFFAOYSA-N 1 0 305.368 4.352 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)cc1 ZINC001560568591 1060377984 /nfs/dbraw/zinc/37/79/84/1060377984.db2.gz UBUQZFBLGVZYKS-GFXBWGLESA-N 1 0 324.443 4.381 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(Br)c1F)c1ccccc1O ZINC001560575445 1060387448 /nfs/dbraw/zinc/38/74/48/1060387448.db2.gz KYQSVDHTAJRCOK-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO CCC[C@H](C)CC[NH2+]Cc1c(O)cccc1Br ZINC001560573462 1060388570 /nfs/dbraw/zinc/38/85/70/1060388570.db2.gz TYLHSIPVRUFZTI-NSHDSACASA-N 1 0 300.240 4.071 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCSC(C)(C)C2)cc1 ZINC001560602482 1060416722 /nfs/dbraw/zinc/41/67/22/1060416722.db2.gz RKBBYAFEPOOMCX-SQRWCISFSA-N 1 0 304.503 4.030 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCc3ccccc3[C@@H]2C(C)C)c1 ZINC001560637732 1060451028 /nfs/dbraw/zinc/45/10/28/1060451028.db2.gz NJJHYORRNRHCSU-FQEVSTJZSA-N 1 0 311.425 4.156 20 10 DICDRO C[C@@H]1C[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@@H]2CCCC[C@@H]21 ZINC001560705680 1060560794 /nfs/dbraw/zinc/56/07/94/1060560794.db2.gz ORUCOUQPMSMLPZ-SUYBPPKGSA-N 1 0 308.416 4.041 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001560708808 1060565586 /nfs/dbraw/zinc/56/55/86/1060565586.db2.gz SCJDVVAPWIGPFM-SFHVURJKSA-N 1 0 315.363 4.396 20 10 DICDRO COc1ccc(C[NH+](CCC(C)C)CCC(C)C)c(O)c1OC ZINC001560715852 1060572948 /nfs/dbraw/zinc/57/29/48/1060572948.db2.gz ZMWQBLPUMMNTSD-UHFFFAOYSA-N 1 0 323.477 4.304 20 10 DICDRO Cc1ccc(C[N@@H+](C/C=C/c2ccc(N(C)C)cc2)C2CC2)o1 ZINC001560718575 1060576695 /nfs/dbraw/zinc/57/66/95/1060576695.db2.gz XSISKVIIJPSRCE-SNAWJCMRSA-N 1 0 310.441 4.332 20 10 DICDRO Cc1ccc(C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)C2CC2)o1 ZINC001560718574 1060576738 /nfs/dbraw/zinc/57/67/38/1060576738.db2.gz XSISKVIIJPSRCE-PLNGDYQASA-N 1 0 310.441 4.332 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H]2Cc2ccccc2)cc1 ZINC001560728622 1060591709 /nfs/dbraw/zinc/59/17/09/1060591709.db2.gz ZIXFBXRJXLKTQJ-LPLSSMDUSA-N 1 0 320.480 4.473 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H]2Cc2ccccc2)cc1 ZINC001560728621 1060592733 /nfs/dbraw/zinc/59/27/33/1060592733.db2.gz ZIXFBXRJXLKTQJ-FLVSMNSFSA-N 1 0 320.480 4.473 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@@H](OC(C)C)C2(C)C)cc1Cl ZINC001560737118 1060606393 /nfs/dbraw/zinc/60/63/93/1060606393.db2.gz SQTWBPCLOVFDJR-HZPDHXFCSA-N 1 0 311.853 4.036 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)c(O)c1 ZINC001560803229 1060664302 /nfs/dbraw/zinc/66/43/02/1060664302.db2.gz PMVXKTVOODIHKL-UHFFFAOYSA-N 1 0 311.356 4.390 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c1 ZINC001560815078 1060675400 /nfs/dbraw/zinc/67/54/00/1060675400.db2.gz QDFKHCUWGWNAGW-CAOSSQGBSA-N 1 0 303.446 4.410 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@]2(C)CC(C)C)c1O ZINC001560845471 1060703217 /nfs/dbraw/zinc/70/32/17/1060703217.db2.gz VHSGVUNJFVVVPL-KRWDZBQOSA-N 1 0 311.853 4.455 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@@H](C)Cc2cccc(F)c2)c1O ZINC001560879661 1060740806 /nfs/dbraw/zinc/74/08/06/1060740806.db2.gz HJMXMVLMLVJQSE-AWEZNQCLSA-N 1 0 301.405 4.157 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H]1CC[C@@H]2CCC[C@H]12 ZINC001560890783 1060754927 /nfs/dbraw/zinc/75/49/27/1060754927.db2.gz QMKRFBRCCRQCQG-GIYDNNGJSA-N 1 0 300.490 4.160 20 10 DICDRO Nc1ccc(N(c2ccccc2)c2ccc3c[nH+]cn3c2)cc1 ZINC001250331074 1060782853 /nfs/dbraw/zinc/78/28/53/1060782853.db2.gz HPOYMIZAKDPKEN-UHFFFAOYSA-N 1 0 300.365 4.386 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc3occc3c2)cc1Cl ZINC001560924083 1060789115 /nfs/dbraw/zinc/78/91/15/1060789115.db2.gz YGNCTNGGKVTFIL-UHFFFAOYSA-N 1 0 301.773 4.390 20 10 DICDRO CCc1cccc(C[N@@H+]2CCc3ccccc3C(C)(C)C2)c1O ZINC001560929832 1060792782 /nfs/dbraw/zinc/79/27/82/1060792782.db2.gz KETPRGIWCKVXJY-UHFFFAOYSA-N 1 0 309.453 4.291 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H](C)Cc2ccccc2C(F)(F)F)c1 ZINC001560937405 1060798404 /nfs/dbraw/zinc/79/84/04/1060798404.db2.gz CZPUMFPHZNKEIJ-ZDUSSCGKSA-N 1 0 323.358 4.440 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccc2c(c1)CCCO2 ZINC001560940170 1060801496 /nfs/dbraw/zinc/80/14/96/1060801496.db2.gz FCXQEGRLIZLYIC-INIZCTEOSA-N 1 0 324.468 4.237 20 10 DICDRO CCO[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2O)C12CCCCC2 ZINC001560971190 1060835079 /nfs/dbraw/zinc/83/50/79/1060835079.db2.gz VVRZIUPZCUEEHI-QGTPRVQTSA-N 1 0 303.446 4.171 20 10 DICDRO Cc1cc(F)c(C[NH2+]Cc2cc(Cl)c(C)cc2O)c(F)c1 ZINC001561020034 1060878278 /nfs/dbraw/zinc/87/82/78/1060878278.db2.gz UYNGTAJVWUPWBQ-UHFFFAOYSA-N 1 0 311.759 4.230 20 10 DICDRO COc1ccc(O)c(C[N@H+]2CC=C(c3cccc(C)c3C)CC2)c1 ZINC001561043256 1060895448 /nfs/dbraw/zinc/89/54/48/1060895448.db2.gz UAMLQNFACJEBNI-UHFFFAOYSA-N 1 0 323.436 4.307 20 10 DICDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001462134396 1060955566 /nfs/dbraw/zinc/95/55/66/1060955566.db2.gz BYJLGBATKYOKEJ-SUMWQHHRSA-N 1 0 305.462 4.319 20 10 DICDRO Cc1cc(F)cc2c1C[N@H+](Cc1ccc(Cl)cc1O)CC2 ZINC001462153030 1060973267 /nfs/dbraw/zinc/97/32/67/1060973267.db2.gz ZVRURUIFSXKFCI-UHFFFAOYSA-N 1 0 305.780 4.051 20 10 DICDRO Cc1ccc(CNc2ccc(Cl)c(C[NH+](C)C)c2)c(O)c1 ZINC001462159239 1060983034 /nfs/dbraw/zinc/98/30/34/1060983034.db2.gz UUZPZKGDDODGGT-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO Cc1ccc(F)c(CN(C)Cc2c(O)cc(C)cc2Cl)c1 ZINC001462168957 1060987809 /nfs/dbraw/zinc/98/78/09/1060987809.db2.gz VGGPWOHWAKCNDZ-UHFFFAOYSA-N 1 0 307.796 4.434 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CCC(c3ccncc3)CC2)c1 ZINC001462208207 1061027437 /nfs/dbraw/zinc/02/74/37/1061027437.db2.gz BMAJFSCUVZIFIO-UHFFFAOYSA-N 1 0 310.441 4.290 20 10 DICDRO Cc1ccc(CCC[N@@H+](C)Cc2ccc(N3CCCC3)cc2)cn1 ZINC001462206921 1061027912 /nfs/dbraw/zinc/02/79/12/1061027912.db2.gz OZTIWPCFLGXULC-UHFFFAOYSA-N 1 0 323.484 4.055 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CC(c3ccc(C)cc3)C2)c1 ZINC001462205638 1061028160 /nfs/dbraw/zinc/02/81/60/1061028160.db2.gz GBPBNIOSVAOTMZ-OOHWJJMZSA-N 1 0 311.425 4.306 20 10 DICDRO COc1cccc(C2([NH2+]Cc3cc(C(C)C)ccc3O)CC2)c1 ZINC001462224409 1061039513 /nfs/dbraw/zinc/03/95/13/1061039513.db2.gz VTXUGSFURSYNNJ-UHFFFAOYSA-N 1 0 311.425 4.303 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)c(O)c1 ZINC001462224625 1061041180 /nfs/dbraw/zinc/04/11/80/1061041180.db2.gz WTOMLDAANSEOSU-UHFFFAOYSA-N 1 0 311.425 4.312 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@@H](c3ccccc3F)C2)cc1 ZINC001462272918 1061066391 /nfs/dbraw/zinc/06/63/91/1061066391.db2.gz OJEBCDHWAQICEX-OOFWQKGWSA-N 1 0 324.443 4.394 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCCCC(F)(F)C1 ZINC001462275781 1061068621 /nfs/dbraw/zinc/06/86/21/1061068621.db2.gz MSXBOCRXFBPNIJ-HNNXBMFYSA-N 1 0 310.432 4.366 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@@H](C(C)(C)C)C[C@@H]2C)cc1OC ZINC001462315174 1061101017 /nfs/dbraw/zinc/10/10/17/1061101017.db2.gz NKGMWSURHYLTBL-DZGCQCFKSA-N 1 0 321.461 4.056 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CC3(CCCCC3)[C@@H]2C(C)C)c(O)c1 ZINC001462327610 1061106240 /nfs/dbraw/zinc/10/62/40/1061106240.db2.gz BGJOGODLENZESP-IBGZPJMESA-N 1 0 317.473 4.500 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@]2(C)CC=CCC2)c(C(F)(F)F)c1 ZINC001462343940 1061119536 /nfs/dbraw/zinc/11/95/36/1061119536.db2.gz RXNDVOQWJSKJAD-MRXNPFEDSA-N 1 0 312.379 4.360 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC001462355548 1061126646 /nfs/dbraw/zinc/12/66/46/1061126646.db2.gz KZBYEEWXQUSRIN-RIVXBTQJSA-N 1 0 302.506 4.406 20 10 DICDRO C[C@@H]([NH2+]CCc1c(F)cccc1Cl)c1ccc(N(C)C)cc1 ZINC001473400322 1061137171 /nfs/dbraw/zinc/13/71/71/1061137171.db2.gz PJFCWUWOZVOHAS-CYBMUJFWSA-N 1 0 320.839 4.438 20 10 DICDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC001462392801 1061145613 /nfs/dbraw/zinc/14/56/13/1061145613.db2.gz HIIXVRZIGVHXCV-CHWSQXEVSA-N 1 0 319.832 4.336 20 10 DICDRO CC(C)[C@@H]1[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC12CC=CC2 ZINC001462395329 1061148316 /nfs/dbraw/zinc/14/83/16/1061148316.db2.gz NCNPLQQUMRSUMU-AQWUKCDYSA-N 1 0 310.485 4.442 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)c(O)c1 ZINC001462402084 1061151893 /nfs/dbraw/zinc/15/18/93/1061151893.db2.gz FOEIOPWXMOLKLW-INIZCTEOSA-N 1 0 315.388 4.232 20 10 DICDRO CCCC[N@H+](CCSc1ccncc1)Cc1ccccc1O ZINC001473423955 1061153380 /nfs/dbraw/zinc/15/33/80/1061153380.db2.gz GLSIGENFNFVNFO-UHFFFAOYSA-N 1 0 316.470 4.182 20 10 DICDRO CCc1cccc(C[NH2+]CCO[C@H](CC)c2ccccc2)c1O ZINC001462407029 1061154729 /nfs/dbraw/zinc/15/47/29/1061154729.db2.gz AHOCVDYWFPPLRC-LJQANCHMSA-N 1 0 313.441 4.212 20 10 DICDRO CCc1cccc(C[NH2+]CCO[C@@H](CC)c2ccccc2)c1O ZINC001462407028 1061154843 /nfs/dbraw/zinc/15/48/43/1061154843.db2.gz AHOCVDYWFPPLRC-IBGZPJMESA-N 1 0 313.441 4.212 20 10 DICDRO COc1cc(O)c(C[N@H+](C)C[C@H](C)C2CCCCC2)cc1OC ZINC001462494578 1061209408 /nfs/dbraw/zinc/20/94/08/1061209408.db2.gz KDUFXQZZXKOUGT-AWEZNQCLSA-N 1 0 321.461 4.058 20 10 DICDRO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001462560868 1061260774 /nfs/dbraw/zinc/26/07/74/1061260774.db2.gz FQGNTZSMYQCMSR-MRXNPFEDSA-N 1 0 309.331 4.320 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2csc3ccccc32)c1 ZINC001462646543 1061315679 /nfs/dbraw/zinc/31/56/79/1061315679.db2.gz BMTLVVFNAYSBRH-LBPRGKRZSA-N 1 0 313.422 4.466 20 10 DICDRO Cc1ccc(Cl)cc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC001462649996 1061317347 /nfs/dbraw/zinc/31/73/47/1061317347.db2.gz YQQYVVRNHJJADH-UHFFFAOYSA-N 1 0 302.849 4.313 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCO[C@H](c2ccccc2)CC1 ZINC001462679057 1061333732 /nfs/dbraw/zinc/33/37/32/1061333732.db2.gz RUFCTYBENMASAP-SFHVURJKSA-N 1 0 317.816 4.009 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)c1ccc(Cl)cc1 ZINC001473951321 1061493775 /nfs/dbraw/zinc/49/37/75/1061493775.db2.gz ZUDUOEXYIPZXHE-UHFFFAOYSA-N 1 0 315.844 4.342 20 10 DICDRO CC(C)(CC[NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1 ZINC001473955854 1061496763 /nfs/dbraw/zinc/49/67/63/1061496763.db2.gz SDZUVOCWHZJVDB-UHFFFAOYSA-N 1 0 309.453 4.469 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001473965010 1061508385 /nfs/dbraw/zinc/50/83/85/1061508385.db2.gz SBOYPJNOZXNELQ-OGZRUICASA-N 1 0 310.441 4.125 20 10 DICDRO CC1CC([NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC001474037237 1061579749 /nfs/dbraw/zinc/57/97/49/1061579749.db2.gz BEQWFRRAQODQJF-UHFFFAOYSA-N 1 0 306.453 4.137 20 10 DICDRO CC(C)C1(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC001474034900 1061580806 /nfs/dbraw/zinc/58/08/06/1061580806.db2.gz COBZOCCRHGKIQM-UHFFFAOYSA-N 1 0 314.395 4.297 20 10 DICDRO Cc1c2ccccc2n(C)c1CNc1ccc2c(c1)[nH+]c(C)n2C ZINC001474051798 1061600139 /nfs/dbraw/zinc/60/01/39/1061600139.db2.gz MHLRMCFPBXSFFX-UHFFFAOYSA-N 1 0 318.424 4.294 20 10 DICDRO Clc1ccc(CCCC[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC001474146252 1061690839 /nfs/dbraw/zinc/69/08/39/1061690839.db2.gz ZBVOFWDOLRXXPU-UHFFFAOYSA-N 1 0 321.873 4.449 20 10 DICDRO CC/C=C\C[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001474160695 1061704269 /nfs/dbraw/zinc/70/42/69/1061704269.db2.gz NMJUFNIFCRELRM-PLNGDYQASA-N 1 0 300.471 4.440 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC3(CCCC3)O2)cc1 ZINC001474195069 1061744597 /nfs/dbraw/zinc/74/45/97/1061744597.db2.gz KHDGPHZMTIYATJ-IBGZPJMESA-N 1 0 316.489 4.114 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)CC2 ZINC001474198034 1061747405 /nfs/dbraw/zinc/74/74/05/1061747405.db2.gz VBMLGLPJPQZIHN-OLEQZPESSA-N 1 0 306.453 4.351 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](c2ccccc2)C(C)C)c1 ZINC001474196251 1061747672 /nfs/dbraw/zinc/74/76/72/1061747672.db2.gz PNCYFSCJHQUOJZ-KXBFYZLASA-N 1 0 313.441 4.491 20 10 DICDRO [O-]c1c(F)cc(F)cc1C[NH2+][C@@H]1CCc2cc(Cl)ccc21 ZINC001474233150 1061795768 /nfs/dbraw/zinc/79/57/68/1061795768.db2.gz OMWGXHDQMFNESN-OAHLLOKOSA-N 1 0 309.743 4.101 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CCC(F)(F)C2)cc1 ZINC001474292629 1061862542 /nfs/dbraw/zinc/86/25/42/1061862542.db2.gz MYZIBWLOJKKLFK-HNNXBMFYSA-N 1 0 310.432 4.448 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1C[C@H]1Cc1ccccc1 ZINC001474299892 1061869794 /nfs/dbraw/zinc/86/97/94/1061869794.db2.gz OSEUXTLLKDHVFS-RTBURBONSA-N 1 0 318.464 4.455 20 10 DICDRO CC[C@@H](C)[C@@H](C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)OC ZINC001474307587 1061872703 /nfs/dbraw/zinc/87/27/03/1061872703.db2.gz ORFOAAOGSABXQU-YLJYHZDGSA-N 1 0 318.505 4.170 20 10 DICDRO C[N@H+](Cc1cccn1C1CC1)Cc1ccc(N2CCCCC2)cc1 ZINC001474307184 1061874605 /nfs/dbraw/zinc/87/46/05/1061874605.db2.gz FMFWWHJGPZWTDN-UHFFFAOYSA-N 1 0 323.484 4.445 20 10 DICDRO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)CC1CCSCC1 ZINC001474307981 1061879259 /nfs/dbraw/zinc/87/92/59/1061879259.db2.gz XJZHYIMUISQCNJ-UHFFFAOYSA-N 1 0 318.530 4.252 20 10 DICDRO CO[C@]1(C)C[C@@H]([N@H+](C)Cc2ccc3ccccc3c2O)C1(C)C ZINC001474327261 1061911207 /nfs/dbraw/zinc/91/12/07/1061911207.db2.gz QFAJYUCOWSDQTE-YLJYHZDGSA-N 1 0 313.441 4.181 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H]2Cc2ccc(C)cc2)c1O ZINC001474347740 1061956888 /nfs/dbraw/zinc/95/68/88/1061956888.db2.gz VWRNRXSYGKDHTF-HXUWFJFHSA-N 1 0 309.453 4.470 20 10 DICDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001474360603 1061987302 /nfs/dbraw/zinc/98/73/02/1061987302.db2.gz BQQGEWVSQXHLMF-GUYCJALGSA-N 1 0 310.432 4.431 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1c(F)cccc1OCC ZINC001474368043 1062001176 /nfs/dbraw/zinc/00/11/76/1062001176.db2.gz GBXQERKNPDBZKL-UHFFFAOYSA-N 1 0 317.404 4.342 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)cc1 ZINC001459346887 1062099655 /nfs/dbraw/zinc/09/96/55/1062099655.db2.gz GDRGPGMVMJFYDD-LAUBAEHRSA-N 1 0 324.468 4.105 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)cc1 ZINC001459346885 1062101311 /nfs/dbraw/zinc/10/13/11/1062101311.db2.gz GDRGPGMVMJFYDD-DYESRHJHSA-N 1 0 324.468 4.105 20 10 DICDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1cc(C(C)C)ccc1O ZINC001474465118 1062146163 /nfs/dbraw/zinc/14/61/63/1062146163.db2.gz YEQSMWLXSTVCDY-PKOBYXMFSA-N 1 0 305.462 4.199 20 10 DICDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1cc(C(C)C)ccc1O ZINC001474465117 1062147046 /nfs/dbraw/zinc/14/70/46/1062147046.db2.gz YEQSMWLXSTVCDY-MJGOQNOKSA-N 1 0 305.462 4.199 20 10 DICDRO CCC[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(OC)cc1O ZINC001474473515 1062152254 /nfs/dbraw/zinc/15/22/54/1062152254.db2.gz UCXJSMLFZBDTCF-SFHVURJKSA-N 1 0 313.441 4.292 20 10 DICDRO COc1ccc(C[NH2+]Cc2cccc(C3CCCC3)c2)c(O)c1 ZINC001474473726 1062152436 /nfs/dbraw/zinc/15/24/36/1062152436.db2.gz ZUEFGDHYVNBCSJ-UHFFFAOYSA-N 1 0 311.425 4.348 20 10 DICDRO COC[C@@H](C[N@H+](Cc1ccccc1O)C1CCCC1)C(C)C ZINC001459467356 1062154326 /nfs/dbraw/zinc/15/43/26/1062154326.db2.gz MENGLOXWFDECDE-QGZVFWFLSA-N 1 0 305.462 4.055 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC001474476914 1062157200 /nfs/dbraw/zinc/15/72/00/1062157200.db2.gz KIRRYIUPQTXKJX-VZSQWMKGSA-N 1 0 324.443 4.394 20 10 DICDRO Cc1cc(C[N@@H+]2CCCc3sccc3C2)ccc1N(C)C ZINC001459468915 1062159711 /nfs/dbraw/zinc/15/97/11/1062159711.db2.gz OVTXSLVAXISMIJ-UHFFFAOYSA-N 1 0 300.471 4.071 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCCC[C@H]2c2cccn2C)cc1 ZINC001459629108 1062265729 /nfs/dbraw/zinc/26/57/29/1062265729.db2.gz GFFXAGVJZSNWOF-FQEVSTJZSA-N 1 0 311.473 4.208 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+]C1CCSCC1 ZINC001255087499 1062310357 /nfs/dbraw/zinc/31/03/57/1062310357.db2.gz AQSSFBCLHUKMQK-QGZVFWFLSA-N 1 0 305.487 4.118 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(c2cccc(F)c2F)CC1 ZINC001474598463 1062310686 /nfs/dbraw/zinc/31/06/86/1062310686.db2.gz CYTMIZLNCVNOKI-UHFFFAOYSA-N 1 0 321.342 4.189 20 10 DICDRO COc1ccc2oc(C[NH2+]Cc3cc(Cl)ccc3O)cc2c1 ZINC001474608533 1062321877 /nfs/dbraw/zinc/32/18/77/1062321877.db2.gz GIEQIABXNYPZJM-UHFFFAOYSA-N 1 0 317.772 4.090 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1csc(C(F)(F)F)c1 ZINC001474608254 1062323201 /nfs/dbraw/zinc/32/32/01/1062323201.db2.gz BQTPRMUBUNXUPI-UHFFFAOYSA-N 1 0 321.751 4.416 20 10 DICDRO CC(C)(C)O[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C1(C)C ZINC001474608811 1062323516 /nfs/dbraw/zinc/32/35/16/1062323516.db2.gz JUYABYCVRZWZFT-HUUCEWRRSA-N 1 0 311.853 4.117 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)CC2(CCCC2)O1 ZINC001474614224 1062329311 /nfs/dbraw/zinc/32/93/11/1062329311.db2.gz PNDSKDIWYKLBDF-OAHLLOKOSA-N 1 0 311.425 4.079 20 10 DICDRO CCC(CC)(CC)C[NH2+][C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001474624731 1062346330 /nfs/dbraw/zinc/34/63/30/1062346330.db2.gz ZVZBMYJKGJDNFA-INIZCTEOSA-N 1 0 304.478 4.080 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@@H](C)C[C@H](C)CC(C)C)C2)cc1 ZINC001474624443 1062346599 /nfs/dbraw/zinc/34/65/99/1062346599.db2.gz UBPGRIQFMBGRGY-SQNIBIBYSA-N 1 0 318.505 4.324 20 10 DICDRO CC[C@H]([NH2+]Cc1cc2cccc(OC)c2o1)c1ccccc1O ZINC001255175419 1062347829 /nfs/dbraw/zinc/34/78/29/1062347829.db2.gz LBZDHOKDXNTTGM-INIZCTEOSA-N 1 0 311.381 4.388 20 10 DICDRO CC[C@@](C)([NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)C1CC1 ZINC001474632102 1062356408 /nfs/dbraw/zinc/35/64/08/1062356408.db2.gz JAEZMZRSFGPXFH-MRXNPFEDSA-N 1 0 314.395 4.440 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CC(C)(C)[C@H]2CCCCO2)c1 ZINC001474656242 1062387596 /nfs/dbraw/zinc/38/75/96/1062387596.db2.gz FDZDUSCQHARNSM-GOSISDBHSA-N 1 0 305.462 4.201 20 10 DICDRO CCOc1ccc(N2CC[NH+](Cc3c(C)cccc3C)CC2)cc1 ZINC001459795953 1062404155 /nfs/dbraw/zinc/40/41/55/1062404155.db2.gz IQBURAZAQXDMSI-UHFFFAOYSA-N 1 0 324.468 4.024 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](C)Cc1ccc2cc[nH]c2c1 ZINC001474679013 1062411682 /nfs/dbraw/zinc/41/16/82/1062411682.db2.gz CIOWMRFSPZSBIB-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCC[C@@H](C2CCOCC2)C1 ZINC001474681558 1062413201 /nfs/dbraw/zinc/41/32/01/1062413201.db2.gz KARJNKKDMSOJRE-OAHLLOKOSA-N 1 0 323.864 4.074 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H]1CCOC(C)(C)C1 ZINC001255534655 1062475874 /nfs/dbraw/zinc/47/58/74/1062475874.db2.gz GYUIVBUCZNUKHW-KBXCAEBGSA-N 1 0 317.473 4.180 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)ccc1N(C)C ZINC001459949078 1062520151 /nfs/dbraw/zinc/52/01/51/1062520151.db2.gz GXNLBQFKOYQXKV-HNNXBMFYSA-N 1 0 314.395 4.224 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC001255719026 1062538901 /nfs/dbraw/zinc/53/89/01/1062538901.db2.gz BDDSKPUQXPUYJQ-UONOGXRCSA-N 1 0 301.352 4.335 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCC12CCOCC2)c1ccc(N(C)C)cc1 ZINC001459979001 1062541544 /nfs/dbraw/zinc/54/15/44/1062541544.db2.gz HJHGGXIYUZXYIM-FUHWJXTLSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@@H](CSc1ccc(F)cc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001255728297 1062549872 /nfs/dbraw/zinc/54/98/72/1062549872.db2.gz QDDWSQHZBUXEKH-ZDUSSCGKSA-N 1 0 317.429 4.031 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CSc1ccc(F)cc1)c1ccccc1O ZINC001255729406 1062551689 /nfs/dbraw/zinc/55/16/89/1062551689.db2.gz HKXNVDYIINDGOE-QWHCGFSZSA-N 1 0 305.418 4.363 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H](C)CSc2ccc(F)cc2)c(O)c1 ZINC001255735865 1062557357 /nfs/dbraw/zinc/55/73/57/1062557357.db2.gz OXJFUHIZUKUOEQ-CQSZACIVSA-N 1 0 319.445 4.419 20 10 DICDRO Cc1ccc(SC[C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001255753011 1062577608 /nfs/dbraw/zinc/57/76/08/1062577608.db2.gz NFYQEVUDVFLVFY-OAHLLOKOSA-N 1 0 313.466 4.200 20 10 DICDRO CCCN(Cc1csc(C(C)C)n1)c1ccc(C[NH3+])cc1 ZINC001256049291 1062689225 /nfs/dbraw/zinc/68/92/25/1062689225.db2.gz ZOELKYIOYOSAEA-UHFFFAOYSA-N 1 0 303.475 4.142 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)cc1C ZINC001256800109 1062988434 /nfs/dbraw/zinc/98/84/34/1062988434.db2.gz YURJGYUMLWFWFI-ICSRJNTNSA-N 1 0 311.425 4.014 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccccc2F)cc1F ZINC001460998915 1063174235 /nfs/dbraw/zinc/17/42/35/1063174235.db2.gz HERAFMRMMKHSGA-UHFFFAOYSA-N 1 0 318.411 4.143 20 10 DICDRO Cc1ccc([C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C2CC2)cc1 ZINC001461025562 1063196828 /nfs/dbraw/zinc/19/68/28/1063196828.db2.gz ZXIHQSFYQFVYBX-HXUWFJFHSA-N 1 0 312.432 4.441 20 10 DICDRO COc1cc(C[NH2+][C@H]2CCC[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC001461042247 1063209373 /nfs/dbraw/zinc/20/93/73/1063209373.db2.gz WPGPAHGWIVYCOE-HIFRSBDPSA-N 1 0 305.462 4.367 20 10 DICDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC001461051904 1063217975 /nfs/dbraw/zinc/21/79/75/1063217975.db2.gz BNZGCSZUWBNOPR-AEFFLSMTSA-N 1 0 318.530 4.156 20 10 DICDRO CCCCCC1CCC([NH2+]CC(=O)c2ccc(O)c(O)c2)CC1 ZINC001257375167 1063243302 /nfs/dbraw/zinc/24/33/02/1063243302.db2.gz SXXLXCKNNOJJCD-UHFFFAOYSA-N 1 0 319.445 4.009 20 10 DICDRO C[C@H](CC(C)(C)c1ccccc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001461118670 1063267212 /nfs/dbraw/zinc/26/72/12/1063267212.db2.gz CUZOEUJNFFQNOY-MRXNPFEDSA-N 1 0 309.453 4.468 20 10 DICDRO Cc1ccccc1C1(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC001461142913 1063290267 /nfs/dbraw/zinc/29/02/67/1063290267.db2.gz WKMAKQPGALIGOE-VURMDHGXSA-N 1 0 320.480 4.396 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)cc1C ZINC001461427358 1063494683 /nfs/dbraw/zinc/49/46/83/1063494683.db2.gz VNALZHUVEUEOFZ-PMACEKPBSA-N 1 0 317.473 4.079 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H](SC)C(C)(C)C)cc1 ZINC001461430225 1063496114 /nfs/dbraw/zinc/49/61/14/1063496114.db2.gz LJGORPHSLCAXSC-KRWDZBQOSA-N 1 0 308.535 4.400 20 10 DICDRO C[C@@H](CC[NH2+]Cc1ccc(N2CCOCC2)cc1)CC(C)(C)C ZINC001461432903 1063498919 /nfs/dbraw/zinc/49/89/19/1063498919.db2.gz DYSFBAIALCVHFF-KRWDZBQOSA-N 1 0 318.505 4.075 20 10 DICDRO CC(C)C[C@@H](C)C[C@@H](C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001258076218 1063501333 /nfs/dbraw/zinc/50/13/33/1063501333.db2.gz YAUPKRDOWWKAQZ-HUUCEWRRSA-N 1 0 305.462 4.307 20 10 DICDRO CC(C)C[C@H](C)C[C@@H](C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001258076219 1063501711 /nfs/dbraw/zinc/50/17/11/1063501711.db2.gz YAUPKRDOWWKAQZ-LSDHHAIUSA-N 1 0 305.462 4.307 20 10 DICDRO COc1ccc(CC(C)(C)[NH2+]Cc2ccc(OC)c(C)c2)cc1 ZINC001461435354 1063502997 /nfs/dbraw/zinc/50/29/97/1063502997.db2.gz AKMYENNVAYYGFJ-UHFFFAOYSA-N 1 0 313.441 4.123 20 10 DICDRO Fc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCCO3)CCC2 ZINC001461483734 1063531432 /nfs/dbraw/zinc/53/14/32/1063531432.db2.gz CBXRWUPLXROKNY-LJQANCHMSA-N 1 0 311.400 4.318 20 10 DICDRO Cc1ccc(F)c(CC[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC001461512421 1063549271 /nfs/dbraw/zinc/54/92/71/1063549271.db2.gz VODYACCQDMQYKI-PLNGDYQASA-N 1 0 312.432 4.046 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CCC[C@@H]2C2CC2)ccc1OC ZINC001461577970 1063591319 /nfs/dbraw/zinc/59/13/19/1063591319.db2.gz FHJVJOGOLAYZFH-IEBWSBKVSA-N 1 0 317.473 4.148 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCCC2CC2)c(C(F)(F)F)c1 ZINC001461605663 1063607149 /nfs/dbraw/zinc/60/71/49/1063607149.db2.gz RFIRKZFKUMMLRB-UHFFFAOYSA-N 1 0 300.368 4.051 20 10 DICDRO COc1cc(C[NH2+][C@@H](C(C)C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC001461644831 1063631782 /nfs/dbraw/zinc/63/17/82/1063631782.db2.gz FYMLJUGSVAYWIB-KRWDZBQOSA-N 1 0 305.462 4.223 20 10 DICDRO Clc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCCO3)CC2 ZINC001461669917 1063649403 /nfs/dbraw/zinc/64/94/03/1063649403.db2.gz IINQWUNPOIBETD-GOSISDBHSA-N 1 0 313.828 4.442 20 10 DICDRO CN(C)c1ccc(/C=C/CNc2ccc3c([nH+]2)CCCC3)cc1 ZINC001461733686 1063685852 /nfs/dbraw/zinc/68/58/52/1063685852.db2.gz PSHNLBOOHMLECC-AATRIKPKSA-N 1 0 307.441 4.152 20 10 DICDRO CSC1(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)CCCCC1 ZINC001461757249 1063699295 /nfs/dbraw/zinc/69/92/95/1063699295.db2.gz XIBOTZZUUBNHSY-BQYQJAHWSA-N 1 0 318.530 4.421 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCC2(c3ccccc3)CC2)cc1F ZINC001461766899 1063705759 /nfs/dbraw/zinc/70/57/59/1063705759.db2.gz NYPUCXZYOKJQCX-UHFFFAOYSA-N 1 0 312.432 4.103 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+][C@]23C[C@H]2CCC3)cc1 ZINC001461778205 1063710657 /nfs/dbraw/zinc/71/06/57/1063710657.db2.gz AMHJTCSFZVTDEW-VQIMIIECSA-N 1 0 312.482 4.417 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H]2CCCC3(CCC3)O2)cc1C ZINC001461792168 1063719704 /nfs/dbraw/zinc/71/97/04/1063719704.db2.gz GZDPAWBMQDIFDL-GOSISDBHSA-N 1 0 317.473 4.365 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H]2CCCC3(CCC3)O2)cc1C ZINC001461792170 1063720156 /nfs/dbraw/zinc/72/01/56/1063720156.db2.gz GZDPAWBMQDIFDL-SFHVURJKSA-N 1 0 317.473 4.365 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC001461839532 1063743983 /nfs/dbraw/zinc/74/39/83/1063743983.db2.gz VDRZINIOIYEDIM-UHFFFAOYSA-N 1 0 312.432 4.365 20 10 DICDRO CCC1(CC)[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2C)C[C@@H]1OC ZINC001461861189 1063754449 /nfs/dbraw/zinc/75/44/49/1063754449.db2.gz KHJSBGCAZMLPKC-MOPGFXCFSA-N 1 0 318.505 4.087 20 10 DICDRO CCC1(CC)[C@H](OC)C[C@H]1[N@H+](C)Cc1ccc(N(C)C)cc1C ZINC001461861197 1063757946 /nfs/dbraw/zinc/75/79/46/1063757946.db2.gz KHJSBGCAZMLPKC-RTBURBONSA-N 1 0 318.505 4.087 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H](C(C)(C)C)CC2)c(O)c1OC ZINC001461876985 1063767538 /nfs/dbraw/zinc/76/75/38/1063767538.db2.gz ZOFVEZKCRBJTKX-OAHLLOKOSA-N 1 0 321.461 4.058 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)c1 ZINC001461885204 1063775983 /nfs/dbraw/zinc/77/59/83/1063775983.db2.gz VANVHNMBGPNXNV-DYVFJYSZSA-N 1 0 315.413 4.275 20 10 DICDRO COc1cc(C[NH+]2Cc3ccccc3C2)c(O)c(C(C)(C)C)c1 ZINC001461893537 1063780427 /nfs/dbraw/zinc/78/04/27/1063780427.db2.gz FBPDSLSJSGCEFG-UHFFFAOYSA-N 1 0 311.425 4.214 20 10 DICDRO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1cc(F)ccc1O ZINC001461897929 1063785675 /nfs/dbraw/zinc/78/56/75/1063785675.db2.gz GQRXPPGWBAGNCR-TZMCWYRMSA-N 1 0 303.352 4.048 20 10 DICDRO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1cc(F)ccc1O ZINC001461897925 1063786172 /nfs/dbraw/zinc/78/61/72/1063786172.db2.gz GQRXPPGWBAGNCR-JSGCOSHPSA-N 1 0 303.352 4.048 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](C3CC3)C2)c(C(F)(F)F)c1 ZINC001461922752 1063805824 /nfs/dbraw/zinc/80/58/24/1063805824.db2.gz ZSRUYMJNNVVDOU-ZDUSSCGKSA-N 1 0 312.379 4.003 20 10 DICDRO C[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)[C@@H]1c1ccccc1 ZINC001461933873 1063819757 /nfs/dbraw/zinc/81/97/57/1063819757.db2.gz GDBOOGOXMRYOEG-PKBHQSAESA-N 1 0 306.453 4.459 20 10 DICDRO CCC[N@@H+](Cc1ccc(OC)c(OC)c1O)CC1CCCCC1 ZINC001461947962 1063833896 /nfs/dbraw/zinc/83/38/96/1063833896.db2.gz HAXIIIBXNGLNHF-UHFFFAOYSA-N 1 0 321.461 4.202 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCc2ccccc2C1 ZINC001461959668 1063842648 /nfs/dbraw/zinc/84/26/48/1063842648.db2.gz PGCJWBTYDOEXFE-QGZVFWFLSA-N 1 0 309.453 4.409 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC001461991262 1063864083 /nfs/dbraw/zinc/86/40/83/1063864083.db2.gz BNZSPUNSATXOCB-UHFFFAOYSA-N 1 0 322.374 4.110 20 10 DICDRO COc1ccccc1C[C@@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001258883209 1063871154 /nfs/dbraw/zinc/87/11/54/1063871154.db2.gz IZNKQCOLIZWDOS-OAHLLOKOSA-N 1 0 321.420 4.275 20 10 DICDRO C[C@H]1C[C@H](C)C[NH+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001462005782 1063873291 /nfs/dbraw/zinc/87/32/91/1063873291.db2.gz BSDISAGLJFJOCO-STQMWFEESA-N 1 0 314.395 4.249 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCOc2ccccc21 ZINC001462025721 1063885547 /nfs/dbraw/zinc/88/55/47/1063885547.db2.gz KPHBBWVFVHMTAA-SFHVURJKSA-N 1 0 324.468 4.141 20 10 DICDRO C[C@H]1CC[N@H+](Cc2ccc(Br)cc2O)CC1(C)C ZINC001462058193 1063908445 /nfs/dbraw/zinc/90/84/45/1063908445.db2.gz HQOYTDHJYAVZSR-NSHDSACASA-N 1 0 312.251 4.023 20 10 DICDRO CO[C@@](C)([C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)C1CC1 ZINC001261366006 1063920431 /nfs/dbraw/zinc/92/04/31/1063920431.db2.gz FLECSEGAIVCTQN-IZSNYMMISA-N 1 0 303.446 4.042 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001261602483 1063940308 /nfs/dbraw/zinc/94/03/08/1063940308.db2.gz VNUIOPTUJKOJGS-RGDJUOJXSA-N 1 0 307.384 4.272 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC001261671230 1063942102 /nfs/dbraw/zinc/94/21/02/1063942102.db2.gz LCVSHCXVLAWOET-BJWYYQGGSA-N 1 0 315.363 4.193 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](C1CC1)[C@@H]1CCCOC1 ZINC001262207194 1063960328 /nfs/dbraw/zinc/96/03/28/1063960328.db2.gz VVUAOCSWHJDVBB-BCEDRHLLSA-N 1 0 315.457 4.044 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCCOCc1ccccc1 ZINC000390079781 1064147387 /nfs/dbraw/zinc/14/73/87/1064147387.db2.gz AWXXDNMSYVJNGA-UHFFFAOYSA-N 1 0 322.452 4.183 20 10 DICDRO C[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000393476926 1064282470 /nfs/dbraw/zinc/28/24/70/1064282470.db2.gz FYPPEEWNBHXTND-INIZCTEOSA-N 1 0 312.432 4.147 20 10 DICDRO CC(C)[N@H+](CCSC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC001307424041 1065384198 /nfs/dbraw/zinc/38/41/98/1065384198.db2.gz LBTVXMAKVDLPDY-UHFFFAOYSA-N 1 0 320.424 4.216 20 10 DICDRO Cc1ccc(CC[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC001307424760 1065386603 /nfs/dbraw/zinc/38/66/03/1065386603.db2.gz VEDGWEJPEUYYMR-UHFFFAOYSA-N 1 0 308.469 4.268 20 10 DICDRO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001307481075 1065427432 /nfs/dbraw/zinc/42/74/32/1065427432.db2.gz WFKZWTIKJXMCAA-CRAIPNDOSA-N 1 0 312.432 4.270 20 10 DICDRO CC(C)C[C@H](C)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC001307566735 1065485681 /nfs/dbraw/zinc/48/56/81/1065485681.db2.gz LSSSYKRWGLPQCL-WMZOPIPTSA-N 1 0 305.462 4.055 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H](C3CCCC3)C2)ccc1N(C)C ZINC001308157899 1065785522 /nfs/dbraw/zinc/78/55/22/1065785522.db2.gz QKQCMLXKWPKGKQ-IBGZPJMESA-N 1 0 300.490 4.463 20 10 DICDRO C[C@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC001308206733 1065815506 /nfs/dbraw/zinc/81/55/06/1065815506.db2.gz TUCZYXDXAGRMNG-MAUKXSAKSA-N 1 0 318.530 4.154 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc3ccccc3n2C)cc1 ZINC001308208228 1065817591 /nfs/dbraw/zinc/81/75/91/1065817591.db2.gz MZINBXHZQQGFRQ-UHFFFAOYSA-N 1 0 321.468 4.314 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccccc2OCC)cc1C ZINC001308218418 1065825919 /nfs/dbraw/zinc/82/59/19/1065825919.db2.gz GFDCWQAOMYPLIC-UHFFFAOYSA-N 1 0 313.441 4.472 20 10 DICDRO CCCC1CCC([NH2+]Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC001308224296 1065832228 /nfs/dbraw/zinc/83/22/28/1065832228.db2.gz FWARRHVTYHUHEJ-UHFFFAOYSA-N 1 0 310.432 4.479 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)CCO1 ZINC001308232711 1065838368 /nfs/dbraw/zinc/83/83/68/1065838368.db2.gz ZXGSBWOTRGFKSC-AEFFLSMTSA-N 1 0 316.489 4.113 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)CCO1 ZINC001308232712 1065838731 /nfs/dbraw/zinc/83/87/31/1065838731.db2.gz ZXGSBWOTRGFKSC-FUHWJXTLSA-N 1 0 316.489 4.113 20 10 DICDRO Cc1cccc2[nH]cc(CC[NH2+]Cc3ccc4c(c3)CCCO4)c21 ZINC001308247646 1065851912 /nfs/dbraw/zinc/85/19/12/1065851912.db2.gz YNZGUUJCZDNJGU-UHFFFAOYSA-N 1 0 320.436 4.134 20 10 DICDRO Cc1ccc([C@H](C)C[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001308275859 1065873993 /nfs/dbraw/zinc/87/39/93/1065873993.db2.gz HIPVQZQHJLOCCG-OOFWQKGWSA-N 1 0 308.469 4.468 20 10 DICDRO Cc1ccc(O[C@@H](C)C[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001308287209 1065884355 /nfs/dbraw/zinc/88/43/55/1065884355.db2.gz SPLYETLCHJFJSP-QWNKOJSDSA-N 1 0 324.468 4.131 20 10 DICDRO CCS[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001308299396 1065894257 /nfs/dbraw/zinc/89/42/57/1065894257.db2.gz CQUBJBQVEMBOSR-PKOBYXMFSA-N 1 0 318.530 4.441 20 10 DICDRO CCS[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001308299395 1065895051 /nfs/dbraw/zinc/89/50/51/1065895051.db2.gz CQUBJBQVEMBOSR-MJGOQNOKSA-N 1 0 318.530 4.441 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC2(Cc3ccccc3)CC2)cc1 ZINC001308335982 1065921147 /nfs/dbraw/zinc/92/11/47/1065921147.db2.gz APXNOQARSRNIRN-TWGQIWQCSA-N 1 0 320.480 4.378 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c(C)c1 ZINC001308377397 1065951443 /nfs/dbraw/zinc/95/14/43/1065951443.db2.gz YXPICWBNUAXEPD-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO COc1cc(C[NH2+]C[C@@H]2CCC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308382287 1065953236 /nfs/dbraw/zinc/95/32/36/1065953236.db2.gz DRXQNFHQDUKMCC-KBPBESRZSA-N 1 0 305.462 4.224 20 10 DICDRO COc1cc(C[NH2+]C[C@H]2CCC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308382289 1065953263 /nfs/dbraw/zinc/95/32/63/1065953263.db2.gz DRXQNFHQDUKMCC-UONOGXRCSA-N 1 0 305.462 4.224 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308431544 1065982765 /nfs/dbraw/zinc/98/27/65/1065982765.db2.gz QVUOCHMYJGEICP-OAHLLOKOSA-N 1 0 311.425 4.179 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](COC)CC(C)(C)C)cc1C ZINC001308447933 1065995448 /nfs/dbraw/zinc/99/54/48/1065995448.db2.gz APCSJGLGINXKAV-QGZVFWFLSA-N 1 0 307.478 4.325 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(Cl)c2C)c1 ZINC001308450647 1065996642 /nfs/dbraw/zinc/99/66/42/1065996642.db2.gz PCGMIUAXIXTLSL-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+]C3CCC(C(C)C)CC3)C2)cc1 ZINC001308461592 1066003341 /nfs/dbraw/zinc/00/33/41/1066003341.db2.gz ZFFRNQDQELKFGD-DAWZGUTISA-N 1 0 316.489 4.078 20 10 DICDRO CC(C)([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCCCO1 ZINC001308495642 1066027906 /nfs/dbraw/zinc/02/79/06/1066027906.db2.gz CTMQCUPDCXTACU-IBGZPJMESA-N 1 0 316.489 4.114 20 10 DICDRO C[C@@H]([NH2+]Cc1ncc(-c2ccccc2)s1)c1ccccc1O ZINC001308505588 1066034559 /nfs/dbraw/zinc/03/45/59/1066034559.db2.gz DWYRVZQAYPLTPF-CYBMUJFWSA-N 1 0 310.422 4.367 20 10 DICDRO COc1ccc(C[NH2+]Cc2cccc(OC(C)(C)C)c2)cc1C ZINC001308509638 1066036684 /nfs/dbraw/zinc/03/66/84/1066036684.db2.gz RZALGDWMQHBEQU-UHFFFAOYSA-N 1 0 313.441 4.471 20 10 DICDRO COc1cc(C[NH2+]C[C@@H]2C[C@@H]2[C@@H]2C[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308521367 1066042046 /nfs/dbraw/zinc/04/20/46/1066042046.db2.gz BQEYUHVGPHVFLL-GFOFROLCSA-N 1 0 317.473 4.080 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CC(C)(C)OC2(C)C)cc1 ZINC001308532401 1066050608 /nfs/dbraw/zinc/05/06/08/1066050608.db2.gz IVNWCPOBHZTVOL-QGZVFWFLSA-N 1 0 318.505 4.216 20 10 DICDRO c1cc(CCC[NH2+]Cc2ccc(N3CCCCC3)cc2)cs1 ZINC001308552750 1066065007 /nfs/dbraw/zinc/06/50/07/1066065007.db2.gz GFLFWANJCWAQFF-UHFFFAOYSA-N 1 0 314.498 4.461 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@]1(C)CCCCO1 ZINC001308558226 1066067041 /nfs/dbraw/zinc/06/70/41/1066067041.db2.gz LGWTUGAWMOCPME-HXUWFJFHSA-N 1 0 316.489 4.068 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCC[C@@H]1C1CC1 ZINC001308582731 1066099994 /nfs/dbraw/zinc/09/99/94/1066099994.db2.gz FTUPTNYTFZEDDX-HXUWFJFHSA-N 1 0 323.436 4.346 20 10 DICDRO CCC[N@H+](Cc1ccc(C)cc1O)[C@H]1CCc2ccccc2C1 ZINC001308592083 1066105428 /nfs/dbraw/zinc/10/54/28/1066105428.db2.gz WXWVZYWQZFJEJF-FQEVSTJZSA-N 1 0 309.453 4.470 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)Cc2cccs2)cc1Cl ZINC001308594806 1066106985 /nfs/dbraw/zinc/10/69/85/1066106985.db2.gz MHKVLJKXHOLXNK-GFCCVEGCSA-N 1 0 309.862 4.479 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@H]2c2cccc(N(C)C)c2)c1O ZINC001308618943 1066121997 /nfs/dbraw/zinc/12/19/97/1066121997.db2.gz LFPQKJLWZGLWCQ-FQEVSTJZSA-N 1 0 324.468 4.358 20 10 DICDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001308634566 1066129900 /nfs/dbraw/zinc/12/99/00/1066129900.db2.gz MTHPRPBKRKMLMY-IIYDPXPESA-N 1 0 308.416 4.184 20 10 DICDRO C[C@@H]1C[N@H+](Cc2c(O)cccc2Br)[C@@H]2CCCC[C@@H]21 ZINC001308637665 1066131452 /nfs/dbraw/zinc/13/14/52/1066131452.db2.gz PLYFWTLMQUYJJC-LALPHHSUSA-N 1 0 324.262 4.165 20 10 DICDRO CCC1CCC([N@H+](C)Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC001308648610 1066136256 /nfs/dbraw/zinc/13/62/56/1066136256.db2.gz ATRBPIUMURPRPP-UHFFFAOYSA-N 1 0 310.432 4.431 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC001308659137 1066142171 /nfs/dbraw/zinc/14/21/71/1066142171.db2.gz KDAMUXPKSBEGRT-QGZVFWFLSA-N 1 0 301.817 4.253 20 10 DICDRO Cc1csc([C@H](C)C[NH2+]Cc2cc(C(C)C)ccc2O)n1 ZINC001308668949 1066146844 /nfs/dbraw/zinc/14/68/44/1066146844.db2.gz HXJHOEPKMYLBLE-GFCCVEGCSA-N 1 0 304.459 4.174 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@]2(C)CCCc3ccccc32)c1O ZINC001308679672 1066152937 /nfs/dbraw/zinc/15/29/37/1066152937.db2.gz DNWIRAJYNJDQNJ-HXUWFJFHSA-N 1 0 311.425 4.051 20 10 DICDRO Cc1cc(C)c2c(c1)C[N@@H+](Cc1ccc(Cl)cc1O)CC2 ZINC001308698710 1066187784 /nfs/dbraw/zinc/18/77/84/1066187784.db2.gz VTRJRSVAWDPWNS-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1ccc(C[NH+]2CCC(c3ccc(N(C)C)cc3)CC2)c(O)c1 ZINC001308708586 1066190805 /nfs/dbraw/zinc/19/08/05/1066190805.db2.gz GTIWTWYVJKZDRP-UHFFFAOYSA-N 1 0 324.468 4.146 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)cc1Cl ZINC001308710193 1066192992 /nfs/dbraw/zinc/19/29/92/1066192992.db2.gz DAXVVWSOMPRWKT-NVXWUHKLSA-N 1 0 311.853 4.037 20 10 DICDRO CC(C)C1C[NH+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001308720812 1066199457 /nfs/dbraw/zinc/19/94/57/1066199457.db2.gz PUZKRMFJTBNFDQ-UHFFFAOYSA-N 1 0 311.425 4.059 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCc2cccc(C)c2)c1 ZINC001308748908 1066221157 /nfs/dbraw/zinc/22/11/57/1066221157.db2.gz XAPLGHRARJGVAG-HOTGVXAUSA-N 1 0 313.441 4.381 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCc2cccc(C)c2)c1 ZINC001308748910 1066221245 /nfs/dbraw/zinc/22/12/45/1066221245.db2.gz XAPLGHRARJGVAG-JKSUJKDBSA-N 1 0 313.441 4.381 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCCc3ccccc3CC2)cc1 ZINC001308768706 1066239905 /nfs/dbraw/zinc/23/99/05/1066239905.db2.gz SBCZBJLENIRUSV-FNORWQNLSA-N 1 0 320.480 4.257 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)c(C(F)(F)F)c1 ZINC001308813061 1066289698 /nfs/dbraw/zinc/28/96/98/1066289698.db2.gz NTFJMWWKFUALKO-DIOULYMOSA-N 1 0 312.379 4.050 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCC(C)(C)C2)c1O ZINC001308821325 1066295285 /nfs/dbraw/zinc/29/52/85/1066295285.db2.gz VVSFSMBQZDVSFW-GFCCVEGCSA-N 1 0 311.853 4.360 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@H]1C[C@H]1c1ccccc1 ZINC001308824985 1066300555 /nfs/dbraw/zinc/30/05/55/1066300555.db2.gz KVSRKIYRSLBBQA-WEYGHZABSA-N 1 0 322.496 4.385 20 10 DICDRO CC[C@H](Cc1ccc(C)cc1)[NH2+]Cc1cc(Cl)ccc1O ZINC001308846778 1066323480 /nfs/dbraw/zinc/32/34/80/1066323480.db2.gz VQCSZCHTOWXAMC-QGZVFWFLSA-N 1 0 303.833 4.465 20 10 DICDRO CCC[C@@H]([NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)C1CCCC1 ZINC001308860206 1066341429 /nfs/dbraw/zinc/34/14/29/1066341429.db2.gz QDJCCJYLPHRZQH-FXAWDEMLSA-N 1 0 316.489 4.222 20 10 DICDRO Cc1ccccc1CC1C[NH+](Cc2cc(C(C)C)ccc2O)C1 ZINC001308871700 1066352301 /nfs/dbraw/zinc/35/23/01/1066352301.db2.gz LLJJEUMPPMSKQW-UHFFFAOYSA-N 1 0 309.453 4.499 20 10 DICDRO Cc1c(Cl)ccc2c1C[N@H+](Cc1cc(F)ccc1O)CC2 ZINC001308908900 1066388312 /nfs/dbraw/zinc/38/83/12/1066388312.db2.gz BUQIWNOQGBOGGO-UHFFFAOYSA-N 1 0 305.780 4.051 20 10 DICDRO CCC[C@@H](C)CC[NH2+]Cc1cc(Br)cc(C)c1O ZINC001308921110 1066398432 /nfs/dbraw/zinc/39/84/32/1066398432.db2.gz HFRCCPJGEQBBOM-LLVKDONJSA-N 1 0 314.267 4.379 20 10 DICDRO Cc1ccc(C[NH2+][C@H](Cc2ccccc2)c2ccccn2)c(O)c1 ZINC001308967076 1066423723 /nfs/dbraw/zinc/42/37/23/1066423723.db2.gz ADZDOGZNJUBPBE-HXUWFJFHSA-N 1 0 318.420 4.169 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)c1nccs1 ZINC000186740141 200001639 /nfs/dbraw/zinc/00/16/39/200001639.db2.gz FBPNUEYFRLTPOG-OLZOCXBDSA-N 1 0 312.438 4.456 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1cccnc1 ZINC000092747613 193187744 /nfs/dbraw/zinc/18/77/44/193187744.db2.gz IJUFGSNEUQMZRZ-KRWDZBQOSA-N 1 0 309.457 4.169 20 10 DICDRO C[C@H]([NH2+][C@H]1CCSc2ccccc21)c1cc(F)ccc1O ZINC000094617493 193385644 /nfs/dbraw/zinc/38/56/44/193385644.db2.gz SMJBCDSBQRBYOZ-NHYWBVRUSA-N 1 0 303.402 4.419 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCSc2ccccc21)c1cc(F)ccc1O ZINC000094617491 193385063 /nfs/dbraw/zinc/38/50/63/193385063.db2.gz SMJBCDSBQRBYOZ-XHDPSFHLSA-N 1 0 303.402 4.419 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1)c1cc(Br)ccc1O ZINC000019899558 182161720 /nfs/dbraw/zinc/16/17/20/182161720.db2.gz JAIXGKFUUNNJIU-OAHLLOKOSA-N 1 0 320.230 4.396 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1)c1cc(Br)ccc1O ZINC000019899559 182161829 /nfs/dbraw/zinc/16/18/29/182161829.db2.gz JAIXGKFUUNNJIU-HNNXBMFYSA-N 1 0 320.230 4.396 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1[N+](=O)[O-] ZINC000271847888 129971888 /nfs/dbraw/zinc/97/18/88/129971888.db2.gz WYQLNCNGORWSEP-UONOGXRCSA-N 1 0 313.401 4.073 20 10 DICDRO CC[C@H]([NH2+][C@H](CCOC)c1ccco1)c1ccc(N(C)C)cc1 ZINC000272626659 130047753 /nfs/dbraw/zinc/04/77/53/130047753.db2.gz ZNJMSBNLMAVIGZ-ZWKOTPCHSA-N 1 0 316.445 4.164 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCOC)c1ccco1)c1ccc(N(C)C)cc1 ZINC000272626647 130048549 /nfs/dbraw/zinc/04/85/49/130048549.db2.gz ZNJMSBNLMAVIGZ-QZTJIDSGSA-N 1 0 316.445 4.164 20 10 DICDRO CC(C)Oc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000273362606 130110995 /nfs/dbraw/zinc/11/09/95/130110995.db2.gz DGLZVTYKKDHOBV-ZDUSSCGKSA-N 1 0 303.377 4.169 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OC(C)C)nc2)c(O)c1C ZINC000273444695 130121882 /nfs/dbraw/zinc/12/18/82/130121882.db2.gz ZNXANVAPRNECPL-OAHLLOKOSA-N 1 0 314.429 4.042 20 10 DICDRO CCOCc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273441674 130121921 /nfs/dbraw/zinc/12/19/21/130121921.db2.gz YRDOOMZFUCPDKL-INIZCTEOSA-N 1 0 313.441 4.396 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@@H](O)c2cccs2)c(O)c1C ZINC000273455253 130123993 /nfs/dbraw/zinc/12/39/93/130123993.db2.gz HARPWFPRJUDJDN-IVMMDQJWSA-N 1 0 319.470 4.233 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@H](O)c2cccs2)c(O)c1C ZINC000273455252 130124121 /nfs/dbraw/zinc/12/41/21/130124121.db2.gz HARPWFPRJUDJDN-INWMFGNUSA-N 1 0 319.470 4.233 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)cc2SC)c1 ZINC000273469258 130125011 /nfs/dbraw/zinc/12/50/11/130125011.db2.gz FJXHAQXADONZCK-CYBMUJFWSA-N 1 0 317.454 4.282 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c(O)c1C ZINC000273469500 130125186 /nfs/dbraw/zinc/12/51/86/130125186.db2.gz JNWOVDUQTAQRHJ-CXAGYDPISA-N 1 0 315.388 4.323 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(O)c1 ZINC000273476837 130126442 /nfs/dbraw/zinc/12/64/42/130126442.db2.gz LBCVPGJGIVOBGL-OLZOCXBDSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(O)c1 ZINC000273476839 130126594 /nfs/dbraw/zinc/12/65/94/130126594.db2.gz LBCVPGJGIVOBGL-QWHCGFSZSA-N 1 0 300.358 4.021 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(F)c(C)c2)c1 ZINC000273493185 130127389 /nfs/dbraw/zinc/12/73/89/130127389.db2.gz OTDDEDGIVOPFCE-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOC3(CCCCC3)C2)c(O)c1 ZINC000273510311 130130886 /nfs/dbraw/zinc/13/08/86/130130886.db2.gz RPKIUDKOPNKLAU-HZPDHXFCSA-N 1 0 303.446 4.233 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cc(Cl)ccc1O ZINC000273621758 130146825 /nfs/dbraw/zinc/14/68/25/130146825.db2.gz ZGNLQHCSTOEAER-ZUZCIYMTSA-N 1 0 303.789 4.089 20 10 DICDRO CC[C@@H]([NH2+]C1(c2nc(C)cs2)CCC1)c1ccccc1O ZINC000274751084 130259481 /nfs/dbraw/zinc/25/94/81/130259481.db2.gz HOEMMNGTJTVAFX-CQSZACIVSA-N 1 0 302.443 4.277 20 10 DICDRO Oc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CCC2 ZINC000284193683 131057958 /nfs/dbraw/zinc/05/79/58/131057958.db2.gz RUJUGCBQMTYGKN-OAQYLSRUSA-N 1 0 322.452 4.160 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)n1 ZINC000284946598 131125821 /nfs/dbraw/zinc/12/58/21/131125821.db2.gz DZLHDAVYSIERAM-OCCSQVGLSA-N 1 0 304.459 4.228 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)c(O)c1 ZINC000285149026 131143124 /nfs/dbraw/zinc/14/31/24/131143124.db2.gz MEHBCXHAAGDSJF-HNNXBMFYSA-N 1 0 313.441 4.087 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(O)c1 ZINC000285398549 131164198 /nfs/dbraw/zinc/16/41/98/131164198.db2.gz XBVKHBWNZKUINM-GFCCVEGCSA-N 1 0 302.443 4.194 20 10 DICDRO COC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(Cl)c1 ZINC000297472009 132017120 /nfs/dbraw/zinc/01/71/20/132017120.db2.gz YRBZUQHCIZTLAF-CVEARBPZSA-N 1 0 317.816 4.010 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCOc3c(Cl)cccc31)CC2 ZINC000297576309 132023144 /nfs/dbraw/zinc/02/31/44/132023144.db2.gz GXTSIFZFXIHHQO-HUUCEWRRSA-N 1 0 315.800 4.146 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCOc3c(Cl)cccc31)CC2 ZINC000297576302 132023610 /nfs/dbraw/zinc/02/36/10/132023610.db2.gz GXTSIFZFXIHHQO-GJZGRUSLSA-N 1 0 315.800 4.146 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc2cccnc21)c1ccc(N(C)C)cc1 ZINC000120501892 132143892 /nfs/dbraw/zinc/14/38/92/132143892.db2.gz NXZINXZTCRJSNZ-OAHLLOKOSA-N 1 0 305.425 4.152 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(C(F)(F)F)c1 ZINC000079249436 331681596 /nfs/dbraw/zinc/68/15/96/331681596.db2.gz RNNINOSLUWJOIT-GFCCVEGCSA-N 1 0 321.342 4.491 20 10 DICDRO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)CCS2 ZINC000043288555 332266116 /nfs/dbraw/zinc/26/61/16/332266116.db2.gz FQTAREULTQHLNR-INIZCTEOSA-N 1 0 315.413 4.087 20 10 DICDRO Cc1noc(C)c1CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185395980 333208188 /nfs/dbraw/zinc/20/81/88/333208188.db2.gz FWKBYGSGCOWGCB-GFCCVEGCSA-N 1 0 310.397 4.044 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)C[C@@H](O)c2cccs2)c(O)c1 ZINC000294821841 335127841 /nfs/dbraw/zinc/12/78/41/335127841.db2.gz QLWWJWZUUGRNIT-SOUVJXGZSA-N 1 0 319.470 4.233 20 10 DICDRO Oc1ccccc1C[NH2+]C(c1cccs1)c1cccs1 ZINC000119435959 333251929 /nfs/dbraw/zinc/25/19/29/333251929.db2.gz MJEPASPWDBODIG-UHFFFAOYSA-N 1 0 301.436 4.394 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1ccc(N(C)C)cc1 ZINC000191859304 333283198 /nfs/dbraw/zinc/28/31/98/333283198.db2.gz WCIXCQJYOQCQFC-LRQRDZAKSA-N 1 0 324.468 4.181 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)c1 ZINC000019999494 333296213 /nfs/dbraw/zinc/29/62/13/333296213.db2.gz VSTSFPMGENVLBU-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1O ZINC000295946773 335138743 /nfs/dbraw/zinc/13/87/43/335138743.db2.gz GSIUNRUMBUKHPR-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(O)c1C ZINC000296633468 335145200 /nfs/dbraw/zinc/14/52/00/335145200.db2.gz BOAMBJKLIHTGMD-UONOGXRCSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)n1 ZINC000273409358 334046252 /nfs/dbraw/zinc/04/62/52/334046252.db2.gz HPYCXTKODXCNJS-BXUZGUMPSA-N 1 0 304.459 4.228 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1O ZINC000273462726 334047138 /nfs/dbraw/zinc/04/71/38/334047138.db2.gz QSLRXCFTIQDKBP-CRFBAAHOSA-N 1 0 315.388 4.102 20 10 DICDRO C[C@@H]([NH2+]CCCc1nccs1)c1cc2c(cc1O)CCCC2 ZINC000273467705 334047488 /nfs/dbraw/zinc/04/74/88/334047488.db2.gz JBKVKHGFHTZPAJ-CYBMUJFWSA-N 1 0 316.470 4.011 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(Cl)cn1 ZINC000274943837 334068007 /nfs/dbraw/zinc/06/80/07/334068007.db2.gz UAJPVXYCNUNSQP-CQSZACIVSA-N 1 0 315.848 4.186 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c(O)c1 ZINC000284319508 334143116 /nfs/dbraw/zinc/14/31/16/334143116.db2.gz ZSZSWSPSSBCTDO-KRWDZBQOSA-N 1 0 324.468 4.460 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c(O)c1 ZINC000285331971 334147167 /nfs/dbraw/zinc/14/71/67/334147167.db2.gz UHOWWBFCMCLGJW-JKSUJKDBSA-N 1 0 303.446 4.151 20 10 DICDRO C[C@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccc(N(C)C)cc1 ZINC000296272467 334231130 /nfs/dbraw/zinc/23/11/30/334231130.db2.gz DSEZXMUBVFXZGW-LBPRGKRZSA-N 1 0 323.362 4.017 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000192791334 336261939 /nfs/dbraw/zinc/26/19/39/336261939.db2.gz UGYPITVEXSZTAB-JLTOFOAXSA-N 1 0 323.392 4.434 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cccc(NC(C)=O)c1)c1ccccc1O ZINC000192947263 336285587 /nfs/dbraw/zinc/28/55/87/336285587.db2.gz JEITXJTUXYNAIB-FZKQIMNGSA-N 1 0 312.413 4.153 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccccc1O ZINC000367828748 336830252 /nfs/dbraw/zinc/83/02/52/336830252.db2.gz WCUSRLFQNMGRFI-MLGOLLRUSA-N 1 0 315.388 4.484 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)c(O)c1 ZINC000375243580 337006524 /nfs/dbraw/zinc/00/65/24/337006524.db2.gz ZEILGHORVLQRNX-VPWXQRGCSA-N 1 0 311.425 4.129 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccc(N(C)C)cc1 ZINC000375345269 337008447 /nfs/dbraw/zinc/00/84/47/337008447.db2.gz MYKFDLUTNVIZFX-FZKQIMNGSA-N 1 0 314.404 4.066 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccccc2-n2cccn2)c1 ZINC000185741692 337250908 /nfs/dbraw/zinc/25/09/08/337250908.db2.gz FFSBCVPXPOYACN-CVEARBPZSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000475191335 339440805 /nfs/dbraw/zinc/44/08/05/339440805.db2.gz CORJLQKHJUSYRH-UHFFFAOYSA-N 1 0 321.399 4.397 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC1=Cc2ccccc2OC1 ZINC000475205132 339441608 /nfs/dbraw/zinc/44/16/08/339441608.db2.gz QIRQBWFJIKFXQP-UHFFFAOYSA-N 1 0 318.420 4.052 20 10 DICDRO Cc1ccc2c(c1)[nH]cc2C1=CCN(c2cc[nH+]cc2C)CC1 ZINC000479364336 339532145 /nfs/dbraw/zinc/53/21/45/339532145.db2.gz IDVWDSVQMVOVOR-UHFFFAOYSA-N 1 0 303.409 4.473 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](c1cccnc1)C(C)C ZINC000479433122 339534881 /nfs/dbraw/zinc/53/48/81/339534881.db2.gz YENNEXRYYQVMHC-HXUWFJFHSA-N 1 0 307.441 4.369 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000479433403 339534884 /nfs/dbraw/zinc/53/48/84/339534884.db2.gz ARAOUMJYRJKMHD-ZDUSSCGKSA-N 1 0 313.832 4.386 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1cccc(C(F)(F)F)c1)CC2 ZINC000296104624 341716061 /nfs/dbraw/zinc/71/60/61/341716061.db2.gz UNWISLHUPVOBAF-CQSZACIVSA-N 1 0 307.315 4.188 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2c1cnn2C)c1ccc2ccccc2c1O ZINC000273392982 518183645 /nfs/dbraw/zinc/18/36/45/518183645.db2.gz LBXAQLVTQVPMDY-UGSOOPFHSA-N 1 0 321.424 4.007 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)cc1 ZINC000182113415 520283955 /nfs/dbraw/zinc/28/39/55/520283955.db2.gz DOYRBKGWPJMIJF-CYBMUJFWSA-N 1 0 303.837 4.042 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1ccccc1O ZINC000157899301 522712764 /nfs/dbraw/zinc/71/27/64/522712764.db2.gz URFFMCYJHUXOLV-DLBZAZTESA-N 1 0 315.388 4.486 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc(-n2cccn2)c1)c1ccccc1O ZINC000156151463 522738707 /nfs/dbraw/zinc/73/87/07/522738707.db2.gz YAWGWHHOUKTQMQ-BEFAXECRSA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)C[C@H](O)c1ccc(F)cc1)c1ccccc1O ZINC000156418449 522908965 /nfs/dbraw/zinc/90/89/65/522908965.db2.gz POURYCSJVBJQIQ-IRWQIABSSA-N 1 0 317.404 4.084 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1ccccc1O ZINC000157899448 522925688 /nfs/dbraw/zinc/92/56/88/522925688.db2.gz URFFMCYJHUXOLV-IAGOWNOFSA-N 1 0 315.388 4.486 20 10 DICDRO COc1ccsc1[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000186105687 524885279 /nfs/dbraw/zinc/88/52/79/524885279.db2.gz FTCDNQRVJYBKFK-AWEZNQCLSA-N 1 0 316.470 4.208 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C2CCN(c3ccccc3)CC2)c1 ZINC000185104276 525362184 /nfs/dbraw/zinc/36/21/84/525362184.db2.gz GNVZSZHIONKTSY-INIZCTEOSA-N 1 0 310.441 4.020 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)c1 ZINC000188050567 525364657 /nfs/dbraw/zinc/36/46/57/525364657.db2.gz WCEASWWNQPGVOA-LRDDRELGSA-N 1 0 301.361 4.014 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000178427843 525481989 /nfs/dbraw/zinc/48/19/89/525481989.db2.gz CZFOBDYRJIPOFH-MSOLQXFVSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000178427861 525501692 /nfs/dbraw/zinc/50/16/92/525501692.db2.gz CZFOBDYRJIPOFH-QZTJIDSGSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)c1cc(F)ccc1O ZINC000185225589 525599071 /nfs/dbraw/zinc/59/90/71/525599071.db2.gz HSCHFRDMXFZESX-FASAQXTFSA-N 1 0 315.388 4.102 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccc(N(C)C)cc1 ZINC000180716271 525648397 /nfs/dbraw/zinc/64/83/97/525648397.db2.gz ZUWHVLUJTOLMSE-FZKQIMNGSA-N 1 0 314.404 4.066 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(N2CCCCC2)cc1 ZINC000119301682 525685219 /nfs/dbraw/zinc/68/52/19/525685219.db2.gz YTPPUMKSVKZXIU-AEFFLSMTSA-N 1 0 316.489 4.285 20 10 DICDRO Cc1csc(C(C)(C)[NH2+]Cc2cc(Cl)cc(C)c2O)n1 ZINC000182214088 526321188 /nfs/dbraw/zinc/32/11/88/526321188.db2.gz HMPDHFYLFMDERN-UHFFFAOYSA-N 1 0 310.850 4.144 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000134918043 527584473 /nfs/dbraw/zinc/58/44/73/527584473.db2.gz OHKGRUNDSQMVEF-CHWSQXEVSA-N 1 0 301.434 4.064 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCOC)c1ccco1)c1ccc(N(C)C)cc1 ZINC000272626653 535931507 /nfs/dbraw/zinc/93/15/07/535931507.db2.gz ZNJMSBNLMAVIGZ-ROUUACIJSA-N 1 0 316.445 4.164 20 10 DICDRO COC1(C)CC[NH+](Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000272407137 536563909 /nfs/dbraw/zinc/56/39/09/536563909.db2.gz YIJSLGKRQSSWIX-UHFFFAOYSA-N 1 0 311.425 4.060 20 10 DICDRO COCc1cc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)ccc1F ZINC000273612554 536714733 /nfs/dbraw/zinc/71/47/33/536714733.db2.gz WOQFDCOEVFEKKG-CQSZACIVSA-N 1 0 317.404 4.145 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2cc(C)sc2C)c1O ZINC000037122996 1035943359 /nfs/dbraw/zinc/94/33/59/1035943359.db2.gz PHMXNDISBZOZTA-GFCCVEGCSA-N 1 0 305.443 4.320 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2ccccc2CF)C2CC2)cc1 ZINC001167108838 1036095337 /nfs/dbraw/zinc/09/53/37/1036095337.db2.gz VGBZNTWFQCJUJG-UHFFFAOYSA-N 1 0 312.432 4.387 20 10 DICDRO CCOC[C@@H]1CC[N@H+](Cc2cc(CC)cc(C(C)(C)C)c2O)C1 ZINC000748093225 1036113609 /nfs/dbraw/zinc/11/36/09/1036113609.db2.gz AJFPHOSCJONUKQ-MRXNPFEDSA-N 1 0 319.489 4.111 20 10 DICDRO c1ccc(Nc2ccc3c(c2)OCCN3)c(C[NH+]2CCCCC2)c1 ZINC001209766322 1036250745 /nfs/dbraw/zinc/25/07/45/1036250745.db2.gz OFIFXNLURZKUHT-UHFFFAOYSA-N 1 0 323.440 4.220 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccc(C#N)cc1 ZINC000075755703 1036700834 /nfs/dbraw/zinc/70/08/34/1036700834.db2.gz RYNXIPJTWYPQJU-KRWDZBQOSA-N 1 0 319.452 4.399 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc2c(s1)CCC2 ZINC000160544960 1037200294 /nfs/dbraw/zinc/20/02/94/1037200294.db2.gz OOBPKYJMRYYADO-CYBMUJFWSA-N 1 0 300.471 4.154 20 10 DICDRO C[N@H+](Cc1cccc(-c2ccncc2)c1)Cc1ccccc1O ZINC000091974437 1037353047 /nfs/dbraw/zinc/35/30/47/1037353047.db2.gz AVSGWEGPQSDLDK-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO CC[C@@H]([NH2+]Cc1cnc(C)cc1C)c1cc(Cl)ccc1O ZINC000834904455 1037744726 /nfs/dbraw/zinc/74/47/26/1037744726.db2.gz YJZDPHQEOIQPTK-MRXNPFEDSA-N 1 0 304.821 4.298 20 10 DICDRO C[C@H]([NH2+]Cc1cc(Br)ccc1O)c1ccccc1 ZINC000076275389 1037822465 /nfs/dbraw/zinc/82/24/65/1037822465.db2.gz ITNLDNIOCOBSLH-NSHDSACASA-N 1 0 306.203 4.006 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001140464715 1038128293 /nfs/dbraw/zinc/12/82/93/1038128293.db2.gz AMNKBIIPHCYMTB-ZDUSSCGKSA-N 1 0 305.780 4.174 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C2(CC)CCOCC2)cc1 ZINC000761336357 1038268738 /nfs/dbraw/zinc/26/87/38/1038268738.db2.gz IRJIKFCUMVXKFG-UHFFFAOYSA-N 1 0 318.505 4.362 20 10 DICDRO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001167533713 1038553677 /nfs/dbraw/zinc/55/36/77/1038553677.db2.gz KKILVVCOWYIKPS-MGPUTAFESA-N 1 0 312.432 4.475 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(Br)c1)c1ccccc1O ZINC000048817733 1038670159 /nfs/dbraw/zinc/67/01/59/1038670159.db2.gz ARDNPYNSJBLQFJ-OAHLLOKOSA-N 1 0 320.230 4.396 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2nc(C)c(C)s2)cc1 ZINC000127698444 1038677321 /nfs/dbraw/zinc/67/73/21/1038677321.db2.gz GMXGLTJKZNFKEO-AWEZNQCLSA-N 1 0 317.502 4.109 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccs1 ZINC000050286872 1038772011 /nfs/dbraw/zinc/77/20/11/1038772011.db2.gz RKYMOIXQMRSJMJ-INIZCTEOSA-N 1 0 300.471 4.371 20 10 DICDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)cn1 ZINC000161536632 1039142575 /nfs/dbraw/zinc/14/25/75/1039142575.db2.gz KMXCPMUVEWUQBQ-SFHVURJKSA-N 1 0 323.484 4.274 20 10 DICDRO C[C@@H]1CC[C@@H](C)[NH+]1Cc1cc(Cl)cc(Br)c1[O-] ZINC000708214543 1039158766 /nfs/dbraw/zinc/15/87/66/1039158766.db2.gz BVFFVFWVAKLSOU-RKDXNWHRSA-N 1 0 318.642 4.181 20 10 DICDRO CN(c1ccc(C[NH2+]Cc2cccn2C)cc1)C1CCCCC1 ZINC000161838306 1039431256 /nfs/dbraw/zinc/43/12/56/1039431256.db2.gz VNXCXXPNMDWCIR-UHFFFAOYSA-N 1 0 311.473 4.084 20 10 DICDRO C[C@@H]1C[C@H]1c1ccc(C[NH2+]CCCSc2nccs2)o1 ZINC000176797317 1039474857 /nfs/dbraw/zinc/47/48/57/1039474857.db2.gz JZLFHMHTYUACJS-DGCLKSJQSA-N 1 0 308.472 4.132 20 10 DICDRO Oc1ccccc1CN(Cc1c(F)cncc1F)C1CCCC1 ZINC000929636922 1039573998 /nfs/dbraw/zinc/57/39/98/1039573998.db2.gz YYYPRXVETKJZTI-UHFFFAOYSA-N 1 0 318.367 4.010 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CC=CCC1)c1cc(Br)ccc1O ZINC000088747605 1039596853 /nfs/dbraw/zinc/59/68/53/1039596853.db2.gz MPMVVCNMLIOWLH-GXTWGEPZSA-N 1 0 310.235 4.304 20 10 DICDRO CC[N@H+](CCc1nccs1)Cc1c(O)ccc2ccccc21 ZINC000134032441 1039615542 /nfs/dbraw/zinc/61/55/42/1039615542.db2.gz WVMVGCXZRFBIND-UHFFFAOYSA-N 1 0 312.438 4.067 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1O ZINC000309943573 1040355484 /nfs/dbraw/zinc/35/54/84/1040355484.db2.gz PEXDVUFPRVSJDN-QUCCMNQESA-N 1 0 324.468 4.098 20 10 DICDRO C[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1ccccn1 ZINC000725841533 1040543136 /nfs/dbraw/zinc/54/31/36/1040543136.db2.gz MHTLPNCQEVUBIW-HNNXBMFYSA-N 1 0 304.393 4.305 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2ccccc2Cl)c1O ZINC000177231364 1040577029 /nfs/dbraw/zinc/57/70/29/1040577029.db2.gz XWZBBGBETLNDKL-JTQLQIEISA-N 1 0 321.779 4.238 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2ccc(N(C)C)cc2)C(C)C)cc1 ZINC000066236468 1040737332 /nfs/dbraw/zinc/73/73/32/1040737332.db2.gz UWKMEFLBUJQEQO-HXUWFJFHSA-N 1 0 312.457 4.248 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1cccc(Cl)c1 ZINC000808733587 1041020627 /nfs/dbraw/zinc/02/06/27/1041020627.db2.gz YHIGMABKROYCIB-SUMWQHHRSA-N 1 0 319.832 4.392 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c1O ZINC000809694767 1041215576 /nfs/dbraw/zinc/21/55/76/1041215576.db2.gz STVPDAGMRCCPBI-IPMKNSEASA-N 1 0 323.436 4.169 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1 ZINC000809728659 1041223759 /nfs/dbraw/zinc/22/37/59/1041223759.db2.gz DYPMUPNQYXTZOY-FQEVSTJZSA-N 1 0 309.457 4.265 20 10 DICDRO COc1cccc(C[NH2+]Cc2cc3cc(C)c(C)cc3o2)c1O ZINC000809739870 1041239402 /nfs/dbraw/zinc/23/94/02/1041239402.db2.gz VMGFXDINCGMLJZ-UHFFFAOYSA-N 1 0 311.381 4.054 20 10 DICDRO CCOc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c(O)c1 ZINC000809782932 1041254479 /nfs/dbraw/zinc/25/44/79/1041254479.db2.gz LHZLNWPTAOMIKW-KRWDZBQOSA-N 1 0 317.454 4.436 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000809782906 1041254598 /nfs/dbraw/zinc/25/45/98/1041254598.db2.gz KPSJVPFQLRQCCY-MRXNPFEDSA-N 1 0 303.427 4.045 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000809783303 1041254982 /nfs/dbraw/zinc/25/49/82/1041254982.db2.gz XUSPVRJEOVIRIX-INIZCTEOSA-N 1 0 303.427 4.045 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2cscc2C(F)(F)F)cc1 ZINC000810126005 1041315144 /nfs/dbraw/zinc/31/51/44/1041315144.db2.gz QBTARNHLTKZPRP-UHFFFAOYSA-N 1 0 314.376 4.123 20 10 DICDRO CCC[C@](C)(O)C[NH2+][C@@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000810218011 1041337288 /nfs/dbraw/zinc/33/72/88/1041337288.db2.gz NQHKSPZNROBECN-ZFWWWQNUSA-N 1 0 319.367 4.003 20 10 DICDRO CC[C@@H]([NH2+]CCCSC)c1ccc(C(F)(F)F)cc1O ZINC000810217699 1041338139 /nfs/dbraw/zinc/33/81/39/1041338139.db2.gz AETRAQLLUWIRBM-GFCCVEGCSA-N 1 0 307.381 4.205 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CSC)c1ccc(C(F)(F)F)cc1O ZINC000810217782 1041338223 /nfs/dbraw/zinc/33/82/23/1041338223.db2.gz BHHAFWHYEBKPQO-JOYOIKCWSA-N 1 0 307.381 4.203 20 10 DICDRO CC[C@H]([NH2+]C[C@@]1(C)CCCO1)c1ccc(C(F)(F)F)cc1O ZINC000810222159 1041339446 /nfs/dbraw/zinc/33/94/46/1041339446.db2.gz OHWGJTDZXXFZKJ-DZGCQCFKSA-N 1 0 317.351 4.021 20 10 DICDRO CC[C@H](O)CCC[NH2+][C@@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000810227344 1041342198 /nfs/dbraw/zinc/34/21/98/1041342198.db2.gz VUNOAHDLJDBICP-JSGCOSHPSA-N 1 0 319.367 4.003 20 10 DICDRO CC[C@@H]([NH2+]C1CCSCC1)c1ccc(C(F)(F)F)cc1O ZINC000810225099 1041342410 /nfs/dbraw/zinc/34/24/10/1041342410.db2.gz TXRNEMGILZKOGJ-CYBMUJFWSA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@H]([NH2+]CCCCCCO)c1ccc(C(F)(F)F)cc1O ZINC000810229243 1041343575 /nfs/dbraw/zinc/34/35/75/1041343575.db2.gz AXELUEHSTSVDLA-AWEZNQCLSA-N 1 0 319.367 4.004 20 10 DICDRO CC[C@@H](O)CCC[NH2+][C@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000810227346 1041343906 /nfs/dbraw/zinc/34/39/06/1041343906.db2.gz VUNOAHDLJDBICP-TZMCWYRMSA-N 1 0 319.367 4.003 20 10 DICDRO CCOC(C)(C)C[NH2+][C@@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000810238308 1041352913 /nfs/dbraw/zinc/35/29/13/1041352913.db2.gz JAYDENDOODZDFY-ZDUSSCGKSA-N 1 0 319.367 4.267 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC[C@@H](c3ccccc3)O2)c1 ZINC000810250957 1041357136 /nfs/dbraw/zinc/35/71/36/1041357136.db2.gz QMNFNNVVAFRFHT-MDYRTPRTSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(N2CCCCCC2)cc1 ZINC000178315844 1041413450 /nfs/dbraw/zinc/41/34/50/1041413450.db2.gz IIQNMUGLZPAKGF-OBZTUIKSSA-N 1 0 314.473 4.038 20 10 DICDRO C[C@@H]([NH2+][C@@H]1COc2ccccc2C1)c1ccc2ccccc2c1O ZINC000328422612 1041435561 /nfs/dbraw/zinc/43/55/61/1041435561.db2.gz ZKAIIRYHJPTGCL-PBHICJAKSA-N 1 0 319.404 4.200 20 10 DICDRO CC(C)([NH2+]Cc1cc(Br)ccc1O)c1ccccc1 ZINC000312001880 1041513754 /nfs/dbraw/zinc/51/37/54/1041513754.db2.gz YGDUYEJOHBMQTP-UHFFFAOYSA-N 1 0 320.230 4.180 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc(Cl)cc2)c(O)c1C ZINC000756365556 1041521437 /nfs/dbraw/zinc/52/14/37/1041521437.db2.gz BAOGHJFUWIAKHX-GUYCJALGSA-N 1 0 319.832 4.047 20 10 DICDRO C[C@H]([NH2+]Cc1ccnc(Cl)c1Cl)c1ccc(N(C)C)cc1 ZINC000811491400 1041524903 /nfs/dbraw/zinc/52/49/03/1041524903.db2.gz KKQAJTKDPPBWQX-NSHDSACASA-N 1 0 324.255 4.305 20 10 DICDRO CCCN(Cc1ccc(SC)s1)c1ccc(C[NH3+])cc1 ZINC000811495782 1041526054 /nfs/dbraw/zinc/52/60/54/1041526054.db2.gz KVHOGTMCZHBGLE-UHFFFAOYSA-N 1 0 306.500 4.345 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)cc1C(C)C ZINC000811781196 1041567160 /nfs/dbraw/zinc/56/71/60/1041567160.db2.gz ZTTBZELGLPIOED-RBUKOAKNSA-N 1 0 317.473 4.213 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C)ccc2OC(F)F)c(O)c1 ZINC000185695447 1041619514 /nfs/dbraw/zinc/61/95/14/1041619514.db2.gz SQHJSLRDBPYFGO-CYBMUJFWSA-N 1 0 321.367 4.461 20 10 DICDRO C[C@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccc(F)cc1[O-] ZINC000185803670 1041621390 /nfs/dbraw/zinc/62/13/90/1041621390.db2.gz XTZSJORTUDXCOL-JTQLQIEISA-N 1 0 318.373 4.099 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2cc3ccccc3o2)c1 ZINC000186070054 1041625385 /nfs/dbraw/zinc/62/53/85/1041625385.db2.gz LEPAZOYDKFRKMK-CYBMUJFWSA-N 1 0 311.381 4.040 20 10 DICDRO COc1ccc(O)c(C[NH2+]Cc2ccc(C3CCCC3)cc2)c1 ZINC000812756798 1041645765 /nfs/dbraw/zinc/64/57/65/1041645765.db2.gz WJFRFRJGVKTRTC-UHFFFAOYSA-N 1 0 311.425 4.348 20 10 DICDRO CCOc1cccc(C[NH2+]CCc2ccc(Cl)c(C)c2)c1O ZINC000812772767 1041645945 /nfs/dbraw/zinc/64/59/45/1041645945.db2.gz IFGQZLIFUAYONH-UHFFFAOYSA-N 1 0 319.832 4.085 20 10 DICDRO C[N@H+](Cc1cc(F)ccc1O)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000812780927 1041646854 /nfs/dbraw/zinc/64/68/54/1041646854.db2.gz BOOUTXCCJOHHGU-OLZOCXBDSA-N 1 0 305.315 4.084 20 10 DICDRO COc1ccc(N2CCC([NH2+]CCC3CCCCC3)CC2)cc1 ZINC000812824083 1041649837 /nfs/dbraw/zinc/64/98/37/1041649837.db2.gz RWTMNARJUOCJMA-UHFFFAOYSA-N 1 0 316.489 4.224 20 10 DICDRO CC[C@H](C)C[C@@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000812836206 1041655484 /nfs/dbraw/zinc/65/54/84/1041655484.db2.gz STAYZNGFFDNBJM-JKSUJKDBSA-N 1 0 304.478 4.078 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCc2ccccc2F)c1 ZINC000813330979 1041697697 /nfs/dbraw/zinc/69/76/97/1041697697.db2.gz KOXMLQXTDBKRSE-ZIAGYGMSSA-N 1 0 317.404 4.212 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2CCCC[C@@H]2CC)ccc1OC ZINC000747854625 1041703017 /nfs/dbraw/zinc/70/30/17/1041703017.db2.gz UADFFOKHVOXROV-WMZOPIPTSA-N 1 0 305.462 4.290 20 10 DICDRO CCOCc1cc(C[NH2+]CC2CCC(C)CC2)ccc1OC ZINC000747854952 1041708444 /nfs/dbraw/zinc/70/84/44/1041708444.db2.gz VXGQLBQXVPWXEY-UHFFFAOYSA-N 1 0 305.462 4.148 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2oc3ccccc3c2C)c1O ZINC000191724144 1041732506 /nfs/dbraw/zinc/73/25/06/1041732506.db2.gz XINUALHJRZNSFB-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000813791012 1041732827 /nfs/dbraw/zinc/73/28/27/1041732827.db2.gz OBIVQLCJCLDFFZ-UHFFFAOYSA-N 1 0 307.846 4.447 20 10 DICDRO COCC(C)(C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000813882891 1041742455 /nfs/dbraw/zinc/74/24/55/1041742455.db2.gz NWMJHDKZJVIQSF-OAHLLOKOSA-N 1 0 322.468 4.139 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2)c(O)c1C ZINC000756572405 1041746674 /nfs/dbraw/zinc/74/66/74/1041746674.db2.gz GEKARBHFJXBLFZ-HUUCEWRRSA-N 1 0 301.434 4.198 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(F)cn2)cc1F ZINC000092747840 1041760664 /nfs/dbraw/zinc/76/06/64/1041760664.db2.gz AETUNBMKWBMBAD-ZDUSSCGKSA-N 1 0 319.399 4.057 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2cncc(F)c2)cc1 ZINC000781920937 1041760696 /nfs/dbraw/zinc/76/06/96/1041760696.db2.gz CALOIHSCMRWDEF-KBPBESRZSA-N 1 0 301.409 4.089 20 10 DICDRO Oc1ccccc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000759826885 1041761580 /nfs/dbraw/zinc/76/15/80/1041761580.db2.gz AMXMCDPPMXJVHG-UHFFFAOYSA-N 1 0 308.208 4.478 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CC3(CCC3)[C@H]2C(C)C)c1O ZINC000814171254 1041779517 /nfs/dbraw/zinc/77/95/17/1041779517.db2.gz MOKWIBXKUBZAAJ-MRXNPFEDSA-N 1 0 309.837 4.065 20 10 DICDRO CSc1ccccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000194836547 1041794415 /nfs/dbraw/zinc/79/44/15/1041794415.db2.gz YQPPRCSTNQTMOL-AWEZNQCLSA-N 1 0 300.471 4.325 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000756624845 1041808255 /nfs/dbraw/zinc/80/82/55/1041808255.db2.gz GXQBYXWVZFEEJY-LBPRGKRZSA-N 1 0 305.418 4.412 20 10 DICDRO C[C@@H]([NH2+][C@H]1C=CCCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000815082397 1041912901 /nfs/dbraw/zinc/91/29/01/1041912901.db2.gz OMJKNLTVRFBCHN-MJGOQNOKSA-N 1 0 314.473 4.063 20 10 DICDRO CC(F)(F)c1ccc(C[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000815141599 1041924664 /nfs/dbraw/zinc/92/46/64/1041924664.db2.gz CMGRAWSWQPCNEW-UHFFFAOYSA-N 1 0 311.759 4.447 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCSc2ccccc2)c(O)c1 ZINC000815554810 1041962082 /nfs/dbraw/zinc/96/20/82/1041962082.db2.gz JKHOHNJWHWJXML-OAHLLOKOSA-N 1 0 301.455 4.452 20 10 DICDRO Cc1cc(F)ccc1[C@H](C)[NH2+]CCCSc1nccs1 ZINC000815581304 1041965616 /nfs/dbraw/zinc/96/56/16/1041965616.db2.gz BRMIDHSJSZCZCP-LBPRGKRZSA-N 1 0 310.463 4.424 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cn1 ZINC000815578736 1041965638 /nfs/dbraw/zinc/96/56/38/1041965638.db2.gz VAUAZPHOZSXTLP-HNNXBMFYSA-N 1 0 314.429 4.044 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+][C@H]1CCSC1 ZINC000815595245 1041969690 /nfs/dbraw/zinc/96/96/90/1041969690.db2.gz LNCBGRCUZHWNDT-WMZOPIPTSA-N 1 0 313.466 4.161 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CC(C)(C)[C@H]2CCCCO2)c(O)c1 ZINC000815596221 1041971000 /nfs/dbraw/zinc/97/10/00/1041971000.db2.gz NUQZZKGZJLYRHD-NVXWUHKLSA-N 1 0 305.462 4.255 20 10 DICDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000815571774 1041972609 /nfs/dbraw/zinc/97/26/09/1041972609.db2.gz LQDXRXJCULVHIP-OAHLLOKOSA-N 1 0 312.432 4.367 20 10 DICDRO COC1CCC(CC[NH2+][C@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000815616289 1041974866 /nfs/dbraw/zinc/97/48/66/1041974866.db2.gz KQRUXDCXLILHME-KLAILNCOSA-N 1 0 305.462 4.255 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]C[C@H]1CCC=CO1 ZINC000815618998 1041976702 /nfs/dbraw/zinc/97/67/02/1041976702.db2.gz ZMQNIDVLENALMC-QUCCMNQESA-N 1 0 323.436 4.348 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)c(O)c1 ZINC000815623882 1041977453 /nfs/dbraw/zinc/97/74/53/1041977453.db2.gz JUMWIDFAPJUATO-OAGGEKHMSA-N 1 0 305.462 4.253 20 10 DICDRO COc1cc(CC[NH2+][C@H](C)c2cc(F)ccc2O)ccc1Cl ZINC000815657373 1041980397 /nfs/dbraw/zinc/98/03/97/1041980397.db2.gz XLDWHOWFDSTSHI-LLVKDONJSA-N 1 0 323.795 4.087 20 10 DICDRO COc1cc(CC[NH2+][C@@H](C)c2ccc(C)cc2O)ccc1Cl ZINC000815657660 1041981152 /nfs/dbraw/zinc/98/11/52/1041981152.db2.gz FGAGNUAWLLDAON-ZDUSSCGKSA-N 1 0 319.832 4.256 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cccc(C(F)(F)F)n2)c(O)c1 ZINC000815637414 1041981580 /nfs/dbraw/zinc/98/15/80/1041981580.db2.gz WAQMZZPTMCCJBT-LBPRGKRZSA-N 1 0 324.346 4.008 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1Cl ZINC000756757755 1041982329 /nfs/dbraw/zinc/98/23/29/1041982329.db2.gz BRHDLWYISVAXGR-GTNSWQLSSA-N 1 0 323.795 4.223 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2c(F)cc(F)cc2F)c(O)c1 ZINC000815649753 1041985472 /nfs/dbraw/zinc/98/54/72/1041985472.db2.gz XYSMPBNDDQVVOF-NSHDSACASA-N 1 0 309.331 4.277 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@H](C(C)(C)C)C1)c1cc(Cl)ccc1O ZINC000756778770 1042017759 /nfs/dbraw/zinc/01/77/59/1042017759.db2.gz PLHFLPFLQIPMLD-RBOXIYTFSA-N 1 0 311.853 4.290 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](c2ccccc2)C(C)C)c1O ZINC000748050423 1042033336 /nfs/dbraw/zinc/03/33/36/1042033336.db2.gz ASTNBBMTVVSBML-GOSISDBHSA-N 1 0 315.388 4.221 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc3ccccc3c2O)cc1 ZINC000816477581 1042055414 /nfs/dbraw/zinc/05/54/14/1042055414.db2.gz CNFRPHMUOZMPMM-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816482685 1042055950 /nfs/dbraw/zinc/05/59/50/1042055950.db2.gz OYLKIAGLRPNKOY-LJQANCHMSA-N 1 0 306.409 4.221 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2ccc3ccccc3c2O)c1 ZINC000816480940 1042056578 /nfs/dbraw/zinc/05/65/78/1042056578.db2.gz BXLISUAXCVPQDY-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO COCc1ccccc1/C=C(\C)C[N@H+](C)Cc1ccccc1O ZINC000816493383 1042057049 /nfs/dbraw/zinc/05/70/49/1042057049.db2.gz ZBXBWDNYWFWPOI-FOWTUZBSSA-N 1 0 311.425 4.074 20 10 DICDRO CC[N@H+](CCc1ccccn1)Cc1ccc2ccccc2c1O ZINC000816496011 1042057105 /nfs/dbraw/zinc/05/71/05/1042057105.db2.gz RZVPGFQBNKEWPN-UHFFFAOYSA-N 1 0 306.409 4.005 20 10 DICDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc3ccccc3c2O)no1 ZINC000816488212 1042057964 /nfs/dbraw/zinc/05/79/64/1042057964.db2.gz LQHJTXCYLHWSFZ-GOSISDBHSA-N 1 0 308.381 4.179 20 10 DICDRO Oc1c(C[NH2+]CCc2cc(F)cc(F)c2)ccc2ccccc21 ZINC000816545756 1042063070 /nfs/dbraw/zinc/06/30/70/1042063070.db2.gz GITVATDBEGEYSJ-UHFFFAOYSA-N 1 0 313.347 4.156 20 10 DICDRO Oc1c(C[NH2+]C[C@@H]2CCOc3ccccc32)ccc2ccccc21 ZINC000816549140 1042064978 /nfs/dbraw/zinc/06/49/78/1042064978.db2.gz FWCKFDIYNHPKAB-INIZCTEOSA-N 1 0 319.404 4.201 20 10 DICDRO CC(C)[C@H](C[NH2+]Cc1ccc2ccccc2c1O)c1cccnc1 ZINC000816555499 1042067013 /nfs/dbraw/zinc/06/70/13/1042067013.db2.gz HJEYDSAEILGQSB-FQEVSTJZSA-N 1 0 320.436 4.470 20 10 DICDRO CC(C)[C@H]1OCCC[C@H]1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816555260 1042067263 /nfs/dbraw/zinc/06/72/63/1042067263.db2.gz YQCORIOIEAHRKP-FXAWDEMLSA-N 1 0 313.441 4.086 20 10 DICDRO COC1CCC(CC[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816569410 1042068676 /nfs/dbraw/zinc/06/86/76/1042068676.db2.gz KMYXDJPQAWBRPF-UHFFFAOYSA-N 1 0 313.441 4.230 20 10 DICDRO C[C@@H](C[N@H+](C)Cc1ccc2ccccc2c1O)c1nccs1 ZINC000816568859 1042068815 /nfs/dbraw/zinc/06/88/15/1042068815.db2.gz RXCRFCYWOPBZRD-ZDUSSCGKSA-N 1 0 312.438 4.237 20 10 DICDRO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816594976 1042069871 /nfs/dbraw/zinc/06/98/71/1042069871.db2.gz VBIBDROTVYFHEQ-NHYWBVRUSA-N 1 0 309.331 4.318 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@H]2c2ccncc2)ccc2ccccc21 ZINC000816610641 1042072739 /nfs/dbraw/zinc/07/27/39/1042072739.db2.gz SBDLNATZGNBOAR-LJQANCHMSA-N 1 0 304.393 4.278 20 10 DICDRO Oc1c(C[NH+]2CC(c3ccccc3F)C2)ccc2ccccc21 ZINC000816616934 1042073556 /nfs/dbraw/zinc/07/35/56/1042073556.db2.gz JYUZJUILQWVXLJ-UHFFFAOYSA-N 1 0 307.368 4.284 20 10 DICDRO Oc1c(C[NH2+]Cc2c(F)cc(F)cc2F)ccc2ccccc21 ZINC000816651121 1042076334 /nfs/dbraw/zinc/07/63/34/1042076334.db2.gz UDZFBFKCBACCKR-UHFFFAOYSA-N 1 0 317.310 4.253 20 10 DICDRO C[C@H]([NH2+]CC1SCCS1)c1ccc2ccccc2c1O ZINC000692856750 1042077855 /nfs/dbraw/zinc/07/78/55/1042077855.db2.gz RGGYLKCDLVGLHO-NSHDSACASA-N 1 0 305.468 4.002 20 10 DICDRO Cc1cc(Br)c([O-])c(C[N@H+]2CCC[C@@H]2C(C)C)c1 ZINC001204657558 1042123383 /nfs/dbraw/zinc/12/33/83/1042123383.db2.gz IFXRKVGLVOAARD-CQSZACIVSA-N 1 0 312.251 4.084 20 10 DICDRO C[C@H]([NH2+]CCCOCC1CC1)c1ccc(N2CCCCC2)cc1 ZINC000162886781 1042093609 /nfs/dbraw/zinc/09/36/09/1042093609.db2.gz LYMCQVYRAHVRBT-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000817366779 1042106042 /nfs/dbraw/zinc/10/60/42/1042106042.db2.gz ZFFSKTCJUCZECM-GFCCVEGCSA-N 1 0 324.346 4.105 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000817408886 1042106872 /nfs/dbraw/zinc/10/68/72/1042106872.db2.gz RKGULWXKSQOSTB-OAHLLOKOSA-N 1 0 321.779 4.188 20 10 DICDRO COc1ccc2oc([C@@H](C)[NH2+]CCc3ccc(N)cc3)c(C)c2c1 ZINC000817956142 1042131017 /nfs/dbraw/zinc/13/10/17/1042131017.db2.gz RQQBTUNMODPFFG-CQSZACIVSA-N 1 0 324.424 4.225 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(N2CCCCC2)cc1 ZINC000817956003 1042131206 /nfs/dbraw/zinc/13/12/06/1042131206.db2.gz NHFSQRLZAGOINB-QGZVFWFLSA-N 1 0 323.484 4.152 20 10 DICDRO CCSc1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955614 1042131491 /nfs/dbraw/zinc/13/14/91/1042131491.db2.gz CVJHYHDUDTZMBV-CQSZACIVSA-N 1 0 300.471 4.274 20 10 DICDRO C[C@@H]([NH2+]C[C@H](N)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000817955315 1042131525 /nfs/dbraw/zinc/13/15/25/1042131525.db2.gz VOFSAURISWUSDN-UTKZUKDTSA-N 1 0 323.484 4.028 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(Cl)c(Cl)c1 ZINC000817955845 1042131623 /nfs/dbraw/zinc/13/16/23/1042131623.db2.gz JDUHFTFMZUCBMI-LLVKDONJSA-N 1 0 309.240 4.469 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](N)c2ccc(C(C)C)cc2)c1 ZINC000817952205 1042131630 /nfs/dbraw/zinc/13/16/30/1042131630.db2.gz CUCBOXZABXQAIA-BEFAXECRSA-N 1 0 312.457 4.175 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1cccc(C(F)(F)F)c1 ZINC000817956251 1042132247 /nfs/dbraw/zinc/13/22/47/1042132247.db2.gz UUHTVYNEUCTXTO-GFCCVEGCSA-N 1 0 308.347 4.181 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000817957159 1042132282 /nfs/dbraw/zinc/13/22/82/1042132282.db2.gz JRGGIRUBBACSHA-LPHOPBHVSA-N 1 0 314.860 4.391 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CCc1ccc(N)cc1 ZINC000817957996 1042132479 /nfs/dbraw/zinc/13/24/79/1042132479.db2.gz RWRZQLLJODTCNZ-HXUWFJFHSA-N 1 0 319.452 4.268 20 10 DICDRO CSc1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1F ZINC000817956440 1042132899 /nfs/dbraw/zinc/13/28/99/1042132899.db2.gz YZEXVEULFQHBLA-LBPRGKRZSA-N 1 0 304.434 4.023 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1cc(Cl)ccc1O ZINC000817968096 1042134727 /nfs/dbraw/zinc/13/47/27/1042134727.db2.gz PAHCCBYFZLFPSY-GTNSWQLSSA-N 1 0 316.832 4.356 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C)cc(N)c1)c1cc(Cl)ccc1O ZINC000817981516 1042136216 /nfs/dbraw/zinc/13/62/16/1042136216.db2.gz SPFDITOEIIEWMP-MRXNPFEDSA-N 1 0 304.821 4.177 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)cc1 ZINC000817977388 1042136342 /nfs/dbraw/zinc/13/63/42/1042136342.db2.gz JDRKVDXSPZPWAZ-MRXNPFEDSA-N 1 0 323.484 4.352 20 10 DICDRO CSc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000178591083 1042351295 /nfs/dbraw/zinc/35/12/95/1042351295.db2.gz UKKOCNJUXZTUCU-CQSZACIVSA-N 1 0 300.471 4.325 20 10 DICDRO CCOCC(C)(C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000319391805 1042365736 /nfs/dbraw/zinc/36/57/36/1042365736.db2.gz YCXSNHNEJBRRJL-AWEZNQCLSA-N 1 0 301.430 4.259 20 10 DICDRO CCOCC(C)(C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000319391807 1042365855 /nfs/dbraw/zinc/36/58/55/1042365855.db2.gz YCXSNHNEJBRRJL-CQSZACIVSA-N 1 0 301.430 4.259 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2cccc(C#N)c2)cc1 ZINC000237001092 1042373874 /nfs/dbraw/zinc/37/38/74/1042373874.db2.gz OOZONXJCIIXJSN-UHFFFAOYSA-N 1 0 321.468 4.474 20 10 DICDRO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)o1 ZINC000237468525 1042376774 /nfs/dbraw/zinc/37/67/74/1042376774.db2.gz OIUYJSHVWHPCEU-RDTXWAMCSA-N 1 0 310.441 4.075 20 10 DICDRO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](CC)c2ccc(C)cc2O)[nH]1 ZINC000279930467 1042385659 /nfs/dbraw/zinc/38/56/59/1042385659.db2.gz AQMPFBPNAVBSBY-GUTXKFCHSA-N 1 0 316.449 4.134 20 10 DICDRO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](CC)c2ccc(C)cc2O)[nH]1 ZINC000279930482 1042386490 /nfs/dbraw/zinc/38/64/90/1042386490.db2.gz AQMPFBPNAVBSBY-YDHLFZDLSA-N 1 0 316.449 4.134 20 10 DICDRO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1ccc2ccccc2c1O ZINC000248732969 1042445466 /nfs/dbraw/zinc/44/54/66/1042445466.db2.gz PCEUOLMTUHQXTA-NLKHACGTSA-N 1 0 323.436 4.154 20 10 DICDRO CCC[C@H](CCc1ccccc1)[NH2+]Cc1cccc(OC)c1O ZINC000237028354 1042465998 /nfs/dbraw/zinc/46/59/98/1042465998.db2.gz ZJQXXAKHFNKXNJ-GOSISDBHSA-N 1 0 313.441 4.292 20 10 DICDRO CC[C@H]([NH2+]Cc1csc([C@@H](C)OC)n1)c1ccc(C)cc1O ZINC000280097785 1042564279 /nfs/dbraw/zinc/56/42/79/1042564279.db2.gz MXGVRZGPDLORME-DOMZBBRYSA-N 1 0 320.458 4.105 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2ncccc2c1)c1ccc(C)cc1O ZINC000280077232 1042564333 /nfs/dbraw/zinc/56/43/33/1042564333.db2.gz LLWYZGRCPXUZPS-SFHVURJKSA-N 1 0 306.409 4.490 20 10 DICDRO CC[C@H]([NH2+][C@H](CCOC)c1ccc(C)o1)c1ccc(C)cc1O ZINC000280272578 1042569152 /nfs/dbraw/zinc/56/91/52/1042569152.db2.gz YACQZRAZGCDAQV-DLBZAZTESA-N 1 0 317.429 4.421 20 10 DICDRO COc1ccc(O)c(C[NH2+]C(C)(C)c2ccc(Cl)cc2)c1 ZINC000271871385 1042670846 /nfs/dbraw/zinc/67/08/46/1042670846.db2.gz MRTNWCSZHPLRQM-UHFFFAOYSA-N 1 0 305.805 4.079 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccccc2N2CCCCC2)cc1 ZINC000237126789 1042678402 /nfs/dbraw/zinc/67/84/02/1042678402.db2.gz CPRMNDHZCULLCQ-UHFFFAOYSA-N 1 0 323.484 4.033 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(SC)cc2)c1O ZINC000894651549 1042971514 /nfs/dbraw/zinc/97/15/14/1042971514.db2.gz GVYGHZJGIIKEHK-CYBMUJFWSA-N 1 0 317.454 4.282 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccccc2SC)c1O ZINC000894659792 1042972462 /nfs/dbraw/zinc/97/24/62/1042972462.db2.gz CBFDNCNCFXFBJB-ZDUSSCGKSA-N 1 0 317.454 4.282 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2cc(C)cc(OC)c2O)c1 ZINC000894843868 1042985246 /nfs/dbraw/zinc/98/52/46/1042985246.db2.gz KNXLXXAYDMCAQJ-UHFFFAOYSA-N 1 0 317.454 4.111 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccc(C)cc1O ZINC000794805428 1043048892 /nfs/dbraw/zinc/04/88/92/1043048892.db2.gz GPYSZSXWNJDFFW-RHSMWYFYSA-N 1 0 301.434 4.280 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)Cc1cccc(OC)c1)c1ccc(C)cc1O ZINC000794810900 1043056977 /nfs/dbraw/zinc/05/69/77/1043056977.db2.gz NPQCTNUVSUVYDC-HNAYVOBHSA-N 1 0 313.441 4.381 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](CC)c2ccc(C)cc2O)cn1 ZINC000794809046 1043057961 /nfs/dbraw/zinc/05/79/61/1043057961.db2.gz PPUHIVPDSYWIGE-QGZVFWFLSA-N 1 0 314.429 4.125 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccc(C)cc1O ZINC000794814390 1043059254 /nfs/dbraw/zinc/05/92/54/1043059254.db2.gz FHHCYRDJFXXFKP-HUUCEWRRSA-N 1 0 319.351 4.153 20 10 DICDRO CC[C@@H]([NH2+]CC[C@@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000794814580 1043059631 /nfs/dbraw/zinc/05/96/31/1043059631.db2.gz LVOWCAXMXMMPCD-UYAOXDASSA-N 1 0 313.441 4.039 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@H](CC(C)C)C1)c1ccc(C)cc1O ZINC000794813891 1043059741 /nfs/dbraw/zinc/05/97/41/1043059741.db2.gz QLLCUAOLIMBBBW-JZXOWHBKSA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)c1ccc(C)cc1O ZINC000794817090 1043061972 /nfs/dbraw/zinc/06/19/72/1043061972.db2.gz OVPNXYCDRRMGKP-UWWQBHOKSA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1ccc(C)cc1O ZINC000794819889 1043065283 /nfs/dbraw/zinc/06/52/83/1043065283.db2.gz YFCZOJWRXLSGRF-AEFFLSMTSA-N 1 0 305.462 4.337 20 10 DICDRO CCC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@@H](O)c1ccccc1 ZINC000794831280 1043067200 /nfs/dbraw/zinc/06/72/00/1043067200.db2.gz PNFKCWSVOUIRCN-IXDGSTSKSA-N 1 0 317.404 4.084 20 10 DICDRO CCC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@H](O)c1ccccc1 ZINC000794831281 1043067489 /nfs/dbraw/zinc/06/74/89/1043067489.db2.gz PNFKCWSVOUIRCN-SOVGHPHASA-N 1 0 317.404 4.084 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000178427853 1043129711 /nfs/dbraw/zinc/12/97/11/1043129711.db2.gz CZFOBDYRJIPOFH-ZWKOTPCHSA-N 1 0 316.489 4.144 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc([C@@H](C)O)cc1)c1ccc(N(C)C)cc1 ZINC000178550289 1043132777 /nfs/dbraw/zinc/13/27/77/1043132777.db2.gz LSVRFZBCFQGNBM-QRWLVFNGSA-N 1 0 312.457 4.047 20 10 DICDRO Oc1ccccc1C[NH2+][C@@H]1CCCO[C@H]1c1ccc(Cl)cc1 ZINC000865831033 1043138531 /nfs/dbraw/zinc/13/85/31/1043138531.db2.gz XTKNSSVODNZCEO-AEFFLSMTSA-N 1 0 317.816 4.056 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(Cl)nc2)cc1 ZINC000179108460 1043140538 /nfs/dbraw/zinc/14/05/38/1043140538.db2.gz CEVHBTMXUAZHJS-AWEZNQCLSA-N 1 0 317.864 4.432 20 10 DICDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cc2cnccc2o1 ZINC000865854562 1043142217 /nfs/dbraw/zinc/14/22/17/1043142217.db2.gz QEMZNOZTBAXGQW-RGDDUWESSA-N 1 0 321.424 4.258 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccc1N(C)C ZINC000179400931 1043144692 /nfs/dbraw/zinc/14/46/92/1043144692.db2.gz GLFQCOOJPUTXAE-KRWDZBQOSA-N 1 0 323.484 4.204 20 10 DICDRO CC(C)COC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccco1 ZINC000183478111 1043164581 /nfs/dbraw/zinc/16/45/81/1043164581.db2.gz SUMAFZPANPLDSR-GOEBONIOSA-N 1 0 303.402 4.050 20 10 DICDRO C[C@H](CCc1cncc2ccccc21)[NH2+]Cc1ccccc1O ZINC000866253495 1043165963 /nfs/dbraw/zinc/16/59/63/1043165963.db2.gz JLIXKYRYFGOPLH-OAHLLOKOSA-N 1 0 306.409 4.051 20 10 DICDRO Cc1ccc(OC(F)F)c(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000183553828 1043167049 /nfs/dbraw/zinc/16/70/49/1043167049.db2.gz AKJPOTQXCPRNGW-LBPRGKRZSA-N 1 0 307.340 4.153 20 10 DICDRO C[C@H]([NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1)c1ccccc1O ZINC000183628906 1043168285 /nfs/dbraw/zinc/16/82/85/1043168285.db2.gz WPJICCZRALJNBL-BXWFABGCSA-N 1 0 311.425 4.211 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1[N+](=O)[O-] ZINC000183614508 1043169099 /nfs/dbraw/zinc/16/90/99/1043169099.db2.gz FKGOCHKLXAUFSX-OLZOCXBDSA-N 1 0 300.358 4.021 20 10 DICDRO CC(C)[C@H]([NH2+]CCCSc1nccs1)c1ccccn1 ZINC000866269691 1043169704 /nfs/dbraw/zinc/16/97/04/1043169704.db2.gz LMESMTJBPFQAMB-AWEZNQCLSA-N 1 0 307.488 4.007 20 10 DICDRO CC(C)COC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccco1 ZINC000185289481 1043198609 /nfs/dbraw/zinc/19/86/09/1043198609.db2.gz WDGHPQQIMQDJNJ-CZUORRHYSA-N 1 0 321.392 4.189 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)c1 ZINC000185288872 1043199457 /nfs/dbraw/zinc/19/94/57/1043199457.db2.gz YFDCKDOEXJVZGE-WBVHZDCISA-N 1 0 317.429 4.358 20 10 DICDRO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cs1 ZINC000185425173 1043201139 /nfs/dbraw/zinc/20/11/39/1043201139.db2.gz XSSRGAVMKKQRNB-NXEZZACHSA-N 1 0 310.850 4.476 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3cccnc3c2)c(O)c1C ZINC000866431656 1043201814 /nfs/dbraw/zinc/20/18/14/1043201814.db2.gz ZBZDCNBJZNNSOP-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO Cc1nccn1CCCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185545170 1043202020 /nfs/dbraw/zinc/20/20/20/1043202020.db2.gz ZZAXFFNDCWIPQE-OAHLLOKOSA-N 1 0 323.440 4.181 20 10 DICDRO Cc1cccnc1[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)C(C)C ZINC000185458521 1043202431 /nfs/dbraw/zinc/20/24/31/1043202431.db2.gz FCELNLYHSCIJLC-DYVFJYSZSA-N 1 0 302.393 4.283 20 10 DICDRO C[C@H]([NH2+][C@@H](CCCO)c1ccccc1)c1cc(Cl)ccc1O ZINC000185532002 1043202799 /nfs/dbraw/zinc/20/27/99/1043202799.db2.gz ZGEHSNLZTAGABE-GUYCJALGSA-N 1 0 319.832 4.210 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(-n3cccn3)cc2)c(O)c1 ZINC000185611929 1043204583 /nfs/dbraw/zinc/20/45/83/1043204583.db2.gz ZHKVUQLURSVGIV-HOTGVXAUSA-N 1 0 321.424 4.298 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@H](C)c2ccc(C)cc2O)on1 ZINC000185562047 1043205263 /nfs/dbraw/zinc/20/52/63/1043205263.db2.gz PVBVUKOVFJDEFF-CYBMUJFWSA-N 1 0 302.418 4.443 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000185678404 1043206092 /nfs/dbraw/zinc/20/60/92/1043206092.db2.gz SKEPSGDIDHNIAJ-SNVBAGLBSA-N 1 0 308.809 4.009 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc2c1CCOC2)c1ccc(C)cc1O ZINC000866477829 1043206668 /nfs/dbraw/zinc/20/66/68/1043206668.db2.gz CBHCTJQVNFGGRK-LJQANCHMSA-N 1 0 311.425 4.014 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21)c1ccc2ccccc2c1O ZINC000185772726 1043206980 /nfs/dbraw/zinc/20/69/80/1043206980.db2.gz IDDHLXYSBYOVMV-JGNHQEBTSA-N 1 0 311.425 4.154 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc2c1CCOC2)c1ccc(N(C)C)cc1 ZINC000866479643 1043207331 /nfs/dbraw/zinc/20/73/31/1043207331.db2.gz WSLZOOUGAVBKBQ-NRFANRHFSA-N 1 0 324.468 4.066 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2cc(OC)ccc2O)CCCC1 ZINC000185748584 1043207645 /nfs/dbraw/zinc/20/76/45/1043207645.db2.gz AOYCCWKBQMTJAE-OAHLLOKOSA-N 1 0 321.461 4.038 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC(F)F)c2)c(O)c1 ZINC000185982625 1043210359 /nfs/dbraw/zinc/21/03/59/1043210359.db2.gz MJGCHVCGTHLQGX-CYBMUJFWSA-N 1 0 321.367 4.195 20 10 DICDRO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000186057506 1043211845 /nfs/dbraw/zinc/21/18/45/1043211845.db2.gz LVPKTKMSXUZIRD-HUUCEWRRSA-N 1 0 323.440 4.482 20 10 DICDRO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000186058007 1043213051 /nfs/dbraw/zinc/21/30/51/1043213051.db2.gz PAILAOQCHPHXRE-CABCVRRESA-N 1 0 323.440 4.482 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(F)c(F)c1 ZINC000186225945 1043218220 /nfs/dbraw/zinc/21/82/20/1043218220.db2.gz OROJLUIAYCVXAB-YVEFUNNKSA-N 1 0 321.367 4.017 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(F)c(F)c1 ZINC000186225910 1043219518 /nfs/dbraw/zinc/21/95/18/1043219518.db2.gz OROJLUIAYCVXAB-SJCJKPOMSA-N 1 0 321.367 4.017 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCSCCC(F)(F)F)c1 ZINC000866543062 1043220017 /nfs/dbraw/zinc/22/00/17/1043220017.db2.gz LEKALTALXPKKAK-LLVKDONJSA-N 1 0 307.381 4.037 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCOc3cc(F)ccc32)c1 ZINC000186374059 1043223531 /nfs/dbraw/zinc/22/35/31/1043223531.db2.gz BVJHSCHAVYABJD-SUMWQHHRSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)c1 ZINC000191857475 1043263323 /nfs/dbraw/zinc/26/33/23/1043263323.db2.gz GINFAWFGXFQVJN-KNBMTAEXSA-N 1 0 311.425 4.129 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc3c(c2)CCCC3)c1 ZINC000122103854 1043281662 /nfs/dbraw/zinc/28/16/62/1043281662.db2.gz HQDTUEQHYROQSC-CQSZACIVSA-N 1 0 311.425 4.130 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1cc(F)cc(F)c1 ZINC000122740808 1043325159 /nfs/dbraw/zinc/32/51/59/1043325159.db2.gz CRKRCMKTDWQIRJ-CYBMUJFWSA-N 1 0 304.384 4.190 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc2c(c1)COC2 ZINC000268840501 1043335231 /nfs/dbraw/zinc/33/52/31/1043335231.db2.gz UCKSDFJDKAQIEU-MRXNPFEDSA-N 1 0 322.452 4.168 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1ccc(N2CCCCC2)cc1 ZINC000271527171 1043431407 /nfs/dbraw/zinc/43/14/07/1043431407.db2.gz QIROGHJPWYCCAN-BEFAXECRSA-N 1 0 324.472 4.128 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc3ncccc23)c(O)c1C ZINC000872124934 1043470814 /nfs/dbraw/zinc/47/08/14/1043470814.db2.gz VPXCRDUPSSUZEL-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc2ncccc12)c1ccc(C)cc1O ZINC000872125112 1043470860 /nfs/dbraw/zinc/47/08/60/1043470860.db2.gz YFAFXFVYRBQWEB-SFHVURJKSA-N 1 0 306.409 4.490 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(C(F)(F)F)nc1 ZINC000872130984 1043473107 /nfs/dbraw/zinc/47/31/07/1043473107.db2.gz UVESAKOODOCKSS-ZWNOBZJWSA-N 1 0 322.330 4.144 20 10 DICDRO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000872134638 1043474689 /nfs/dbraw/zinc/47/46/89/1043474689.db2.gz SWPPLQPOGBRYSL-GXTWGEPZSA-N 1 0 307.397 4.056 20 10 DICDRO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000872133325 1043476146 /nfs/dbraw/zinc/47/61/46/1043476146.db2.gz LWIBJRFZCVHJCQ-DOTOQJQBSA-N 1 0 324.472 4.187 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(C(F)(F)F)nc1 ZINC000873186656 1043526371 /nfs/dbraw/zinc/52/63/71/1043526371.db2.gz ULCDBPAPMDFJJO-LBPRGKRZSA-N 1 0 323.362 4.017 20 10 DICDRO CC[C@@H]1CC[C@H](C)[N@H+](Cc2c(O)cccc2Br)C1 ZINC000707132388 1043540205 /nfs/dbraw/zinc/54/02/05/1043540205.db2.gz OXAOJBXBMQZUEC-NWDGAFQWSA-N 1 0 312.251 4.165 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2cc3cc(C)ccc3o2)c1O ZINC000895273573 1043604434 /nfs/dbraw/zinc/60/44/34/1043604434.db2.gz YMIMINGPDNAWMF-UHFFFAOYSA-N 1 0 311.381 4.054 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccnnc2)c(C)n1-c1cccc(C)c1 ZINC000926765286 1043628505 /nfs/dbraw/zinc/62/85/05/1043628505.db2.gz RXAJSYVPJWKGOC-MRXNPFEDSA-N 1 0 320.440 4.043 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2cc[nH]c(=O)c2)c(C)n1-c1ccccc1 ZINC000926764710 1043628529 /nfs/dbraw/zinc/62/85/29/1043628529.db2.gz KYPIEPCFDFURAN-HNNXBMFYSA-N 1 0 321.424 4.046 20 10 DICDRO C[C@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1ccc2ccccc2c1O ZINC000926916406 1043654801 /nfs/dbraw/zinc/65/48/01/1043654801.db2.gz PZYBGVHNTAAOKE-BOUXLOLZSA-N 1 0 311.425 4.155 20 10 DICDRO C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc(Cl)cc1O ZINC000926919137 1043656199 /nfs/dbraw/zinc/65/61/99/1043656199.db2.gz LRJWBOQFZJJAQX-SNVBAGLBSA-N 1 0 322.861 4.232 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1cccc(Cl)c1 ZINC000783518642 1043657045 /nfs/dbraw/zinc/65/70/45/1043657045.db2.gz MOWWRTLWLLIQQW-STQMWFEESA-N 1 0 305.805 4.164 20 10 DICDRO CSc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000021520151 1043665010 /nfs/dbraw/zinc/66/50/10/1043665010.db2.gz BJLJDQYVKHKFLE-AWEZNQCLSA-N 1 0 300.471 4.325 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCc2cccnc21)c1ccc(N(C)C)cc1 ZINC000927060867 1043674790 /nfs/dbraw/zinc/67/47/90/1043674790.db2.gz DPRCVFHKODGDTK-OALUTQOASA-N 1 0 309.457 4.266 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)c1O ZINC000895414062 1043681140 /nfs/dbraw/zinc/68/11/40/1043681140.db2.gz JZRNZYMOWYDSOV-INIZCTEOSA-N 1 0 317.816 4.140 20 10 DICDRO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1cnn(C)c1 ZINC000927067779 1043681683 /nfs/dbraw/zinc/68/16/83/1043681683.db2.gz GRTXCPJRTJFFIW-IFXJQAMLSA-N 1 0 323.440 4.327 20 10 DICDRO COc1cccc(C[N@H+](C)[C@H](C)c2cc3ccccc3o2)c1O ZINC000126023688 1043696096 /nfs/dbraw/zinc/69/60/96/1043696096.db2.gz NBBZJARFYDSUKP-CYBMUJFWSA-N 1 0 311.381 4.340 20 10 DICDRO CCc1onc(C)c1C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000927135768 1043697186 /nfs/dbraw/zinc/69/71/86/1043697186.db2.gz UOLDADUBOPCDLT-LBPRGKRZSA-N 1 0 310.397 4.255 20 10 DICDRO CCC[N@H+](Cc1ccc(C(F)F)nc1)Cc1ccccc1O ZINC000876654810 1043703996 /nfs/dbraw/zinc/70/39/96/1043703996.db2.gz PWTCMZGRUQAALG-UHFFFAOYSA-N 1 0 306.356 4.137 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(Cl)cc2)cc1 ZINC000021812826 1043707437 /nfs/dbraw/zinc/70/74/37/1043707437.db2.gz LDSXOVSIOVTRJE-UHFFFAOYSA-N 1 0 302.849 4.476 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)c(O)c1 ZINC000876913032 1043722898 /nfs/dbraw/zinc/72/28/98/1043722898.db2.gz NKQCVGQJJVBCNJ-LBPRGKRZSA-N 1 0 307.340 4.153 20 10 DICDRO CC[N@H+](Cc1cc(Cl)c(C)cc1O)[C@@H]1CCOC(C)(C)C1 ZINC000825943560 1043751985 /nfs/dbraw/zinc/75/19/85/1043751985.db2.gz HJHWKCXZIOENHI-CQSZACIVSA-N 1 0 311.853 4.134 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(OC(F)(F)F)c1)c1ccccc1O ZINC000877757185 1043791627 /nfs/dbraw/zinc/79/16/27/1043791627.db2.gz MDAPBCRFUSFBSA-NSHDSACASA-N 1 0 311.303 4.142 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1OCC ZINC000877757100 1043791913 /nfs/dbraw/zinc/79/19/13/1043791913.db2.gz FXNLDIJLTGUGTO-AWEZNQCLSA-N 1 0 315.413 4.040 20 10 DICDRO Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccccc2O)C1 ZINC000877755471 1043793042 /nfs/dbraw/zinc/79/30/42/1043793042.db2.gz CEJKFMLRQJVIGA-BRWVUGGUSA-N 1 0 310.441 4.473 20 10 DICDRO CC(C)c1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1[N+](=O)[O-] ZINC000877757387 1043793890 /nfs/dbraw/zinc/79/38/90/1043793890.db2.gz WROQATWREYGFBA-ZDUSSCGKSA-N 1 0 314.385 4.275 20 10 DICDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)n1 ZINC000127010473 1043798695 /nfs/dbraw/zinc/79/86/95/1043798695.db2.gz ZTVYTMLYWDDYPM-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)c2cccs2)c1 ZINC000127056484 1043873325 /nfs/dbraw/zinc/87/33/25/1043873325.db2.gz OKAUMHQMTFACFR-GFCCVEGCSA-N 1 0 305.443 4.091 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(N(C)C)cc1 ZINC000127265215 1043910872 /nfs/dbraw/zinc/91/08/72/1043910872.db2.gz RBYRKNBIPMYOBO-PKOBYXMFSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@H]([NH2+][C@H]1c2ccccc2CC12CCOCC2)c1ccccc1O ZINC000290104824 1043918031 /nfs/dbraw/zinc/91/80/31/1043918031.db2.gz IGMQRLMBOPUVST-YWZLYKJASA-N 1 0 323.436 4.137 20 10 DICDRO C[C@]1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCCS1 ZINC000127889464 1043977313 /nfs/dbraw/zinc/97/73/13/1043977313.db2.gz QHMXFKLORYSCCQ-GOSISDBHSA-N 1 0 304.503 4.052 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2cc3cnccc3o2)cc1 ZINC000879714908 1043982956 /nfs/dbraw/zinc/98/29/56/1043982956.db2.gz KYQYVXPAKRVFBY-CQSZACIVSA-N 1 0 309.413 4.135 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(F)cc2C)c1O ZINC000896797478 1044014936 /nfs/dbraw/zinc/01/49/36/1044014936.db2.gz JJSAMTWYBHYEAP-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCCOc2ccccc21 ZINC000359004620 1044121121 /nfs/dbraw/zinc/12/11/21/1044121121.db2.gz ULJGPXYAABAOCX-SFHVURJKSA-N 1 0 320.436 4.490 20 10 DICDRO CCc1noc(C)c1C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000293109179 1044248369 /nfs/dbraw/zinc/24/83/69/1044248369.db2.gz YJFAZQKJNNBHJF-UHFFFAOYSA-N 1 0 322.408 4.208 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000883266172 1044252924 /nfs/dbraw/zinc/25/29/24/1044252924.db2.gz UHIJMRPXZUVLSF-GFCCVEGCSA-N 1 0 315.388 4.268 20 10 DICDRO CO[C@H]1C[C@H](C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000883269141 1044254873 /nfs/dbraw/zinc/25/48/73/1044254873.db2.gz ABGBGUGPLBHIOJ-MBOZVWFJSA-N 1 0 316.489 4.143 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000883267300 1044255038 /nfs/dbraw/zinc/25/50/38/1044255038.db2.gz ZIBJZSOOLDNUTN-KRWDZBQOSA-N 1 0 309.409 4.055 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(C)nc2Cl)cc1 ZINC000883302015 1044262967 /nfs/dbraw/zinc/26/29/67/1044262967.db2.gz OGSJVQBRENHLLC-CQSZACIVSA-N 1 0 317.864 4.350 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)o1 ZINC000293301442 1044268681 /nfs/dbraw/zinc/26/86/81/1044268681.db2.gz DTLKLEBFFCZRNS-CYBMUJFWSA-N 1 0 302.418 4.109 20 10 DICDRO Cc1nocc1C[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000293537693 1044295851 /nfs/dbraw/zinc/29/58/51/1044295851.db2.gz JXNOQNSQCDLQIE-UHFFFAOYSA-N 1 0 313.445 4.042 20 10 DICDRO COC1CCC([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000840794187 1044302980 /nfs/dbraw/zinc/30/29/80/1044302980.db2.gz XJJANLKMFQHPKX-VQSBYGRUSA-N 1 0 316.489 4.285 20 10 DICDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000192744890 1044305699 /nfs/dbraw/zinc/30/56/99/1044305699.db2.gz JEDPQZDWGAQRAN-KGLIPLIRSA-N 1 0 312.413 4.071 20 10 DICDRO CC(C)C[C@H]([NH2+]CCCSc1nccs1)c1ccccn1 ZINC000132159153 1044315845 /nfs/dbraw/zinc/31/58/45/1044315845.db2.gz SMMJDCISKGZADX-HNNXBMFYSA-N 1 0 321.515 4.397 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1cccnc1Cl ZINC000132204303 1044318009 /nfs/dbraw/zinc/31/80/09/1044318009.db2.gz KIYSDWZPCRQEDJ-SNVBAGLBSA-N 1 0 313.879 4.025 20 10 DICDRO c1csc(SCCC[NH2+][C@H]2CCCc3sccc32)n1 ZINC000132262082 1044319347 /nfs/dbraw/zinc/31/93/47/1044319347.db2.gz RKFNXUUVZVFKTB-LBPRGKRZSA-N 1 0 310.513 4.354 20 10 DICDRO Cc1ncsc1C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000132324645 1044321623 /nfs/dbraw/zinc/32/16/23/1044321623.db2.gz FWSSJWHCJIMWGF-CQSZACIVSA-N 1 0 315.486 4.293 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)C1CCSCC1 ZINC000475199800 1044322072 /nfs/dbraw/zinc/32/20/72/1044322072.db2.gz ASRCUKXMGYUIGI-CQSZACIVSA-N 1 0 302.487 4.108 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000475201667 1044323056 /nfs/dbraw/zinc/32/30/56/1044323056.db2.gz JJAMHTYYYGDLQV-DYVFJYSZSA-N 1 0 308.425 4.493 20 10 DICDRO Cc1cc(C)c(O)c(C[NH2+]C2(c3nccs3)CCCC2)c1 ZINC000132490170 1044325610 /nfs/dbraw/zinc/32/56/10/1044325610.db2.gz BTYDXCRLSJSRJM-UHFFFAOYSA-N 1 0 302.443 4.025 20 10 DICDRO CCc1noc(C)c1C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000293772667 1044327709 /nfs/dbraw/zinc/32/77/09/1044327709.db2.gz SGBOYRZGUUNMHJ-LBPRGKRZSA-N 1 0 310.397 4.255 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cnn(-c3ccccc3)c2)c(O)c1 ZINC000293882805 1044347604 /nfs/dbraw/zinc/34/76/04/1044347604.db2.gz VLQSFXASLNWIDH-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)o1 ZINC000293901388 1044348246 /nfs/dbraw/zinc/34/82/46/1044348246.db2.gz ZPZYGBZZZXVBFW-QGZVFWFLSA-N 1 0 315.461 4.242 20 10 DICDRO FC1(F)CCCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001202587945 1044364580 /nfs/dbraw/zinc/36/45/80/1044364580.db2.gz WCKOPICDLOIXGQ-OAHLLOKOSA-N 1 0 309.400 4.317 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccccc1O ZINC000361292547 1044386872 /nfs/dbraw/zinc/38/68/72/1044386872.db2.gz HCOZALBJTNTBJX-FOIQADDNSA-N 1 0 304.393 4.227 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOc2ccccc21)c1ccc(N(C)C)cc1 ZINC000133513658 1044406077 /nfs/dbraw/zinc/40/60/77/1044406077.db2.gz QKHGYINYZPMNQX-KXBFYZLASA-N 1 0 310.441 4.317 20 10 DICDRO CCn1cc([C@H](C)[NH2+]Cc2cc(-c3ccccc3)ccc2O)cn1 ZINC000294773169 1044459787 /nfs/dbraw/zinc/45/97/87/1044459787.db2.gz GDFDPGPEDXMWDG-HNNXBMFYSA-N 1 0 321.424 4.126 20 10 DICDRO COc1ccc([C@H]([NH2+][C@H]2CCc3cccc(O)c32)C2CC2)cc1 ZINC000296017538 1044581983 /nfs/dbraw/zinc/58/19/83/1044581983.db2.gz PDQMHPIVKIGVTB-FXAWDEMLSA-N 1 0 309.409 4.129 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCSc3c(F)cccc31)CC2 ZINC000296004322 1044582219 /nfs/dbraw/zinc/58/22/19/1044582219.db2.gz OOVWVCKNKZQXBG-LSDHHAIUSA-N 1 0 315.413 4.345 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCSc3c(F)cccc31)CC2 ZINC000296004313 1044582765 /nfs/dbraw/zinc/58/27/65/1044582765.db2.gz OOVWVCKNKZQXBG-GJZGRUSLSA-N 1 0 315.413 4.345 20 10 DICDRO CCOc1cccc(C[NH2+]C(C)(C)c2ccc(F)cc2F)c1O ZINC000886350320 1044634381 /nfs/dbraw/zinc/63/43/81/1044634381.db2.gz QOMOJENNYDCMKW-UHFFFAOYSA-N 1 0 321.367 4.094 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccnc(C(F)(F)F)c2)c(O)c1 ZINC000296647461 1044638173 /nfs/dbraw/zinc/63/81/73/1044638173.db2.gz YOLNJFPIEXDUGU-LBPRGKRZSA-N 1 0 324.346 4.274 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccnc(C(F)(F)F)c2)c(O)c1 ZINC000296647458 1044638432 /nfs/dbraw/zinc/63/84/32/1044638432.db2.gz YOLNJFPIEXDUGU-GFCCVEGCSA-N 1 0 324.346 4.274 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc2ccccc2c1O ZINC000886684424 1044679540 /nfs/dbraw/zinc/67/95/40/1044679540.db2.gz LDPILNVHZPATJU-GFCCVEGCSA-N 1 0 308.381 4.262 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)ccc2ccccc21 ZINC000816481717 1044689934 /nfs/dbraw/zinc/68/99/34/1044689934.db2.gz GSVGBPRGZNXWJQ-AWEZNQCLSA-N 1 0 309.331 4.320 20 10 DICDRO CC[C@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1ccccc1O ZINC000886773798 1044695074 /nfs/dbraw/zinc/69/50/74/1044695074.db2.gz BEKAEKOQVFQVLE-FUHWJXTLSA-N 1 0 303.446 4.172 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c(O)c1 ZINC000886774472 1044696982 /nfs/dbraw/zinc/69/69/82/1044696982.db2.gz ODHYYYQKMQEGKO-CRAIPNDOSA-N 1 0 303.446 4.091 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c1 ZINC000886774793 1044697020 /nfs/dbraw/zinc/69/70/20/1044697020.db2.gz VVMUIGUQXVAEBG-CRAIPNDOSA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000090763044 1044748760 /nfs/dbraw/zinc/74/87/60/1044748760.db2.gz FCBXTJWNYGELOC-FZKQIMNGSA-N 1 0 315.461 4.202 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCN(Cc3ccccc3)C2)c(O)c1 ZINC000301386430 1044884326 /nfs/dbraw/zinc/88/43/26/1044884326.db2.gz ZAZPEMKRDVTFAT-MJGOQNOKSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C2CCC3(CCOCC3)CC2)c1 ZINC000371865553 1044894684 /nfs/dbraw/zinc/89/46/84/1044894684.db2.gz WLBMHJINLLYBLW-HNNXBMFYSA-N 1 0 303.446 4.091 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2CCC3(CCOCC3)CC2)c1 ZINC000371865554 1044895846 /nfs/dbraw/zinc/89/58/46/1044895846.db2.gz WLBMHJINLLYBLW-OAHLLOKOSA-N 1 0 303.446 4.091 20 10 DICDRO C[C@H](CCc1ccc(Cl)s1)[NH2+]CCc1ccc(N)cc1 ZINC000841038746 1044929609 /nfs/dbraw/zinc/92/96/09/1044929609.db2.gz PIKDBDRZGRUEFT-GFCCVEGCSA-N 1 0 308.878 4.137 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000134925781 1044971953 /nfs/dbraw/zinc/97/19/53/1044971953.db2.gz PNLXNHDSCRGJNT-VXGBXAGGSA-N 1 0 319.424 4.203 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000134918021 1044973064 /nfs/dbraw/zinc/97/30/64/1044973064.db2.gz OHKGRUNDSQMVEF-STQMWFEESA-N 1 0 301.434 4.064 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccc1)C1CCOCC1)c1ccccc1O ZINC000374677397 1045082623 /nfs/dbraw/zinc/08/26/23/1045082623.db2.gz JAEQSWZQUSRWER-FOIQADDNSA-N 1 0 311.425 4.211 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000779021761 1045146569 /nfs/dbraw/zinc/14/65/69/1045146569.db2.gz YKKBGQVETTWVIC-MRXNPFEDSA-N 1 0 307.315 4.147 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCSC1)c1ccc(N2CCCCC2)cc1 ZINC000159516760 1045201167 /nfs/dbraw/zinc/20/11/67/1045201167.db2.gz VUAFQJQHXXFFGJ-DOTOQJQBSA-N 1 0 304.503 4.223 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000779065499 1045236842 /nfs/dbraw/zinc/23/68/42/1045236842.db2.gz OTQWEQMLXUJQGQ-UHFFFAOYSA-N 1 0 305.780 4.354 20 10 DICDRO CC(C)([NH2+]Cc1ccc2c(c1)CCO2)c1nc2ccccc2s1 ZINC000527745411 1045257640 /nfs/dbraw/zinc/25/76/40/1045257640.db2.gz POWUHPMKIGJMMC-UHFFFAOYSA-N 1 0 324.449 4.256 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1cc(F)ccc1O ZINC000527966821 1045289340 /nfs/dbraw/zinc/28/93/40/1045289340.db2.gz OVKCJQSKMCQJRO-KZULUSFZSA-N 1 0 300.377 4.118 20 10 DICDRO CO[C@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000779150850 1045322826 /nfs/dbraw/zinc/32/28/26/1045322826.db2.gz YFGRZAYWABQQEQ-ACJLOTCBSA-N 1 0 319.832 4.220 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](c1ccncc1)C1CC1 ZINC001120257845 1045534641 /nfs/dbraw/zinc/53/46/41/1045534641.db2.gz ANDVHKLDTCKOTA-JOTOCRJQSA-N 1 0 308.425 4.385 20 10 DICDRO c1csc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)c1 ZINC000020545182 1045582059 /nfs/dbraw/zinc/58/20/59/1045582059.db2.gz LJHQLAOUBDEXSD-UHFFFAOYSA-N 1 0 300.471 4.071 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)c(Cl)c1 ZINC000021010705 1045582604 /nfs/dbraw/zinc/58/26/04/1045582604.db2.gz JWJQOEPCWYMOPX-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)[C@@H]2CC3CCC2CC3)c1O ZINC000381911012 1045584784 /nfs/dbraw/zinc/58/47/84/1045584784.db2.gz NIBJYOMSDAFEIC-VXTDNTOSSA-N 1 0 303.446 4.095 20 10 DICDRO COc1ccc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)cc1C ZINC000751148583 1045585170 /nfs/dbraw/zinc/58/51/70/1045585170.db2.gz XFLBEBYCMYAQGY-UHFFFAOYSA-N 1 0 305.368 4.307 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000800493338 1045631627 /nfs/dbraw/zinc/63/16/27/1045631627.db2.gz WUVRKYIMXQMIKB-GXFFZTMASA-N 1 0 320.795 4.226 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000800493337 1045632348 /nfs/dbraw/zinc/63/23/48/1045632348.db2.gz WUVRKYIMXQMIKB-GWCFXTLKSA-N 1 0 320.795 4.226 20 10 DICDRO C[C@@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1cc(F)ccc1O ZINC000800496166 1045634037 /nfs/dbraw/zinc/63/40/37/1045634037.db2.gz SSNWJDYUGUJFRH-BMIGLBTASA-N 1 0 305.780 4.003 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCCC23CCOCC3)c2c1c(F)ccc2O ZINC000800498442 1045634861 /nfs/dbraw/zinc/63/48/61/1045634861.db2.gz KJCMPHRVWNGOFH-INWMFGNUSA-N 1 0 319.420 4.019 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCc2cccc3[nH]ccc32)c2c1c(F)ccc2O ZINC000800499979 1045635158 /nfs/dbraw/zinc/63/51/58/1045635158.db2.gz LVJOOSSHPZAKQG-YVEFUNNKSA-N 1 0 324.399 4.393 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CC2CCC(F)(F)CC2)c2c1c(F)ccc2O ZINC000800499868 1045635772 /nfs/dbraw/zinc/63/57/72/1045635772.db2.gz NTQVYPAVRDXGCN-GWCFXTLKSA-N 1 0 313.363 4.495 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000800525309 1045639817 /nfs/dbraw/zinc/63/98/17/1045639817.db2.gz SOPPDMIVAMYTMM-NQIIRXRSSA-N 1 0 323.484 4.483 20 10 DICDRO FCCC[C@@H]1CCC[C@H]1[NH2+]CCCSc1nccs1 ZINC000800971243 1045671222 /nfs/dbraw/zinc/67/12/22/1045671222.db2.gz HVMDUFDHEJFMKK-QWHCGFSZSA-N 1 0 302.484 4.133 20 10 DICDRO Cc1cc(C)cc([C@@H](O)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000800991209 1045677505 /nfs/dbraw/zinc/67/75/05/1045677505.db2.gz BQKQIJKNXUYQFE-APWZRJJASA-N 1 0 313.441 4.010 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2ccccc2OC1)c1ccc(C)cc1O ZINC000800986614 1045677681 /nfs/dbraw/zinc/67/76/81/1045677681.db2.gz JRXIYTLFWVHQDB-SJLPKXTDSA-N 1 0 311.425 4.135 20 10 DICDRO Cc1cc(C)cc([C@H](O)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000800991211 1045678735 /nfs/dbraw/zinc/67/87/35/1045678735.db2.gz BQKQIJKNXUYQFE-QFBILLFUSA-N 1 0 313.441 4.010 20 10 DICDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000800994772 1045679212 /nfs/dbraw/zinc/67/92/12/1045679212.db2.gz XHLHLCQQMDMOHC-YVEFUNNKSA-N 1 0 315.388 4.186 20 10 DICDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000800993023 1045679798 /nfs/dbraw/zinc/67/97/98/1045679798.db2.gz LUUOMVTYQQFLEQ-QFYYESIMSA-N 1 0 319.351 4.017 20 10 DICDRO COc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1C ZINC000753613703 1045777672 /nfs/dbraw/zinc/77/76/72/1045777672.db2.gz ZCUAKXCJZOZODR-MRXNPFEDSA-N 1 0 312.457 4.229 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000753857046 1045812837 /nfs/dbraw/zinc/81/28/37/1045812837.db2.gz CVMPCNQFWYPLKD-SFHVURJKSA-N 1 0 316.395 4.116 20 10 DICDRO C[C@H](C[NH2+]CCCSc1nccs1)Cc1ccccc1 ZINC000753963317 1045825269 /nfs/dbraw/zinc/82/52/69/1045825269.db2.gz QBVGWNHCHIQLKN-AWEZNQCLSA-N 1 0 306.500 4.094 20 10 DICDRO Oc1ccccc1C[N@H+](CC[C@@H]1CCCCO1)C1CCCC1 ZINC000754042824 1045838744 /nfs/dbraw/zinc/83/87/44/1045838744.db2.gz DSLVQMUCSGCAQY-SFHVURJKSA-N 1 0 303.446 4.096 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCOC(C)(C)C2)cc1 ZINC000754078954 1045844744 /nfs/dbraw/zinc/84/47/44/1045844744.db2.gz CMMFWMIYANLRMM-GOSISDBHSA-N 1 0 318.505 4.360 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)Cc2ccc(F)cc2C)c1O ZINC000754153370 1045857876 /nfs/dbraw/zinc/85/78/76/1045857876.db2.gz GNXKCWWJFQIADB-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000079249411 1045875626 /nfs/dbraw/zinc/87/56/26/1045875626.db2.gz WCJJRPZJKMGCMP-HNNXBMFYSA-N 1 0 311.425 4.260 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cccs2)ccc1N(C)C ZINC001139670996 1045877045 /nfs/dbraw/zinc/87/70/45/1045877045.db2.gz KEUAWOLQMYXFBF-QGZVFWFLSA-N 1 0 300.471 4.460 20 10 DICDRO C[C@H](c1ccccc1)[N@H+](CCC[C@H](C)O)Cc1ccccc1O ZINC000828564685 1045915474 /nfs/dbraw/zinc/91/54/74/1045915474.db2.gz VESXRMAORBUTAX-DLBZAZTESA-N 1 0 313.441 4.116 20 10 DICDRO C[C@@H](O)CCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000828564687 1045915833 /nfs/dbraw/zinc/91/58/33/1045915833.db2.gz VESXRMAORBUTAX-IAGOWNOFSA-N 1 0 313.441 4.116 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@H](c3ccccc3C)C2)c1O ZINC000754729531 1045920848 /nfs/dbraw/zinc/92/08/48/1045920848.db2.gz AKUXFIPLQAQNEZ-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1O ZINC000754726918 1045921327 /nfs/dbraw/zinc/92/13/27/1045921327.db2.gz AWIFQYQBZUHLPX-QGZVFWFLSA-N 1 0 315.388 4.185 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2C[C@H](c3ccccc3)C[C@@H]2C)c1O ZINC000754725840 1045921440 /nfs/dbraw/zinc/92/14/40/1045921440.db2.gz BSVLHKVYDNUTCE-DOTOQJQBSA-N 1 0 311.425 4.087 20 10 DICDRO COc1ccccc1C[N@H+](Cc1cc(C)cc(C)c1O)C1CC1 ZINC000754724209 1045921543 /nfs/dbraw/zinc/92/15/43/1045921543.db2.gz ZTYQWPZSZGLNMX-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(OC)c(F)c1)c1ccccc1O ZINC000192795857 1045934417 /nfs/dbraw/zinc/93/44/17/1045934417.db2.gz QTGBGSXPFSQDFO-WBMJQRKESA-N 1 0 303.377 4.342 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)cc1F ZINC000192795699 1045935116 /nfs/dbraw/zinc/93/51/16/1045935116.db2.gz XQHIRBLVWAULGG-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cc1 ZINC000192870736 1045946798 /nfs/dbraw/zinc/94/67/98/1045946798.db2.gz KJKWJYLYRIQOCE-AWEZNQCLSA-N 1 0 307.393 4.405 20 10 DICDRO CC[C@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000802309008 1045950714 /nfs/dbraw/zinc/95/07/14/1045950714.db2.gz LPTIUSCTUPVOOD-QINHECLXSA-N 1 0 318.505 4.387 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC2CC(c3ccccc3)C2)c1 ZINC000802309417 1045952167 /nfs/dbraw/zinc/95/21/67/1045952167.db2.gz RQNOOFBEVIOSDW-UQPPLGOBSA-N 1 0 311.425 4.245 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCC2C[C@@H](C)O[C@H](C)C2)c2c1c(F)ccc2O ZINC000802309695 1045952452 /nfs/dbraw/zinc/95/24/52/1045952452.db2.gz UDUAQDGRYVZGNP-VPWBDBDCSA-N 1 0 321.436 4.263 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000193009329 1045959912 /nfs/dbraw/zinc/95/99/12/1045959912.db2.gz TYESMMHSDMZPGS-KBPBESRZSA-N 1 0 316.420 4.312 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)CCCC(F)(F)F)c(O)c1 ZINC000755224029 1045964766 /nfs/dbraw/zinc/96/47/66/1045964766.db2.gz XOPGQTCYURSFTA-LLVKDONJSA-N 1 0 305.340 4.002 20 10 DICDRO Cc1cc(C[N@H+]2CC[C@H](OC(C)C)C2)c(C)n1-c1ccccc1 ZINC001137858960 1045987485 /nfs/dbraw/zinc/98/74/85/1045987485.db2.gz BWECJUAJQRHMSZ-FQEVSTJZSA-N 1 0 312.457 4.093 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3cccnc3C2)c(C)n1-c1ccccc1 ZINC001137859277 1045987560 /nfs/dbraw/zinc/98/75/60/1045987560.db2.gz RDOGPUCMIGIDGO-UHFFFAOYSA-N 1 0 317.436 4.047 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001137856136 1045987831 /nfs/dbraw/zinc/98/78/31/1045987831.db2.gz RLUXLOSEJBICLZ-GHTZIAJQSA-N 1 0 324.468 4.095 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001137856139 1045988053 /nfs/dbraw/zinc/98/80/53/1045988053.db2.gz RLUXLOSEJBICLZ-WIYYLYMNSA-N 1 0 324.468 4.095 20 10 DICDRO CCCC[N@H+](Cc1cnc2c(C)cccn12)Cc1ccccc1O ZINC000802657616 1046027106 /nfs/dbraw/zinc/02/71/06/1046027106.db2.gz LABFEWZQLGGOQP-UHFFFAOYSA-N 1 0 323.440 4.151 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCO[C@H](CC)C1 ZINC000802657330 1046028102 /nfs/dbraw/zinc/02/81/02/1046028102.db2.gz AZWFZXSEPHCROZ-FUHWJXTLSA-N 1 0 305.462 4.200 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c1O ZINC000802659108 1046030803 /nfs/dbraw/zinc/03/08/03/1046030803.db2.gz DTVVPVGYVYZYSR-BTTYYORXSA-N 1 0 311.853 4.037 20 10 DICDRO CC(C)CCOCC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000755944495 1046030759 /nfs/dbraw/zinc/03/07/59/1046030759.db2.gz ZVXGORYJKMQVOP-UHFFFAOYSA-N 1 0 317.429 4.050 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000756031363 1046039075 /nfs/dbraw/zinc/03/90/75/1046039075.db2.gz ZKQLWTJPAZUABF-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)CCS1 ZINC000756147527 1046055691 /nfs/dbraw/zinc/05/56/91/1046055691.db2.gz SOIWRMNLKANBGM-INIZCTEOSA-N 1 0 304.503 4.004 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3ccccc23)c2c1c(F)ccc2O ZINC000756343489 1046066861 /nfs/dbraw/zinc/06/68/61/1046066861.db2.gz MXTZRXJIYXWJTA-PXAZEXFGSA-N 1 0 324.399 4.393 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1F ZINC000756362740 1046068774 /nfs/dbraw/zinc/06/87/74/1046068774.db2.gz CKAGAJBZNZNALG-IAQYHMDHSA-N 1 0 303.352 4.317 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(OC(F)F)cc2)c1 ZINC000756359949 1046068815 /nfs/dbraw/zinc/06/88/15/1046068815.db2.gz CNWSATSHUFZOND-ZDUSSCGKSA-N 1 0 321.367 4.195 20 10 DICDRO C[C@H](CCc1ccco1)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756356644 1046070399 /nfs/dbraw/zinc/07/03/99/1046070399.db2.gz HDPOQMOPGHRGJK-JMSVASOKSA-N 1 0 303.377 4.284 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2OC(F)F)c(O)c1C ZINC000756366878 1046071077 /nfs/dbraw/zinc/07/10/77/1046071077.db2.gz JQPBTDKRCNMQDJ-CYBMUJFWSA-N 1 0 321.367 4.461 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2ccsc2)N(C)C)c(O)c1C ZINC000756371873 1046071257 /nfs/dbraw/zinc/07/12/57/1046071257.db2.gz OUJDFDOARQHXTR-YOEHRIQHSA-N 1 0 318.486 4.024 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc(Cl)cc2)c(O)c1C ZINC000756365543 1046072858 /nfs/dbraw/zinc/07/28/58/1046072858.db2.gz BAOGHJFUWIAKHX-CXAGYDPISA-N 1 0 319.832 4.047 20 10 DICDRO C[C@H]([NH2+]CCc1cccs1)c1cc2c(cc1O)CCCC2 ZINC000756373086 1046072992 /nfs/dbraw/zinc/07/29/92/1046072992.db2.gz SJCAGAZCSRHPKI-ZDUSSCGKSA-N 1 0 301.455 4.226 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(OC(C)C)cc2)c1 ZINC000756383927 1046073570 /nfs/dbraw/zinc/07/35/70/1046073570.db2.gz LNNAPGIUIMFTAQ-MRXNPFEDSA-N 1 0 313.441 4.381 20 10 DICDRO C[C@H](Cc1ccco1)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000756379306 1046075118 /nfs/dbraw/zinc/07/51/18/1046075118.db2.gz NCHKTSQWDAOSPM-MNOVXSKESA-N 1 0 324.218 4.030 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2cccc3ccccc32)c1 ZINC000756402693 1046075528 /nfs/dbraw/zinc/07/55/28/1046075528.db2.gz NVGFCNHDPJYWBT-OAHLLOKOSA-N 1 0 321.420 4.447 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCCOc2ccc(F)cc2)c1 ZINC000756402538 1046075561 /nfs/dbraw/zinc/07/55/61/1046075561.db2.gz UOYKNXWEZOEJQV-OAHLLOKOSA-N 1 0 317.404 4.350 20 10 DICDRO C[C@H]([NH2+]CCCCOc1ccc(F)cc1)c1cc(F)ccc1O ZINC000756402606 1046076839 /nfs/dbraw/zinc/07/68/39/1046076839.db2.gz VTICUGMSGZACDP-ZDUSSCGKSA-N 1 0 321.367 4.180 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cccc3cccnc32)c(O)c1C ZINC000756392822 1046077333 /nfs/dbraw/zinc/07/73/33/1046077333.db2.gz NNOXXYXIPGNRTA-INIZCTEOSA-N 1 0 320.436 4.451 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193902932 1046081205 /nfs/dbraw/zinc/08/12/05/1046081205.db2.gz HAWIMXKNKSLFSH-CHWSQXEVSA-N 1 0 300.358 4.021 20 10 DICDRO CO[C@H](C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)c1ccccc1 ZINC000756445204 1046082016 /nfs/dbraw/zinc/08/20/16/1046082016.db2.gz LGUFZPBPSFIJKY-YLQAJVPDSA-N 1 0 315.388 4.057 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)c(F)c2)c2c1c(F)ccc2O ZINC000756457837 1046084648 /nfs/dbraw/zinc/08/46/48/1046084648.db2.gz RQWVJHWYEFAZTO-LKFCYVNXSA-N 1 0 307.315 4.148 20 10 DICDRO CCCOc1ncccc1C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000756455082 1046084965 /nfs/dbraw/zinc/08/49/65/1046084965.db2.gz HCYSFPBZZSLDJZ-OAHLLOKOSA-N 1 0 314.429 4.044 20 10 DICDRO CCCOc1ncccc1C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000756455081 1046085637 /nfs/dbraw/zinc/08/56/37/1046085637.db2.gz HCYSFPBZZSLDJZ-HNNXBMFYSA-N 1 0 314.429 4.044 20 10 DICDRO C[C@@H]([NH2+]Cc1cc2c(s1)CCCC2)c1cc(F)ccc1O ZINC000756483461 1046089376 /nfs/dbraw/zinc/08/93/76/1046089376.db2.gz OBKFWRKXQAFOOG-LLVKDONJSA-N 1 0 305.418 4.322 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cc(F)ccc32)c2c1c(F)ccc2O ZINC000756489253 1046089467 /nfs/dbraw/zinc/08/94/67/1046089467.db2.gz HTIDWKSRHQOLDD-HPEXNQPKSA-N 1 0 315.363 4.496 20 10 DICDRO C[C@H]([NH2+][C@@H]1CSCc2ccccc21)c1cc(F)ccc1O ZINC000756490056 1046089882 /nfs/dbraw/zinc/08/98/82/1046089882.db2.gz SMTPPOZNDLZRQV-MEDUHNTESA-N 1 0 303.402 4.170 20 10 DICDRO COc1ccc(CC[C@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000756502907 1046090950 /nfs/dbraw/zinc/09/09/50/1046090950.db2.gz HVIBDCKGMLPFAB-JKSUJKDBSA-N 1 0 313.441 4.381 20 10 DICDRO C[C@H](COc1ccccc1)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756493433 1046091043 /nfs/dbraw/zinc/09/10/43/1046091043.db2.gz DPHUSKUTVJXTIY-XJKCOSOUSA-N 1 0 315.388 4.137 20 10 DICDRO C[C@H](COc1ccccc1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756494877 1046091104 /nfs/dbraw/zinc/09/11/04/1046091104.db2.gz OXIAGLCNMOPXDN-OLZOCXBDSA-N 1 0 305.805 4.164 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)cc1 ZINC000756498700 1046091539 /nfs/dbraw/zinc/09/15/39/1046091539.db2.gz YREJAOMMPVFTTB-MKBNYLNASA-N 1 0 315.388 4.439 20 10 DICDRO C[C@H](COc1ccccc1)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756493431 1046091820 /nfs/dbraw/zinc/09/18/20/1046091820.db2.gz DPHUSKUTVJXTIY-IOASZLSFSA-N 1 0 315.388 4.137 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2csc(C(C)C)n2)c(O)c1C ZINC000756525246 1046094484 /nfs/dbraw/zinc/09/44/84/1046094484.db2.gz AVSRARSLNDICTJ-AWEZNQCLSA-N 1 0 318.486 4.482 20 10 DICDRO COc1ccccc1C1(C[NH2+][C@H](C)c2ccc(C)cc2O)CC1 ZINC000756518353 1046094760 /nfs/dbraw/zinc/09/47/60/1046094760.db2.gz SYGRZHBCISPWCU-OAHLLOKOSA-N 1 0 311.425 4.092 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2csc(C(C)C)n2)c(O)c1C ZINC000756525251 1046094965 /nfs/dbraw/zinc/09/49/65/1046094965.db2.gz AVSRARSLNDICTJ-CQSZACIVSA-N 1 0 318.486 4.482 20 10 DICDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756536348 1046095581 /nfs/dbraw/zinc/09/55/81/1046095581.db2.gz VCBNCJITSQFJBU-HWWQOWPSSA-N 1 0 315.388 4.006 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(Cl)cc1 ZINC000194257468 1046095991 /nfs/dbraw/zinc/09/59/91/1046095991.db2.gz POACJERWKACJGF-GUYCJALGSA-N 1 0 319.832 4.392 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CCc1ccc(O)cc1)c1cc(Cl)ccc1O ZINC000756534360 1046096111 /nfs/dbraw/zinc/09/61/11/1046096111.db2.gz KHJCSEUNHQWUCA-QWHCGFSZSA-N 1 0 319.832 4.423 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2c[nH]c3cccc(C)c23)c1 ZINC000756537017 1046097066 /nfs/dbraw/zinc/09/70/66/1046097066.db2.gz XCQJIKDQZKMRQU-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cc2c(cc1O)CCCC2 ZINC000756550874 1046097874 /nfs/dbraw/zinc/09/78/74/1046097874.db2.gz UBTUZHKMRLONNO-BFUOFWGJSA-N 1 0 323.436 4.315 20 10 DICDRO C[C@@H]([NH2+]CCCc1c[nH]c2ccccc12)c1cc(F)ccc1O ZINC000756548710 1046098342 /nfs/dbraw/zinc/09/83/42/1046098342.db2.gz CRTUNUBGBFYMQW-CYBMUJFWSA-N 1 0 312.388 4.296 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2F)c2c1c(F)ccc2O ZINC000756547855 1046098585 /nfs/dbraw/zinc/09/85/85/1046098585.db2.gz IBXSWDOQOWSSSN-LKFCYVNXSA-N 1 0 307.315 4.148 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCOc3ccccc32)c(O)c1C ZINC000756548760 1046098654 /nfs/dbraw/zinc/09/86/54/1046098654.db2.gz DRMZHRBPVIRFMT-HOTGVXAUSA-N 1 0 311.425 4.226 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCc2c[nH]c3ccccc23)c1 ZINC000756549704 1046098870 /nfs/dbraw/zinc/09/88/70/1046098870.db2.gz GWFMRXXQMYMJDW-HNNXBMFYSA-N 1 0 308.425 4.465 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](Nc2ccccc2)C(C)C)c1 ZINC000756555612 1046100952 /nfs/dbraw/zinc/10/09/52/1046100952.db2.gz LHEJLROITGLYNT-LPHOPBHVSA-N 1 0 312.457 4.488 20 10 DICDRO COc1ccc2[nH]cc(CC[NH2+][C@@H](C)c3cc(C)ccc3O)c2c1 ZINC000756573415 1046102454 /nfs/dbraw/zinc/10/24/54/1046102454.db2.gz JRNQNCLACLQXGB-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756581208 1046102689 /nfs/dbraw/zinc/10/26/89/1046102689.db2.gz AZYWGWRZZGPYSO-ZDUSSCGKSA-N 1 0 318.848 4.271 20 10 DICDRO Cc1noc(C)c1[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756575464 1046102929 /nfs/dbraw/zinc/10/29/29/1046102929.db2.gz UGXMZSRERZEVLT-MWODSPESSA-N 1 0 304.365 4.035 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCc2cccc(F)c2)c1 ZINC000756583417 1046103892 /nfs/dbraw/zinc/10/38/92/1046103892.db2.gz NNSYEQIUVCTNCA-ZIAGYGMSSA-N 1 0 317.404 4.212 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2c[nH]c3ccc(F)cc23)c(O)c1 ZINC000756589278 1046103936 /nfs/dbraw/zinc/10/39/36/1046103936.db2.gz LMENBFCZZFLSFT-CYBMUJFWSA-N 1 0 312.388 4.214 20 10 DICDRO CCCC[C@H](COC)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756584982 1046104588 /nfs/dbraw/zinc/10/45/88/1046104588.db2.gz IAKPTPFBOOYCFH-GDBMZVCRSA-N 1 0 301.430 4.401 20 10 DICDRO C[C@H]([NH2+]CC1(c2cccc(F)c2)CC1)c1cc(F)ccc1O ZINC000756590444 1046104807 /nfs/dbraw/zinc/10/48/07/1046104807.db2.gz CCNNGJTVDVWAAL-LBPRGKRZSA-N 1 0 303.352 4.053 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000756581518 1046104821 /nfs/dbraw/zinc/10/48/21/1046104821.db2.gz DCDIPBJCIUIGTG-DLBZAZTESA-N 1 0 310.441 4.020 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccncc1 ZINC000756608668 1046108175 /nfs/dbraw/zinc/10/81/75/1046108175.db2.gz QOQHYGDHNWEKRF-BYCMXARLSA-N 1 0 300.377 4.216 20 10 DICDRO Cc1cccc(F)c1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756608354 1046108563 /nfs/dbraw/zinc/10/85/63/1046108563.db2.gz KUDJSRXIBBEJED-IAQYHMDHSA-N 1 0 303.352 4.317 20 10 DICDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756608835 1046108931 /nfs/dbraw/zinc/10/89/31/1046108931.db2.gz DULWYKJKDHENPZ-ZIAGYGMSSA-N 1 0 305.462 4.125 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)C12CCC2 ZINC000756613494 1046109478 /nfs/dbraw/zinc/10/94/78/1046109478.db2.gz PSDNCXLINMSJHP-KNXALSJPSA-N 1 0 309.837 4.044 20 10 DICDRO CS[C@@H]1CC[C@@H]([NH2+][C@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000756611590 1046109484 /nfs/dbraw/zinc/10/94/84/1046109484.db2.gz UAKTVIUQBSBWFQ-DAXOMENPSA-N 1 0 305.487 4.206 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)Oc1ccccc1F ZINC000756609736 1046109512 /nfs/dbraw/zinc/10/95/12/1046109512.db2.gz NGIFLBQEDUPTQT-NEPJUHHUSA-N 1 0 323.795 4.303 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)C12CCC2 ZINC000756613717 1046110344 /nfs/dbraw/zinc/11/03/44/1046110344.db2.gz QJYYNJFVLNNRLD-RUAUBTSSSA-N 1 0 319.420 4.017 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)Sc1ccccc1)c1cc(F)ccc1O ZINC000756611401 1046110529 /nfs/dbraw/zinc/11/05/29/1046110529.db2.gz SKYFFPLAOUPVOU-QWHCGFSZSA-N 1 0 305.418 4.363 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)Oc2ccccc2F)c(O)c1C ZINC000756609716 1046110651 /nfs/dbraw/zinc/11/06/51/1046110651.db2.gz NAJXSXIXFWTAQI-DZGCQCFKSA-N 1 0 317.404 4.266 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)C1CCOCC1 ZINC000756627315 1046111467 /nfs/dbraw/zinc/11/14/67/1046111467.db2.gz HEOLJYPHSLZNIN-LIRRHRJNSA-N 1 0 317.473 4.127 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000756624919 1046112622 /nfs/dbraw/zinc/11/26/22/1046112622.db2.gz HIPXQYIMZBYWJA-GFCCVEGCSA-N 1 0 305.418 4.412 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000756624843 1046112878 /nfs/dbraw/zinc/11/28/78/1046112878.db2.gz GXQBYXWVZFEEJY-GFCCVEGCSA-N 1 0 305.418 4.412 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1cc2c(cc1O)CCCC2 ZINC000756636289 1046113728 /nfs/dbraw/zinc/11/37/28/1046113728.db2.gz WMHAROZNFUDJDA-HUUCEWRRSA-N 1 0 310.441 4.120 20 10 DICDRO C[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)c1ccncc1 ZINC000756637022 1046113769 /nfs/dbraw/zinc/11/37/69/1046113769.db2.gz YVQVACSLPUSPOB-LSDHHAIUSA-N 1 0 306.409 4.395 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccncc1 ZINC000756636282 1046114043 /nfs/dbraw/zinc/11/40/43/1046114043.db2.gz WMHAROZNFUDJDA-CABCVRRESA-N 1 0 310.441 4.120 20 10 DICDRO C[C@@H]([NH2+]CCc1cc(F)ccc1F)c1cc(Cl)ccc1O ZINC000756638021 1046114207 /nfs/dbraw/zinc/11/42/07/1046114207.db2.gz QKINVSPGUJCHRL-SNVBAGLBSA-N 1 0 311.759 4.217 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1SCCc2ccccc21)c1cc(F)ccc1O ZINC000756636865 1046114259 /nfs/dbraw/zinc/11/42/59/1046114259.db2.gz XENVZSBXXHFASO-XIKOKIGWSA-N 1 0 317.429 4.213 20 10 DICDRO CC[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)Oc1ccccc1F ZINC000756637290 1046114863 /nfs/dbraw/zinc/11/48/63/1046114863.db2.gz IWUZRVFBNDYUGV-HUUCEWRRSA-N 1 0 317.404 4.348 20 10 DICDRO COCCC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000756648158 1046115802 /nfs/dbraw/zinc/11/58/02/1046115802.db2.gz ZCADYHIGVBLDTB-ZFWWWQNUSA-N 1 0 321.436 4.266 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756647569 1046115925 /nfs/dbraw/zinc/11/59/25/1046115925.db2.gz PRGQLXKQYLJEEL-SWLSCSKDSA-N 1 0 315.388 4.186 20 10 DICDRO COc1ccc(CC[NH2+][C@H](C)c2cc(F)ccc2O)c(Cl)c1 ZINC000756647280 1046116118 /nfs/dbraw/zinc/11/61/18/1046116118.db2.gz SAJQDOXZPIPHFA-LLVKDONJSA-N 1 0 323.795 4.087 20 10 DICDRO C[C@@H]([NH2+]CCNc1ccccc1)c1ccc2ccccc2c1O ZINC000756644223 1046116544 /nfs/dbraw/zinc/11/65/44/1046116544.db2.gz ZNSNLPPSQFUXQQ-OAHLLOKOSA-N 1 0 306.409 4.308 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H](CCO)C2CCCCC2)c2c1c(F)ccc2O ZINC000756659871 1046117939 /nfs/dbraw/zinc/11/79/39/1046117939.db2.gz GZBDQLKKYZLPDZ-KCXAZCMYSA-N 1 0 321.436 4.001 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756671352 1046117965 /nfs/dbraw/zinc/11/79/65/1046117965.db2.gz GWRMDJQABHYHLE-DOMZBBRYSA-N 1 0 315.388 4.186 20 10 DICDRO CC(C)c1csc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC000756657737 1046118066 /nfs/dbraw/zinc/11/80/66/1046118066.db2.gz FWFXAZUOEXWLFO-CMPLNLGQSA-N 1 0 320.433 4.449 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756671354 1046118828 /nfs/dbraw/zinc/11/88/28/1046118828.db2.gz GWRMDJQABHYHLE-IUODEOHRSA-N 1 0 315.388 4.186 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000756687385 1046119536 /nfs/dbraw/zinc/11/95/36/1046119536.db2.gz WBQZZJKPPOKZJI-KBXCAEBGSA-N 1 0 311.425 4.437 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1cc(C)ccc1O ZINC000756687387 1046120177 /nfs/dbraw/zinc/12/01/77/1046120177.db2.gz WBQZZJKPPOKZJI-KDOFPFPSSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756675979 1046120708 /nfs/dbraw/zinc/12/07/08/1046120708.db2.gz KDKFKYYZPAORPO-HUBLWGQQSA-N 1 0 300.377 4.134 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1)c1cc(Cl)ccc1O ZINC000756704134 1046122632 /nfs/dbraw/zinc/12/26/32/1046122632.db2.gz FQACZZDNLOOFSU-QWHCGFSZSA-N 1 0 305.805 4.164 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)Oc2ccccc2Cl)c(O)c1 ZINC000756732517 1046123665 /nfs/dbraw/zinc/12/36/65/1046123665.db2.gz MCOFHNFDPRNGHE-ZIAGYGMSSA-N 1 0 319.832 4.472 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)Oc2ccccc2Cl)c1 ZINC000756733881 1046124572 /nfs/dbraw/zinc/12/45/72/1046124572.db2.gz SZIAKQKSGMRGBR-KGLIPLIRSA-N 1 0 319.832 4.472 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000756755597 1046126324 /nfs/dbraw/zinc/12/63/24/1046126324.db2.gz BGODSHPGSZNUOP-LRDDRELGSA-N 1 0 311.853 4.292 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2nc(C3CC3)cs2)c2c1c(F)ccc2O ZINC000756758415 1046128190 /nfs/dbraw/zinc/12/81/90/1046128190.db2.gz FMYFARYPAUQWFK-BXKDBHETSA-N 1 0 318.417 4.203 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)c1ccccc1Cl ZINC000756760950 1046128244 /nfs/dbraw/zinc/12/82/44/1046128244.db2.gz QDIHONJJXMZJMD-FZKQIMNGSA-N 1 0 319.832 4.392 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2nc(C3CC3)cs2)c2c1c(F)ccc2O ZINC000756758418 1046128307 /nfs/dbraw/zinc/12/83/07/1046128307.db2.gz FMYFARYPAUQWFK-CABZTGNLSA-N 1 0 318.417 4.203 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)[C@H]2CCCCO2)c(O)c1C ZINC000756758171 1046128318 /nfs/dbraw/zinc/12/83/18/1046128318.db2.gz SNAZEVUBLFSEPT-NVXWUHKLSA-N 1 0 305.462 4.255 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)c1 ZINC000756757761 1046128494 /nfs/dbraw/zinc/12/84/94/1046128494.db2.gz BRHXYVQOEPAWSV-IAQYHMDHSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@H](C)c3c1c(O)ccc3F)CO2 ZINC000756758313 1046128505 /nfs/dbraw/zinc/12/85/05/1046128505.db2.gz DDZSGZAXYDYJCZ-NILFDRSVSA-N 1 0 313.372 4.111 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c(C)c1 ZINC000756761112 1046128646 /nfs/dbraw/zinc/12/86/46/1046128646.db2.gz RGWMXYVZCQBUNH-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756769249 1046129931 /nfs/dbraw/zinc/12/99/31/1046129931.db2.gz PGRREZSZIDFFBS-IMSIIYSGSA-N 1 0 318.392 4.078 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1c(C)n(C)c3ccccc31)CC2 ZINC001138252406 1046129953 /nfs/dbraw/zinc/12/99/53/1046129953.db2.gz GBCLZMOCJOXSGY-UHFFFAOYSA-N 1 0 320.436 4.054 20 10 DICDRO CC(C)[C@@H](O)C(C)(C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756769288 1046130648 /nfs/dbraw/zinc/13/06/48/1046130648.db2.gz DONOWSKAMPCJHT-IFXJQAMLSA-N 1 0 315.457 4.239 20 10 DICDRO Cc1c(CN(C)Cc2cccc(F)c2F)c2ccccc2n1C ZINC001138260105 1046131473 /nfs/dbraw/zinc/13/14/73/1046131473.db2.gz UYSIUAHQWACROG-UHFFFAOYSA-N 1 0 314.379 4.397 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3SCCS[C@H]23)c(O)c1C ZINC000756777705 1046131457 /nfs/dbraw/zinc/13/14/57/1046131457.db2.gz KPNCIEVASCBOAD-PWXKEOIMSA-N 1 0 323.527 4.039 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c2ccccc2n1C ZINC001138256995 1046132049 /nfs/dbraw/zinc/13/20/49/1046132049.db2.gz RMJBIHYMGVJBLJ-CYBMUJFWSA-N 1 0 310.363 4.261 20 10 DICDRO CCCCCn1cc(C[NH2+][C@H](C)c2cc(F)ccc2O)c(C)n1 ZINC000756779403 1046132200 /nfs/dbraw/zinc/13/22/00/1046132200.db2.gz KPWPFJCFTYAFTQ-CQSZACIVSA-N 1 0 319.424 4.077 20 10 DICDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2F)CC1)c1cc(F)ccc1O ZINC000756780510 1046132420 /nfs/dbraw/zinc/13/24/20/1046132420.db2.gz YVJGPIPUQJYKLP-NSHDSACASA-N 1 0 321.342 4.192 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCCc2cccs2)c2c1c(F)ccc2O ZINC000756780968 1046133163 /nfs/dbraw/zinc/13/31/63/1046133163.db2.gz ZLFGMMPZXHDGCG-FZMZJTMJSA-N 1 0 305.418 4.364 20 10 DICDRO COc1ccc(C[C@H](C)C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000756783656 1046133275 /nfs/dbraw/zinc/13/32/75/1046133275.db2.gz GUUOIMCQNWVQQO-JKSUJKDBSA-N 1 0 313.441 4.239 20 10 DICDRO CCCCCn1cc(C[NH2+][C@H](C)c2ccc(C)cc2O)c(C)n1 ZINC000756780869 1046133690 /nfs/dbraw/zinc/13/36/90/1046133690.db2.gz XGSXSMUUWHLQGU-MRXNPFEDSA-N 1 0 315.461 4.247 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C)[C@@H]2c2ccccc2)c(O)c1C ZINC000756784020 1046134069 /nfs/dbraw/zinc/13/40/69/1046134069.db2.gz KBRAQCMAKBITRD-PWIZWCRZSA-N 1 0 324.468 4.105 20 10 DICDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CCO1 ZINC000756874515 1046147988 /nfs/dbraw/zinc/14/79/88/1046147988.db2.gz QCBQKRWBTJVGIT-NHIYQJMISA-N 1 0 321.436 4.263 20 10 DICDRO CSc1cc(C)ccc1C[NH2+]Cc1c(O)cccc1Cl ZINC000756900252 1046149222 /nfs/dbraw/zinc/14/92/22/1046149222.db2.gz LZJJAWVVXLXSGI-UHFFFAOYSA-N 1 0 307.846 4.366 20 10 DICDRO CC[N@H+](Cc1cccs1)Cc1ccc2c(c1)CCCN2C ZINC001138356082 1046155483 /nfs/dbraw/zinc/15/54/83/1046155483.db2.gz GYZDHACYRCBKMW-UHFFFAOYSA-N 1 0 300.471 4.153 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CC(c3ccccc3)C2)c(OC)c1 ZINC001138389260 1046161805 /nfs/dbraw/zinc/16/18/05/1046161805.db2.gz HPVNHCNSTPXTDA-UHFFFAOYSA-N 1 0 324.468 4.141 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccsc2)c(OC)c1 ZINC001138389262 1046162657 /nfs/dbraw/zinc/16/26/57/1046162657.db2.gz HQEIEACAGZNINJ-UHFFFAOYSA-N 1 0 318.486 4.235 20 10 DICDRO C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000757277510 1046172540 /nfs/dbraw/zinc/17/25/40/1046172540.db2.gz QGVOFBWPYMPOBR-QFBILLFUSA-N 1 0 311.425 4.134 20 10 DICDRO COc1c(C)cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1C ZINC001138429057 1046177150 /nfs/dbraw/zinc/17/71/50/1046177150.db2.gz DDQAIKHBSRVPAH-UHFFFAOYSA-N 1 0 312.457 4.010 20 10 DICDRO C[C@H]([NH2+]Cc1nccc2c1CCCC2)c1cc(Cl)ccc1O ZINC000903183008 1046184584 /nfs/dbraw/zinc/18/45/84/1046184584.db2.gz XDLOHEULZMNBRV-LBPRGKRZSA-N 1 0 316.832 4.170 20 10 DICDRO Cn1cc(Cl)cc1C[N@H+](C)Cc1c(O)ccc2ccccc21 ZINC000757604326 1046190731 /nfs/dbraw/zinc/19/07/31/1046190731.db2.gz BRJJPYAWBPGFAS-UHFFFAOYSA-N 1 0 314.816 4.169 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCNc2cccc(F)c2)c(O)c1C ZINC000757655291 1046197376 /nfs/dbraw/zinc/19/73/76/1046197376.db2.gz DIQDXDWACOYZAX-OAHLLOKOSA-N 1 0 316.420 4.301 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC2CCC(OC)CC2)cc1 ZINC000757683442 1046201216 /nfs/dbraw/zinc/20/12/16/1046201216.db2.gz XBUULHRPNOWAQH-VXESANQCSA-N 1 0 318.505 4.389 20 10 DICDRO CC[C@@H]([NH2+]Cc1c[nH]c(=O)c2ccccc12)c1ccc(C)cc1O ZINC000903234691 1046201991 /nfs/dbraw/zinc/20/19/91/1046201991.db2.gz LMUXKKOHLJKPBC-GOSISDBHSA-N 1 0 322.408 4.195 20 10 DICDRO COC1CCC(CC[NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000757681876 1046201781 /nfs/dbraw/zinc/20/17/81/1046201781.db2.gz GEFJUFAJYYCVCN-KLAILNCOSA-N 1 0 305.462 4.255 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2c[nH]c(=O)c3ccccc23)c(O)c1C ZINC000903235987 1046202527 /nfs/dbraw/zinc/20/25/27/1046202527.db2.gz RUACNMMMSPFIES-AWEZNQCLSA-N 1 0 322.408 4.114 20 10 DICDRO Cc1cccc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)c1 ZINC000321089519 1046202723 /nfs/dbraw/zinc/20/27/23/1046202723.db2.gz JVBBIDNSNNGPET-UHFFFAOYSA-N 1 0 308.469 4.318 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)s1 ZINC000757703517 1046203346 /nfs/dbraw/zinc/20/33/46/1046203346.db2.gz VOKKENNRTVJXNA-BREBYQMCSA-N 1 0 320.433 4.238 20 10 DICDRO CC[C@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1cc(Cl)ccc1O ZINC000903283634 1046222127 /nfs/dbraw/zinc/22/21/27/1046222127.db2.gz RZTOSNRYBZKWOA-DJBJLQPQSA-N 1 0 309.837 4.044 20 10 DICDRO Cc1cc(CO)cc(C)c1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000903303962 1046231457 /nfs/dbraw/zinc/23/14/57/1046231457.db2.gz XEBPYDXDMUVUAI-CYBMUJFWSA-N 1 0 319.832 4.006 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C2CC3(C2)COC(C)(C)C3)c2c1c(F)ccc2O ZINC000903323269 1046236761 /nfs/dbraw/zinc/23/67/61/1046236761.db2.gz IHUOYHRBROSEPU-AKIUGDJFSA-N 1 0 319.420 4.017 20 10 DICDRO CC[C@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1ccc(C)cc1O ZINC000903322450 1046237417 /nfs/dbraw/zinc/23/74/17/1046237417.db2.gz CVEXFXDKFOVMJA-RCDNUKIMSA-N 1 0 303.446 4.089 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C2CC3(C2)COC(C)(C)C3)c(O)c1 ZINC000903325148 1046238694 /nfs/dbraw/zinc/23/86/94/1046238694.db2.gz SUNCXAYTQCVYLJ-XVTSOASTSA-N 1 0 303.446 4.007 20 10 DICDRO C[C@@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1cc(Cl)ccc1O ZINC000903325600 1046239150 /nfs/dbraw/zinc/23/91/50/1046239150.db2.gz VCXRSTSOLAQYHO-FFLHNBHYSA-N 1 0 309.837 4.044 20 10 DICDRO C[C@H]([NH2+][C@H](c1ncccn1)C1CC1)c1ccc2ccccc2c1O ZINC000903324259 1046239878 /nfs/dbraw/zinc/23/98/78/1046239878.db2.gz CXPHWCBHNFCEKD-UGSOOPFHSA-N 1 0 319.408 4.137 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cccc3cccnc32)c(O)c1 ZINC000321589643 1046240799 /nfs/dbraw/zinc/24/07/99/1046240799.db2.gz RLKQGMSMLPAOFR-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO Cc1cccnc1[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)C(C)(C)C ZINC000903327923 1046241389 /nfs/dbraw/zinc/24/13/89/1046241389.db2.gz BJJQNZMEUCRBSC-DNVCBOLYSA-N 1 0 310.441 4.460 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccccc1N1CCCC1 ZINC001138613039 1046242105 /nfs/dbraw/zinc/24/21/05/1046242105.db2.gz GADZOBDDNMJBAS-UHFFFAOYSA-N 1 0 310.441 4.015 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](c2ccccn2)C2CC2)cc1 ZINC000903338205 1046250291 /nfs/dbraw/zinc/25/02/91/1046250291.db2.gz GXIDBYVPFLPGOI-QRWLVFNGSA-N 1 0 309.457 4.340 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cc(F)ccc1OC ZINC000903371167 1046259383 /nfs/dbraw/zinc/25/93/83/1046259383.db2.gz PPUJYFICRYXBIJ-CVEARBPZSA-N 1 0 315.388 4.268 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cc(F)ccc1OC ZINC000903371260 1046259853 /nfs/dbraw/zinc/25/98/53/1046259853.db2.gz QTWAGEKBIOEVJL-MLGOLLRUSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cnn(CC3CCC3)c2)c1 ZINC000903404358 1046267624 /nfs/dbraw/zinc/26/76/24/1046267624.db2.gz JEGIXCUCJUFONP-CABCVRRESA-N 1 0 313.445 4.109 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)c1 ZINC000903404361 1046267726 /nfs/dbraw/zinc/26/77/26/1046267726.db2.gz JEGIXCUCJUFONP-LSDHHAIUSA-N 1 0 313.445 4.109 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)cc1 ZINC000903427690 1046277463 /nfs/dbraw/zinc/27/74/63/1046277463.db2.gz IQMFQOIIYBSIRH-MGPUTAFESA-N 1 0 309.457 4.340 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000903430365 1046279854 /nfs/dbraw/zinc/27/98/54/1046279854.db2.gz ZBWQZTLUUZMSFM-SPLOXXLWSA-N 1 0 322.452 4.468 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903430337 1046279939 /nfs/dbraw/zinc/27/99/39/1046279939.db2.gz YUOAISLYCDPCBX-VQTJNVASSA-N 1 0 309.457 4.340 20 10 DICDRO Cc1cc([C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C2CC2)ccc1F ZINC000758638782 1046282715 /nfs/dbraw/zinc/28/27/15/1046282715.db2.gz IRCBXLIGDNDLPK-FQEVSTJZSA-N 1 0 312.432 4.441 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](c2cccnc2)C2CC2)cc1 ZINC000758633771 1046283071 /nfs/dbraw/zinc/28/30/71/1046283071.db2.gz YBJRCSZJVOZZDD-HXUWFJFHSA-N 1 0 309.457 4.169 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2oc3ccccc3c2C)c1 ZINC000089726137 1046303279 /nfs/dbraw/zinc/30/32/79/1046303279.db2.gz LYKVCNSCTSVWEJ-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)Cc1ccc(Cl)cc1 ZINC001168187086 1046329335 /nfs/dbraw/zinc/32/93/35/1046329335.db2.gz DUOFZDYVPBPGBL-AWEZNQCLSA-N 1 0 303.833 4.499 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)c2ccc(C)nc2)cc1 ZINC000759188855 1046331178 /nfs/dbraw/zinc/33/11/78/1046331178.db2.gz ZKECNGLUXPYEHZ-UHFFFAOYSA-N 1 0 311.473 4.261 20 10 DICDRO Clc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1Cl ZINC000689267723 1046347326 /nfs/dbraw/zinc/34/73/26/1046347326.db2.gz XOFQDACWFBSZRQ-UHFFFAOYSA-N 1 0 308.208 4.218 20 10 DICDRO CCc1cccnc1[C@H](C)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000780714339 1046400638 /nfs/dbraw/zinc/40/06/38/1046400638.db2.gz SNIIXFDXECIBAY-INIZCTEOSA-N 1 0 311.473 4.341 20 10 DICDRO CC[C@@H]1C[C@@H](C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)CCO1 ZINC000780754399 1046403571 /nfs/dbraw/zinc/40/35/71/1046403571.db2.gz OKZWIUQHHFHWSS-AZUAARDMSA-N 1 0 318.505 4.168 20 10 DICDRO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000780793434 1046406991 /nfs/dbraw/zinc/40/69/91/1046406991.db2.gz NPFKZNQKRRQSDD-WCQYABFASA-N 1 0 318.358 4.055 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)ccc1Br)c1ccccc1O ZINC000038039004 1046411236 /nfs/dbraw/zinc/41/12/36/1046411236.db2.gz KCOSQDOVTUPZDW-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)ccc1Br)c1ccccc1O ZINC000038039005 1046411497 /nfs/dbraw/zinc/41/14/97/1046411497.db2.gz KCOSQDOVTUPZDW-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)CC1 ZINC000090723105 1046416944 /nfs/dbraw/zinc/41/69/44/1046416944.db2.gz WEIXRJXNKFYGCI-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO CCOCCC1(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)CC1 ZINC000090722845 1046417201 /nfs/dbraw/zinc/41/72/01/1046417201.db2.gz XRQUEBZJBMKKAS-GOSISDBHSA-N 1 0 304.478 4.000 20 10 DICDRO CC[N@H+](Cc1ccc(-c2cccnc2)cc1)Cc1ccccc1O ZINC001139644886 1046493616 /nfs/dbraw/zinc/49/36/16/1046493616.db2.gz UGOYRTXZMONDAY-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO CC[N@H+](Cc1cccc(OC)c1O)[C@@H](C)c1ccc(F)cc1 ZINC000092123849 1046495417 /nfs/dbraw/zinc/49/54/17/1046495417.db2.gz FKOUDKCOPKINQD-ZDUSSCGKSA-N 1 0 303.377 4.123 20 10 DICDRO Cc1cc(C[N@@H+]2CCCC3(CC(F)C3)CC2)ccc1N(C)C ZINC001139673456 1046497521 /nfs/dbraw/zinc/49/75/21/1046497521.db2.gz HQLXTBGUOTYWDV-UHFFFAOYSA-N 1 0 304.453 4.165 20 10 DICDRO Cc1cc(CN2C[C@H](C)OC[C@@H]2c2ccccc2)ccc1N(C)C ZINC001139674282 1046497675 /nfs/dbraw/zinc/49/76/75/1046497675.db2.gz SAWRFWLNCZGIFO-LAUBAEHRSA-N 1 0 324.468 4.023 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)[C@@H](O)c1ccc(C)cc1 ZINC001202963587 1046503025 /nfs/dbraw/zinc/50/30/25/1046503025.db2.gz CBBHXOXLUODCCO-IIBYNOLFSA-N 1 0 322.452 4.007 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(Cl)c1OC)c1ccccc1O ZINC000897481851 1046555220 /nfs/dbraw/zinc/55/52/20/1046555220.db2.gz IUIHRCHEUPLAJU-OAHLLOKOSA-N 1 0 305.805 4.295 20 10 DICDRO Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2ccc3c(c2)CCO3)c1C ZINC000729681533 1046577876 /nfs/dbraw/zinc/57/78/76/1046577876.db2.gz CNTDQTASAWCDTK-UHFFFAOYSA-N 1 0 320.436 4.318 20 10 DICDRO CN(Cc1cc(F)ccc1O)Cc1ccc(Cl)cc1Cl ZINC001140057718 1046578142 /nfs/dbraw/zinc/57/81/42/1046578142.db2.gz LETIBOVCIRHMGI-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO Cc1cc(C[NH2+]C2CCSCC2)c(C)n1-c1cccc(C)c1 ZINC000729684492 1046578234 /nfs/dbraw/zinc/57/82/34/1046578234.db2.gz WBGSKZHNWVSDKW-UHFFFAOYSA-N 1 0 314.498 4.388 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000783309823 1046579792 /nfs/dbraw/zinc/57/97/92/1046579792.db2.gz MYXJKVONHXGSEC-RBSFLKMASA-N 1 0 322.880 4.016 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOc2ccc(F)cc21)c1ccccc1O ZINC000783502439 1046602080 /nfs/dbraw/zinc/60/20/80/1046602080.db2.gz SQXUSPQPMUCFOP-LRDDRELGSA-N 1 0 301.361 4.096 20 10 DICDRO C[C@H]([NH2+][C@H](CN1CCCCC1)c1ccccc1)c1ccccc1O ZINC000783504755 1046602166 /nfs/dbraw/zinc/60/21/66/1046602166.db2.gz DLCXNLCDMFCZIH-FXAWDEMLSA-N 1 0 324.468 4.270 20 10 DICDRO C[C@@H]([NH2+][C@@H](CN1CCCCC1)c1ccccc1)c1ccccc1O ZINC000783504758 1046602274 /nfs/dbraw/zinc/60/22/74/1046602274.db2.gz DLCXNLCDMFCZIH-XLIONFOSSA-N 1 0 324.468 4.270 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000783520100 1046603672 /nfs/dbraw/zinc/60/36/72/1046603672.db2.gz ZRWNDIANMNEWMV-YVEFUNNKSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1cccc(Cl)c1 ZINC000783518638 1046604097 /nfs/dbraw/zinc/60/40/97/1046604097.db2.gz MOWWRTLWLLIQQW-OLZOCXBDSA-N 1 0 305.805 4.164 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000783520098 1046604359 /nfs/dbraw/zinc/60/43/59/1046604359.db2.gz ZRWNDIANMNEWMV-SJCJKPOMSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@H]([NH2+]C1(CCOCc2ccccc2)CC1)c1ccccc1O ZINC000783528445 1046604913 /nfs/dbraw/zinc/60/49/13/1046604913.db2.gz NQLCICGNEVACGE-INIZCTEOSA-N 1 0 311.425 4.182 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841746847 1046608026 /nfs/dbraw/zinc/60/80/26/1046608026.db2.gz LOPVZAYMXYFYDX-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc(C)c(C[NH+]2CCC(Oc3ccccc3)CC2)c1O ZINC001140178553 1046610371 /nfs/dbraw/zinc/61/03/71/1046610371.db2.gz OEPVLSHJUYDFEU-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1ccc(C)c(C[N@H+](C)Cc2cccc3cccnc32)c1O ZINC001140182661 1046610442 /nfs/dbraw/zinc/61/04/42/1046610442.db2.gz WNICCGPAYSDCIE-UHFFFAOYSA-N 1 0 306.409 4.189 20 10 DICDRO Cc1ccc(C2CC[NH+](Cc3cc(Cl)ccc3O)CC2)cn1 ZINC000783603777 1046613060 /nfs/dbraw/zinc/61/30/60/1046613060.db2.gz XVYBPXYHCSNYFD-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO CC(C)COc1cccc(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000834531028 1046626391 /nfs/dbraw/zinc/62/63/91/1046626391.db2.gz NYSOKCSRVOCIHE-SFHVURJKSA-N 1 0 311.425 4.204 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@H]3CCc4cccc(O)c43)c[nH]c2c1 ZINC000834551623 1046630766 /nfs/dbraw/zinc/63/07/66/1046630766.db2.gz HYDOPRGLMWJJID-KRWDZBQOSA-N 1 0 306.409 4.002 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCc2ncsc2C1 ZINC000783745560 1046630957 /nfs/dbraw/zinc/63/09/57/1046630957.db2.gz NZDLUGWCCURMOE-UHFFFAOYSA-N 1 0 322.433 4.074 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](C)c2ncc(C)s2)cc1 ZINC000248647287 1046631675 /nfs/dbraw/zinc/63/16/75/1046631675.db2.gz SWXMCYXAWBGWBZ-ZFWWWQNUSA-N 1 0 317.502 4.362 20 10 DICDRO C[C@@H](NC(C)(C)C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834584986 1046633948 /nfs/dbraw/zinc/63/39/48/1046633948.db2.gz BMSRWSQTPWTWLQ-CRAIPNDOSA-N 1 0 324.468 4.099 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cc(F)ccc1F ZINC000834669000 1046646080 /nfs/dbraw/zinc/64/60/80/1046646080.db2.gz QATFKVLQCAPUAR-CVEARBPZSA-N 1 0 303.352 4.399 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](c3cccc(C)c3)C2)c1O ZINC000784025080 1046652913 /nfs/dbraw/zinc/65/29/13/1046652913.db2.gz FDIJBXHMABKINM-QGZVFWFLSA-N 1 0 311.425 4.007 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccccc1-c1cccnc1 ZINC001140320878 1046653568 /nfs/dbraw/zinc/65/35/68/1046653568.db2.gz RVRWQHNTLCNESY-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001140341197 1046666584 /nfs/dbraw/zinc/66/65/84/1046666584.db2.gz CDOMDCGORBOLMP-INIZCTEOSA-N 1 0 319.857 4.336 20 10 DICDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)cn1 ZINC001140341799 1046667682 /nfs/dbraw/zinc/66/76/82/1046667682.db2.gz HUGBBNZVIUCNCJ-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CCCc1cccnc1)c1ccc(N(C)C)cc1 ZINC000834769725 1046667748 /nfs/dbraw/zinc/66/77/48/1046667748.db2.gz QRUINDHMEHJTBQ-DLBZAZTESA-N 1 0 311.473 4.210 20 10 DICDRO COc1cccc([C@H]2CC[N@H+](Cc3c(O)cccc3Cl)C2)c1 ZINC001140342708 1046668017 /nfs/dbraw/zinc/66/80/17/1046668017.db2.gz VIBUEELSSCPEOX-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001140344949 1046668059 /nfs/dbraw/zinc/66/80/59/1046668059.db2.gz OBOBMDXWWZVQFA-GFCCVEGCSA-N 1 0 305.780 4.174 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC001140344952 1046668676 /nfs/dbraw/zinc/66/86/76/1046668676.db2.gz OBOBMDXWWZVQFA-LBPRGKRZSA-N 1 0 305.780 4.174 20 10 DICDRO Cc1ccccc1O[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001140344829 1046668705 /nfs/dbraw/zinc/66/87/05/1046668705.db2.gz NBMNHFPNBCRSPU-CQSZACIVSA-N 1 0 317.816 4.007 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1 ZINC000784267012 1046677755 /nfs/dbraw/zinc/67/77/55/1046677755.db2.gz UXFIVCQOAWVMLP-APPDUMDISA-N 1 0 317.816 4.392 20 10 DICDRO C[C@H](CCO)CC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834832883 1046680278 /nfs/dbraw/zinc/68/02/78/1046680278.db2.gz SOTZELKDJADDIP-ROUUACIJSA-N 1 0 318.505 4.126 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(C2CC2)ccc1F)c1cc(F)ccc1O ZINC000834841677 1046682854 /nfs/dbraw/zinc/68/28/54/1046682854.db2.gz YKAYOXZHYCRXTN-LLVKDONJSA-N 1 0 303.352 4.399 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CC1=CCOCC1 ZINC000834860784 1046688497 /nfs/dbraw/zinc/68/84/97/1046688497.db2.gz UEJZUMJZAATKEZ-FQEVSTJZSA-N 1 0 323.436 4.002 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)ccn1 ZINC000834859793 1046688634 /nfs/dbraw/zinc/68/86/34/1046688634.db2.gz JGOQERUAEVYBER-KRWDZBQOSA-N 1 0 309.457 4.231 20 10 DICDRO COc1ccc(C[NH2+]CC2(c3ccccc3F)CCC2)cc1C ZINC001203033460 1046691520 /nfs/dbraw/zinc/69/15/20/1046691520.db2.gz ZINQRNHSKUFAIX-UHFFFAOYSA-N 1 0 313.416 4.354 20 10 DICDRO C[C@H](CCCCO)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834876394 1046693104 /nfs/dbraw/zinc/69/31/04/1046693104.db2.gz BKUZZBPOFKHHRN-QZTJIDSGSA-N 1 0 318.505 4.269 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CCCCO)c1ccc(N2CCCCCC2)cc1 ZINC000834876396 1046693370 /nfs/dbraw/zinc/69/33/70/1046693370.db2.gz BKUZZBPOFKHHRN-ZWKOTPCHSA-N 1 0 318.505 4.269 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1ccc(C)cc1O ZINC000834883592 1046696361 /nfs/dbraw/zinc/69/63/61/1046696361.db2.gz RKEMLTPOCCNJSY-RDJZCZTQSA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@H]([NH2+]CCCc1ncccc1C)c1ccc(N(C)C)cc1 ZINC000834884155 1046697335 /nfs/dbraw/zinc/69/73/35/1046697335.db2.gz WHQSHQHYGWNWTC-IBGZPJMESA-N 1 0 311.473 4.130 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c1O ZINC000834883211 1046697371 /nfs/dbraw/zinc/69/73/71/1046697371.db2.gz NONRVPYYKUPWLS-KBPBESRZSA-N 1 0 323.864 4.354 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@@H](C(C)C)C1)c1ccc(C)cc1O ZINC000834885938 1046701027 /nfs/dbraw/zinc/70/10/27/1046701027.db2.gz NSMUOKXNCPIPLX-HHXXYDBFSA-N 1 0 305.462 4.193 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccc2ccccc2c1O ZINC000834892647 1046703668 /nfs/dbraw/zinc/70/36/68/1046703668.db2.gz CEEQGGHASXPYPX-DCGLDWPTSA-N 1 0 307.397 4.099 20 10 DICDRO C[C@@H]([NH2+]CC[C@]1(C)CC1(Cl)Cl)c1cc(F)ccc1O ZINC000834894373 1046705842 /nfs/dbraw/zinc/70/58/42/1046705842.db2.gz RRMBTDIAWHGCIP-NOZJJQNGSA-N 1 0 306.208 4.156 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000834897600 1046706949 /nfs/dbraw/zinc/70/69/49/1046706949.db2.gz UYCNPDNFTWVPSM-QMTHXVAHSA-N 1 0 321.342 4.456 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c1 ZINC000834895274 1046708026 /nfs/dbraw/zinc/70/80/26/1046708026.db2.gz XRPKNEIOTHMBIA-FZMZJTMJSA-N 1 0 302.245 4.325 20 10 DICDRO CCCc1ncc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)o1 ZINC000834898832 1046710321 /nfs/dbraw/zinc/71/03/21/1046710321.db2.gz HBVVOXBRWGFNIL-CYBMUJFWSA-N 1 0 314.429 4.062 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+][C@@H](C)c3cc(F)ccc3O)C2)c1 ZINC000834902796 1046711465 /nfs/dbraw/zinc/71/14/65/1046711465.db2.gz GIJYOZZUIBMELH-NOLJZWGESA-N 1 0 315.388 4.137 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+][C@@H](C)c3ccc(C)cc3O)C2)c1 ZINC000834906390 1046715795 /nfs/dbraw/zinc/71/57/95/1046715795.db2.gz ZKESCFBWFYKCDI-XIRDDKMYSA-N 1 0 311.425 4.306 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1cc(F)ccc1O ZINC000834909081 1046717518 /nfs/dbraw/zinc/71/75/18/1046717518.db2.gz KMIMSZJESVPDIV-AXAPSJFSSA-N 1 0 321.417 4.164 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(C)cn1)c1cc(Cl)ccc1O ZINC000834908165 1046718282 /nfs/dbraw/zinc/71/82/82/1046718282.db2.gz CGUPUEFSQJAPIF-MRXNPFEDSA-N 1 0 304.821 4.032 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1ccccc1O ZINC000834909356 1046718312 /nfs/dbraw/zinc/71/83/12/1046718312.db2.gz MQPMYDHIKYEOKD-XJKCOSOUSA-N 1 0 303.427 4.025 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)c(O)c1 ZINC000834908404 1046718833 /nfs/dbraw/zinc/71/88/33/1046718833.db2.gz DQXWRNASFLVQLC-CKEIUWERSA-N 1 0 317.454 4.333 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001140465097 1046738262 /nfs/dbraw/zinc/73/82/62/1046738262.db2.gz HGKDFSQYXICBGO-CYBMUJFWSA-N 1 0 305.780 4.174 20 10 DICDRO CCC[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccccn1 ZINC000835038225 1046744561 /nfs/dbraw/zinc/74/45/61/1046744561.db2.gz OUMGUASWXVGHLV-QRBZPYHOSA-N 1 0 309.457 4.292 20 10 DICDRO Cc1cnc(C(C)(C)[NH2+]C/C=C\c2ccc(N(C)C)cc2)s1 ZINC000835043556 1046746344 /nfs/dbraw/zinc/74/63/44/1046746344.db2.gz RXNBDHSEGCTHSM-SREVYHEPSA-N 1 0 315.486 4.056 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000797008456 1046770780 /nfs/dbraw/zinc/77/07/80/1046770780.db2.gz LGZBJROZTHJOGV-ZDUSSCGKSA-N 1 0 318.461 4.464 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000797008454 1046771157 /nfs/dbraw/zinc/77/11/57/1046771157.db2.gz LGZBJROZTHJOGV-CYBMUJFWSA-N 1 0 318.461 4.464 20 10 DICDRO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000797058784 1046782182 /nfs/dbraw/zinc/78/21/82/1046782182.db2.gz GWLJMWRINDOAIQ-TWOQFEAHSA-N 1 0 313.441 4.090 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccc(C)cc1)c1ccc(C)cc1O ZINC000797060368 1046783135 /nfs/dbraw/zinc/78/31/35/1046783135.db2.gz LYGKDSLSSYWHFS-ZAAXVRCTSA-N 1 0 313.441 4.172 20 10 DICDRO C[C@H]([NH2+][C@@H]1CSC[C@@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000797067195 1046784445 /nfs/dbraw/zinc/78/44/45/1046784445.db2.gz XRGNNQXPUXOMKN-TXPKVOOTSA-N 1 0 318.530 4.469 20 10 DICDRO C[C@H]([NH2+][C@@H]1CSC[C@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000797067193 1046784979 /nfs/dbraw/zinc/78/49/79/1046784979.db2.gz XRGNNQXPUXOMKN-JTDSTZFVSA-N 1 0 318.530 4.469 20 10 DICDRO C[C@]1(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C[C@]1(F)Cl ZINC001203048239 1046788703 /nfs/dbraw/zinc/78/87/03/1046788703.db2.gz JKCJIAVFTXTREX-ZWKOTPCHSA-N 1 0 324.871 4.471 20 10 DICDRO CC[C@H]([NH2+]CC1(c2ccccn2)CCC1)c1ccc(C)cc1O ZINC000797099615 1046790236 /nfs/dbraw/zinc/79/02/36/1046790236.db2.gz MJCWKGOWZHMVNY-KRWDZBQOSA-N 1 0 310.441 4.258 20 10 DICDRO [O-]c1cc(F)cc(F)c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001140582773 1046794043 /nfs/dbraw/zinc/79/40/43/1046794043.db2.gz MPXMTCKTORETBC-INIZCTEOSA-N 1 0 307.315 4.147 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC(Oc3ccccc3C)CC2)c1 ZINC001140617465 1046811777 /nfs/dbraw/zinc/81/17/77/1046811777.db2.gz PQGLJNUZQZLNLU-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C)ccc2O)cc1 ZINC001140620977 1046814985 /nfs/dbraw/zinc/81/49/85/1046814985.db2.gz JNXJXKYOOSWBPV-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N2CCCCC2)cc1)C1CCOCC1 ZINC000093604712 1046832256 /nfs/dbraw/zinc/83/22/56/1046832256.db2.gz RLBBIPFJFRMGTK-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO CCCC[NH+](CCCC)Cc1ccc(N2CCOCC2)cc1F ZINC001140663730 1046843065 /nfs/dbraw/zinc/84/30/65/1046843065.db2.gz NKKYDUFWLUOBCW-UHFFFAOYSA-N 1 0 322.468 4.065 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1O ZINC001140746212 1046881928 /nfs/dbraw/zinc/88/19/28/1046881928.db2.gz WAPUSUDBHAKHSA-MRXNPFEDSA-N 1 0 319.351 4.022 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1O ZINC001140747529 1046884085 /nfs/dbraw/zinc/88/40/85/1046884085.db2.gz DPOPSYCKFAAFBR-INIZCTEOSA-N 1 0 319.351 4.022 20 10 DICDRO Cc1c(O)ccc(C[N@@H+](C)C2CCC(C(C)(C)C)CC2)c1O ZINC001140748167 1046885503 /nfs/dbraw/zinc/88/55/03/1046885503.db2.gz SXEPZJGZWLWLGI-UHFFFAOYSA-N 1 0 305.462 4.443 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000797880708 1046901667 /nfs/dbraw/zinc/90/16/67/1046901667.db2.gz YJOYTMPZZJFBGO-YGUOUDRMSA-N 1 0 305.780 4.221 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](c3ccccc3F)C2)c1 ZINC000797997112 1046917744 /nfs/dbraw/zinc/91/77/44/1046917744.db2.gz QXFAGUNNGDSGMN-IHRRRGAJSA-N 1 0 315.388 4.137 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1cc(F)ccc1O ZINC000797998292 1046918412 /nfs/dbraw/zinc/91/84/12/1046918412.db2.gz FGZKNICUPZWCEL-RBOXIYTFSA-N 1 0 303.352 4.267 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)c1 ZINC000798086490 1046927604 /nfs/dbraw/zinc/92/76/04/1046927604.db2.gz RPOORJSHVTWRBL-SAZUREKKSA-N 1 0 317.816 4.090 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)c(Cl)c1 ZINC001140922001 1046951317 /nfs/dbraw/zinc/95/13/17/1046951317.db2.gz ZKHDKHWKRZANLC-SFHVURJKSA-N 1 0 315.848 4.138 20 10 DICDRO CC[N@H+](Cc1cccs1)Cc1ccc(N(C)C)cc1Cl ZINC001140926715 1046953624 /nfs/dbraw/zinc/95/36/24/1046953624.db2.gz RKUFMYQANXHLHP-UHFFFAOYSA-N 1 0 308.878 4.490 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccc(Br)cc2)c(O)c1 ZINC001140950015 1046958709 /nfs/dbraw/zinc/95/87/09/1046958709.db2.gz QTTMIGZLLSRIMP-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(SC)cc2)c(O)c1 ZINC000798501629 1046959216 /nfs/dbraw/zinc/95/92/16/1046959216.db2.gz FHQGARBIERZYBP-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c(O)c1 ZINC001140950774 1046959766 /nfs/dbraw/zinc/95/97/66/1046959766.db2.gz HWLXEXACUYRBLN-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1ccc(C[N@H+](C)CCc2ccc(C(F)(F)F)cc2)c(O)c1 ZINC001140955014 1046961839 /nfs/dbraw/zinc/96/18/39/1046961839.db2.gz PALTYONIZLNQDP-UHFFFAOYSA-N 1 0 323.358 4.394 20 10 DICDRO Cc1ccc(C[NH+]2CCC3(CCc4ccccc4O3)CC2)c(O)c1 ZINC001140958369 1046962847 /nfs/dbraw/zinc/96/28/47/1046962847.db2.gz ZLXPIYYXTHPMMO-UHFFFAOYSA-N 1 0 323.436 4.060 20 10 DICDRO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccc(C)cc2O)on1 ZINC001140957782 1046962967 /nfs/dbraw/zinc/96/29/67/1046962967.db2.gz NUJCGKZFGSUHKM-UHFFFAOYSA-N 1 0 322.408 4.199 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCc3cccnc32)cc1 ZINC000798926598 1046987202 /nfs/dbraw/zinc/98/72/02/1046987202.db2.gz LNMVWWJNMKUEQM-IBGZPJMESA-N 1 0 309.457 4.095 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1 ZINC000798936256 1046990654 /nfs/dbraw/zinc/99/06/54/1046990654.db2.gz BHCPIZLCJCZLGK-JYJNAYRXSA-N 1 0 311.425 4.306 20 10 DICDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1 ZINC001141161965 1047029126 /nfs/dbraw/zinc/02/91/26/1047029126.db2.gz IPFDHFBFOHYOBT-MRXNPFEDSA-N 1 0 303.789 4.088 20 10 DICDRO CCC[N@@H+](Cc1ccc(N2CCC(OC)CC2)cc1)CC(C)C ZINC000827537120 1047114275 /nfs/dbraw/zinc/11/42/75/1047114275.db2.gz BDNVCHWGCLAZFY-UHFFFAOYSA-N 1 0 318.505 4.170 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001116402249 1047136923 /nfs/dbraw/zinc/13/69/23/1047136923.db2.gz OUKPCWLMXWYYBB-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)COc2ccccc2F)c(O)c1C ZINC001116584494 1047159545 /nfs/dbraw/zinc/15/95/45/1047159545.db2.gz GWWSMNVHZDGELG-UKRRQHHQSA-N 1 0 317.404 4.266 20 10 DICDRO COCCC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CCCC1 ZINC001116584374 1047160018 /nfs/dbraw/zinc/16/00/18/1047160018.db2.gz FDHPZJGQGDOQKU-HOTGVXAUSA-N 1 0 317.473 4.435 20 10 DICDRO Cc1csc(CCC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)n1 ZINC001116584709 1047160254 /nfs/dbraw/zinc/16/02/54/1047160254.db2.gz KFHDFQYCOBVEGW-AWEZNQCLSA-N 1 0 304.459 4.057 20 10 DICDRO COc1cccc2cc(C[NH2+][C@H](C)c3ccc(C)cc3O)oc21 ZINC001116585376 1047160488 /nfs/dbraw/zinc/16/04/88/1047160488.db2.gz YZNJWLDPURTOFY-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO Cc1csc(CCC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)n1 ZINC001117061467 1047193755 /nfs/dbraw/zinc/19/37/55/1047193755.db2.gz XKBOCJHIRFXHTB-AWEZNQCLSA-N 1 0 304.459 4.057 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)c(O)c1 ZINC000839192976 1047203833 /nfs/dbraw/zinc/20/38/33/1047203833.db2.gz PMRVXXJIRXYQIB-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CC(C)(C)c1ccccn1 ZINC001117779567 1047244178 /nfs/dbraw/zinc/24/41/78/1047244178.db2.gz QJJCKUMDFRVXAW-LSDHHAIUSA-N 1 0 310.441 4.211 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2c2ccccc2)c1O ZINC000388391099 1047287338 /nfs/dbraw/zinc/28/73/38/1047287338.db2.gz JETBUODTJCDVKE-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCOCc2ccccc2)c1 ZINC000389930227 1047292717 /nfs/dbraw/zinc/29/27/17/1047292717.db2.gz HXSHIRJPMQEZBB-DLBZAZTESA-N 1 0 313.441 4.347 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)COCc1ccccc1)c1ccccc1O ZINC000389902841 1047292876 /nfs/dbraw/zinc/29/28/76/1047292876.db2.gz DIYMYHGICAGFFQ-APWZRJJASA-N 1 0 313.441 4.286 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)COCc1ccccc1)c1ccccc1O ZINC000389902842 1047293236 /nfs/dbraw/zinc/29/32/36/1047293236.db2.gz DIYMYHGICAGFFQ-LPHOPBHVSA-N 1 0 313.441 4.286 20 10 DICDRO CSc1cccc(F)c1C[NH2+]Cc1cc(Cl)ccc1O ZINC000796452178 1047293532 /nfs/dbraw/zinc/29/35/32/1047293532.db2.gz XAAPUESNAPVFGV-UHFFFAOYSA-N 1 0 311.809 4.196 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)COCc2ccccc2)c1 ZINC000389900075 1047293581 /nfs/dbraw/zinc/29/35/81/1047293581.db2.gz BIJMNIPICJXIKH-SJORKVTESA-N 1 0 313.441 4.204 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)c2c1c(F)ccc2O ZINC001118428298 1047293803 /nfs/dbraw/zinc/29/38/03/1047293803.db2.gz SCEXHQVPSOTRSK-HMUNZLOLSA-N 1 0 311.347 4.103 20 10 DICDRO C[C@@H]([NH2+]CCCOCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000390242617 1047294522 /nfs/dbraw/zinc/29/45/22/1047294522.db2.gz OWKAUSYOCSPSNV-QGZVFWFLSA-N 1 0 312.457 4.010 20 10 DICDRO C[C@H]([NH2+]CC1(O)CCCCCC1)c1ccc2ccccc2c1O ZINC000390166475 1047295563 /nfs/dbraw/zinc/29/55/63/1047295563.db2.gz NGWBZLYHMWTBMJ-HNNXBMFYSA-N 1 0 313.441 4.281 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CN1CCCCC1)c1ccc2ccccc2c1O ZINC000390350940 1047297238 /nfs/dbraw/zinc/29/72/38/1047297238.db2.gz YSTKAEWRXMYJMO-JKSUJKDBSA-N 1 0 312.457 4.070 20 10 DICDRO C[C@@H]([NH2+]Cc1csc(Br)c1)c1ccccc1O ZINC000397333123 1047325721 /nfs/dbraw/zinc/32/57/21/1047325721.db2.gz RUPFJUUUCCBIBE-SECBINFHSA-N 1 0 312.232 4.067 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc2ccccc2c1O ZINC000390425942 1047297945 /nfs/dbraw/zinc/29/79/45/1047297945.db2.gz QKABNDSKNGDJHI-CQSZACIVSA-N 1 0 302.377 4.268 20 10 DICDRO C[C@@H]([NH2+]CC1(N(C)C)CCCC1)c1ccc2ccccc2c1O ZINC000391185313 1047304445 /nfs/dbraw/zinc/30/44/45/1047304445.db2.gz MOCHSFPGZGUTIV-OAHLLOKOSA-N 1 0 312.457 4.070 20 10 DICDRO Cc1cccnc1[C@H]([NH2+]Cc1ccc2c(c1)CCO2)C(C)(C)C ZINC000897997740 1047309185 /nfs/dbraw/zinc/30/91/85/1047309185.db2.gz JNHJYAZLCKLARG-IBGZPJMESA-N 1 0 310.441 4.202 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC[C@@H](C)c2ccccc2)c1O ZINC000393380112 1047309435 /nfs/dbraw/zinc/30/94/35/1047309435.db2.gz FWBOIFLRVNSZII-CYBMUJFWSA-N 1 0 319.832 4.338 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC[C@H](C)c2ccccc2)c1O ZINC000393380115 1047309894 /nfs/dbraw/zinc/30/98/94/1047309894.db2.gz FWBOIFLRVNSZII-ZDUSSCGKSA-N 1 0 319.832 4.338 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001118813063 1047312252 /nfs/dbraw/zinc/31/22/52/1047312252.db2.gz SJTVSQZLOWJRDU-LRDDRELGSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccccc1[C@@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000725777844 1047313386 /nfs/dbraw/zinc/31/33/86/1047313386.db2.gz HITAHNSWBVEYEM-QGZVFWFLSA-N 1 0 318.420 4.238 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1ccccn1 ZINC000725841538 1047318279 /nfs/dbraw/zinc/31/82/79/1047318279.db2.gz MHTLPNCQEVUBIW-OAHLLOKOSA-N 1 0 304.393 4.305 20 10 DICDRO Cc1nc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)cs1 ZINC000725846376 1047319463 /nfs/dbraw/zinc/31/94/63/1047319463.db2.gz BLPBFLHSEHRMTJ-UHFFFAOYSA-N 1 0 310.422 4.114 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)c1 ZINC000725844197 1047319572 /nfs/dbraw/zinc/31/95/72/1047319572.db2.gz KIXKXETYXYRMMH-LJQANCHMSA-N 1 0 317.404 4.417 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]CCSCc1ccccc1 ZINC000725842060 1047320194 /nfs/dbraw/zinc/32/01/94/1047320194.db2.gz ZIYGYNHRWCOYKG-UHFFFAOYSA-N 1 0 307.846 4.069 20 10 DICDRO Cc1[nH]c2ccc(C[NH2+]Cc3cc(Cl)ccc3O)cc2c1C ZINC000725848419 1047321225 /nfs/dbraw/zinc/32/12/25/1047321225.db2.gz SSRGZCRHDCOKRT-UHFFFAOYSA-N 1 0 314.816 4.434 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(O)c1 ZINC000398170947 1047326337 /nfs/dbraw/zinc/32/63/37/1047326337.db2.gz FPLGHHZHACOKDE-AOIWGVFYSA-N 1 0 324.468 4.014 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(O)c1 ZINC000398170965 1047326598 /nfs/dbraw/zinc/32/65/98/1047326598.db2.gz FPLGHHZHACOKDE-ZIFCJYIRSA-N 1 0 324.468 4.014 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccccc1O ZINC000398163647 1047327479 /nfs/dbraw/zinc/32/74/79/1047327479.db2.gz CTIAPOBFSIIPNE-KPFFTGBYSA-N 1 0 324.468 4.096 20 10 DICDRO COc1cccc([C@@H]2C[C@H]2C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000840888734 1047354514 /nfs/dbraw/zinc/35/45/14/1047354514.db2.gz NVJUPLWBCLXMOP-ALKREAHSSA-N 1 0 311.425 4.164 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC(C)(C)c2cccnc2)cc1 ZINC000840891538 1047354766 /nfs/dbraw/zinc/35/47/66/1047354766.db2.gz IDLXDDGBMSURHX-MRXNPFEDSA-N 1 0 311.473 4.166 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C)c1ccncc1 ZINC000840895471 1047356852 /nfs/dbraw/zinc/35/68/52/1047356852.db2.gz YLPLOPFVGGOGIG-OXJNMPFZSA-N 1 0 311.473 4.128 20 10 DICDRO Cc1nc([C@@H](C)[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)cs1 ZINC000840894404 1047357259 /nfs/dbraw/zinc/35/72/59/1047357259.db2.gz RBGQIQSUDZJYFA-ZIAGYGMSSA-N 1 0 317.502 4.108 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2c(O)cc(C)cc2Cl)cc1F ZINC000840902296 1047357636 /nfs/dbraw/zinc/35/76/36/1047357636.db2.gz NTQNKYPNTRRJIM-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(Cl)c1 ZINC000840910451 1047359244 /nfs/dbraw/zinc/35/92/44/1047359244.db2.gz MUWMKVRGWKTQNX-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1cnc([C@@H]([NH2+]Cc2ccc(N(C)C)cc2C)C2CC2)s1 ZINC000840933651 1047360460 /nfs/dbraw/zinc/36/04/60/1047360460.db2.gz IYKWPCUUBPNADS-KRWDZBQOSA-N 1 0 315.486 4.067 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)c(Cl)c1 ZINC000840936612 1047360568 /nfs/dbraw/zinc/36/05/68/1047360568.db2.gz MRASLDCJJAURCJ-KBPBESRZSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(N(C)C)cc2C)s1 ZINC000840918083 1047361022 /nfs/dbraw/zinc/36/10/22/1047361022.db2.gz QIXFHQAJWCDJMK-AWEZNQCLSA-N 1 0 317.502 4.327 20 10 DICDRO CC[C@@](C)([NH2+]Cc1ccc(N(C)C)cc1C)c1nc(C)cs1 ZINC000840934928 1047361329 /nfs/dbraw/zinc/36/13/29/1047361329.db2.gz ZTDBPPBKNPBAHP-GOSISDBHSA-N 1 0 317.502 4.241 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](c1ccccc1)[C@H]1CCCO1 ZINC000840929975 1047361393 /nfs/dbraw/zinc/36/13/93/1047361393.db2.gz DZWPJGMAXSOKKZ-NHCUHLMSSA-N 1 0 324.468 4.071 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1nc(C)cs1 ZINC000840934510 1047361721 /nfs/dbraw/zinc/36/17/21/1047361721.db2.gz RBROBOOQFVFXBZ-INIZCTEOSA-N 1 0 303.475 4.067 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000840938398 1047361909 /nfs/dbraw/zinc/36/19/09/1047361909.db2.gz DIALKCPEFNMPIA-CTNGQTDRSA-N 1 0 324.468 4.071 20 10 DICDRO Cc1csc([C@@H](C)C[NH2+]Cc2c(O)cc(C)cc2Cl)n1 ZINC000840939204 1047362561 /nfs/dbraw/zinc/36/25/61/1047362561.db2.gz KKUFVVMLHCQITO-JTQLQIEISA-N 1 0 310.850 4.012 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](CC)c2ccccc2)ccc1OC ZINC000840956049 1047362970 /nfs/dbraw/zinc/36/29/70/1047362970.db2.gz IBQXPQOVPTVGMI-IBGZPJMESA-N 1 0 313.441 4.473 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)c1 ZINC000840961732 1047366058 /nfs/dbraw/zinc/36/60/58/1047366058.db2.gz BWFFBZBGKCLNQM-HXUWFJFHSA-N 1 0 323.436 4.054 20 10 DICDRO CCN(CC)c1ccc(CNc2cccc(C[NH2+]C)c2)cc1F ZINC000841042512 1047375145 /nfs/dbraw/zinc/37/51/45/1047375145.db2.gz JSTQLTWDARLIQU-UHFFFAOYSA-N 1 0 315.436 4.003 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000841058413 1047376420 /nfs/dbraw/zinc/37/64/20/1047376420.db2.gz GJRVQGUCGFAPFJ-NYPGBQQYSA-N 1 0 321.468 4.015 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1 ZINC000841058412 1047376495 /nfs/dbraw/zinc/37/64/95/1047376495.db2.gz GJRVQGUCGFAPFJ-KTBYTZPXSA-N 1 0 321.468 4.015 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2SCCc3ccccc32)cc1C ZINC000749293544 1047407501 /nfs/dbraw/zinc/40/75/01/1047407501.db2.gz AXSMJXCLMNCNFO-IBGZPJMESA-N 1 0 313.466 4.129 20 10 DICDRO COc1ccc(C[NH2+]C[C@H]2SCCc3ccccc32)cc1C ZINC000749300068 1047408291 /nfs/dbraw/zinc/40/82/91/1047408291.db2.gz WDQCQWGYAIUDEI-LJQANCHMSA-N 1 0 313.466 4.124 20 10 DICDRO CCOCc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841744393 1047447216 /nfs/dbraw/zinc/44/72/16/1047447216.db2.gz HHCPJGIITXLOFI-ZDUSSCGKSA-N 1 0 319.832 4.433 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1O ZINC000841750879 1047449970 /nfs/dbraw/zinc/44/99/70/1047449970.db2.gz KAXHMYJPMZWAIR-QWRGUYRKSA-N 1 0 320.776 4.366 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccc(Cl)cc1O ZINC000841750243 1047450678 /nfs/dbraw/zinc/45/06/78/1047450678.db2.gz WEPOQWRZRHZPCZ-SGTLLEGYSA-N 1 0 317.816 4.010 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccco1 ZINC000841753149 1047452520 /nfs/dbraw/zinc/45/25/20/1047452520.db2.gz JTCRCCMVRRFZBN-RISCZKNCSA-N 1 0 309.793 4.067 20 10 DICDRO CC[C@H]([NH2+][C@H]1COCc2ccccc21)c1cc(Cl)ccc1O ZINC000841758228 1047453350 /nfs/dbraw/zinc/45/33/50/1047453350.db2.gz ABMBTAMHNZWALI-IRXDYDNUSA-N 1 0 317.816 4.358 20 10 DICDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841757284 1047453513 /nfs/dbraw/zinc/45/35/13/1047453513.db2.gz NCLWZBAMKHKDKT-VEVIJQCQSA-N 1 0 319.832 4.127 20 10 DICDRO CC(C)c1csc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)n1 ZINC000841758264 1047453792 /nfs/dbraw/zinc/45/37/92/1047453792.db2.gz KXSYDYFCFFQRKT-JTQLQIEISA-N 1 0 310.850 4.476 20 10 DICDRO C[C@@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1ccc(Cl)cc1O ZINC000841758023 1047453840 /nfs/dbraw/zinc/45/38/40/1047453840.db2.gz RDMXPUHQTOQBHV-PELKAZGASA-N 1 0 308.636 4.280 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1ccc(Cl)cc1O ZINC000841758029 1047453964 /nfs/dbraw/zinc/45/39/64/1047453964.db2.gz RDMXPUHQTOQBHV-UFBFGSQYSA-N 1 0 308.636 4.280 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841765248 1047455696 /nfs/dbraw/zinc/45/56/96/1047455696.db2.gz WCTLWJKKIORDKI-CYBMUJFWSA-N 1 0 318.848 4.271 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cc(F)c(F)c(F)c2)c(O)c1 ZINC000757639289 1047493461 /nfs/dbraw/zinc/49/34/61/1047493461.db2.gz QJLMWWBQYOUESO-NSHDSACASA-N 1 0 309.331 4.011 20 10 DICDRO CC[N@H+](Cc1csc(Cl)c1)Cc1ccc(N(C)C)cc1 ZINC001142776213 1047493625 /nfs/dbraw/zinc/49/36/25/1047493625.db2.gz XOFYBFXEJSBBFJ-UHFFFAOYSA-N 1 0 308.878 4.490 20 10 DICDRO CCOc1cccc(C[NH2+]C2(c3cccc(F)c3)CCC2)c1O ZINC000842744679 1047501719 /nfs/dbraw/zinc/50/17/19/1047501719.db2.gz ZPKUBAGEVRZFHC-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO CCOc1cccc(C[NH2+]C2(c3ccccc3F)CCC2)c1O ZINC000842748367 1047501930 /nfs/dbraw/zinc/50/19/30/1047501930.db2.gz OERISHWRVFSJTQ-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cccc(-c3ccccn3)c1)CC2 ZINC001142849011 1047503349 /nfs/dbraw/zinc/50/33/49/1047503349.db2.gz ITOIPHAYOPRFFK-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO CCOc1cccc(C[NH2+]C2(c3ccc(C)cc3)CCC2)c1O ZINC000842773654 1047503364 /nfs/dbraw/zinc/50/33/64/1047503364.db2.gz JHDSXMCGCPMDCY-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO COc1ccccc1C1([NH2+][C@@H](C)c2ccc(Cl)cc2O)CC1 ZINC000842902155 1047511795 /nfs/dbraw/zinc/51/17/95/1047511795.db2.gz MESZZGDUDSAKMP-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(c3cccc(F)c3)CCC2)c1 ZINC000842902857 1047512279 /nfs/dbraw/zinc/51/22/79/1047512279.db2.gz ONHWDMSTJUDKPS-CYBMUJFWSA-N 1 0 315.388 4.270 20 10 DICDRO COc1ccccc1C1([NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000842902971 1047513695 /nfs/dbraw/zinc/51/36/95/1047513695.db2.gz PDOUWECHCKWQLR-OAHLLOKOSA-N 1 0 311.425 4.358 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2(c3ccccc3F)CCC2)c1 ZINC000842905783 1047514026 /nfs/dbraw/zinc/51/40/26/1047514026.db2.gz LXYHFLYUKAVUGT-ZDUSSCGKSA-N 1 0 315.388 4.270 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2cccc(C(C)(C)C)c2O)c1 ZINC001143110895 1047532629 /nfs/dbraw/zinc/53/26/29/1047532629.db2.gz SQHJNMJIPIXKTH-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cccc(C(C)(C)C)c2O)no1 ZINC001143104644 1047532752 /nfs/dbraw/zinc/53/27/52/1047532752.db2.gz WTCKXULNLBWZDP-KRWDZBQOSA-N 1 0 314.429 4.323 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C2(c3ccccc3C)CC2)c1O ZINC000843418989 1047548975 /nfs/dbraw/zinc/54/89/75/1047548975.db2.gz NNANMELOYQWICN-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO COc1ccccc1C1([NH2+]Cc2cc(Cl)cc(C)c2O)CC1 ZINC000843422721 1047549505 /nfs/dbraw/zinc/54/95/05/1047549505.db2.gz QUBLDVGGNLGTGK-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO COc1ccc(C2([NH2+]Cc3ccc(N(C)C)cc3)CCCC2)cc1 ZINC000237502063 1047781706 /nfs/dbraw/zinc/78/17/06/1047781706.db2.gz NNGKROXNCSKBHL-UHFFFAOYSA-N 1 0 324.468 4.320 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCCC23CCCCC3)c(O)c1OC ZINC001182844942 1047846869 /nfs/dbraw/zinc/84/68/69/1047846869.db2.gz PTNJBPSCBTVULD-INIZCTEOSA-N 1 0 319.445 4.002 20 10 DICDRO CC[NH+](CC)Cc1ccc(F)c(Nc2ccc3c(c2)CCN3)c1 ZINC001159522614 1047860379 /nfs/dbraw/zinc/86/03/79/1047860379.db2.gz LAPIHGVVJFJQBR-UHFFFAOYSA-N 1 0 313.420 4.379 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2C[C@H](OC(C)(C)C)C23CCC3)c1O ZINC001182902604 1047860818 /nfs/dbraw/zinc/86/08/18/1047860818.db2.gz OCCNRKOIXOLUJN-IRXDYDNUSA-N 1 0 317.473 4.171 20 10 DICDRO Cc1cc(O)c(C[NH+]2CC(C)(c3ccccc3)C2)cc1Cl ZINC001183012966 1047876818 /nfs/dbraw/zinc/87/68/18/1047876818.db2.gz WMYFLIIJBIULNF-UHFFFAOYSA-N 1 0 301.817 4.128 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C[C@@H]2CC2(C)C)c(C(F)(F)F)c1 ZINC001183075146 1047881592 /nfs/dbraw/zinc/88/15/92/1047881592.db2.gz OXPVFAZPULUKDV-ZDUSSCGKSA-N 1 0 314.395 4.249 20 10 DICDRO Cc1cc(CC[NH2+][C@@H]2C[C@@H]3CCC[C@H]23)c(C)n1-c1ccccc1 ZINC001183179590 1047899990 /nfs/dbraw/zinc/89/99/90/1047899990.db2.gz GTFSXPHUPVRFHZ-SESVDKBCSA-N 1 0 308.469 4.415 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)COCC2CCCCC2)ccc1N(C)C ZINC001198001069 1047911574 /nfs/dbraw/zinc/91/15/74/1047911574.db2.gz MHSUJXJHZRLQJA-KRWDZBQOSA-N 1 0 318.505 4.136 20 10 DICDRO CCc1cccnc1[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000780708767 1047916906 /nfs/dbraw/zinc/91/69/06/1047916906.db2.gz HRQCGMPJJOYOGI-INIZCTEOSA-N 1 0 309.457 4.095 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@H](Oc2ccccc2)C1(C)C)c1ccccc1O ZINC001183362885 1047920321 /nfs/dbraw/zinc/92/03/21/1047920321.db2.gz FLQGGBKUJMLRFJ-KYNGSXCRSA-N 1 0 311.425 4.289 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(Cl)cc1O)c1ccccc1OC ZINC001183444615 1047929086 /nfs/dbraw/zinc/92/90/86/1047929086.db2.gz OVMAKRQQNBSALY-HNNXBMFYSA-N 1 0 305.805 4.295 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(F)c1Cl)c1ccc(N(C)C)cc1 ZINC000775830155 1047934011 /nfs/dbraw/zinc/93/40/11/1047934011.db2.gz DUSLULKZTMTUCQ-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO Cc1cc(C[N@@H+]2CCC23CCCCC3)c(O)cc1Br ZINC001250120304 1047951843 /nfs/dbraw/zinc/95/18/43/1047951843.db2.gz AXKDQEIKUSDPQC-UHFFFAOYSA-N 1 0 324.262 4.372 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c(O)cc1Br ZINC001250129112 1047963032 /nfs/dbraw/zinc/96/30/32/1047963032.db2.gz XWMAPTLQAMBEEN-WFASDCNBSA-N 1 0 324.262 4.228 20 10 DICDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(Br)cc(C)c1O ZINC000160953715 1048022902 /nfs/dbraw/zinc/02/29/02/1048022902.db2.gz CTXVTWFIRVXHHH-CQSZACIVSA-N 1 0 312.251 4.228 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000773425752 1048025679 /nfs/dbraw/zinc/02/56/79/1048025679.db2.gz BYOZXZQDEPXIKO-INIZCTEOSA-N 1 0 311.473 4.341 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)cc1 ZINC001199110954 1048038957 /nfs/dbraw/zinc/03/89/57/1048038957.db2.gz RSWOHWCEXHZULZ-NRFANRHFSA-N 1 0 323.436 4.261 20 10 DICDRO CCc1onc(C)c1C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000927133336 1048053497 /nfs/dbraw/zinc/05/34/97/1048053497.db2.gz CABWXIWSZKOOTA-AWEZNQCLSA-N 1 0 308.809 4.145 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(c3ccc(F)cc3)CC2)cc1 ZINC001203934035 1048060408 /nfs/dbraw/zinc/06/04/08/1048060408.db2.gz KTPWJJWQANQAQI-UHFFFAOYSA-N 1 0 312.432 4.271 20 10 DICDRO CC(C)C(C[NH2+]Cc1ccc(N2CCSCC2)cc1)C(C)C ZINC001199377113 1048063442 /nfs/dbraw/zinc/06/34/42/1048063442.db2.gz WGMGAOWUGQSYRN-UHFFFAOYSA-N 1 0 320.546 4.258 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cc1 ZINC001203934648 1048064327 /nfs/dbraw/zinc/06/43/27/1048064327.db2.gz YSMYRWFGEMXKJH-IBGZPJMESA-N 1 0 316.395 4.368 20 10 DICDRO Cc1cc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)ccc1N(C)C ZINC001174983392 1048081115 /nfs/dbraw/zinc/08/11/15/1048081115.db2.gz IUGUPORGJDBLFY-IBGZPJMESA-N 1 0 309.457 4.039 20 10 DICDRO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000776013770 1048089031 /nfs/dbraw/zinc/08/90/31/1048089031.db2.gz OFOWCYOZAOIYDA-CABZTGNLSA-N 1 0 307.743 4.208 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c1O ZINC000776023629 1048105563 /nfs/dbraw/zinc/10/55/63/1048105563.db2.gz LQIYZYORVIKRTM-BMIGLBTASA-N 1 0 305.805 4.360 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)CC(C)(C)C1 ZINC001199831004 1048107542 /nfs/dbraw/zinc/10/75/42/1048107542.db2.gz VRRUSYZGMJQNBM-YJBOKZPZSA-N 1 0 300.490 4.373 20 10 DICDRO c1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001199972688 1048128215 /nfs/dbraw/zinc/12/82/15/1048128215.db2.gz YBPFEJFKDPNLPT-FQEVSTJZSA-N 1 0 322.452 4.290 20 10 DICDRO FC1(F)CC[C@H](C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000797467911 1048134551 /nfs/dbraw/zinc/13/45/51/1048134551.db2.gz BVDYFJMINBMDFS-INIZCTEOSA-N 1 0 308.416 4.202 20 10 DICDRO CCC[N@@H+]1CCCC[C@H]1c1ccc(NCc2ccc(N)cc2)nc1 ZINC001162791108 1048359977 /nfs/dbraw/zinc/35/99/77/1048359977.db2.gz ZRGWLEMQJZGZIR-IBGZPJMESA-N 1 0 324.472 4.213 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(NCc2ccc(N3CCCC3)cc2)c1 ZINC001201813208 1048377652 /nfs/dbraw/zinc/37/76/52/1048377652.db2.gz CTUIUMHNPKKNQK-UHFFFAOYSA-N 1 0 323.484 4.269 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C2C[C@H](C)O[C@@H](C)C2)cc1 ZINC001201842553 1048387699 /nfs/dbraw/zinc/38/76/99/1048387699.db2.gz MPXVWTCCVMBZIA-IRXDYDNUSA-N 1 0 318.505 4.359 20 10 DICDRO COc1ccc(C[NH2+]CC2(c3ccccc3Cl)CC2)cc1C ZINC001201882352 1048389554 /nfs/dbraw/zinc/38/95/54/1048389554.db2.gz RWVTWOXPBZPVPP-UHFFFAOYSA-N 1 0 315.844 4.478 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccc(-c2cccnc2)cc1 ZINC000776219973 1048394104 /nfs/dbraw/zinc/39/41/04/1048394104.db2.gz SQOLRHPFDPQNHQ-UHFFFAOYSA-N 1 0 324.811 4.397 20 10 DICDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccc3cc[nH]c3c2)cc1 ZINC001175611800 1048396018 /nfs/dbraw/zinc/39/60/18/1048396018.db2.gz OFKQZBOQEFSSJJ-UHFFFAOYSA-N 1 0 307.441 4.256 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001203664173 1048403064 /nfs/dbraw/zinc/40/30/64/1048403064.db2.gz PQMGWQJHKYRSBJ-ZDUSSCGKSA-N 1 0 305.780 4.174 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001203664172 1048404031 /nfs/dbraw/zinc/40/40/31/1048404031.db2.gz PQMGWQJHKYRSBJ-CYBMUJFWSA-N 1 0 305.780 4.174 20 10 DICDRO C[C@@H]([NH2+]CCSc1ccc(Cl)cc1)c1ccccc1O ZINC000775128355 1048409476 /nfs/dbraw/zinc/40/94/76/1048409476.db2.gz AGUFWXVECYEMTM-GFCCVEGCSA-N 1 0 307.846 4.489 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)c1O ZINC000775137601 1048424326 /nfs/dbraw/zinc/42/43/26/1048424326.db2.gz PCVOAIZTJFVVIV-SNVBAGLBSA-N 1 0 307.743 4.128 20 10 DICDRO CCCN(Cc1ccc2nc(C)ccc2c1)c1ccc(C[NH3+])cc1 ZINC000775139603 1048429024 /nfs/dbraw/zinc/42/90/24/1048429024.db2.gz DIXWQMKTANRDLW-UHFFFAOYSA-N 1 0 319.452 4.419 20 10 DICDRO Cc1c2ccccc2n(C)c1CNc1ccccc1CC[NH+](C)C ZINC001202058149 1048432178 /nfs/dbraw/zinc/43/21/78/1048432178.db2.gz LDIQKTIYQUEKJC-UHFFFAOYSA-N 1 0 321.468 4.203 20 10 DICDRO CCCN(Cc1cnc(C(C)(C)C)s1)c1ccc(C[NH3+])cc1 ZINC000775141199 1048433685 /nfs/dbraw/zinc/43/36/85/1048433685.db2.gz YPXVISQYTGDRKH-UHFFFAOYSA-N 1 0 317.502 4.316 20 10 DICDRO CCCN(Cc1ccc(F)c2cccnc12)c1ccc(C[NH3+])cc1 ZINC000775141001 1048434073 /nfs/dbraw/zinc/43/40/73/1048434073.db2.gz SQJQHUQSMWTYJO-UHFFFAOYSA-N 1 0 323.415 4.249 20 10 DICDRO CC(C)[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)Cc1ccccc1 ZINC001202058512 1048434255 /nfs/dbraw/zinc/43/42/55/1048434255.db2.gz PAOUKLSOHOPGTP-HXUWFJFHSA-N 1 0 309.453 4.226 20 10 DICDRO CCCN(Cc1cnc(C(C)C)s1)c1ccc(C[NH3+])cc1 ZINC000775144300 1048444341 /nfs/dbraw/zinc/44/43/41/1048444341.db2.gz ATUBUDJZOFNFAF-UHFFFAOYSA-N 1 0 303.475 4.142 20 10 DICDRO Nc1ccc(CCc2ccc(Nc3ccc(C[NH3+])cc3)cc2)cc1 ZINC001175969245 1048510375 /nfs/dbraw/zinc/51/03/75/1048510375.db2.gz XCQSPNQHEKNBRV-UHFFFAOYSA-N 1 0 317.436 4.256 20 10 DICDRO Nc1ccc(Cc2ccccc2Nc2ccc(C[NH3+])cc2)cc1 ZINC001175971955 1048512650 /nfs/dbraw/zinc/51/26/50/1048512650.db2.gz QWCZIVVLHLUAJF-UHFFFAOYSA-N 1 0 303.409 4.062 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)Cc2cc(C)ccc2F)c1O ZINC000775168911 1048519033 /nfs/dbraw/zinc/51/90/33/1048519033.db2.gz UHSUDTKIRVSGBX-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO Cc1cc(N(c2ccc(N)cc2)c2ccc(N)cc2)cc(C)[nH+]1 ZINC001176056938 1048554465 /nfs/dbraw/zinc/55/44/65/1048554465.db2.gz IJZXPBVJUZOTAK-UHFFFAOYSA-N 1 0 304.397 4.333 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1O)c1nc(-c2ccccc2)cs1 ZINC000107321740 1048580403 /nfs/dbraw/zinc/58/04/03/1048580403.db2.gz VWQQWTVFKGLYRT-ZDUSSCGKSA-N 1 0 310.422 4.367 20 10 DICDRO COc1cc(C[NH2+]Cc2ccc(C)s2)c(O)c(C(C)(C)C)c1 ZINC000850033127 1048612073 /nfs/dbraw/zinc/61/20/73/1048612073.db2.gz MWSMMXSWPALFMG-UHFFFAOYSA-N 1 0 319.470 4.358 20 10 DICDRO COc1cc(C[NH2+][C@H](C)CC(F)(F)F)c(O)c(C(C)(C)C)c1 ZINC000850249427 1048626987 /nfs/dbraw/zinc/62/69/87/1048626987.db2.gz YKGUQHHSOZFGPK-SNVBAGLBSA-N 1 0 319.367 4.129 20 10 DICDRO COc1cc(C[NH2+]C[C@@H](C)CC(F)F)c(O)c(C(C)(C)C)c1 ZINC000850334118 1048634739 /nfs/dbraw/zinc/63/47/39/1048634739.db2.gz KVCYGMMCTYWXFD-NSHDSACASA-N 1 0 315.404 4.079 20 10 DICDRO COc1ccc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCCC2)cc1 ZINC000237513247 1048638540 /nfs/dbraw/zinc/63/85/40/1048638540.db2.gz APORQEFHOZCNAU-UHFFFAOYSA-N 1 0 323.436 4.189 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](c2ccccc2F)C(C)C)c1O ZINC000850361922 1048639196 /nfs/dbraw/zinc/63/91/96/1048639196.db2.gz GJJXPFABMOKUSH-SFHVURJKSA-N 1 0 317.404 4.417 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccc(C(F)F)nc1 ZINC000850435154 1048656013 /nfs/dbraw/zinc/65/60/13/1048656013.db2.gz IVWGPWQNFPBPSE-CYBMUJFWSA-N 1 0 319.399 4.244 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1cc2cnccc2o1 ZINC000850435160 1048656903 /nfs/dbraw/zinc/65/69/03/1048656903.db2.gz IZYWYWFOAHPTHX-AWEZNQCLSA-N 1 0 309.413 4.053 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCO2)c1ccc(N(C)C)cc1 ZINC000850463602 1048665056 /nfs/dbraw/zinc/66/50/56/1048665056.db2.gz WLTDXHOMOKVXTR-HOTGVXAUSA-N 1 0 324.468 4.489 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cc2cnccc2o1 ZINC000850462731 1048665918 /nfs/dbraw/zinc/66/59/18/1048665918.db2.gz QCBZNFYSQKWXLN-UONOGXRCSA-N 1 0 309.413 4.306 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](C)c2ccccn2)c1O ZINC000850481423 1048669151 /nfs/dbraw/zinc/66/91/51/1048669151.db2.gz GWRPATOOQWJVRX-CHWSQXEVSA-N 1 0 304.821 4.203 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)c1ccsc1 ZINC000850485723 1048671554 /nfs/dbraw/zinc/67/15/54/1048671554.db2.gz BABWDHQOXGOMSP-YJBOKZPZSA-N 1 0 316.470 4.076 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)c1ccccn1)c1cc(Cl)ccc1O ZINC000850482375 1048671562 /nfs/dbraw/zinc/67/15/62/1048671562.db2.gz OVMTWXJUODDKGZ-WFASDCNBSA-N 1 0 304.821 4.285 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@@H](O)c2ccccc21)c1cc(Cl)ccc1O ZINC000850527546 1048680651 /nfs/dbraw/zinc/68/06/51/1048680651.db2.gz GUQCHYDSZQSAHG-LZLYRXPVSA-N 1 0 317.816 4.265 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(COC)cs1)c1ccc(C)cc1O ZINC000850531432 1048682648 /nfs/dbraw/zinc/68/26/48/1048682648.db2.gz DQJKOHFCOQFFEO-INIZCTEOSA-N 1 0 305.443 4.149 20 10 DICDRO COCc1csc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000850533407 1048685638 /nfs/dbraw/zinc/68/56/38/1048685638.db2.gz XKSPFCBOVCTSMW-SNVBAGLBSA-N 1 0 311.834 4.104 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)cc1 ZINC000850543629 1048687302 /nfs/dbraw/zinc/68/73/02/1048687302.db2.gz NJSDKLCSZQPXHB-VLIAUNLRSA-N 1 0 310.441 4.186 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@@H](O)C(C)C)c1ccccc1O ZINC000850555199 1048689051 /nfs/dbraw/zinc/68/90/51/1048689051.db2.gz NGLADUQUIFZQJG-IHPCNDPISA-N 1 0 313.441 4.191 20 10 DICDRO COc1cccc(C2([NH2+][C@@H](C)c3cc(F)ccc3O)CCC2)c1 ZINC000850566694 1048696068 /nfs/dbraw/zinc/69/60/68/1048696068.db2.gz QAYGIMRDVGUNIN-ZDUSSCGKSA-N 1 0 315.388 4.270 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@@H](C)O)c1cc(Cl)ccc1O ZINC000850585523 1048700849 /nfs/dbraw/zinc/70/08/49/1048700849.db2.gz YXQMBXPQORTMNW-PUECVXPYSA-N 1 0 319.832 4.208 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H](C)O)c1O ZINC000850582386 1048702076 /nfs/dbraw/zinc/70/20/76/1048702076.db2.gz FNAOVISMMXDPSC-GDZNZVCISA-N 1 0 319.832 4.127 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(F)cc1Cl)c1ccc(N(C)C)cc1 ZINC000775362617 1048703870 /nfs/dbraw/zinc/70/38/70/1048703870.db2.gz IYXWTZZRERLWHU-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO C[C@H]([NH2+]Cc1cnc(C2CCC2)s1)c1ccc(N(C)C)cc1 ZINC000775365071 1048704675 /nfs/dbraw/zinc/70/46/75/1048704675.db2.gz RZWRWLZADNVEIF-ZDUSSCGKSA-N 1 0 315.486 4.327 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc2cccnc12 ZINC000775361235 1048704711 /nfs/dbraw/zinc/70/47/11/1048704711.db2.gz BVLPYRQHQROKNP-MRXNPFEDSA-N 1 0 319.452 4.460 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc2cccnc12 ZINC000775361230 1048705167 /nfs/dbraw/zinc/70/51/67/1048705167.db2.gz BVLPYRQHQROKNP-INIZCTEOSA-N 1 0 319.452 4.460 20 10 DICDRO COc1ccccc1/C=C/C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000775364571 1048707119 /nfs/dbraw/zinc/70/71/19/1048707119.db2.gz RWVLCOFVZZPONF-DYLHUKMJSA-N 1 0 310.441 4.125 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2ccc3ccccc3c2)c1 ZINC000775370019 1048713081 /nfs/dbraw/zinc/71/30/81/1048713081.db2.gz KCRMBSAKYKKFEX-HNNXBMFYSA-N 1 0 321.420 4.447 20 10 DICDRO COc1cc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)ccc1C ZINC001190444755 1048730801 /nfs/dbraw/zinc/73/08/01/1048730801.db2.gz BRSYUEPONSMWEF-UHFFFAOYSA-N 1 0 324.468 4.234 20 10 DICDRO CO[C@@H]1CCC[C@H]1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000775417518 1048794899 /nfs/dbraw/zinc/79/48/99/1048794899.db2.gz MTOYMPLZUGFXDF-XKGZKEIXSA-N 1 0 316.489 4.143 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cc(C2CC2)no1)C1CCCC1 ZINC000851770586 1048799969 /nfs/dbraw/zinc/79/99/69/1048799969.db2.gz QZKBISWZVYCOQD-UHFFFAOYSA-N 1 0 312.413 4.202 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC=CC23CCCCC3)c1O ZINC001176996452 1048814149 /nfs/dbraw/zinc/81/41/49/1048814149.db2.gz XSVQETTVTMZZHO-UHFFFAOYSA-N 1 0 319.832 4.323 20 10 DICDRO CSc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000851950383 1048815321 /nfs/dbraw/zinc/81/53/21/1048815321.db2.gz OEQBFSZRQUVULI-AWEZNQCLSA-N 1 0 300.471 4.325 20 10 DICDRO CCC(C)(C)[C@H](C)[NH2+]Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000852355208 1048837780 /nfs/dbraw/zinc/83/77/80/1048837780.db2.gz PXUYXEZAXWJVIN-INIZCTEOSA-N 1 0 318.505 4.216 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC(c3nc4ccccc4o3)CC2)c1 ZINC000161064793 1048839780 /nfs/dbraw/zinc/83/97/80/1048839780.db2.gz OKYXXTSXYXHHID-UHFFFAOYSA-N 1 0 322.408 4.221 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC001191194454 1048880579 /nfs/dbraw/zinc/88/05/79/1048880579.db2.gz SEIHSAQKZZGHMJ-HXUWFJFHSA-N 1 0 308.469 4.207 20 10 DICDRO CCc1onc(C)c1C[NH2+]Cc1cc(C)n(-c2ccccc2)c1C ZINC001203357550 1048881002 /nfs/dbraw/zinc/88/10/02/1048881002.db2.gz KRPKFNQZRLCVBZ-UHFFFAOYSA-N 1 0 323.440 4.243 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)CCCO3)c(O)c1 ZINC000853241400 1048891216 /nfs/dbraw/zinc/89/12/16/1048891216.db2.gz LZLDQHRXBUIYKL-CABCVRRESA-N 1 0 311.425 4.437 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)CC(F)(F)F)c1 ZINC000853241212 1048891394 /nfs/dbraw/zinc/89/13/94/1048891394.db2.gz PUYSJIITMWCXIM-SNVBAGLBSA-N 1 0 305.340 4.030 20 10 DICDRO C[C@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000853242351 1048891551 /nfs/dbraw/zinc/89/15/51/1048891551.db2.gz PLKLBXLKORHQQJ-LBPRGKRZSA-N 1 0 323.362 4.017 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000853239905 1048891797 /nfs/dbraw/zinc/89/17/97/1048891797.db2.gz FDIXMQDJKUVWHF-GFCCVEGCSA-N 1 0 302.384 4.382 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cnccc2C(F)(F)F)c(O)c1C ZINC000853243098 1048893614 /nfs/dbraw/zinc/89/36/14/1048893614.db2.gz XJMUKMRQGDVNIO-GFCCVEGCSA-N 1 0 324.346 4.274 20 10 DICDRO c1nc(C2CCCC2)sc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001177586417 1048919206 /nfs/dbraw/zinc/91/92/06/1048919206.db2.gz CTMQXHXQAVRWMP-UHFFFAOYSA-N 1 0 314.454 4.025 20 10 DICDRO CC[C@H](Cc1ccccc1)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177624437 1048925429 /nfs/dbraw/zinc/92/54/29/1048925429.db2.gz OGSURKDECPBZFI-MRXNPFEDSA-N 1 0 318.411 4.142 20 10 DICDRO CCOc1cccc(C[N@H+](C)C(C)(C)Cc2ccccc2)c1O ZINC001203615275 1048942514 /nfs/dbraw/zinc/94/25/14/1048942514.db2.gz PLVFMKPWJJJFDP-UHFFFAOYSA-N 1 0 313.441 4.244 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)c(O)c1 ZINC001203628618 1048943261 /nfs/dbraw/zinc/94/32/61/1048943261.db2.gz DWMUYVLBUVCWQQ-QGZVFWFLSA-N 1 0 311.425 4.171 20 10 DICDRO Cc1cccc(C[N@@H+](C)Cc2cc(Br)ccc2O)c1 ZINC001203636109 1048944609 /nfs/dbraw/zinc/94/46/09/1048944609.db2.gz OLKRMIVGIMGVBW-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c(O)c1 ZINC001203628012 1048945289 /nfs/dbraw/zinc/94/52/89/1048945289.db2.gz VTULENFTBYXQKE-CYBMUJFWSA-N 1 0 317.816 4.044 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC001203657721 1048951143 /nfs/dbraw/zinc/95/11/43/1048951143.db2.gz MVTQZSCCLILXKZ-LBPRGKRZSA-N 1 0 305.780 4.174 20 10 DICDRO Oc1ccc(Cl)cc1C[NH+]1CCC(c2cccs2)CC1 ZINC001203658464 1048951861 /nfs/dbraw/zinc/95/18/61/1048951861.db2.gz WKCMSPRPYDYBPJ-UHFFFAOYSA-N 1 0 307.846 4.487 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001203657719 1048951992 /nfs/dbraw/zinc/95/19/92/1048951992.db2.gz MVTQZSCCLILXKZ-GFCCVEGCSA-N 1 0 305.780 4.174 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1cc2c(cc1O)CCCC2 ZINC000854225490 1048954745 /nfs/dbraw/zinc/95/47/45/1048954745.db2.gz GJZXIUYVMHIJBG-XCLFUZPHSA-N 1 0 322.452 4.191 20 10 DICDRO CS[C@@H]1CCC[C@@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC001177860138 1048955586 /nfs/dbraw/zinc/95/55/86/1048955586.db2.gz RTIQJDJSFUONFX-GOVFWEMJSA-N 1 0 304.503 4.030 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001203678246 1048960088 /nfs/dbraw/zinc/96/00/88/1048960088.db2.gz IIKASPMGDNXSPW-KRWDZBQOSA-N 1 0 319.351 4.016 20 10 DICDRO CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177971923 1048967027 /nfs/dbraw/zinc/96/70/27/1048967027.db2.gz AODLUZQAFCDPRG-FUHWJXTLSA-N 1 0 305.487 4.166 20 10 DICDRO CCCC[C@@H](CCC)C[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001178010110 1048974024 /nfs/dbraw/zinc/97/40/24/1048974024.db2.gz PQWJWVGVGUAJFH-GOSISDBHSA-N 1 0 318.505 4.219 20 10 DICDRO CC[C@H]([NH2+]CCSCc1ccccc1)c1ccccc1O ZINC000775485023 1048996776 /nfs/dbraw/zinc/99/67/76/1048996776.db2.gz MXDWLMFLDQLFHB-KRWDZBQOSA-N 1 0 301.455 4.366 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](COC)c2ccccc2)cc1 ZINC001178207446 1048999381 /nfs/dbraw/zinc/99/93/81/1048999381.db2.gz CYIWOFIQKMCGAM-HXUWFJFHSA-N 1 0 312.457 4.010 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@]2(C)CCOc3ccccc32)cc1 ZINC001203799566 1048999927 /nfs/dbraw/zinc/99/99/27/1048999927.db2.gz IAYAKIDRALDWIN-OAQYLSRUSA-N 1 0 324.468 4.320 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@]2(C)CCOc3ccccc32)cc1 ZINC001203799565 1049000478 /nfs/dbraw/zinc/00/04/78/1049000478.db2.gz IAYAKIDRALDWIN-NRFANRHFSA-N 1 0 324.468 4.320 20 10 DICDRO COc1cc(C[NH+]2CCC(c3ccsc3)CC2)c(O)cc1C ZINC000776776921 1049009142 /nfs/dbraw/zinc/00/91/42/1049009142.db2.gz PTWQQUVEDPZQAD-UHFFFAOYSA-N 1 0 317.454 4.150 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2(C3CC3)CCC2)cc1F ZINC001178272190 1049009301 /nfs/dbraw/zinc/00/93/01/1049009301.db2.gz HOAMCHLMWDEDMJ-UHFFFAOYSA-N 1 0 304.453 4.342 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(COC)cc1)c1cc(Cl)ccc1O ZINC000775487676 1049009540 /nfs/dbraw/zinc/00/95/40/1049009540.db2.gz NDGDLJYASFRGAQ-KRWDZBQOSA-N 1 0 319.832 4.433 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](OC)c1ccccc1)c1cc(Cl)ccc1O ZINC000775493879 1049026329 /nfs/dbraw/zinc/02/63/29/1049026329.db2.gz VYLIAEZCUZAJLJ-SJLPKXTDSA-N 1 0 319.832 4.474 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccc3ncsc3c2)cc1C ZINC000776807718 1049027474 /nfs/dbraw/zinc/02/74/74/1049027474.db2.gz IJGBOZMMOBUEGH-ZDUSSCGKSA-N 1 0 312.438 4.470 20 10 DICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001192005857 1049029338 /nfs/dbraw/zinc/02/93/38/1049029338.db2.gz NBGPZUYQERTBII-NUJGCVRESA-N 1 0 311.425 4.424 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)c1ccccc1OC)c1ccccc1O ZINC000775497206 1049031504 /nfs/dbraw/zinc/03/15/04/1049031504.db2.gz OHQKWYACKRMLCL-KRWDZBQOSA-N 1 0 313.441 4.419 20 10 DICDRO C[C@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC001178436645 1049032286 /nfs/dbraw/zinc/03/22/86/1049032286.db2.gz ODMMNULWISUVCR-BTYIYWSLSA-N 1 0 307.437 4.425 20 10 DICDRO CC[C@@H]([NH2+]CCOc1cccc(Cl)c1)c1ccccc1O ZINC000775497760 1049033023 /nfs/dbraw/zinc/03/30/23/1049033023.db2.gz UWENKKDKSBWDHR-MRXNPFEDSA-N 1 0 305.805 4.165 20 10 DICDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2ccc(F)cc2)cc1F ZINC000113335151 1049033899 /nfs/dbraw/zinc/03/38/99/1049033899.db2.gz MTZYQAGCDAENOY-UHFFFAOYSA-N 1 0 304.384 4.056 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)cc1 ZINC001203935306 1049034371 /nfs/dbraw/zinc/03/43/71/1049034371.db2.gz CFDWXCHCIZMSMP-MRXNPFEDSA-N 1 0 314.395 4.102 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccccc1O ZINC000775499746 1049035513 /nfs/dbraw/zinc/03/55/13/1049035513.db2.gz VECVSRQQVPVPQZ-QRFRQXIXSA-N 1 0 324.468 4.268 20 10 DICDRO CC[C@H]([NH2+]CCc1c[nH]c2cccc(C)c12)c1ccccc1O ZINC000775498887 1049038332 /nfs/dbraw/zinc/03/83/32/1049038332.db2.gz OVZRWMSOQSXSHU-KRWDZBQOSA-N 1 0 308.425 4.465 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2cccc(C(F)F)c2)cc1 ZINC001178493079 1049038767 /nfs/dbraw/zinc/03/87/67/1049038767.db2.gz SJEKRDGGORUXNC-XQRVVYSFSA-N 1 0 316.395 4.493 20 10 DICDRO COc1ccc(N2CC[NH+](C[C@@H](C)CC(C)(C)C)CC2)cc1F ZINC001192108555 1049040544 /nfs/dbraw/zinc/04/05/44/1049040544.db2.gz XRFTXHOOMOXTNQ-HNNXBMFYSA-N 1 0 322.468 4.029 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)Oc1ccc(F)cc1)c1ccccc1O ZINC000775509317 1049041674 /nfs/dbraw/zinc/04/16/74/1049041674.db2.gz PCSPMAWZZVKZPI-GUYCJALGSA-N 1 0 303.377 4.040 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C(C)C)no1)c1cc(Cl)ccc1O ZINC000775508336 1049043239 /nfs/dbraw/zinc/04/32/39/1049043239.db2.gz UARQEYPCVLWLCJ-AWEZNQCLSA-N 1 0 308.809 4.398 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](O)c1ccccc1C)c1cc(Cl)ccc1O ZINC000775503914 1049046944 /nfs/dbraw/zinc/04/69/44/1049046944.db2.gz PRQNUSZLJZQDOI-FUHWJXTLSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(C)nc1)c1cc(Cl)ccc1O ZINC000775503429 1049047216 /nfs/dbraw/zinc/04/72/16/1049047216.db2.gz IKBKAEBSQNTSBP-MRXNPFEDSA-N 1 0 304.821 4.032 20 10 DICDRO CCc1cnc(CC[NH2+][C@@H](CC)c2cc(Cl)ccc2O)s1 ZINC000775508055 1049047388 /nfs/dbraw/zinc/04/73/88/1049047388.db2.gz HHRUCQZQKIZUIK-AWEZNQCLSA-N 1 0 324.877 4.348 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000775507611 1049048258 /nfs/dbraw/zinc/04/82/58/1049048258.db2.gz NRASWIRTXKFATM-QFBILLFUSA-N 1 0 310.441 4.102 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@H]21)c1cc(Cl)ccc1O ZINC000775513540 1049049647 /nfs/dbraw/zinc/04/96/47/1049049647.db2.gz LACQCIHVUZCOFU-MKVSYHDVSA-N 1 0 309.837 4.044 20 10 DICDRO CC[C@@H]([NH2+]CCCc1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775513631 1049050518 /nfs/dbraw/zinc/05/05/18/1049050518.db2.gz SGWPHBXUYXXETP-MRXNPFEDSA-N 1 0 322.836 4.324 20 10 DICDRO CC[C@@H]([NH2+]CC1(CCOC)CCC1)c1cc(Cl)ccc1O ZINC000775513406 1049053005 /nfs/dbraw/zinc/05/30/05/1049053005.db2.gz IDYMKORNDRFBDJ-OAHLLOKOSA-N 1 0 311.853 4.293 20 10 DICDRO CC[C@H]([NH2+]CC1CCC(OC)CC1)c1cc(Cl)ccc1O ZINC000775511341 1049054653 /nfs/dbraw/zinc/05/46/53/1049054653.db2.gz DSGWUHYDOREJFO-PXCJXSSVSA-N 1 0 311.853 4.292 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CO)c1ccccc1C)c1cc(Cl)ccc1O ZINC000775511622 1049056766 /nfs/dbraw/zinc/05/67/66/1049056766.db2.gz FRZFPLOEPBVLDI-SJORKVTESA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(OC)cc1Cl)c1ccccc1O ZINC000775513799 1049057345 /nfs/dbraw/zinc/05/73/45/1049057345.db2.gz NCHCWASIDOYOLU-KRWDZBQOSA-N 1 0 319.832 4.338 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)[C@@H](C)O ZINC001178709953 1049079347 /nfs/dbraw/zinc/07/93/47/1049079347.db2.gz QBYVPHRNZAWQIM-CXAGYDPISA-N 1 0 321.505 4.236 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](O)c1cccc(C)c1)c1cc(Cl)ccc1O ZINC000775522770 1049081604 /nfs/dbraw/zinc/08/16/04/1049081604.db2.gz ZWJSHNZVISMISO-SJLPKXTDSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+]CCc1ccncc1C)c1cc(Cl)ccc1O ZINC000775524015 1049084811 /nfs/dbraw/zinc/08/48/11/1049084811.db2.gz ONENGEDREZVPTC-INIZCTEOSA-N 1 0 304.821 4.032 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775523522 1049088021 /nfs/dbraw/zinc/08/80/21/1049088021.db2.gz JQCSCTQNOCKFTG-MEBBXXQBSA-N 1 0 322.836 4.495 20 10 DICDRO CC[C@@H]([NH2+]CCOCc1ccc(Cl)cc1)c1ccccc1O ZINC000775525253 1049088328 /nfs/dbraw/zinc/08/83/28/1049088328.db2.gz YWFOAYAWFQATHD-QGZVFWFLSA-N 1 0 319.832 4.303 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)cc1F)c1cc(Cl)ccc1O ZINC000775527700 1049097294 /nfs/dbraw/zinc/09/72/94/1049097294.db2.gz SPKWKJOKZABLEU-MRXNPFEDSA-N 1 0 323.795 4.434 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1cc(Cl)ccc1O ZINC000775525709 1049100718 /nfs/dbraw/zinc/10/07/18/1049100718.db2.gz MJKCQMCYXOJGHV-ZWNOBZJWSA-N 1 0 322.840 4.089 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](OC)c1cccc(Cl)c1)c1ccccc1O ZINC000775528558 1049107165 /nfs/dbraw/zinc/10/71/65/1049107165.db2.gz ZIKDLQCJFCHZMK-SJLPKXTDSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](OC)c1cccc(Cl)c1)c1ccccc1O ZINC000775528554 1049107377 /nfs/dbraw/zinc/10/73/77/1049107377.db2.gz ZIKDLQCJFCHZMK-AEFFLSMTSA-N 1 0 319.832 4.474 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(F)ccc1F ZINC001204220530 1049114555 /nfs/dbraw/zinc/11/45/55/1049114555.db2.gz CULNCVKWENPZRI-UHFFFAOYSA-N 1 0 304.384 4.053 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(C)c(F)c1 ZINC001192565324 1049116028 /nfs/dbraw/zinc/11/60/28/1049116028.db2.gz LDPIARJTRIHCHA-LJQANCHMSA-N 1 0 300.421 4.441 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@](C)(F)[C@@H](F)C2)c2ccccc21 ZINC001204233150 1049116278 /nfs/dbraw/zinc/11/62/78/1049116278.db2.gz OLGVYMBEBPWBLG-OALUTQOASA-N 1 0 318.411 4.178 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C2CC2)[C@@H]2CCCCO2)cc1C ZINC001179044302 1049122268 /nfs/dbraw/zinc/12/22/68/1049122268.db2.gz AHXAONFMVIZKLV-PMACEKPBSA-N 1 0 317.473 4.221 20 10 DICDRO CCCc1ccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)s1 ZINC000857046728 1049122306 /nfs/dbraw/zinc/12/23/06/1049122306.db2.gz PTVQJEAQAVSFIE-LBPRGKRZSA-N 1 0 305.443 4.266 20 10 DICDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c(O)c1 ZINC001204277414 1049124968 /nfs/dbraw/zinc/12/49/68/1049124968.db2.gz DGPPODKUZKCBCZ-MRXNPFEDSA-N 1 0 303.789 4.088 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(OC)ccc2F)cc1 ZINC000857080133 1049126220 /nfs/dbraw/zinc/12/62/20/1049126220.db2.gz DODGDUFVRZIZQD-CQSZACIVSA-N 1 0 316.420 4.141 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000857081710 1049126243 /nfs/dbraw/zinc/12/62/43/1049126243.db2.gz QNXIJJILGSCAHP-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c(O)c1 ZINC001204275045 1049126668 /nfs/dbraw/zinc/12/66/68/1049126668.db2.gz MIHCFVNCVYQORS-INIZCTEOSA-N 1 0 303.789 4.088 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)c(O)c1C ZINC000857083618 1049127053 /nfs/dbraw/zinc/12/70/53/1049127053.db2.gz YGZXAQAOSJDVNY-VXGBXAGGSA-N 1 0 302.245 4.244 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@@]1(C)C[C@]1(F)Cl ZINC001179095000 1049130382 /nfs/dbraw/zinc/13/03/82/1049130382.db2.gz GEUWUOCIZNDPJW-DLBZAZTESA-N 1 0 308.828 4.281 20 10 DICDRO C[C@H]1CC[C@@](C)(C[NH2+]Cc2ccc(N(C)C)c(F)c2)C1(C)C ZINC001179110917 1049132095 /nfs/dbraw/zinc/13/20/95/1049132095.db2.gz POHGRBDRRCCGFB-LIRRHRJNSA-N 1 0 306.469 4.444 20 10 DICDRO c1cncc([C@@H]2CCCC[N@H+]2Cc2ccc(N3CCCC3)cc2)c1 ZINC001204326933 1049141944 /nfs/dbraw/zinc/14/19/44/1049141944.db2.gz IZYGRUGIDRNFSO-NRFANRHFSA-N 1 0 321.468 4.409 20 10 DICDRO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204328271 1049142217 /nfs/dbraw/zinc/14/22/17/1049142217.db2.gz FMMGEYNBZLUPQS-QGZVFWFLSA-N 1 0 306.453 4.234 20 10 DICDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001204322065 1049142824 /nfs/dbraw/zinc/14/28/24/1049142824.db2.gz NFRZCBYQGBXOGJ-QGZVFWFLSA-N 1 0 324.468 4.488 20 10 DICDRO CC[C@H]([NH2+]CCCNc1cccc(F)c1)c1ccccc1O ZINC000775550992 1049142936 /nfs/dbraw/zinc/14/29/36/1049142936.db2.gz FCIUXIJGCAGTLS-KRWDZBQOSA-N 1 0 302.393 4.074 20 10 DICDRO CC[C@@H]([NH2+]CCCNc1ccccc1F)c1ccccc1O ZINC000775551528 1049144899 /nfs/dbraw/zinc/14/48/99/1049144899.db2.gz OGZSXNBNAYPIQB-MRXNPFEDSA-N 1 0 302.393 4.074 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000775555940 1049153994 /nfs/dbraw/zinc/15/39/94/1049153994.db2.gz SZENBVMYAZYDOH-JLJPHGGASA-N 1 0 309.837 4.044 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc3cccnc3c2)c(Cl)c1 ZINC001179343279 1049158788 /nfs/dbraw/zinc/15/87/88/1049158788.db2.gz GRKYEYLRTRGEMZ-UHFFFAOYSA-N 1 0 312.800 4.192 20 10 DICDRO COC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CCCCC1 ZINC000775562364 1049167954 /nfs/dbraw/zinc/16/79/54/1049167954.db2.gz HZINDKQWPWAUMN-OCCSQVGLSA-N 1 0 307.409 4.019 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC001179489110 1049170351 /nfs/dbraw/zinc/17/03/51/1049170351.db2.gz FMPUKECADJIOAD-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@@H]1CCC(C)(C)CO1 ZINC001179685154 1049191675 /nfs/dbraw/zinc/19/16/75/1049191675.db2.gz DYAISIOZQPMDPH-INIZCTEOSA-N 1 0 314.473 4.172 20 10 DICDRO CSc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC000115629079 1049199443 /nfs/dbraw/zinc/19/94/43/1049199443.db2.gz ROLMGJKAQUEKPZ-UHFFFAOYSA-N 1 0 300.471 4.073 20 10 DICDRO CNc1ccccc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC001179844885 1049213614 /nfs/dbraw/zinc/21/36/14/1049213614.db2.gz FZAPMGSPUZXYNG-UHFFFAOYSA-N 1 0 323.484 4.351 20 10 DICDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001204658821 1049214673 /nfs/dbraw/zinc/21/46/73/1049214673.db2.gz YGZUHRXTLAMFDR-INIZCTEOSA-N 1 0 314.395 4.392 20 10 DICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)CC1CCSCC1 ZINC001179850549 1049216885 /nfs/dbraw/zinc/21/68/85/1049216885.db2.gz YBRHDEBROBJQKI-UHFFFAOYSA-N 1 0 317.454 4.131 20 10 DICDRO C[C@H]1C[C@H]1c1ccc(CNCc2cc(F)c(N(C)C)cc2F)o1 ZINC000858100624 1049218535 /nfs/dbraw/zinc/21/85/35/1049218535.db2.gz LJWVLNRMDPPPAQ-SMDDNHRTSA-N 1 0 320.383 4.037 20 10 DICDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858160825 1049224748 /nfs/dbraw/zinc/22/47/48/1049224748.db2.gz RTOPIGWRYXNXFO-SNVBAGLBSA-N 1 0 324.337 4.242 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H](c2ccccn2)C2CCC2)cc1 ZINC000858239609 1049229202 /nfs/dbraw/zinc/22/92/02/1049229202.db2.gz UVBRTESNPTYUKZ-BXKJMJEDSA-N 1 0 321.468 4.292 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H](c2ccccn2)C2CCC2)cc1 ZINC000858239611 1049229999 /nfs/dbraw/zinc/22/99/99/1049229999.db2.gz UVBRTESNPTYUKZ-IZRJCCQOSA-N 1 0 321.468 4.292 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCCc3ccc(Cl)cc32)c1O ZINC000858296467 1049237248 /nfs/dbraw/zinc/23/72/48/1049237248.db2.gz TZRXJGUZULTDKE-INIZCTEOSA-N 1 0 317.816 4.221 20 10 DICDRO COCc1ccc(C[NH2+]Cc2cc(C)n(-c3ccccc3)c2C)o1 ZINC000858293566 1049237539 /nfs/dbraw/zinc/23/75/39/1049237539.db2.gz NOOMSPFPJXWUFP-UHFFFAOYSA-N 1 0 324.424 4.123 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2cncc(F)c2)c(C)n1-c1ccccc1 ZINC000858294423 1049238166 /nfs/dbraw/zinc/23/81/66/1049238166.db2.gz YUBJAOJITFFMTG-OAHLLOKOSA-N 1 0 323.415 4.479 20 10 DICDRO CCOc1cccc(C[NH2+]CC2(C(F)(F)F)CCCC2)c1O ZINC000858307157 1049238247 /nfs/dbraw/zinc/23/82/47/1049238247.db2.gz BPNHEJZVDATRFC-UHFFFAOYSA-N 1 0 317.351 4.003 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccccc2CC(F)(F)F)cc1C ZINC000858330259 1049243007 /nfs/dbraw/zinc/24/30/07/1049243007.db2.gz MMDIWVHWVDUTES-UHFFFAOYSA-N 1 0 323.358 4.398 20 10 DICDRO FC(F)(F)Cc1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000858330513 1049243963 /nfs/dbraw/zinc/24/39/63/1049243963.db2.gz WFIITMULXCKNMK-UHFFFAOYSA-N 1 0 321.342 4.016 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH+]1CCC(OCCC(C)C)CC1 ZINC001179988275 1049246623 /nfs/dbraw/zinc/24/66/23/1049246623.db2.gz CYJVAQGHOGKMMT-UHFFFAOYSA-N 1 0 318.505 4.088 20 10 DICDRO CCc1cccc(C[N@@H+]2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c1O ZINC001180017480 1049258455 /nfs/dbraw/zinc/25/84/55/1049258455.db2.gz CLLYITPAXKJRSZ-KDOFPFPSSA-N 1 0 313.416 4.472 20 10 DICDRO C[C@H]([NH2+]CC[C@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000858445098 1049260350 /nfs/dbraw/zinc/26/03/50/1049260350.db2.gz AEROBPQBFPJCMP-ZWKOTPCHSA-N 1 0 316.489 4.144 20 10 DICDRO CCCC[N@H+](Cc1cccc(N(C)C)c1)Cc1ccccc1O ZINC001193840829 1049262571 /nfs/dbraw/zinc/26/25/71/1049262571.db2.gz ZWKKYHLVMHTZEQ-UHFFFAOYSA-N 1 0 312.457 4.261 20 10 DICDRO Cc1cc([C@H](C)NCc2cc(C)n(-c3ccccc3)c2C)no1 ZINC000858542041 1049272941 /nfs/dbraw/zinc/27/29/41/1049272941.db2.gz HTUGOILUWNZDFA-HNNXBMFYSA-N 1 0 309.413 4.241 20 10 DICDRO C[C@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1ccccc1O ZINC000858563818 1049273884 /nfs/dbraw/zinc/27/38/84/1049273884.db2.gz WPDPQMNSMQUPLI-VIFPVBQESA-N 1 0 301.333 4.323 20 10 DICDRO CC[C@@H](C)[C@H](C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C)OC ZINC001180077740 1049274874 /nfs/dbraw/zinc/27/48/74/1049274874.db2.gz UDBHHEUYRHGIAP-APWZRJJASA-N 1 0 306.494 4.024 20 10 DICDRO C[C@H]([NH2+]C1(c2c(F)cccc2F)CCC1)c1ccccc1O ZINC000858603009 1049282192 /nfs/dbraw/zinc/28/21/92/1049282192.db2.gz PAZVIDUOAFQSDR-LBPRGKRZSA-N 1 0 303.352 4.400 20 10 DICDRO CC[C@@H](C)[C@@H](C)[N@H+](Cc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC001180188225 1049296599 /nfs/dbraw/zinc/29/65/99/1049296599.db2.gz CEWHUUKKMRPUEK-CHWSQXEVSA-N 1 0 310.432 4.430 20 10 DICDRO CC[C@@H](C)[C@H](C)[N@H+](Cc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC001180188226 1049297389 /nfs/dbraw/zinc/29/73/89/1049297389.db2.gz CEWHUUKKMRPUEK-OLZOCXBDSA-N 1 0 310.432 4.430 20 10 DICDRO CC[C@H](C)[C@H](C)[N@H+](Cc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC001180188228 1049297784 /nfs/dbraw/zinc/29/77/84/1049297784.db2.gz CEWHUUKKMRPUEK-STQMWFEESA-N 1 0 310.432 4.430 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)CC)cc1)c1nc(C)cs1 ZINC000773841578 1049299604 /nfs/dbraw/zinc/29/96/04/1049299604.db2.gz XHMYIQBVKZYDIU-INIZCTEOSA-N 1 0 303.475 4.149 20 10 DICDRO CC(C)[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001180166466 1049305623 /nfs/dbraw/zinc/30/56/23/1049305623.db2.gz PNDZBYWAYZABNC-GFCCVEGCSA-N 1 0 302.384 4.248 20 10 DICDRO CCC[C@@]1(C)CCC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001180203160 1049307669 /nfs/dbraw/zinc/30/76/69/1049307669.db2.gz KZVQBVRSNDAYCQ-SFHVURJKSA-N 1 0 310.432 4.433 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC001180208852 1049309359 /nfs/dbraw/zinc/30/93/59/1049309359.db2.gz RICCGIQNQNGCPA-NRFANRHFSA-N 1 0 324.468 4.025 20 10 DICDRO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ccc(Cl)cc1O)CCC2 ZINC001204924571 1049313914 /nfs/dbraw/zinc/31/39/14/1049313914.db2.gz XEMUNOBKLILIGH-CQSZACIVSA-N 1 0 322.861 4.320 20 10 DICDRO COc1cc2ccccc2cc1C[N@H+](C)Cc1ccccc1O ZINC001180238817 1049318396 /nfs/dbraw/zinc/31/83/96/1049318396.db2.gz CELDXKGYWQTQFB-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO Cc1ccc(CC2CC[NH+](Cc3cc(F)ccc3O)CC2)cc1 ZINC001204952990 1049321716 /nfs/dbraw/zinc/32/17/16/1049321716.db2.gz QNOWUFVDBJZFQY-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO CCC[N@H+](Cc1ccc(F)cc1)Cc1c(C)cc(OC)cc1O ZINC001180249241 1049322066 /nfs/dbraw/zinc/32/20/66/1049322066.db2.gz FPGFHWRGZCDWPU-UHFFFAOYSA-N 1 0 317.404 4.261 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)cc1 ZINC000859568136 1049340094 /nfs/dbraw/zinc/34/00/94/1049340094.db2.gz OHNYCYKNEVDMHC-HXUWFJFHSA-N 1 0 309.457 4.169 20 10 DICDRO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2cc(C(C)C)ccc2O)CCO1 ZINC001180326685 1049345187 /nfs/dbraw/zinc/34/51/87/1049345187.db2.gz OUMRUHNQRFXFAI-QZTJIDSGSA-N 1 0 305.462 4.199 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CC[C@@H]3CCCC[C@@H]3C2)cc1F ZINC001205081790 1049369144 /nfs/dbraw/zinc/36/91/44/1049369144.db2.gz KVZXPLLEJZNKAV-UONOGXRCSA-N 1 0 308.416 4.043 20 10 DICDRO CC1CC[NH+](Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC001205101156 1049379031 /nfs/dbraw/zinc/37/90/31/1049379031.db2.gz OXICDSITQDGHMF-UHFFFAOYSA-N 1 0 300.368 4.003 20 10 DICDRO COc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2C)C2CC2)cc1 ZINC001180574189 1049379451 /nfs/dbraw/zinc/37/94/51/1049379451.db2.gz NIJCWMSYYWRDPN-UHFFFAOYSA-N 1 0 324.468 4.234 20 10 DICDRO CCNc1ccccc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001180558752 1049381082 /nfs/dbraw/zinc/38/10/82/1049381082.db2.gz SNFFRRNOEJJIDL-UHFFFAOYSA-N 1 0 323.484 4.349 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H](OC)C1CCCCC1 ZINC001205143811 1049392608 /nfs/dbraw/zinc/39/26/08/1049392608.db2.gz ZMVRIPYUCCSEHQ-HXUWFJFHSA-N 1 0 318.505 4.170 20 10 DICDRO Cc1cccc([C@H]2CC[N@@H+](Cc3ccc(N(C)C)cc3C)C2)c1 ZINC001180818949 1049409962 /nfs/dbraw/zinc/40/99/62/1049409962.db2.gz FFPLWQAPJNLMCC-FQEVSTJZSA-N 1 0 308.469 4.359 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)C1CC1 ZINC001181223067 1049455061 /nfs/dbraw/zinc/45/50/61/1049455061.db2.gz MSZPSBOXWUAMNB-UONOGXRCSA-N 1 0 306.881 4.464 20 10 DICDRO Cc1cc(Br)cc(C[N@H+](CC2CC2)C2CCC2)c1O ZINC001181213367 1049455191 /nfs/dbraw/zinc/45/51/91/1049455191.db2.gz MRIVKBFSUDDIAP-UHFFFAOYSA-N 1 0 324.262 4.228 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1C[C@H](c2ccccc2F)C1 ZINC001181305098 1049462593 /nfs/dbraw/zinc/46/25/93/1049462593.db2.gz MAVJYDKSLYKJKW-QAQDUYKDSA-N 1 0 312.432 4.236 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]Cc1cc(F)c(Cl)cc1F ZINC001181338110 1049462892 /nfs/dbraw/zinc/46/28/92/1049462892.db2.gz ZTRMHKSYPZEUAG-UHFFFAOYSA-N 1 0 318.150 4.267 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cc1Cl ZINC001181350750 1049466644 /nfs/dbraw/zinc/46/66/44/1049466644.db2.gz UOCXMOMJNYXVPM-ONGXEEELSA-N 1 0 307.743 4.127 20 10 DICDRO CO[C@H](C)[C@H](C)[NH2+]Cc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 ZINC001205531083 1049493204 /nfs/dbraw/zinc/49/32/04/1049493204.db2.gz WKNSYQHJPNEWAL-SOUVJXGZSA-N 1 0 324.896 4.089 20 10 DICDRO Cc1cccc(C[NH2+]Cc2csc(C(F)(F)F)c2)c1O ZINC000862536593 1049500295 /nfs/dbraw/zinc/50/02/95/1049500295.db2.gz PQQOVIPQJZDRQQ-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2c2ccccn2)c1O ZINC000775652071 1049525088 /nfs/dbraw/zinc/52/50/88/1049525088.db2.gz VLHMSEIJXCWQIT-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1cccc(C)c1O)CC3 ZINC000775654613 1049527077 /nfs/dbraw/zinc/52/70/77/1049527077.db2.gz MPUNWQHWTNFWLP-UHFFFAOYSA-N 1 0 306.409 4.049 20 10 DICDRO C[C@H](C1CC1)[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001181827744 1049527980 /nfs/dbraw/zinc/52/79/80/1049527980.db2.gz OLVAOQHTNNDOBT-LLVKDONJSA-N 1 0 300.368 4.002 20 10 DICDRO C[N@H+](Cc1cccn1C(F)F)Cc1ccc(N2CCCC2)cc1 ZINC001205708697 1049541047 /nfs/dbraw/zinc/54/10/47/1049541047.db2.gz GLWOYPDAMJKRLU-UHFFFAOYSA-N 1 0 319.399 4.115 20 10 DICDRO Cc1cccc(C[NH+]2CCC(OCC3CCCCC3)CC2)c1O ZINC000775665906 1049546732 /nfs/dbraw/zinc/54/67/32/1049546732.db2.gz NIOSRPBKEWGGTP-UHFFFAOYSA-N 1 0 317.473 4.262 20 10 DICDRO F[C@H]1CCC2(C1)CC[NH+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001204320853 1049570292 /nfs/dbraw/zinc/57/02/92/1049570292.db2.gz BEMPTLHLEZHGKO-SFHVURJKSA-N 1 0 316.464 4.391 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@@H]2CC3CCC2CC3)c1O ZINC001205943386 1049608170 /nfs/dbraw/zinc/60/81/70/1049608170.db2.gz QBMYZPUWVAFQSY-KOHJWAIASA-N 1 0 324.262 4.131 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1cccs1 ZINC000163600495 1049617992 /nfs/dbraw/zinc/61/79/92/1049617992.db2.gz LZEOONMWSUHNTN-CQSZACIVSA-N 1 0 318.511 4.152 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2C)c1 ZINC001182346349 1049629877 /nfs/dbraw/zinc/62/98/77/1049629877.db2.gz YEQHINJKRWSLJQ-GOSISDBHSA-N 1 0 315.388 4.185 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)cc(C)c2O)n1 ZINC000775697354 1049630508 /nfs/dbraw/zinc/63/05/08/1049630508.db2.gz AIEUOWPQNBWVPI-KRWDZBQOSA-N 1 0 316.832 4.395 20 10 DICDRO CC(C)[C@H]1[N@H+](Cc2ccc(Br)cc2O)CC1(C)C ZINC001206040928 1049638021 /nfs/dbraw/zinc/63/80/21/1049638021.db2.gz QOSNZEIUHUEXIK-CQSZACIVSA-N 1 0 312.251 4.021 20 10 DICDRO CSc1ccccc1C[N@H+](C)Cc1c(O)ccc2ccncc21 ZINC000794657060 1049653186 /nfs/dbraw/zinc/65/31/86/1049653186.db2.gz RZYROULBOCLZLF-UHFFFAOYSA-N 1 0 324.449 4.294 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@H]2CCC[C@H]2C(C)(C)C)c1O ZINC001182444464 1049654013 /nfs/dbraw/zinc/65/40/13/1049654013.db2.gz RRVHDWVEANLLLR-CVEARBPZSA-N 1 0 305.462 4.356 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccc(N(C)C)cc1 ZINC000774445815 1049664810 /nfs/dbraw/zinc/66/48/10/1049664810.db2.gz RWGDEEXHEFLYCG-HXUWFJFHSA-N 1 0 323.484 4.267 20 10 DICDRO CCO[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000774495853 1049677321 /nfs/dbraw/zinc/67/73/21/1049677321.db2.gz KHBCXYPRERLPLM-JXFKEZNVSA-N 1 0 312.457 4.181 20 10 DICDRO CCO[C@@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1ccccc1 ZINC000774498698 1049677512 /nfs/dbraw/zinc/67/75/12/1049677512.db2.gz SFQSSCVJJOORNN-LPHOPBHVSA-N 1 0 313.441 4.437 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)C1)c1ccc(C)cc1O ZINC000794795500 1049694651 /nfs/dbraw/zinc/69/46/51/1049694651.db2.gz PWQMGNVPBNYNCA-ICSRJNTNSA-N 1 0 324.468 4.016 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1ccc(C)cc1O ZINC000794789929 1049694991 /nfs/dbraw/zinc/69/49/91/1049694991.db2.gz BBPINIJVQXYCBO-BBRMVZONSA-N 1 0 313.397 4.231 20 10 DICDRO CC[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(C)cc1O ZINC000794800574 1049696694 /nfs/dbraw/zinc/69/66/94/1049696694.db2.gz DTUWGWVACREORQ-SJLPKXTDSA-N 1 0 306.494 4.108 20 10 DICDRO CCc1ccc([C@@H](COC)[NH2+][C@H](CC)c2ccc(C)cc2O)o1 ZINC000794802428 1049697248 /nfs/dbraw/zinc/69/72/48/1049697248.db2.gz ODMMYMWUDRXMHT-IAGOWNOFSA-N 1 0 317.429 4.284 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CC)c1c(C)nn(C)c1C)c1ccc(C)cc1O ZINC000794802098 1049698049 /nfs/dbraw/zinc/69/80/49/1049698049.db2.gz MQQIFHJOJZLVND-SJORKVTESA-N 1 0 315.461 4.243 20 10 DICDRO CC[C@@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(C)cc1O ZINC000794795505 1049698063 /nfs/dbraw/zinc/69/80/63/1049698063.db2.gz PXBFHKQWFKCPJD-GOSISDBHSA-N 1 0 308.425 4.465 20 10 DICDRO CC[C@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1)c1ccc(C)cc1O ZINC000794791893 1049698105 /nfs/dbraw/zinc/69/81/05/1049698105.db2.gz JXXHYLMQJANMJO-WMZOPIPTSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)c1ccc(C)cc1O ZINC000794802149 1049699095 /nfs/dbraw/zinc/69/90/95/1049699095.db2.gz MTGDIJXYNLXIPZ-LJQANCHMSA-N 1 0 321.424 4.127 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1CCc2ccccc2CC1 ZINC001182685610 1049700240 /nfs/dbraw/zinc/70/02/40/1049700240.db2.gz SLVGJRAOGOPXKW-UHFFFAOYSA-N 1 0 301.817 4.083 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1 ZINC001206319988 1049712413 /nfs/dbraw/zinc/71/24/13/1049712413.db2.gz GHCZVOOWEWNTQH-QBTDHISASA-N 1 0 300.490 4.016 20 10 DICDRO CCCCC[C@@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206385531 1049724401 /nfs/dbraw/zinc/72/44/01/1049724401.db2.gz WFDIUSIBMNZGRZ-SJORKVTESA-N 1 0 304.478 4.080 20 10 DICDRO CC[C@H](C[C@@H](C)CC)[NH2+][C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206646215 1049774761 /nfs/dbraw/zinc/77/47/61/1049774761.db2.gz PYIGGKISXGSYFT-BBWFWOEESA-N 1 0 304.478 4.078 20 10 DICDRO COCc1csc(C[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC001206691369 1049779852 /nfs/dbraw/zinc/77/98/52/1049779852.db2.gz HJSSHFNLHCQKRA-UHFFFAOYSA-N 1 0 313.422 4.043 20 10 DICDRO CC1(c2ccccc2)C[NH+](Cc2ccc3ccccc3c2O)C1 ZINC001206743360 1049788922 /nfs/dbraw/zinc/78/89/22/1049788922.db2.gz RIRCSQODKLRMJN-UHFFFAOYSA-N 1 0 303.405 4.319 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(C)cc1OC ZINC001206783102 1049800037 /nfs/dbraw/zinc/80/00/37/1049800037.db2.gz QPYTUDGMBBSNJL-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO Cc1cc(CC[NH2+][C@@H](C)[C@H]2CC2(F)F)c(C)n1-c1ccccc1 ZINC001207017053 1049821105 /nfs/dbraw/zinc/82/11/05/1049821105.db2.gz IBUZZFLUJPHGSG-KBXCAEBGSA-N 1 0 318.411 4.270 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C1CCC(OC(C)(C)C)CC1 ZINC001207057347 1049827442 /nfs/dbraw/zinc/82/74/42/1049827442.db2.gz FMXMFJOSPSUDMH-UHFFFAOYSA-N 1 0 318.505 4.277 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]CC2CCC=CCC2)c1O ZINC001207638812 1049919876 /nfs/dbraw/zinc/91/98/76/1049919876.db2.gz KAXYFLARHRCVEW-UHFFFAOYSA-N 1 0 324.262 4.299 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@@H]2CC(C)(C)OC2(C)C)c1 ZINC001207658398 1049921801 /nfs/dbraw/zinc/92/18/01/1049921801.db2.gz LCQFYVNAQSAXTG-INIZCTEOSA-N 1 0 305.462 4.199 20 10 DICDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000760663667 1049922960 /nfs/dbraw/zinc/92/29/60/1049922960.db2.gz ZMIYQRRXRNATIC-AWEZNQCLSA-N 1 0 302.384 4.353 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2C[C@H]2Cc2ccccc2)cc1Cl ZINC001207806264 1049941702 /nfs/dbraw/zinc/94/17/02/1049941702.db2.gz SAJGURDHBHHKQE-HZPDHXFCSA-N 1 0 315.844 4.322 20 10 DICDRO COc1cc(Cl)ccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000156813357 1049991015 /nfs/dbraw/zinc/99/10/15/1049991015.db2.gz MCORFJXGLDKPAQ-CYBMUJFWSA-N 1 0 318.848 4.265 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(Cl)s1)c1ccc(N(C)C)cc1 ZINC000222844910 1049992403 /nfs/dbraw/zinc/99/24/03/1049992403.db2.gz MRFUUYBMJIFNJE-LBPRGKRZSA-N 1 0 308.878 4.361 20 10 DICDRO CCOc1ccc(C[NH2+]C2(Cc3ccccc3)CCC2)c(O)c1 ZINC000760718873 1050016450 /nfs/dbraw/zinc/01/64/50/1050016450.db2.gz SGSIKKNABDEYMZ-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO Cc1ccc2[nH]cc(C[N@@H+](C)Cc3ccc(N(C)C)cc3)c2c1 ZINC001209500186 1050063504 /nfs/dbraw/zinc/06/35/04/1050063504.db2.gz SUOOCCVYLFPIRN-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO c1cc(C[NH+]2CCCCC2)cc(Nc2ccc3c(c2)OCCN3)c1 ZINC001209765891 1050082132 /nfs/dbraw/zinc/08/21/32/1050082132.db2.gz CJGJYZRHOSYRNS-UHFFFAOYSA-N 1 0 323.440 4.220 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccnc(Cl)c2F)cc1 ZINC000823671327 1050148203 /nfs/dbraw/zinc/14/82/03/1050148203.db2.gz LQNOMWOQKHAUHL-UHFFFAOYSA-N 1 0 321.827 4.010 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)cc1C ZINC000823753522 1050153199 /nfs/dbraw/zinc/15/31/99/1050153199.db2.gz WTVPCQCNMAPOFO-CQSZACIVSA-N 1 0 321.342 4.198 20 10 DICDRO Oc1c(Cl)cccc1Nc1cc[nH+]cc1Oc1ccccc1 ZINC001210216979 1050161138 /nfs/dbraw/zinc/16/11/38/1050161138.db2.gz PYOFPAMYCZOSNW-UHFFFAOYSA-N 1 0 312.756 4.398 20 10 DICDRO CC[C@H](CCO)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000166803373 1050182027 /nfs/dbraw/zinc/18/20/27/1050182027.db2.gz KNAHYTPXCFHNGV-ZWKOTPCHSA-N 1 0 318.505 4.126 20 10 DICDRO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000378895292 1050190531 /nfs/dbraw/zinc/19/05/31/1050190531.db2.gz NCEOQBLEUYDDFF-INIZCTEOSA-N 1 0 312.457 4.391 20 10 DICDRO COc1ccc(O)c(C[NH2+]Cc2ccccc2-c2ccccc2)c1 ZINC000734003490 1050213567 /nfs/dbraw/zinc/21/35/67/1050213567.db2.gz ISNQKSHLLFIPIB-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CCCCO)c1ccc(C(F)(F)F)cc1O ZINC000824653984 1050230063 /nfs/dbraw/zinc/23/00/63/1050230063.db2.gz KBFHDCZKEFLIRS-SMDDNHRTSA-N 1 0 319.367 4.003 20 10 DICDRO COc1ccccc1C1(C[NH2+][C@H](C)c2ccccc2O)CCC1 ZINC000760897548 1050234917 /nfs/dbraw/zinc/23/49/17/1050234917.db2.gz NFUMKZGGWZBELS-OAHLLOKOSA-N 1 0 311.425 4.173 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCC[C@@H]2CCCCO2)c2c1c(F)ccc2O ZINC000760907905 1050240225 /nfs/dbraw/zinc/24/02/25/1050240225.db2.gz UUBGECOQZFYKST-VNHYZAJKSA-N 1 0 307.409 4.019 20 10 DICDRO Cc1cc(O)c(CNc2ccc(CC[NH+](C)C)cc2)cc1Cl ZINC000825008592 1050262350 /nfs/dbraw/zinc/26/23/50/1050262350.db2.gz ZYXZYQGLIFEIAB-UHFFFAOYSA-N 1 0 318.848 4.070 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC[C@]2(C)CC2(Cl)Cl)c1 ZINC000824977761 1050263022 /nfs/dbraw/zinc/26/30/22/1050263022.db2.gz PVQTVDLXLGXANY-QMTHXVAHSA-N 1 0 318.244 4.025 20 10 DICDRO CCOCc1ccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)cc1 ZINC000825103461 1050269440 /nfs/dbraw/zinc/26/94/40/1050269440.db2.gz YMKLEDBSOMFYQH-UHFFFAOYSA-N 1 0 319.832 4.180 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825127647 1050280156 /nfs/dbraw/zinc/28/01/56/1050280156.db2.gz ZCYVXHWPMXLCRZ-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO C[C@H](CCc1cccc(F)c1)[NH2+]Cc1cc(Cl)ccc1O ZINC000734510689 1050280466 /nfs/dbraw/zinc/28/04/66/1050280466.db2.gz YNAOPMPKYSOXJD-GFCCVEGCSA-N 1 0 307.796 4.296 20 10 DICDRO c1csc(SCCC[NH2+]C[C@@H]2C[C@H]2c2ccccc2)n1 ZINC000760956065 1050282097 /nfs/dbraw/zinc/28/20/97/1050282097.db2.gz UOGFRBYNNHNGHD-GJZGRUSLSA-N 1 0 304.484 4.019 20 10 DICDRO CCc1nc([C@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)cs1 ZINC000825291536 1050290091 /nfs/dbraw/zinc/29/00/91/1050290091.db2.gz NCQMFDZVDCPVEP-JTQLQIEISA-N 1 0 310.850 4.224 20 10 DICDRO COc1cccc(C2([NH2+]Cc3cc(Cl)c(C)cc3O)CC2)c1 ZINC000825337435 1050295445 /nfs/dbraw/zinc/29/54/45/1050295445.db2.gz LVHGFDHDQJFNOC-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCOC3(CCCCC3)C2)cc1Cl ZINC000825341673 1050296174 /nfs/dbraw/zinc/29/61/74/1050296174.db2.gz QBOTXMLPVPSVIJ-HNNXBMFYSA-N 1 0 323.864 4.326 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1Cl ZINC000771934863 1050300656 /nfs/dbraw/zinc/30/06/56/1050300656.db2.gz DGIFPONTGYJUMV-UHFFFAOYSA-N 1 0 318.848 4.047 20 10 DICDRO C[C@H](O)C[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000157679813 1050300881 /nfs/dbraw/zinc/30/08/81/1050300881.db2.gz KZTMBRZOOYGAJD-BZSNNMDCSA-N 1 0 318.505 4.125 20 10 DICDRO Oc1ccc(Br)cc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000771937378 1050301105 /nfs/dbraw/zinc/30/11/05/1050301105.db2.gz BXMWTGAZJNCSHX-HNNXBMFYSA-N 1 0 318.214 4.102 20 10 DICDRO CCOc1ccc(C[NH2+][C@@]2(C)CCCc3ccccc32)c(O)c1 ZINC000734843359 1050323733 /nfs/dbraw/zinc/32/37/33/1050323733.db2.gz LAANMOQPISQHGS-FQEVSTJZSA-N 1 0 311.425 4.132 20 10 DICDRO C[N@H+](CCOc1ccccc1)Cc1c(O)ccc2ccccc21 ZINC000058592855 1050346583 /nfs/dbraw/zinc/34/65/83/1050346583.db2.gz FFUBKZPHSXMUFF-UHFFFAOYSA-N 1 0 307.393 4.056 20 10 DICDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000772453708 1050354677 /nfs/dbraw/zinc/35/46/77/1050354677.db2.gz FBRSJZYNXHWGHI-GOSISDBHSA-N 1 0 323.484 4.477 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)CCCO)c1ccc(N2CCCCC2)cc1 ZINC000772479357 1050363303 /nfs/dbraw/zinc/36/33/03/1050363303.db2.gz AMFSTVZLZKYUSE-QGZVFWFLSA-N 1 0 318.505 4.126 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC(C)(C)C[C@H]3C)CC2)cc1 ZINC000766213648 1050370378 /nfs/dbraw/zinc/37/03/78/1050370378.db2.gz HVYKQQJASIARGN-DNVCBOLYSA-N 1 0 316.489 4.078 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CSc3ccccc32)cc1 ZINC000735508657 1050402273 /nfs/dbraw/zinc/40/22/73/1050402273.db2.gz JSFJSBHXRKEUMR-GOSISDBHSA-N 1 0 312.482 4.469 20 10 DICDRO COc1ccc(C[NH2+]C[C@H](Nc2ccccc2)C(C)C)cc1C ZINC000735676594 1050420982 /nfs/dbraw/zinc/42/09/82/1050420982.db2.gz UMSWSVIMLHTLNB-IBGZPJMESA-N 1 0 312.457 4.230 20 10 DICDRO Cc1cc(C)c(C[NH2+]CCCSc2nccs2)c(C)c1 ZINC000735925794 1050438640 /nfs/dbraw/zinc/43/86/40/1050438640.db2.gz SCVWACVOLQCCFX-UHFFFAOYSA-N 1 0 306.500 4.340 20 10 DICDRO CCOc1ccc(C[N@H+](CC)Cc2c[nH]c3ccccc23)c(O)c1 ZINC000785985265 1050442658 /nfs/dbraw/zinc/44/26/58/1050442658.db2.gz SHUXPSKXWAWKDX-UHFFFAOYSA-N 1 0 324.424 4.294 20 10 DICDRO CC[C@H]([NH2+]Cc1c(C)cccc1F)c1ccc(N(C)C)cc1 ZINC000766215084 1050448096 /nfs/dbraw/zinc/44/80/96/1050448096.db2.gz CCORJJHQUMEKAH-IBGZPJMESA-N 1 0 300.421 4.441 20 10 DICDRO CCOCc1cc(C[NH2+]Cc2cccc3cc[nH]c32)ccc1OC ZINC000786162667 1050455124 /nfs/dbraw/zinc/45/51/24/1050455124.db2.gz WKOSGXMZARKKBN-UHFFFAOYSA-N 1 0 324.424 4.003 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)Oc1ccccc1F ZINC000766215914 1050463836 /nfs/dbraw/zinc/46/38/36/1050463836.db2.gz IFCBCDFQXZIONJ-HUUCEWRRSA-N 1 0 316.420 4.010 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1C ZINC000736590298 1050483086 /nfs/dbraw/zinc/48/30/86/1050483086.db2.gz SCZPYERUDPYXLT-QGZVFWFLSA-N 1 0 313.416 4.213 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](c2ccccn2)C(C)C)cc1 ZINC000736648127 1050485718 /nfs/dbraw/zinc/48/57/18/1050485718.db2.gz PGFJOCVTAGKJBK-HXUWFJFHSA-N 1 0 311.473 4.415 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCc1ccc(Cl)s1 ZINC000226646354 1050503375 /nfs/dbraw/zinc/50/33/75/1050503375.db2.gz BMEOYVCJUBEXDU-UHFFFAOYSA-N 1 0 302.226 4.093 20 10 DICDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000738243483 1050531587 /nfs/dbraw/zinc/53/15/87/1050531587.db2.gz PBIXPHRZRQYFKG-FQEVSTJZSA-N 1 0 318.420 4.450 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@@H](c3ccc(C)cc3)C[C@H]2C)c1O ZINC000787326435 1050593520 /nfs/dbraw/zinc/59/35/20/1050593520.db2.gz DPDZPKMHQPGWLY-QAPCUYQASA-N 1 0 311.425 4.087 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)[C@@H]2CCC[C@@H](C)C2)c1O ZINC001171190439 1050597630 /nfs/dbraw/zinc/59/76/30/1050597630.db2.gz SICVIBUEAIVRLC-MBNYWOFBSA-N 1 0 307.409 4.038 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCS1)c1ccc(N2CCCCC2)cc1 ZINC000168653689 1050618390 /nfs/dbraw/zinc/61/83/90/1050618390.db2.gz QNZCWFDGUHISCU-QAPCUYQASA-N 1 0 304.503 4.223 20 10 DICDRO Fc1ccc2c(c1Cl)[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC000845928229 1050636790 /nfs/dbraw/zinc/63/67/90/1050636790.db2.gz AVGYWWWZRDIPAI-HNNXBMFYSA-N 1 0 317.791 4.191 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)c2cc(F)cc(F)c2)c1 ZINC000845971115 1050639379 /nfs/dbraw/zinc/63/93/79/1050639379.db2.gz HEFCWQJQXHBFCT-NWDGAFQWSA-N 1 0 321.367 4.133 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)c2cc(F)cc(F)c2)c1 ZINC000845971114 1050639944 /nfs/dbraw/zinc/63/99/44/1050639944.db2.gz HEFCWQJQXHBFCT-NEPJUHHUSA-N 1 0 321.367 4.133 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCc2ccsc2)c1 ZINC000845970849 1050640316 /nfs/dbraw/zinc/64/03/16/1050640316.db2.gz DEUVRGQFCIMRJZ-STQMWFEESA-N 1 0 305.443 4.134 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccccc1OC(F)F)c1ccccc1O ZINC000788257685 1050660080 /nfs/dbraw/zinc/66/00/80/1050660080.db2.gz CRFNKIALXKTBON-OAHLLOKOSA-N 1 0 321.367 4.277 20 10 DICDRO CCC(O)(CC)CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000788262815 1050662166 /nfs/dbraw/zinc/66/21/66/1050662166.db2.gz PSYCNRMHQYMZPC-CQSZACIVSA-N 1 0 301.430 4.137 20 10 DICDRO CC[C@H]([NH2+]CCC[C@@H]1CC1(Cl)Cl)c1ccccc1O ZINC000846109401 1050664443 /nfs/dbraw/zinc/66/44/43/1050664443.db2.gz ILCLLTWAKUGORZ-YPMHNXCESA-N 1 0 302.245 4.407 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c1 ZINC000846117590 1050665989 /nfs/dbraw/zinc/66/59/89/1050665989.db2.gz QGGFIOVPDDTWLM-JBACZVJFSA-N 1 0 323.436 4.195 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2oc3ccccc3c2C)c1O ZINC000846147390 1050672510 /nfs/dbraw/zinc/67/25/10/1050672510.db2.gz UNZNOKGUKUZFGL-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1 ZINC000846108025 1050672766 /nfs/dbraw/zinc/67/27/66/1050672766.db2.gz BHQOAHBPLUGOEV-WDEREUQCSA-N 1 0 318.244 4.025 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC(C)(C)c2ccc(F)cc2)c1O ZINC000846147269 1050672904 /nfs/dbraw/zinc/67/29/04/1050672904.db2.gz VABBKLNEJMSFJF-CYBMUJFWSA-N 1 0 317.404 4.168 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](c3ccccc3F)C2)c1O ZINC000846167864 1050677947 /nfs/dbraw/zinc/67/79/47/1050677947.db2.gz NCCWKDPWPQVXGY-IHRRRGAJSA-N 1 0 315.388 4.137 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2F)c1O ZINC000846165838 1050677963 /nfs/dbraw/zinc/67/79/63/1050677963.db2.gz ZPJZYADNJGZORG-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(F)c(F)cc1Cl ZINC001144729246 1050678043 /nfs/dbraw/zinc/67/80/43/1050678043.db2.gz GOYRMYKNPZOKBX-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO CCCNc1ccc(C[NH2+][C@H](C)c2cccc(OC)c2O)cc1 ZINC000846166999 1050678781 /nfs/dbraw/zinc/67/87/81/1050678781.db2.gz QOYOUTFRICCTTK-CQSZACIVSA-N 1 0 314.429 4.074 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCc3ccc(C)cc32)c1O ZINC000846170159 1050679908 /nfs/dbraw/zinc/67/99/08/1050679908.db2.gz JBNIUJCOJBQMIF-KDOFPFPSSA-N 1 0 311.425 4.437 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c1O ZINC000846169633 1050680345 /nfs/dbraw/zinc/68/03/45/1050680345.db2.gz IUJAUZCKKYEOLJ-NOLJZWGESA-N 1 0 315.388 4.137 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(c3cccc(F)c3)CCC2)c1O ZINC000846171816 1050680694 /nfs/dbraw/zinc/68/06/94/1050680694.db2.gz HVHAKISBVOLZES-CYBMUJFWSA-N 1 0 315.388 4.270 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1O ZINC000846168651 1050680794 /nfs/dbraw/zinc/68/07/94/1050680794.db2.gz BTTQLNIHGPHPML-QWHCGFSZSA-N 1 0 313.388 4.267 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(OC(C)C)cc2)c1O ZINC000846138396 1050682571 /nfs/dbraw/zinc/68/25/71/1050682571.db2.gz KELORIJFERSIJE-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1O ZINC000846145749 1050684361 /nfs/dbraw/zinc/68/43/61/1050684361.db2.gz QBHCMLAOTQFMAM-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC(C)(C)c2cccs2)c1O ZINC000846147474 1050685989 /nfs/dbraw/zinc/68/59/89/1050685989.db2.gz VLXYNUYZGWVELT-LBPRGKRZSA-N 1 0 305.443 4.091 20 10 DICDRO C[C@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000846205441 1050686018 /nfs/dbraw/zinc/68/60/18/1050686018.db2.gz PMCBZBHKJFLURK-SJORKVTESA-N 1 0 316.489 4.143 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cc(F)c(Cl)cc2F)cc1C ZINC000788532736 1050705346 /nfs/dbraw/zinc/70/53/46/1050705346.db2.gz UBOIBTOFWMPURI-UHFFFAOYSA-N 1 0 311.759 4.230 20 10 DICDRO CC[C@@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000788608834 1050705750 /nfs/dbraw/zinc/70/57/50/1050705750.db2.gz CVXOEMNTTMYDME-OAHLLOKOSA-N 1 0 323.864 4.029 20 10 DICDRO CSC1(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)CC1 ZINC000788606030 1050714103 /nfs/dbraw/zinc/71/41/03/1050714103.db2.gz PGUZTKDOGJGHFB-AWEZNQCLSA-N 1 0 322.493 4.362 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000788614005 1050717029 /nfs/dbraw/zinc/71/70/29/1050717029.db2.gz PPMKBYTZVCDMHB-PXNSSMCTSA-N 1 0 324.468 4.350 20 10 DICDRO CC[C@H]([NH2+][C@H](C(C)C)[C@H](O)c1ccccc1)c1ccccc1O ZINC000788618473 1050717733 /nfs/dbraw/zinc/71/77/33/1050717733.db2.gz ARAPRACEKLOJLT-DFQSSKMNSA-N 1 0 313.441 4.191 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCO[C@H](CC(C)C)C2)c(O)c1 ZINC000788708982 1050731989 /nfs/dbraw/zinc/73/19/89/1050731989.db2.gz CATFWQGICZTGAJ-YESZJQIVSA-N 1 0 305.462 4.253 20 10 DICDRO Cc1cc(C)cc([C@@H](O)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788820331 1050757714 /nfs/dbraw/zinc/75/77/14/1050757714.db2.gz UQHAKZBBWNSPFW-LPHOPBHVSA-N 1 0 313.441 4.010 20 10 DICDRO CCOC[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)C(C)C ZINC000788971124 1050766993 /nfs/dbraw/zinc/76/69/93/1050766993.db2.gz IABFRNRCJNCMKK-IBGZPJMESA-N 1 0 313.441 4.210 20 10 DICDRO COc1c2ccccc2oc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000788982229 1050770552 /nfs/dbraw/zinc/77/05/52/1050770552.db2.gz WMYLRAHPHSEONH-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c(C)c1 ZINC000788985729 1050772610 /nfs/dbraw/zinc/77/26/10/1050772610.db2.gz QUCJTFHEJMVCGL-CQSZACIVSA-N 1 0 317.404 4.479 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2c2ccsc2)c1O ZINC000761191817 1050773099 /nfs/dbraw/zinc/77/30/99/1050773099.db2.gz WYEXRLKDMLHINT-AWEZNQCLSA-N 1 0 323.845 4.453 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1O ZINC000761191818 1050773148 /nfs/dbraw/zinc/77/31/48/1050773148.db2.gz WYEXRLKDMLHINT-CQSZACIVSA-N 1 0 323.845 4.453 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)C1CCC(F)(F)CC1 ZINC000788989060 1050774681 /nfs/dbraw/zinc/77/46/81/1050774681.db2.gz UPVSGARIRFEAJS-NSHDSACASA-N 1 0 320.474 4.429 20 10 DICDRO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000788978899 1050777809 /nfs/dbraw/zinc/77/78/09/1050777809.db2.gz BBWKCYIEJLZLLQ-NSHDSACASA-N 1 0 315.344 4.137 20 10 DICDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000772956223 1050779914 /nfs/dbraw/zinc/77/99/14/1050779914.db2.gz AIGYXLNDLFTESH-HNAYVOBHSA-N 1 0 310.441 4.154 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)CCc2ccc(C)o2)c1O ZINC000761207840 1050781033 /nfs/dbraw/zinc/78/10/33/1050781033.db2.gz TYYWLGCUGOLYMX-NSHDSACASA-N 1 0 323.820 4.067 20 10 DICDRO CCSCC[C@@H](C)[N@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000761207287 1050786563 /nfs/dbraw/zinc/78/65/63/1050786563.db2.gz ZRUHOVVHKNBGPP-LLVKDONJSA-N 1 0 317.882 4.018 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000742384003 1050827515 /nfs/dbraw/zinc/82/75/15/1050827515.db2.gz XUWVZFTVLIIHAJ-ZDUSSCGKSA-N 1 0 324.207 4.231 20 10 DICDRO FC(F)Oc1ccc(N2CCC[C@H]([NH2+]C3CCCCC3)C2)cc1 ZINC000742385245 1050828126 /nfs/dbraw/zinc/82/81/26/1050828126.db2.gz UWAIUXVDUGWLHU-HNNXBMFYSA-N 1 0 324.415 4.179 20 10 DICDRO FC(F)Oc1ccc(N2CCC([NH2+]C3CCCCC3)CC2)cc1 ZINC000742369775 1050832608 /nfs/dbraw/zinc/83/26/08/1050832608.db2.gz RNXPUYDPXUMUBH-UHFFFAOYSA-N 1 0 324.415 4.179 20 10 DICDRO C[C@@H]1CC[C@@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC000742369366 1050832907 /nfs/dbraw/zinc/83/29/07/1050832907.db2.gz BKAZGNICTMTSIJ-UKRRQHHQSA-N 1 0 324.415 4.035 20 10 DICDRO c1ccc(C[C@H]2C[C@H]2[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000742375022 1050835825 /nfs/dbraw/zinc/83/58/25/1050835825.db2.gz KXZHAYWRFFTIKI-RBBKRZOGSA-N 1 0 320.480 4.398 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2CC(c3cccc(Cl)c3)C2)c1 ZINC000742376837 1050837830 /nfs/dbraw/zinc/83/78/30/1050837830.db2.gz ABNXHXNQHUHLNJ-UHFFFAOYSA-N 1 0 301.817 4.390 20 10 DICDRO CO[C@@H](C[NH2+]Cc1cc(C)c(C)cc1O)c1ccc(Cl)cc1 ZINC000742377468 1050838047 /nfs/dbraw/zinc/83/80/47/1050838047.db2.gz MKEXYZQVIUVEGX-SFHVURJKSA-N 1 0 319.832 4.140 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(C)cn2)cc1F ZINC000789593963 1050853552 /nfs/dbraw/zinc/85/35/52/1050853552.db2.gz DEYMQGBDODXXHF-UHFFFAOYSA-N 1 0 315.436 4.007 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2OCCc3ccccc32)cc1 ZINC000772980477 1050880520 /nfs/dbraw/zinc/88/05/20/1050880520.db2.gz PFMXKHRQRINUAL-KKSFZXQISA-N 1 0 324.468 4.107 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccccc2O)C2CCCCC2)nc1 ZINC000746894965 1050950650 /nfs/dbraw/zinc/95/06/50/1050950650.db2.gz GQEFALIMMINTQT-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO CCn1ccc(C[N@H+](C)Cc2cc(C(C)C)c(C)cc2O)c1 ZINC000790452184 1050961482 /nfs/dbraw/zinc/96/14/82/1050961482.db2.gz UQVQAJRFXTWMBU-UHFFFAOYSA-N 1 0 300.446 4.277 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCSC1)c1ccc(N2CCCCCC2)cc1 ZINC000790494908 1050964513 /nfs/dbraw/zinc/96/45/13/1050964513.db2.gz GIEPWBFVLQNACN-SJORKVTESA-N 1 0 318.530 4.471 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCSC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000790496810 1050965494 /nfs/dbraw/zinc/96/54/94/1050965494.db2.gz OBBMFKPGRDKYIQ-CABCVRRESA-N 1 0 322.493 4.220 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1cc(F)ccc1O ZINC000790714660 1050988914 /nfs/dbraw/zinc/98/89/14/1050988914.db2.gz GZVHMINCKKDQCX-DZGCQCFKSA-N 1 0 307.409 4.064 20 10 DICDRO CCCN(Cc1ncc(C(C)(C)C)s1)c1ccc(C[NH3+])cc1 ZINC000790926746 1051005851 /nfs/dbraw/zinc/00/58/51/1051005851.db2.gz RARVWJKDGSACCW-UHFFFAOYSA-N 1 0 317.502 4.316 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C2CCN(Cc3ccccc3)CC2)c1 ZINC000192743417 1051011883 /nfs/dbraw/zinc/01/18/83/1051011883.db2.gz MWZUHYDQUNCYRB-KRWDZBQOSA-N 1 0 324.468 4.016 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1CCC2(CCCCC2)O1 ZINC000790994994 1051015769 /nfs/dbraw/zinc/01/57/69/1051015769.db2.gz GSFVHXQOPRPPBV-HNNXBMFYSA-N 1 0 309.837 4.017 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000773002627 1051018150 /nfs/dbraw/zinc/01/81/50/1051018150.db2.gz XKGROZBSCRCSHX-INIZCTEOSA-N 1 0 312.457 4.229 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(NCc2c(O)ccc(Cl)c2F)c1 ZINC000790979593 1051019157 /nfs/dbraw/zinc/01/91/57/1051019157.db2.gz CRGMLIXYVTVWMF-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCC3(CCCC3)C2)c1 ZINC000743391170 1051021603 /nfs/dbraw/zinc/02/16/03/1051021603.db2.gz YAVIWGCXMXRNRH-UHFFFAOYSA-N 1 0 303.446 4.161 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC000743403968 1051024016 /nfs/dbraw/zinc/02/40/16/1051024016.db2.gz YNUSTTVMRCTBDU-HXUWFJFHSA-N 1 0 319.404 4.119 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCCC(F)(F)F ZINC000743495958 1051038859 /nfs/dbraw/zinc/03/88/59/1051038859.db2.gz KDZGKYVWXJNEIH-UHFFFAOYSA-N 1 0 309.331 4.491 20 10 DICDRO CSC(C)(C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000743497182 1051039207 /nfs/dbraw/zinc/03/92/07/1051039207.db2.gz CQZJYGGITMEMRI-UHFFFAOYSA-N 1 0 301.455 4.290 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)C1CC1 ZINC000773090870 1051061235 /nfs/dbraw/zinc/06/12/35/1051061235.db2.gz GHIFWVYVBOZYLI-OXQOHEQNSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)[C@H]1CCCO1 ZINC000773102630 1051062260 /nfs/dbraw/zinc/06/22/60/1051062260.db2.gz HHIBRDSTNRHKEX-LSTHTHJFSA-N 1 0 316.489 4.285 20 10 DICDRO CC[C@H]([NH2+]CCSCC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000773148492 1051080352 /nfs/dbraw/zinc/08/03/52/1051080352.db2.gz XREUKYDJCIPHSR-AWEZNQCLSA-N 1 0 320.424 4.089 20 10 DICDRO Fc1cccc2c1CC[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)C2 ZINC001171395458 1051080914 /nfs/dbraw/zinc/08/09/14/1051080914.db2.gz FJKPFSKQQDCGJR-GOSISDBHSA-N 1 0 324.443 4.073 20 10 DICDRO Cc1[nH]c2ccc(NCc3cc4ccccc4cc3O)cc2[nH+]1 ZINC001171404473 1051090601 /nfs/dbraw/zinc/09/06/01/1051090601.db2.gz DBHCZGOJSNWDJL-UHFFFAOYSA-N 1 0 303.365 4.342 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@H]1CCc2c(F)cccc2C1 ZINC001171407488 1051095371 /nfs/dbraw/zinc/09/53/71/1051095371.db2.gz IQDGXIMIPMHUCR-SFHVURJKSA-N 1 0 321.395 4.332 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(OC)ccc1O)c1ccc(Cl)cc1 ZINC000036978975 1051106133 /nfs/dbraw/zinc/10/61/33/1051106133.db2.gz VQCDXJJOKRHZPK-MRXNPFEDSA-N 1 0 305.805 4.295 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccccc1OC ZINC000036995181 1051107576 /nfs/dbraw/zinc/10/75/76/1051107576.db2.gz RJHMTBYHDZUELJ-HNNXBMFYSA-N 1 0 305.805 4.295 20 10 DICDRO CCC[N@H+](Cc1ccc(Br)o1)Cc1ccccc1O ZINC000792163787 1051122175 /nfs/dbraw/zinc/12/21/75/1051122175.db2.gz CUMBPQYEQBFWDN-UHFFFAOYSA-N 1 0 324.218 4.160 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1 ZINC000792190050 1051126368 /nfs/dbraw/zinc/12/63/68/1051126368.db2.gz QJVWWKZNLKKPLZ-HNNXBMFYSA-N 1 0 314.395 4.163 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Br)cc2O)cc1 ZINC000691412428 1051167938 /nfs/dbraw/zinc/16/79/38/1051167938.db2.gz BHMQUSDQBGHAEG-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO CC[N@H+](CCCCCF)Cc1cc(Br)ccc1O ZINC000792866765 1051218780 /nfs/dbraw/zinc/21/87/80/1051218780.db2.gz JECQNKXSPIGSQH-UHFFFAOYSA-N 1 0 318.230 4.116 20 10 DICDRO CSCCCC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792992986 1051237749 /nfs/dbraw/zinc/23/77/49/1051237749.db2.gz QNFOBERXFIVZBC-UHFFFAOYSA-N 1 0 320.424 4.004 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cnc(-c3ccccc3)s2)c1 ZINC000747099548 1051238119 /nfs/dbraw/zinc/23/81/19/1051238119.db2.gz FUJIPESWFFLARG-UHFFFAOYSA-N 1 0 310.422 4.114 20 10 DICDRO COC[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1ccco1 ZINC000747099536 1051239550 /nfs/dbraw/zinc/23/95/50/1051239550.db2.gz FKEDOESGUIATRG-SFHVURJKSA-N 1 0 323.392 4.130 20 10 DICDRO CO[C@]1(C)CCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000793218350 1051261281 /nfs/dbraw/zinc/26/12/81/1051261281.db2.gz RYJQWHANFYDGSD-HXUWFJFHSA-N 1 0 311.425 4.060 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccc(C)cc3C)C2)c1 ZINC000793233964 1051266277 /nfs/dbraw/zinc/26/62/77/1051266277.db2.gz XXIQUGOHRNFHMV-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO CCCN(CCC)c1ccc(C[N@@H+]2CCC[C@@](C)(O)CC2)cc1 ZINC000793252106 1051273888 /nfs/dbraw/zinc/27/38/88/1051273888.db2.gz XETDQIPQIGATCS-HXUWFJFHSA-N 1 0 318.505 4.050 20 10 DICDRO CO[C@]1(C)CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000793341447 1051280496 /nfs/dbraw/zinc/28/04/96/1051280496.db2.gz VFHFWOFWBGCMAY-HXUWFJFHSA-N 1 0 316.489 4.068 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CC[C@](C)(c3ccccc3)C2)c(O)c1 ZINC000793391460 1051295844 /nfs/dbraw/zinc/29/58/44/1051295844.db2.gz YKUMWFJQQSYTQD-XLIONFOSSA-N 1 0 311.425 4.001 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CC[C@](C)(c3ccccc3)C2)c(O)c1 ZINC000793391458 1051296243 /nfs/dbraw/zinc/29/62/43/1051296243.db2.gz YKUMWFJQQSYTQD-PXNSSMCTSA-N 1 0 311.425 4.001 20 10 DICDRO COc1ccc(C[NH2+]C2CC(c3ccc(Cl)cc3)C2)c(O)c1 ZINC000793388579 1051296544 /nfs/dbraw/zinc/29/65/44/1051296544.db2.gz PXESPYIMLUYFMO-UHFFFAOYSA-N 1 0 317.816 4.090 20 10 DICDRO CC[N@H+](Cc1ccc(C)cc1)Cc1c(O)ccc2ccncc21 ZINC000746029415 1051308378 /nfs/dbraw/zinc/30/83/78/1051308378.db2.gz RQHAIDAMSRCGGF-UHFFFAOYSA-N 1 0 306.409 4.271 20 10 DICDRO Oc1ccc(Cl)cc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000793620651 1051329643 /nfs/dbraw/zinc/32/96/43/1051329643.db2.gz QSLZXFHOCJJGOJ-UHFFFAOYSA-N 1 0 307.743 4.210 20 10 DICDRO CSC[C@H]1CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000793790145 1051337483 /nfs/dbraw/zinc/33/74/83/1051337483.db2.gz JZUZDORUNPJMKF-HNNXBMFYSA-N 1 0 307.503 4.399 20 10 DICDRO CC[C@H](C)OCC[C@@H](C)[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001172346407 1051364918 /nfs/dbraw/zinc/36/49/18/1051364918.db2.gz JAYXUJAFGKUVMC-SJORKVTESA-N 1 0 306.494 4.168 20 10 DICDRO CC[C@@H](C)OCC[C@H](C)[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001172346400 1051365067 /nfs/dbraw/zinc/36/50/67/1051365067.db2.gz JAYXUJAFGKUVMC-DLBZAZTESA-N 1 0 306.494 4.168 20 10 DICDRO CCOCC[C@@H](C)[NH2+][C@@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001172422583 1051384314 /nfs/dbraw/zinc/38/43/14/1051384314.db2.gz GDMOIADNYNKLAY-RDTXWAMCSA-N 1 0 305.462 4.037 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H](C)CCOC(C)C ZINC001172441162 1051407900 /nfs/dbraw/zinc/40/79/00/1051407900.db2.gz TYLBAVMKHTZVRZ-KXBFYZLASA-N 1 0 319.489 4.426 20 10 DICDRO CC[C@H](C[C@H](C)CO)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766360787 1051409129 /nfs/dbraw/zinc/40/91/29/1051409129.db2.gz NXFBWJJMDXCLOH-JENIJYKNSA-N 1 0 318.505 4.125 20 10 DICDRO CCCCCC[C@H](CCCC)[NH2+]C[C@@H](O)c1ccc(O)c(O)c1 ZINC001172510484 1051426377 /nfs/dbraw/zinc/42/63/77/1051426377.db2.gz CYHGFPHDRQYJPV-QFBILLFUSA-N 1 0 323.477 4.250 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCCCC3(C)C)CC2)cc1 ZINC000766576349 1051510000 /nfs/dbraw/zinc/51/00/00/1051510000.db2.gz MPZHQUWJGJCRGI-LJQANCHMSA-N 1 0 316.489 4.222 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCc3c2cccc3OC)cc1 ZINC000766583750 1051516776 /nfs/dbraw/zinc/51/67/76/1051516776.db2.gz KHDIVFXKOXLWIQ-QRWLVFNGSA-N 1 0 324.468 4.489 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCCC1 ZINC000766586313 1051517576 /nfs/dbraw/zinc/51/75/76/1051517576.db2.gz YXDXZKRUQQJJSV-KRWDZBQOSA-N 1 0 318.505 4.390 20 10 DICDRO Cc1cccc(C[NH2+][C@@H](C)Cc2c(F)cccc2Cl)c1O ZINC001172851373 1051537547 /nfs/dbraw/zinc/53/75/47/1051537547.db2.gz IJIIOLKCNJALQE-LBPRGKRZSA-N 1 0 307.796 4.214 20 10 DICDRO C[C@@H](Cc1c(F)cccc1Cl)[N@H+](C)Cc1ccccc1O ZINC001172857516 1051542891 /nfs/dbraw/zinc/54/28/91/1051542891.db2.gz QBXJQLUEBUFHPI-LBPRGKRZSA-N 1 0 307.796 4.248 20 10 DICDRO C[C@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1ccc(N(C)C)cc1 ZINC001172860737 1051548334 /nfs/dbraw/zinc/54/83/34/1051548334.db2.gz NUURYCYJUZQFJJ-CYBMUJFWSA-N 1 0 320.839 4.266 20 10 DICDRO C[C@@H](CSc1ccc(Cl)cc1)[NH2+]Cc1cccc(O)c1O ZINC001172880521 1051563740 /nfs/dbraw/zinc/56/37/40/1051563740.db2.gz SLKUNUYRDWXXLS-NSHDSACASA-N 1 0 323.845 4.022 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC001169367247 1051591510 /nfs/dbraw/zinc/59/15/10/1051591510.db2.gz QKNFVQHIOBMCBX-TZIWHRDSSA-N 1 0 308.469 4.254 20 10 DICDRO Oc1ccc(CC[NH2+]C2CCC3(CCCCC3)CC2)cc1O ZINC001173115340 1051612010 /nfs/dbraw/zinc/61/20/10/1051612010.db2.gz VSYOLJOGHRLMHN-UHFFFAOYSA-N 1 0 303.446 4.123 20 10 DICDRO C[C@@H](c1cccc(Br)c1)[N@H+](C)Cc1ccccc1O ZINC000766885241 1051731410 /nfs/dbraw/zinc/73/14/10/1051731410.db2.gz LDLYTORTZDKFAV-LBPRGKRZSA-N 1 0 320.230 4.348 20 10 DICDRO CCCC[NH+]1CCC([NH2+][C@@H](CC)c2cccc(Cl)c2[O-])CC1 ZINC000806134948 1051734819 /nfs/dbraw/zinc/73/48/19/1051734819.db2.gz DPGKUODWAJOHRU-KRWDZBQOSA-N 1 0 324.896 4.351 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)c1cc(Cl)cc(Cl)c1[O-] ZINC000806135035 1051735875 /nfs/dbraw/zinc/73/58/75/1051735875.db2.gz FFFHEGDSWHGFGD-YGRLFVJLSA-N 1 0 319.276 4.080 20 10 DICDRO CC[C@H]1CC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000806137867 1051737589 /nfs/dbraw/zinc/73/75/89/1051737589.db2.gz SYYGUKPGJHFMDC-SUMWQHHRSA-N 1 0 324.415 4.035 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000806176114 1051747661 /nfs/dbraw/zinc/74/76/61/1051747661.db2.gz LFQZIAGGAYJDGK-GXTWGEPZSA-N 1 0 309.425 4.122 20 10 DICDRO Cc1oc2ccccc2c1C[NH2+]Cc1c(O)cccc1Cl ZINC000767193684 1051772293 /nfs/dbraw/zinc/77/22/93/1051772293.db2.gz DBKBMMVTNBPZHR-UHFFFAOYSA-N 1 0 301.773 4.390 20 10 DICDRO Oc1ccc(C[NH2+]C2CCC3(CCc4ccccc43)CC2)cc1O ZINC001173688368 1051780506 /nfs/dbraw/zinc/78/05/06/1051780506.db2.gz CBZWCIHTUXIOFV-UHFFFAOYSA-N 1 0 323.436 4.014 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cccc(-c2ccccn2)c1 ZINC000130269955 1051786905 /nfs/dbraw/zinc/78/69/05/1051786905.db2.gz KXHHWVXKSNDNJY-UHFFFAOYSA-N 1 0 324.811 4.397 20 10 DICDRO CCc1cc(C[N@H+](C)CC2CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000767975476 1051869094 /nfs/dbraw/zinc/86/90/94/1051869094.db2.gz FHUAZHOONIPVPM-UHFFFAOYSA-N 1 0 319.489 4.111 20 10 DICDRO Cc1ccc(O)c(C[N@H+](C)Cc2ccccc2Br)c1 ZINC000768162838 1051889026 /nfs/dbraw/zinc/88/90/26/1051889026.db2.gz JPYQVANUBMRKQE-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](Cc2ccccc2F)C2CC2)c1 ZINC000768204023 1051895361 /nfs/dbraw/zinc/89/53/61/1051895361.db2.gz OLOXVCREVLOYEH-UHFFFAOYSA-N 1 0 315.388 4.095 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@H]2CCCc3ccccc32)c1O ZINC000768193845 1051900796 /nfs/dbraw/zinc/90/07/96/1051900796.db2.gz SLOKMRQVGAIDID-SFHVURJKSA-N 1 0 311.425 4.300 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2ccc(Cl)s2)c(O)c1 ZINC000768193717 1051901151 /nfs/dbraw/zinc/90/11/51/1051901151.db2.gz OCDZQRMOXMAEAG-UHFFFAOYSA-N 1 0 311.834 4.138 20 10 DICDRO Cc1ccc(O)c(C[N@H+](Cc2ccc(F)cc2F)C2CC2)c1 ZINC000768256325 1051909669 /nfs/dbraw/zinc/90/96/69/1051909669.db2.gz CDGLNLAPPWBINI-UHFFFAOYSA-N 1 0 303.352 4.143 20 10 DICDRO CCOc1ccc(C[N@H+](Cc2cccs2)C2CC2)c(O)c1 ZINC000768252001 1051910171 /nfs/dbraw/zinc/91/01/71/1051910171.db2.gz DRKIYDCBOWSJEP-UHFFFAOYSA-N 1 0 303.427 4.017 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1O ZINC000768319535 1051915986 /nfs/dbraw/zinc/91/59/86/1051915986.db2.gz PLKFGNZLAJRINE-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2ccccc2C)c1O ZINC000768320454 1051916138 /nfs/dbraw/zinc/91/61/38/1051916138.db2.gz VXWNGRCSROHXMR-GOSISDBHSA-N 1 0 311.425 4.436 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1O ZINC000768329888 1051917872 /nfs/dbraw/zinc/91/78/72/1051917872.db2.gz JUBOQKXESPTRQQ-QGZVFWFLSA-N 1 0 315.388 4.267 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccccn2)c(C)n1-c1cccc(C)c1 ZINC000743503655 1051942916 /nfs/dbraw/zinc/94/29/16/1051942916.db2.gz NBECCVVHYWNXQA-UHFFFAOYSA-N 1 0 305.425 4.087 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCc3sccc3[C@@H]2CC)c1O ZINC000768828561 1051970337 /nfs/dbraw/zinc/97/03/37/1051970337.db2.gz WFTRETHMYNZBPB-HNNXBMFYSA-N 1 0 317.454 4.362 20 10 DICDRO COc1ccc2ccccc2c1C[N@H+](C)Cc1ccccc1O ZINC000768873624 1051974889 /nfs/dbraw/zinc/97/48/89/1051974889.db2.gz SJNOGCCPMPWFQX-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO Oc1cccc(C[N@@H+](Cc2cc(Cl)ccc2O)CC2CC2)c1 ZINC000769192617 1052001445 /nfs/dbraw/zinc/00/14/45/1052001445.db2.gz OCNBARIANSDUIX-UHFFFAOYSA-N 1 0 317.816 4.163 20 10 DICDRO CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)Cc1ccccc1O ZINC000769200654 1052006158 /nfs/dbraw/zinc/00/61/58/1052006158.db2.gz HCFZSFGBWQJMQJ-UHFFFAOYSA-N 1 0 314.385 4.021 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCOc2ccccc21 ZINC000769201606 1052007987 /nfs/dbraw/zinc/00/79/87/1052007987.db2.gz XXDONSLZGHNKFW-INIZCTEOSA-N 1 0 311.425 4.171 20 10 DICDRO CCC[N@H+](Cc1cc(F)c(F)c(F)c1)Cc1ccccc1O ZINC000769201527 1052009531 /nfs/dbraw/zinc/00/95/31/1052009531.db2.gz WCMPKDYHNNUYCG-UHFFFAOYSA-N 1 0 309.331 4.222 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000769314071 1052020957 /nfs/dbraw/zinc/02/09/57/1052020957.db2.gz COPBGAMJLVCHCF-GOSISDBHSA-N 1 0 317.816 4.009 20 10 DICDRO COC[C@@H]([NH2+]Cc1cc(C)c(C)cc1O)c1cccc(Cl)c1 ZINC000808455051 1052026362 /nfs/dbraw/zinc/02/63/62/1052026362.db2.gz UGNMNHUBHIBPEO-QGZVFWFLSA-N 1 0 319.832 4.140 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC(OC3CCC(C)CC3)CC2)c1 ZINC000769384419 1052037655 /nfs/dbraw/zinc/03/76/55/1052037655.db2.gz OEIATCZLULLUMS-UHFFFAOYSA-N 1 0 317.473 4.260 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](CC)Cc2ccccn2)cc1F ZINC000769402528 1052040078 /nfs/dbraw/zinc/04/00/78/1052040078.db2.gz IAVUXJQRCFROFT-UHFFFAOYSA-N 1 0 315.436 4.089 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c1O ZINC000808719488 1052077254 /nfs/dbraw/zinc/07/72/54/1052077254.db2.gz XDOGWXCVAXRUIS-MNOVXSKESA-N 1 0 303.780 4.440 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C2CCC(OC)CC2)cc1F ZINC000769425187 1052044617 /nfs/dbraw/zinc/04/46/17/1052044617.db2.gz NZMCATBRMSBHBP-UHFFFAOYSA-N 1 0 322.468 4.061 20 10 DICDRO FC(F)(F)C1=CC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000769484027 1052053331 /nfs/dbraw/zinc/05/33/31/1052053331.db2.gz JIFYBARNWRDMAC-UHFFFAOYSA-N 1 0 324.390 4.371 20 10 DICDRO FC(F)C1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000769445623 1052054405 /nfs/dbraw/zinc/05/44/05/1052054405.db2.gz GQFLRZPEXCSTAT-UHFFFAOYSA-N 1 0 308.416 4.154 20 10 DICDRO CCOc1cccc(C[N@@H+]2C[C@H](c3ccccc3)C[C@@H]2C)c1O ZINC000769445435 1052055303 /nfs/dbraw/zinc/05/53/03/1052055303.db2.gz IICNASNWFUNPHN-MAUKXSAKSA-N 1 0 311.425 4.169 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCOC2CCCC2)c1O ZINC000808687257 1052061062 /nfs/dbraw/zinc/06/10/62/1052061062.db2.gz PUZBIJQIZYQKAB-CYBMUJFWSA-N 1 0 311.853 4.354 20 10 DICDRO CCc1nc(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cs1 ZINC000808690785 1052061098 /nfs/dbraw/zinc/06/10/98/1052061098.db2.gz ORUIELBYNSBBAT-LLVKDONJSA-N 1 0 324.877 4.266 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cc1F ZINC000808673285 1052064580 /nfs/dbraw/zinc/06/45/80/1052064580.db2.gz AAVCWKYBZYHKFO-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c1O ZINC000808702806 1052066287 /nfs/dbraw/zinc/06/62/87/1052066287.db2.gz BLCRPSFBFJDSNQ-JGGQBBKZSA-N 1 0 311.853 4.208 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccc(Cl)nc2)c1O ZINC000808678084 1052066929 /nfs/dbraw/zinc/06/69/29/1052066929.db2.gz LDHNFPRINXBCEB-JTQLQIEISA-N 1 0 311.212 4.253 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c1O ZINC000808702803 1052067420 /nfs/dbraw/zinc/06/74/20/1052067420.db2.gz BLCRPSFBFJDSNQ-BJJXKVORSA-N 1 0 311.853 4.208 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)c1O ZINC000769498005 1052067650 /nfs/dbraw/zinc/06/76/50/1052067650.db2.gz JDKSNKBXEKJCHJ-MAUKXSAKSA-N 1 0 311.425 4.169 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H]2C)c1O ZINC000769498007 1052068524 /nfs/dbraw/zinc/06/85/24/1052068524.db2.gz JDKSNKBXEKJCHJ-YJBOKZPZSA-N 1 0 311.425 4.169 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c1O ZINC000808706331 1052068844 /nfs/dbraw/zinc/06/88/44/1052068844.db2.gz HDILQTDRKRCGSG-ZFWWWQNUSA-N 1 0 323.864 4.496 20 10 DICDRO Cc1cccc([C@@H](O)C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808706202 1052069440 /nfs/dbraw/zinc/06/94/40/1052069440.db2.gz FDWQZQXLCXMFGV-DYVFJYSZSA-N 1 0 319.832 4.047 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC[C@H]2CCCCO2)c1O ZINC000808713543 1052073022 /nfs/dbraw/zinc/07/30/22/1052073022.db2.gz ITWOSLXLVCZPBV-UKRRQHHQSA-N 1 0 311.853 4.354 20 10 DICDRO CC[N@H+](Cc1ccc(C)o1)Cc1cc(Br)ccc1O ZINC000769539936 1052077880 /nfs/dbraw/zinc/07/78/80/1052077880.db2.gz NEQNDSBYSDHCON-UHFFFAOYSA-N 1 0 324.218 4.078 20 10 DICDRO C[C@H]([NH2+]C[C@H]1COc2ccccc21)c1ccc2ccccc2c1O ZINC000808727592 1052083288 /nfs/dbraw/zinc/08/32/88/1052083288.db2.gz JNMPTMSESXJKHF-HOCLYGCPSA-N 1 0 319.404 4.372 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1COc2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000808728395 1052083673 /nfs/dbraw/zinc/08/36/73/1052083673.db2.gz QXAUMYNJZIZRGV-WMLDXEAASA-N 1 0 323.436 4.098 20 10 DICDRO CN(C)c1cccc(C[N@H+](C)Cc2c(O)ccc3ccccc32)c1 ZINC000769854625 1052111882 /nfs/dbraw/zinc/11/18/82/1052111882.db2.gz UJYJFTOJUYZOTJ-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO [NH3+]C1(c2nnc(-c3ccc(-n4cccc4)cc3)o2)CCCCCC1 ZINC001217694963 1052117725 /nfs/dbraw/zinc/11/77/25/1052117725.db2.gz GVRLTUGRKDXTRM-UHFFFAOYSA-N 1 0 322.412 4.036 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](C)c2ccc(F)cc2Cl)c1 ZINC000130314546 1052131019 /nfs/dbraw/zinc/13/10/19/1052131019.db2.gz JVMVUOHZKGCWHK-LLVKDONJSA-N 1 0 323.795 4.434 20 10 DICDRO CC(C)([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(Cl)c1F ZINC000769937598 1052133882 /nfs/dbraw/zinc/13/38/82/1052133882.db2.gz PBFNPLUJNUCEES-UHFFFAOYSA-N 1 0 319.807 4.439 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1CCC[NH2+]CC1 ZINC001217996011 1052182993 /nfs/dbraw/zinc/18/29/93/1052182993.db2.gz UKWCZTFHECHOOD-PXKHIBQASA-N 1 0 311.385 4.329 20 10 DICDRO c1ccc(/N=N/c2c(O[C@@H]3CC[NH2+]C3)ccc3ccccc32)nc1 ZINC001218038079 1052187962 /nfs/dbraw/zinc/18/79/62/1052187962.db2.gz DODKJGGKLMZAKW-MTLKIYMJSA-N 1 0 318.380 4.391 20 10 DICDRO Cc1ccc(O[C@H]2CC[NH2+]C[C@@H]2F)c(/N=N/c2ccccc2)c1 ZINC001218072583 1052192962 /nfs/dbraw/zinc/19/29/62/1052192962.db2.gz SEPXFTGFAHZIQB-SSIVSPEBSA-N 1 0 313.376 4.489 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@H]3CCOC4(C[NH2+]C4)C3)cc2)cc1 ZINC001218087307 1052195179 /nfs/dbraw/zinc/19/51/79/1052195179.db2.gz AVOVJMOUDIAJFH-VEGAHXMMSA-N 1 0 323.396 4.002 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CC[C@@]34CC[NH2+]C4)cc2)C=C1 ZINC001218113982 1052198751 /nfs/dbraw/zinc/19/87/51/1052198751.db2.gz APZXDSNIWDFQKW-MOPGFXCFSA-N 1 0 323.396 4.329 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@H]3CC[C@@H]4[NH2+]CCO[C@H]43)cc2)cc1 ZINC001218149690 1052202431 /nfs/dbraw/zinc/20/24/31/1052202431.db2.gz ONQNLSBQXLTKGK-KKVDKANRSA-N 1 0 323.396 4.000 20 10 DICDRO Cc1ccc(O[C@@H]2C[C@H]3C[NH2+]C[C@@H]32)c(/N=N/c2ccccc2)c1 ZINC001218329830 1052226123 /nfs/dbraw/zinc/22/61/23/1052226123.db2.gz GUVSPKFBELMPNM-MPIAMIRDSA-N 1 0 307.397 4.397 20 10 DICDRO CN(C)c1ccc(/N=N/c2ccc(O[C@H]3C=CC[NH2+]C3)cc2)cc1 ZINC001218332515 1052227290 /nfs/dbraw/zinc/22/72/90/1052227290.db2.gz CSURTEKTYXQUQH-XJUMHSELSA-N 1 0 322.412 4.075 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@@H]3CC[C@@H]4C[NH2+]C[C@H]34)cc2)cc1 ZINC001218459928 1052241252 /nfs/dbraw/zinc/24/12/52/1052241252.db2.gz IXZMRLQVUXCXSA-CTYXQYFRSA-N 1 0 307.397 4.479 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@@H]3CC[C@H]4C[NH2+]C[C@H]43)cc2)cc1 ZINC001218459932 1052241939 /nfs/dbraw/zinc/24/19/39/1052241939.db2.gz IXZMRLQVUXCXSA-PSGYSBPMSA-N 1 0 307.397 4.479 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CC[C@@H]4C[NH2+]C[C@H]34)cc2)C=C1 ZINC001218468539 1052242599 /nfs/dbraw/zinc/24/25/99/1052242599.db2.gz SEFSQMQBLZPWNZ-ZNZDAUKMSA-N 1 0 323.396 4.184 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1Cc2ccccc2O1)c1ccc2ccccc2c1O ZINC000324389266 1052308129 /nfs/dbraw/zinc/30/81/29/1052308129.db2.gz PPKXUAOBSOMOTK-YOEHRIQHSA-N 1 0 319.404 4.200 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(OC)cc1 ZINC000324389803 1052308443 /nfs/dbraw/zinc/30/84/43/1052308443.db2.gz YPNAESCHXHNHJD-FQEVSTJZSA-N 1 0 324.468 4.319 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2ccccc2Cl)c1 ZINC000315376568 1052336769 /nfs/dbraw/zinc/33/67/69/1052336769.db2.gz FYCCKABTLDTARV-QWHCGFSZSA-N 1 0 319.832 4.336 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cc(F)ccc1F ZINC000315409081 1052337855 /nfs/dbraw/zinc/33/78/55/1052337855.db2.gz IQJQZKFNJFXFKP-QWHCGFSZSA-N 1 0 304.384 4.443 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)[C@H]2CCCC[C@H]12 ZINC000915208803 1052367847 /nfs/dbraw/zinc/36/78/47/1052367847.db2.gz IDXAPMWWNPWXTC-OGWOLHLISA-N 1 0 310.441 4.341 20 10 DICDRO CC(C)(C)OC1CC(CC[NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000762460339 1052386942 /nfs/dbraw/zinc/38/69/42/1052386942.db2.gz JFRLOSQDVWXDAD-UHFFFAOYSA-N 1 0 311.853 4.119 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCC2CC(OC(C)(C)C)C2)c1 ZINC000762640479 1052410343 /nfs/dbraw/zinc/41/03/43/1052410343.db2.gz FIPGZYYZKSAOJS-HLIUYOAVSA-N 1 0 321.461 4.035 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2cccc(OC(C)C)c2)c1 ZINC000237205809 1052437202 /nfs/dbraw/zinc/43/72/02/1052437202.db2.gz FDJUSILFCGQHMY-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)cc1 ZINC000324511058 1052552070 /nfs/dbraw/zinc/55/20/70/1052552070.db2.gz MUQVEZZDUODSMI-MRXNPFEDSA-N 1 0 324.468 4.319 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2nc3ccccc3o2)C2CC2)cc1 ZINC000917074013 1052690990 /nfs/dbraw/zinc/69/09/90/1052690990.db2.gz MWKJDWBHJSIWIO-UHFFFAOYSA-N 1 0 321.424 4.058 20 10 DICDRO Fc1ccc(SCCC[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000917392630 1052724024 /nfs/dbraw/zinc/72/40/24/1052724024.db2.gz GFVLZDJRLIZQBV-UHFFFAOYSA-N 1 0 317.429 4.033 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(OC(C)(C)C)cc2)cc1C ZINC000920415447 1052938619 /nfs/dbraw/zinc/93/86/19/1052938619.db2.gz WBPFLJPYTSWGKP-UHFFFAOYSA-N 1 0 313.441 4.471 20 10 DICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]CCSC)cc1 ZINC000920957023 1052956860 /nfs/dbraw/zinc/95/68/60/1052956860.db2.gz TXXUJYFTMLCWMK-UHFFFAOYSA-N 1 0 314.498 4.166 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3ccccc3n2)cc1 ZINC000921066322 1052960783 /nfs/dbraw/zinc/96/07/83/1052960783.db2.gz JFBJJWBGEYLQHD-UHFFFAOYSA-N 1 0 319.452 4.371 20 10 DICDRO C[C@H](c1ccccc1)N(Cc1ccon1)Cc1ccccc1O ZINC000179647197 1053020446 /nfs/dbraw/zinc/02/04/46/1053020446.db2.gz ZQABWUKEWLFKQM-OAHLLOKOSA-N 1 0 308.381 4.144 20 10 DICDRO COCCCC[N@H+](Cc1ccccc1)Cc1cccc(C)c1O ZINC000179860740 1053032424 /nfs/dbraw/zinc/03/24/24/1053032424.db2.gz CPJGMSJQEWJBLX-UHFFFAOYSA-N 1 0 313.441 4.129 20 10 DICDRO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2cccc(C)c2O)s1 ZINC000180406709 1053055659 /nfs/dbraw/zinc/05/56/59/1053055659.db2.gz ZITPJADUKRLUOS-CYBMUJFWSA-N 1 0 304.459 4.221 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1C[NH+]2CCC1CC2 ZINC001228418004 1053097951 /nfs/dbraw/zinc/09/79/51/1053097951.db2.gz CSVQDQGNHYFQHQ-GEXZYOHASA-N 1 0 323.396 4.281 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1c(F)cc(F)cc1F ZINC001350944249 1053121214 /nfs/dbraw/zinc/12/12/14/1053121214.db2.gz OJWQXGLVYHFYDS-BMIGLBTASA-N 1 0 321.342 4.456 20 10 DICDRO Oc1ccccc1C[N@H+](C/C(Cl)=C\Cl)C1CCCC1 ZINC000763541383 1053140412 /nfs/dbraw/zinc/14/04/12/1053140412.db2.gz FLFPEPFVXCZVON-UKTHLTGXSA-N 1 0 300.229 4.456 20 10 DICDRO Cc1ccc([C@@H](C)C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001318691360 1053183399 /nfs/dbraw/zinc/18/33/99/1053183399.db2.gz DEVBKYQUBKFEBF-SFHVURJKSA-N 1 0 308.469 4.489 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001319690784 1053263733 /nfs/dbraw/zinc/26/37/33/1053263733.db2.gz GXZHMRYGQJKXIH-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1cccc2cc(C[NH2+][C@@H](C)c3cc(F)ccc3O)oc21 ZINC001320118116 1053305913 /nfs/dbraw/zinc/30/59/13/1053305913.db2.gz DRDKXPOPGJLVEH-NSHDSACASA-N 1 0 315.344 4.137 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001320118650 1053307248 /nfs/dbraw/zinc/30/72/48/1053307248.db2.gz OKNCNEQCNWQCQQ-RDJZCZTQSA-N 1 0 324.468 4.495 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2coc(-c3ccccc3)n2)c1 ZINC001320125007 1053307515 /nfs/dbraw/zinc/30/75/15/1053307515.db2.gz PHQSOWBLXNQUFA-OAHLLOKOSA-N 1 0 322.408 4.249 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCCOC1CCCC1 ZINC001320119257 1053307789 /nfs/dbraw/zinc/30/77/89/1053307789.db2.gz YVLIRBYZDYNQGO-GOEBONIOSA-N 1 0 303.446 4.188 20 10 DICDRO COc1cccc2cc(C[NH2+][C@@H](C)c3cc(C)ccc3O)oc21 ZINC001320248464 1053317586 /nfs/dbraw/zinc/31/75/86/1053317586.db2.gz VONOWGRIIVTTAZ-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc([C@@H](C)O)cc1 ZINC001320248628 1053318541 /nfs/dbraw/zinc/31/85/41/1053318541.db2.gz XCAWUZCLHZGTPU-CKEIUWERSA-N 1 0 311.425 4.092 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc([C@H](C)O)cc1 ZINC001320249284 1053318647 /nfs/dbraw/zinc/31/86/47/1053318647.db2.gz XCAWUZCLHZGTPU-JKIFEVAISA-N 1 0 311.425 4.092 20 10 DICDRO CN1CC(Oc2ccc3ccccc3c2/N=N/c2ccccn2)C1 ZINC001229449321 1053323243 /nfs/dbraw/zinc/32/32/43/1053323243.db2.gz BYGAWAAJOULLFG-QURGRASLSA-N 1 0 318.380 4.343 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CC1(CCO)CCCCC1 ZINC001320410430 1053331257 /nfs/dbraw/zinc/33/12/57/1053331257.db2.gz BFGMZKPBEUXLGT-JKSUJKDBSA-N 1 0 317.473 4.171 20 10 DICDRO Fc1cccc([C@H]2CC[N@@H+]2Cc2ccc(N3CCCC3)cc2)c1 ZINC001320508573 1053340134 /nfs/dbraw/zinc/34/01/34/1053340134.db2.gz BLJIMFOCDCVFRG-HXUWFJFHSA-N 1 0 310.416 4.373 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c1O ZINC000775642100 1053353639 /nfs/dbraw/zinc/35/36/39/1053353639.db2.gz GAYHSEAGWWGOPI-NSHDSACASA-N 1 0 307.743 4.128 20 10 DICDRO COc1ccc(C2([NH2+]C/C=C\c3ccc(N(C)C)cc3)CC2)cc1 ZINC001200088045 1053370810 /nfs/dbraw/zinc/37/08/10/1053370810.db2.gz IDRLEIJVOXAZEN-PLNGDYQASA-N 1 0 322.452 4.053 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(N(C)C)cc1)c1ccc(C)cc1O ZINC001321075493 1053389094 /nfs/dbraw/zinc/38/90/94/1053389094.db2.gz XSVKOBDASMJVSZ-LJQANCHMSA-N 1 0 312.457 4.050 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CCCC12CCOCC2 ZINC001321239369 1053403535 /nfs/dbraw/zinc/40/35/35/1053403535.db2.gz KHLKITNNYRELKF-BFYDXBDKSA-N 1 0 315.457 4.188 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](OC)c1ccc(F)cc1)c1ccc(C)cc1O ZINC001321235815 1053403589 /nfs/dbraw/zinc/40/35/89/1053403589.db2.gz NDARSJIOHOETHS-IEBWSBKVSA-N 1 0 317.404 4.268 20 10 DICDRO CC[C@H]([NH2+]C[C@H](OC)c1ccc(F)cc1)c1ccc(C)cc1O ZINC001321235814 1053403723 /nfs/dbraw/zinc/40/37/23/1053403723.db2.gz NDARSJIOHOETHS-HKUYNNGSSA-N 1 0 317.404 4.268 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc2c(n1)CCCC2 ZINC001321280801 1053405012 /nfs/dbraw/zinc/40/50/12/1053405012.db2.gz BWYKIFYTUXIXBX-KBXCAEBGSA-N 1 0 322.452 4.313 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc2c(n1)CCCC2 ZINC001321280803 1053405479 /nfs/dbraw/zinc/40/54/79/1053405479.db2.gz BWYKIFYTUXIXBX-KSSFIOAISA-N 1 0 322.452 4.313 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCc2cn(C(C)C)nc21)c1ccccc1O ZINC001321387765 1053411193 /nfs/dbraw/zinc/41/11/93/1053411193.db2.gz WIFIMQUJVKACJJ-IAGOWNOFSA-N 1 0 313.445 4.288 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCC1C[C@@H](C)O[C@H](C)C1 ZINC001321457407 1053414489 /nfs/dbraw/zinc/41/44/89/1053414489.db2.gz OQLVEEUUBPWTSO-ANQUJSFKSA-N 1 0 317.473 4.432 20 10 DICDRO Cc1ccccc1OCCC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001200323658 1053557561 /nfs/dbraw/zinc/55/75/61/1053557561.db2.gz SHOPLVBMVCDCND-RMKNXTFCSA-N 1 0 324.468 4.133 20 10 DICDRO CS[C@H]1CC[C@H]([N@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC001323271108 1053570983 /nfs/dbraw/zinc/57/09/83/1053570983.db2.gz YLBCAILTEBGVMY-GJZGRUSLSA-N 1 0 323.502 4.111 20 10 DICDRO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001323318097 1053572453 /nfs/dbraw/zinc/57/24/53/1053572453.db2.gz FPYQVIOAAFVBSB-NRFANRHFSA-N 1 0 323.484 4.353 20 10 DICDRO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001323318098 1053576122 /nfs/dbraw/zinc/57/61/22/1053576122.db2.gz FPYQVIOAAFVBSB-OAQYLSRUSA-N 1 0 323.484 4.353 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H]3CCCC[C@]32c2ccccc2)c1O ZINC001323331056 1053576289 /nfs/dbraw/zinc/57/62/89/1053576289.db2.gz NOFOLGIKWWUIDW-NQIIRXRSSA-N 1 0 323.436 4.302 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@H](C)CCc1ccccc1 ZINC001200378901 1053609882 /nfs/dbraw/zinc/60/98/82/1053609882.db2.gz RJRWAACNNDTSIY-QGZVFWFLSA-N 1 0 310.485 4.420 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1ccccc1O ZINC000183504068 1053665180 /nfs/dbraw/zinc/66/51/80/1053665180.db2.gz LBILRPHKXSWKIR-KRWDZBQOSA-N 1 0 324.468 4.479 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Oc2ccccc2)nc1)c1ccccc1O ZINC000183475178 1053665541 /nfs/dbraw/zinc/66/55/41/1053665541.db2.gz BIYNWUMMLDSCKS-OAHLLOKOSA-N 1 0 320.392 4.430 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H](Cc2ccccc2)C2CC2)cc1 ZINC001200473126 1053687691 /nfs/dbraw/zinc/68/76/91/1053687691.db2.gz ZYOPBTVZTQESMA-NOUOYNBVSA-N 1 0 320.480 4.377 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCCNc1ccccc1 ZINC001325339925 1053714555 /nfs/dbraw/zinc/71/45/55/1053714555.db2.gz LZBXWMMVDCRLBE-WBVHZDCISA-N 1 0 310.441 4.341 20 10 DICDRO CC1(CC(F)(F)F)C[NH+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001325501163 1053721220 /nfs/dbraw/zinc/72/12/20/1053721220.db2.gz CERCYUVJTDIUQK-UHFFFAOYSA-N 1 0 312.379 4.061 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC(C)(C)c1cccnc1 ZINC001325582624 1053722179 /nfs/dbraw/zinc/72/21/79/1053722179.db2.gz RNHIMZXYSNKGAD-GDBMZVCRSA-N 1 0 310.441 4.211 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC001326035482 1053745848 /nfs/dbraw/zinc/74/58/48/1053745848.db2.gz JQULCIXUHXUSBD-BVGQSLNGSA-N 1 0 322.452 4.498 20 10 DICDRO CC[C@@H]1CC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001231469882 1053756974 /nfs/dbraw/zinc/75/69/74/1053756974.db2.gz VXCBZTHXUVCPSQ-MRXNPFEDSA-N 1 0 311.425 4.203 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@H+](CC1CC1)C1CC1 ZINC001231468696 1053759034 /nfs/dbraw/zinc/75/90/34/1053759034.db2.gz GJNOMYIBJVJHEM-UHFFFAOYSA-N 1 0 323.436 4.346 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CC2 ZINC001326426074 1053781618 /nfs/dbraw/zinc/78/16/18/1053781618.db2.gz FMKFHZSCJWTGTR-NRFANRHFSA-N 1 0 306.453 4.372 20 10 DICDRO O=C1CCC2(CC1)CC[NH+](Cc1c(O)ccc3ccccc31)CC2 ZINC001231590959 1053790994 /nfs/dbraw/zinc/79/09/94/1053790994.db2.gz RSZCPERXTRBMTO-UHFFFAOYSA-N 1 0 323.436 4.271 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)c1O ZINC001231593824 1053791035 /nfs/dbraw/zinc/79/10/35/1053791035.db2.gz VHFUMHGZACEMRE-UHFFFAOYSA-N 1 0 318.420 4.298 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1c(O)ccc2ccccc21 ZINC001231590475 1053791195 /nfs/dbraw/zinc/79/11/95/1053791195.db2.gz CXDDAZBFHAMBSO-UHFFFAOYSA-N 1 0 307.393 4.273 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c1O ZINC001231592226 1053791447 /nfs/dbraw/zinc/79/14/47/1053791447.db2.gz GJKGGDIRETVTRB-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(C)c2O)cc1 ZINC001231592074 1053792499 /nfs/dbraw/zinc/79/24/99/1053792499.db2.gz GABYSPUNODZJKC-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO Cc1cccc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)c1O ZINC001231594674 1053793306 /nfs/dbraw/zinc/79/33/06/1053793306.db2.gz NAKQTIXRTADAFM-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO C[C@H]1C(=O)CC[N@H+](Cc2c(O)ccc3ccccc32)C12CCCC2 ZINC001231590045 1053793409 /nfs/dbraw/zinc/79/34/09/1053793409.db2.gz ZPZWNDAIGFDBEL-HNNXBMFYSA-N 1 0 323.436 4.269 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCCc1ncccc1C ZINC001326622964 1053796382 /nfs/dbraw/zinc/79/63/82/1053796382.db2.gz NORDZYGPCNQYCA-RDJZCZTQSA-N 1 0 310.441 4.175 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2cccc(Cl)c2F)c1O ZINC001326801649 1053805114 /nfs/dbraw/zinc/80/51/14/1053805114.db2.gz ZOBDVJNZDKOBNT-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO Cc1cc(C)c(C[N@@H+]2CCc3ccc(Cl)cc3C2)c(O)c1 ZINC001231841893 1053888196 /nfs/dbraw/zinc/88/81/96/1053888196.db2.gz FYRDBVZCNXRBLU-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1cc(C)c(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c(O)c1 ZINC001231845999 1053890781 /nfs/dbraw/zinc/89/07/81/1053890781.db2.gz XCSSCZVNYDWHCV-UHFFFAOYSA-N 1 0 324.468 4.241 20 10 DICDRO c1csc(SCCC[NH2+]C2CCc3ccccc3CC2)n1 ZINC001200692056 1053897969 /nfs/dbraw/zinc/89/79/69/1053897969.db2.gz OAIOZFICDSEWSD-UHFFFAOYSA-N 1 0 318.511 4.163 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CCOC3(C)C)CC2)cc1Cl ZINC001231871714 1053898566 /nfs/dbraw/zinc/89/85/66/1053898566.db2.gz PSHJOYQBOONNHD-UHFFFAOYSA-N 1 0 323.864 4.135 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)cc1Cl ZINC001231870425 1053899815 /nfs/dbraw/zinc/89/98/15/1053899815.db2.gz ZTRXCLZTIUQJRV-OKILXGFUSA-N 1 0 313.828 4.441 20 10 DICDRO Oc1c(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)ccc2ccccc21 ZINC001231879653 1053901513 /nfs/dbraw/zinc/90/15/13/1053901513.db2.gz MJQPBTMMFATSGX-OAHLLOKOSA-N 1 0 309.331 4.115 20 10 DICDRO COc1ccc2c(c1)CC[N@@H+](Cc1ccc3ccccc3c1O)C2 ZINC001231879481 1053903375 /nfs/dbraw/zinc/90/33/75/1053903375.db2.gz DTTGXWZGVOATHJ-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2c(F)cc(F)cc2Cl)cc1 ZINC001232104046 1053965084 /nfs/dbraw/zinc/96/50/84/1053965084.db2.gz LVYGEHAAOUZFHW-UHFFFAOYSA-N 1 0 324.802 4.316 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(Br)ccc1O)c1ccccc1 ZINC000076275390 1053974826 /nfs/dbraw/zinc/97/48/26/1053974826.db2.gz ITNLDNIOCOBSLH-LLVKDONJSA-N 1 0 306.203 4.006 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1CCC12CCOCC2 ZINC001329374674 1053987622 /nfs/dbraw/zinc/98/76/22/1053987622.db2.gz DIUWLSBBFPIGCX-BZUAXINKSA-N 1 0 315.457 4.045 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1CCC12CCOCC2 ZINC001329374676 1053987876 /nfs/dbraw/zinc/98/78/76/1053987876.db2.gz DIUWLSBBFPIGCX-OWCLPIDISA-N 1 0 315.457 4.045 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccnc3c(F)cccc23)cc1 ZINC001232213028 1053994151 /nfs/dbraw/zinc/99/41/51/1053994151.db2.gz CKGMYXBNXYNICI-UHFFFAOYSA-N 1 0 323.415 4.072 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cncc(C)c2)cc1F ZINC000184351450 1053997935 /nfs/dbraw/zinc/99/79/35/1053997935.db2.gz LTJCPSLXNJMOJP-HNNXBMFYSA-N 1 0 315.436 4.226 20 10 DICDRO CC[C@H](C[NH2+]Cc1ccc(OC)c(C)c1)Oc1ccccc1C ZINC001200813843 1053999414 /nfs/dbraw/zinc/99/94/14/1053999414.db2.gz ZLJUIMRYIXTADW-GOSISDBHSA-N 1 0 313.441 4.259 20 10 DICDRO C[N@H+](Cc1cc(Cl)c(O)cc1O)C(C)(C)Cc1ccccc1 ZINC001232263101 1054006487 /nfs/dbraw/zinc/00/64/87/1054006487.db2.gz GWTHAQKQBXGPMO-UHFFFAOYSA-N 1 0 319.832 4.204 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2cc(Cl)c(OC)cc2O)cc1 ZINC001232268665 1054009208 /nfs/dbraw/zinc/00/92/08/1054009208.db2.gz QGTSFDAKUBJRBX-UHFFFAOYSA-N 1 0 319.832 4.249 20 10 DICDRO c1c2ccccc2[nH]c1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001330532110 1054038169 /nfs/dbraw/zinc/03/81/69/1054038169.db2.gz CWYALGWCBJGGPZ-UHFFFAOYSA-N 1 0 305.425 4.058 20 10 DICDRO C[N@H+](Cc1cc2ccc(Cl)cc2[nH]1)Cc1ccccc1O ZINC001232735113 1054110825 /nfs/dbraw/zinc/11/08/25/1054110825.db2.gz PPUMHISETQGKQS-UHFFFAOYSA-N 1 0 300.789 4.159 20 10 DICDRO FC(F)c1cccc(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001332314802 1054112737 /nfs/dbraw/zinc/11/27/37/1054112737.db2.gz MCLQQSVFVWERER-UHFFFAOYSA-N 1 0 303.352 4.239 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](c1ccccn1)C1CC1 ZINC001332455122 1054119820 /nfs/dbraw/zinc/11/98/20/1054119820.db2.gz GUUZCAOBMNQOAU-OWDMVUQNSA-N 1 0 308.425 4.385 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)c(O)c1 ZINC001232840163 1054126645 /nfs/dbraw/zinc/12/66/45/1054126645.db2.gz NNWJEFXXIGVKMY-SFHVURJKSA-N 1 0 324.468 4.228 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc3ccccc3c2)c(O)c1 ZINC001232840716 1054127875 /nfs/dbraw/zinc/12/78/75/1054127875.db2.gz IAIJRHLSMXSZNL-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2ccccc2)C2CCC2)c(O)c1 ZINC001232841703 1054131130 /nfs/dbraw/zinc/13/11/30/1054131130.db2.gz OYUNGYJOODOXQO-UHFFFAOYSA-N 1 0 310.441 4.013 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+][C@H]1CCCc2cccnc21 ZINC001332912657 1054131411 /nfs/dbraw/zinc/13/14/11/1054131411.db2.gz JWSMHBLCYRXXJE-BPUTZDHNSA-N 1 0 308.425 4.311 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000848560291 1054148956 /nfs/dbraw/zinc/14/89/56/1054148956.db2.gz KONGBWVZNDUGHQ-SWLSCSKDSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C2CC2)[C@@H]2CCCCO2)c(O)c1C ZINC000848560123 1054149478 /nfs/dbraw/zinc/14/94/78/1054149478.db2.gz YUZINMPOPJDXQI-WBAXXEDZSA-N 1 0 303.446 4.007 20 10 DICDRO CC[C@H]([NH2+][C@H](C1CC1)[C@H]1CCCCO1)c1ccc(C)cc1O ZINC000848557536 1054149779 /nfs/dbraw/zinc/14/97/79/1054149779.db2.gz FOGIAGDJKWMOOI-QXAKKESOSA-N 1 0 303.446 4.089 20 10 DICDRO COc1c(C)cccc1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000848564209 1054151539 /nfs/dbraw/zinc/15/15/39/1054151539.db2.gz JLWFGMJYKLNDNB-UHFFFAOYSA-N 1 0 324.468 4.284 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2noc3ccccc32)c2c1c(F)ccc2O ZINC000848574207 1054156821 /nfs/dbraw/zinc/15/68/21/1054156821.db2.gz BYNHTOZWUOVBHZ-GXFFZTMASA-N 1 0 312.344 4.011 20 10 DICDRO CCN(Cc1ccccc1O)Cc1c(F)cc(Cl)cc1OC ZINC001233003918 1054168396 /nfs/dbraw/zinc/16/83/96/1054168396.db2.gz ZDQLXJLVLLCDHK-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO Cc1cc(Br)cc(C[NH+]2CC3(C2)CCCCC3)c1O ZINC001233110141 1054187748 /nfs/dbraw/zinc/18/77/48/1054187748.db2.gz VVWDRMOGJMWXOA-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)cc1 ZINC000184836445 1054202448 /nfs/dbraw/zinc/20/24/48/1054202448.db2.gz NBCJPCZDKZQSIU-AWEZNQCLSA-N 1 0 311.425 4.130 20 10 DICDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(C(C)(C)C)ccc2O)no1 ZINC001233284449 1054221417 /nfs/dbraw/zinc/22/14/17/1054221417.db2.gz VENIQXQQTYVUEG-KRWDZBQOSA-N 1 0 314.429 4.323 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c1 ZINC001233285916 1054221553 /nfs/dbraw/zinc/22/15/53/1054221553.db2.gz XNTWTEPSUXGPOH-AWEZNQCLSA-N 1 0 315.379 4.464 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1 ZINC001233284406 1054221914 /nfs/dbraw/zinc/22/19/14/1054221914.db2.gz TVNYXNQCFSABAM-GOSISDBHSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC001233286077 1054222993 /nfs/dbraw/zinc/22/29/93/1054222993.db2.gz DMUOGWIRNMGOOO-GOSISDBHSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](c3cccnc3)C2)c1 ZINC001233286323 1054223410 /nfs/dbraw/zinc/22/34/10/1054223410.db2.gz OQNABIQMLDNOFE-MRXNPFEDSA-N 1 0 310.441 4.074 20 10 DICDRO COc1cc(Cl)cc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1O ZINC001233287588 1054224072 /nfs/dbraw/zinc/22/40/72/1054224072.db2.gz YIUPQBXWFWBTTH-LBPRGKRZSA-N 1 0 317.816 4.174 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)Cc2ccc(C)c(C)c2)c1O ZINC001233290828 1054225806 /nfs/dbraw/zinc/22/58/06/1054225806.db2.gz YMYRFZFESRXTNS-UHFFFAOYSA-N 1 0 319.832 4.303 20 10 DICDRO [O-]c1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001233334371 1054233670 /nfs/dbraw/zinc/23/36/70/1054233670.db2.gz DARLDDBOJNPKBH-CQSZACIVSA-N 1 0 303.352 4.050 20 10 DICDRO Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1ccc(N)cc1 ZINC001356083711 1054273970 /nfs/dbraw/zinc/27/39/70/1054273970.db2.gz YQVKVFMVINEDKH-ZDUSSCGKSA-N 1 0 303.475 4.350 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC001233452212 1054275827 /nfs/dbraw/zinc/27/58/27/1054275827.db2.gz OBUZLKGIHVEJLC-HNNXBMFYSA-N 1 0 322.330 4.143 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC001233454002 1054277665 /nfs/dbraw/zinc/27/76/65/1054277665.db2.gz CFTKJRRQQIHXLI-HNNXBMFYSA-N 1 0 322.330 4.143 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCc2ccsc2C1 ZINC001233454154 1054278450 /nfs/dbraw/zinc/27/84/50/1054278450.db2.gz IKXAPXYRGCFBKF-UHFFFAOYSA-N 1 0 313.344 4.031 20 10 DICDRO Cc1ccsc1CC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001337800339 1054286517 /nfs/dbraw/zinc/28/65/17/1054286517.db2.gz MWEGLDSIIPVUOL-ZIAGYGMSSA-N 1 0 301.455 4.451 20 10 DICDRO COC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)c1ccccc1 ZINC001337801569 1054287320 /nfs/dbraw/zinc/28/73/20/1054287320.db2.gz UQZSMXKFGOENCT-OIISXLGYSA-N 1 0 311.425 4.226 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](COCC(C)C)c2ccco2)c1O ZINC000848895393 1054287938 /nfs/dbraw/zinc/28/79/38/1054287938.db2.gz SPEMJPQMXHWJHJ-KRWDZBQOSA-N 1 0 317.429 4.051 20 10 DICDRO CCc1cccc(C[NH2+][C@@](C)(CC)c2nc(C)cs2)c1O ZINC000848897486 1054287979 /nfs/dbraw/zinc/28/79/79/1054287979.db2.gz PYTJNLJDPHKRAO-KRWDZBQOSA-N 1 0 304.459 4.135 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccccc2C(F)(F)F)c1O ZINC000848896080 1054288551 /nfs/dbraw/zinc/28/85/51/1054288551.db2.gz ZRUYSONBQYUIGY-UHFFFAOYSA-N 1 0 309.331 4.263 20 10 DICDRO CCc1cccc(C[NH2+][C@H](COCC(C)C)c2ccco2)c1O ZINC000848895394 1054288594 /nfs/dbraw/zinc/28/85/94/1054288594.db2.gz SPEMJPQMXHWJHJ-QGZVFWFLSA-N 1 0 317.429 4.051 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccc(C)cc2SC)c1O ZINC000848899295 1054290300 /nfs/dbraw/zinc/29/03/00/1054290300.db2.gz MZOSCXMLCHZVCG-UHFFFAOYSA-N 1 0 301.455 4.275 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(COC)o2)c1O ZINC000848902911 1054291108 /nfs/dbraw/zinc/29/11/08/1054291108.db2.gz JSQHKPJVISBVNN-KRWDZBQOSA-N 1 0 315.413 4.031 20 10 DICDRO CCc1cccc(C[NH2+]Cc2c(F)cccc2SC)c1O ZINC000848910016 1054295293 /nfs/dbraw/zinc/29/52/93/1054295293.db2.gz FWXYPDKSDOTQPK-UHFFFAOYSA-N 1 0 305.418 4.105 20 10 DICDRO Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cc1 ZINC000185098948 1054365448 /nfs/dbraw/zinc/36/54/48/1054365448.db2.gz JIUBVHDXXLGHSI-MGPUTAFESA-N 1 0 321.420 4.238 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CC1(c2ccccn2)CCC1 ZINC001340993257 1054373834 /nfs/dbraw/zinc/37/38/34/1054373834.db2.gz ZDQFNQAEPZDOAX-HOTGVXAUSA-N 1 0 322.452 4.355 20 10 DICDRO Cc1cccc(NC(=[NH2+])NCc2cc(Cl)cc(Cl)c2[O-])c1 ZINC000849078310 1054376970 /nfs/dbraw/zinc/37/69/70/1054376970.db2.gz YSSWXYXBLXOJQY-UHFFFAOYSA-N 1 0 324.211 4.144 20 10 DICDRO C[C@@H](O)c1ccc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)cc1 ZINC000185119952 1054379494 /nfs/dbraw/zinc/37/94/94/1054379494.db2.gz KZSUPTOAARDZII-HUUCEWRRSA-N 1 0 321.420 4.450 20 10 DICDRO C[C@@H](O)c1ccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cc1 ZINC000185119911 1054380268 /nfs/dbraw/zinc/38/02/68/1054380268.db2.gz KZSUPTOAARDZII-LSDHHAIUSA-N 1 0 321.420 4.450 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2coc(-c3cccs3)n2)c1 ZINC000185145579 1054412037 /nfs/dbraw/zinc/41/20/37/1054412037.db2.gz SPXQYTBUTKWNKE-LBPRGKRZSA-N 1 0 314.410 4.268 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCc2c1cccc2O ZINC001342391530 1054420726 /nfs/dbraw/zinc/42/07/26/1054420726.db2.gz ZWRMCWLVVRMEHC-KCXAZCMYSA-N 1 0 309.409 4.232 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1[C@@H]2CCCO[C@H]2C1(C)C ZINC001342406518 1054420885 /nfs/dbraw/zinc/42/08/85/1054420885.db2.gz LUMRZCBMYLFXOP-MEYPQBBUSA-N 1 0 315.457 4.042 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(Cl)s2)c1 ZINC000185178290 1054441035 /nfs/dbraw/zinc/44/10/35/1054441035.db2.gz KVAZMOXCVVACAY-SNVBAGLBSA-N 1 0 311.834 4.009 20 10 DICDRO C[C@@H]([NH2+]CCCCOCc1ccccc1)c1cc(F)ccc1O ZINC000185247221 1054488101 /nfs/dbraw/zinc/48/81/01/1054488101.db2.gz MESHKMOMROUCEG-OAHLLOKOSA-N 1 0 317.404 4.179 20 10 DICDRO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000185323837 1054524420 /nfs/dbraw/zinc/52/44/20/1054524420.db2.gz ZKZPBADMWKDZJA-QWHCGFSZSA-N 1 0 316.470 4.448 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C#N)cc1F)c1cc2c(cc1O)CCCC2 ZINC000185378024 1054532569 /nfs/dbraw/zinc/53/25/69/1054532569.db2.gz KDWAXPOANXGPFP-CYBMUJFWSA-N 1 0 324.399 4.133 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C#N)cc1F)c1cc2c(cc1O)CCCC2 ZINC000185378007 1054532672 /nfs/dbraw/zinc/53/26/72/1054532672.db2.gz KDWAXPOANXGPFP-ZDUSSCGKSA-N 1 0 324.399 4.133 20 10 DICDRO C[C@H]([NH2+]CCc1nc(C(C)(C)C)cs1)c1cc(F)ccc1O ZINC000185373988 1054533415 /nfs/dbraw/zinc/53/34/15/1054533415.db2.gz RMDTUTFCDHYEOD-NSHDSACASA-N 1 0 322.449 4.179 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc3ccccc3c2)c(O)c1 ZINC000185406839 1054538868 /nfs/dbraw/zinc/53/88/68/1054538868.db2.gz ZVDBCBUOUCIOKL-BTYIYWSLSA-N 1 0 321.420 4.238 20 10 DICDRO Cc1ccc(C)c(NCc2cc(Cl)c3cccnc3c2O)[nH+]1 ZINC001168528600 1054565679 /nfs/dbraw/zinc/56/56/79/1054565679.db2.gz VXEHUQUCNMXGCP-UHFFFAOYSA-N 1 0 313.788 4.218 20 10 DICDRO c1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000073052598 1054628048 /nfs/dbraw/zinc/62/80/48/1054628048.db2.gz CAVZTEPUQMDFJU-OAQYLSRUSA-N 1 0 306.453 4.454 20 10 DICDRO C[C@H]1C[C@H]2C[N@H+](Cc3cccc(-c4ccccc4)c3O)CC[C@H]2O1 ZINC001235001500 1054639916 /nfs/dbraw/zinc/63/99/16/1054639916.db2.gz NEVIMJQAKDSIHC-ZAAXVRCTSA-N 1 0 323.436 4.059 20 10 DICDRO CO[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)[C@@H](C)C1 ZINC001235000860 1054641148 /nfs/dbraw/zinc/64/11/48/1054641148.db2.gz QVMRIDZKQQUCEO-MAUKXSAKSA-N 1 0 311.425 4.059 20 10 DICDRO C[N@H+](Cc1ccc(Oc2cccnc2)cc1)Cc1ccccc1O ZINC001235114128 1054659363 /nfs/dbraw/zinc/65/93/63/1054659363.db2.gz IQLNISNYOAVUOU-UHFFFAOYSA-N 1 0 320.392 4.212 20 10 DICDRO Cc1ccc2c(c1)C1(CC2)CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001235609296 1054754465 /nfs/dbraw/zinc/75/44/65/1054754465.db2.gz VIGSJVPGOYLZIL-UHFFFAOYSA-N 1 0 306.453 4.057 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c(O)c1 ZINC001235675992 1054771641 /nfs/dbraw/zinc/77/16/41/1054771641.db2.gz NMEVVDGQTMJMDJ-OAHLLOKOSA-N 1 0 315.379 4.259 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCc3ccsc3C2)c(O)c1 ZINC001235683403 1054773404 /nfs/dbraw/zinc/77/34/04/1054773404.db2.gz FSPXGDLGCGFLQJ-UHFFFAOYSA-N 1 0 301.455 4.310 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c(O)c1 ZINC001235685555 1054776283 /nfs/dbraw/zinc/77/62/83/1054776283.db2.gz QBJZRSNGUWFWNS-MRXNPFEDSA-N 1 0 324.468 4.464 20 10 DICDRO CC(C)(C)c1ccc(C[NH+]2CCC(c3ccccn3)CC2)c(O)c1 ZINC001235686247 1054778137 /nfs/dbraw/zinc/77/81/37/1054778137.db2.gz ZPVHPVQATBAVRK-UHFFFAOYSA-N 1 0 324.468 4.464 20 10 DICDRO Nc1ccc(C[N@@H+]2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1 ZINC001235712907 1054786928 /nfs/dbraw/zinc/78/69/28/1054786928.db2.gz SETQAICCQOGAIL-OAHLLOKOSA-N 1 0 320.358 4.277 20 10 DICDRO Nc1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)cc1 ZINC001235793321 1054806590 /nfs/dbraw/zinc/80/65/90/1054806590.db2.gz GBVOWXPBWLQJIS-QFIPXVFZSA-N 1 0 314.432 4.417 20 10 DICDRO Nc1ccc(C[N@@H+]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1 ZINC001235919491 1054849438 /nfs/dbraw/zinc/84/94/38/1054849438.db2.gz WSWLKQYSCRVWKE-HNNXBMFYSA-N 1 0 320.358 4.277 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2c[nH]c3ccccc32)c1O ZINC001236190242 1054988608 /nfs/dbraw/zinc/98/86/08/1054988608.db2.gz IIMSEYUWTOMYFF-GOSISDBHSA-N 1 0 322.408 4.225 20 10 DICDRO [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc(Cl)ccc2[O-])C2CCCC2)CC1 ZINC001236566218 1055186596 /nfs/dbraw/zinc/18/65/96/1055186596.db2.gz FYJOOUGQKXOVAM-JCNLHEQBSA-N 1 0 322.880 4.060 20 10 DICDRO C[C@H]([NH2+]C1CCCCCC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000764496797 1055200933 /nfs/dbraw/zinc/20/09/33/1055200933.db2.gz BKNOCPKRAPKNJR-HNNXBMFYSA-N 1 0 320.452 4.036 20 10 DICDRO CCC(CC)[N@H+](C)Cc1cc(C)cc(Br)c1[O-] ZINC001236670177 1055220110 /nfs/dbraw/zinc/22/01/10/1055220110.db2.gz VSFONKPMLBSLHK-UHFFFAOYSA-N 1 0 300.240 4.084 20 10 DICDRO Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)CCCO2 ZINC000764633691 1055227035 /nfs/dbraw/zinc/22/70/35/1055227035.db2.gz FKMPIKPCANQYMY-FQEVSTJZSA-N 1 0 324.468 4.373 20 10 DICDRO CC1(C)CCC[N@@H+]1Cc1cc(OCc2ccccc2)ccc1O ZINC001236778048 1055255948 /nfs/dbraw/zinc/25/59/48/1055255948.db2.gz AOCZDXVVJUGAIY-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO CC(C)(C)C[N@H+](Cc1cc(Cl)ccc1[O-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236769468 1055256311 /nfs/dbraw/zinc/25/63/11/1055256311.db2.gz VXIWGEIIKRWLCT-WKILWMFISA-N 1 0 324.896 4.164 20 10 DICDRO CCC(CC)[N@H+](Cc1ccc(Cl)cc1[O-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781553 1055256490 /nfs/dbraw/zinc/25/64/90/1055256490.db2.gz GBOYTXVSIAZESO-JCNLHEQBSA-N 1 0 324.896 4.306 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c(O)c1 ZINC001236790295 1055262193 /nfs/dbraw/zinc/26/21/93/1055262193.db2.gz VJJZPSGTPQBHKS-UHFFFAOYSA-N 1 0 324.468 4.187 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(O)c1 ZINC001236808051 1055266834 /nfs/dbraw/zinc/26/68/34/1055266834.db2.gz LATDUZWODMAMBL-GOSISDBHSA-N 1 0 315.388 4.185 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)c([O-])c1Cl ZINC001236805961 1055268459 /nfs/dbraw/zinc/26/84/59/1055268459.db2.gz ICWYNFATEYOEBQ-CQSZACIVSA-N 1 0 323.864 4.456 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)c([O-])c1Cl ZINC001236811597 1055271521 /nfs/dbraw/zinc/27/15/21/1055271521.db2.gz NEIATCZUZSNRJE-OLZOCXBDSA-N 1 0 309.837 4.066 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(O)c1 ZINC001236814566 1055272196 /nfs/dbraw/zinc/27/21/96/1055272196.db2.gz UXLTVRHYUZEIKV-GOSISDBHSA-N 1 0 315.388 4.185 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC001236826498 1055281438 /nfs/dbraw/zinc/28/14/38/1055281438.db2.gz LIUOJXZYQDLAIT-LJQANCHMSA-N 1 0 304.393 4.278 20 10 DICDRO Oc1cc2ccccc2cc1C[NH+]1CCC(OC2CCC2)CC1 ZINC001236827401 1055281655 /nfs/dbraw/zinc/28/16/55/1055281655.db2.gz RPKHEUAJHAUUIE-UHFFFAOYSA-N 1 0 311.425 4.079 20 10 DICDRO C[C@H]1CC[N@H+](Cc2cc3ccccc3cc2O)CCC1(F)F ZINC001236826753 1055281703 /nfs/dbraw/zinc/28/17/03/1055281703.db2.gz MFPDVRSZBVIVHG-ZDUSSCGKSA-N 1 0 305.368 4.413 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC001236834771 1055283322 /nfs/dbraw/zinc/28/33/22/1055283322.db2.gz CWUJHQGWUSTALQ-LJQANCHMSA-N 1 0 304.393 4.278 20 10 DICDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC000764900485 1055287063 /nfs/dbraw/zinc/28/70/63/1055287063.db2.gz BTWGCIIHWHSYSC-QGZVFWFLSA-N 1 0 324.468 4.016 20 10 DICDRO Oc1ccccc1C[N@H+](CCCc1ccncc1)Cc1ccco1 ZINC000764978426 1055303072 /nfs/dbraw/zinc/30/30/72/1055303072.db2.gz ZHHDFJKFDWAAEU-UHFFFAOYSA-N 1 0 322.408 4.015 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)c1 ZINC000764989811 1055306622 /nfs/dbraw/zinc/30/66/22/1055306622.db2.gz LZFYJOPQBPONFY-HXUWFJFHSA-N 1 0 312.457 4.392 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(N(C)CC)cc2)c1 ZINC000764988466 1055307892 /nfs/dbraw/zinc/30/78/92/1055307892.db2.gz GKBDPKLDQUKGBI-MRXNPFEDSA-N 1 0 312.457 4.392 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccnc(Cl)c2)cc1 ZINC000765103657 1055330458 /nfs/dbraw/zinc/33/04/58/1055330458.db2.gz GRUAZAGWLOCMBA-CQSZACIVSA-N 1 0 317.864 4.432 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCc3ccc(OC)cc32)cc1 ZINC000765108187 1055332199 /nfs/dbraw/zinc/33/21/99/1055332199.db2.gz VKNROBUEQSMEGF-OAQYLSRUSA-N 1 0 324.468 4.319 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](OC)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000765261044 1055347431 /nfs/dbraw/zinc/34/74/31/1055347431.db2.gz LVAOJXWAWYWOJM-WOJBJXKFSA-N 1 0 312.457 4.181 20 10 DICDRO COc1ccccc1CC[N@H+](C)Cc1ccc(C(C)C)cc1O ZINC001237049272 1055349365 /nfs/dbraw/zinc/34/93/65/1055349365.db2.gz MZOTUCKBIMKUSB-UHFFFAOYSA-N 1 0 313.441 4.199 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(C)c2)c(O)c1 ZINC001237043877 1055349564 /nfs/dbraw/zinc/34/95/64/1055349564.db2.gz JZQNFXGXPIVYPS-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C23CCCC3)c(O)c1 ZINC001237051287 1055349674 /nfs/dbraw/zinc/34/96/74/1055349674.db2.gz JOQYTNOSSGWUJD-OAHLLOKOSA-N 1 0 315.457 4.239 20 10 DICDRO Cc1cccc(N2CC[NH+](Cc3ccc(C(C)C)cc3O)CC2)c1 ZINC001237046104 1055351366 /nfs/dbraw/zinc/35/13/66/1055351366.db2.gz PMQKSSODQPZANQ-UHFFFAOYSA-N 1 0 324.468 4.146 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CC[C@](CF)(C(F)(F)F)C2)c(O)c1 ZINC001237046666 1055352078 /nfs/dbraw/zinc/35/20/78/1055352078.db2.gz VDTHGTYJCPAFFK-OAHLLOKOSA-N 1 0 319.342 4.240 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c(O)c1 ZINC001237054242 1055352892 /nfs/dbraw/zinc/35/28/92/1055352892.db2.gz UBGBPMBPKJARHG-IBGZPJMESA-N 1 0 311.425 4.169 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](C(=O)c3ccccc3)C2)c(O)c1 ZINC001237056804 1055355380 /nfs/dbraw/zinc/35/53/80/1055355380.db2.gz ZVIMNTDKMNFGFC-IBGZPJMESA-N 1 0 323.436 4.220 20 10 DICDRO CCOc1ccccc1C[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000765282659 1055355627 /nfs/dbraw/zinc/35/56/27/1055355627.db2.gz WYNVKLJFOFVLLA-LJQANCHMSA-N 1 0 312.457 4.392 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC001237052868 1055356574 /nfs/dbraw/zinc/35/65/74/1055356574.db2.gz DXCILQQMCQLZCE-FQEVSTJZSA-N 1 0 311.425 4.089 20 10 DICDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000765312227 1055360945 /nfs/dbraw/zinc/36/09/45/1055360945.db2.gz ALVPSZYFBOFNQK-SOUVJXGZSA-N 1 0 324.896 4.262 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC000765306405 1055361954 /nfs/dbraw/zinc/36/19/54/1055361954.db2.gz CYBYJVWUUJSEBO-IAGOWNOFSA-N 1 0 316.489 4.080 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000765334034 1055363919 /nfs/dbraw/zinc/36/39/19/1055363919.db2.gz WGWUHUPYEBTBFD-GOSISDBHSA-N 1 0 304.384 4.272 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCCO1)c1ccc(N2CCCCCC2)cc1 ZINC000765341989 1055366314 /nfs/dbraw/zinc/36/63/14/1055366314.db2.gz BGENFAUBXMWCTP-PXNSSMCTSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765343835 1055367373 /nfs/dbraw/zinc/36/73/73/1055367373.db2.gz NGOAYYBXIYZJQW-WBVHZDCISA-N 1 0 320.452 4.036 20 10 DICDRO C[N@H+](Cc1cccs1)Cc1cc(C(F)(F)F)ccc1O ZINC001237139262 1055379180 /nfs/dbraw/zinc/37/91/80/1055379180.db2.gz JNIGGEBKCKRFSW-UHFFFAOYSA-N 1 0 301.333 4.105 20 10 DICDRO C[N@H+](CCc1ccccc1)Cc1cc(C(F)(F)F)ccc1O ZINC001237135049 1055379684 /nfs/dbraw/zinc/37/96/84/1055379684.db2.gz FYTVXNGDSIAHOT-UHFFFAOYSA-N 1 0 309.331 4.086 20 10 DICDRO C[C@]1(F)CCCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237137877 1055380160 /nfs/dbraw/zinc/38/01/60/1055380160.db2.gz QGGXGKLRJYYUAT-AWEZNQCLSA-N 1 0 305.315 4.125 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1cncc(F)c1 ZINC000765449458 1055391444 /nfs/dbraw/zinc/39/14/44/1055391444.db2.gz KVXMJCPFTGFWRY-OAHLLOKOSA-N 1 0 313.420 4.062 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cc2c(s1)CCC2 ZINC000765475916 1055397635 /nfs/dbraw/zinc/39/76/35/1055397635.db2.gz XWWJABQSJGSNIY-GFCCVEGCSA-N 1 0 318.461 4.293 20 10 DICDRO Cc1ccsc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765478665 1055399305 /nfs/dbraw/zinc/39/93/05/1055399305.db2.gz FBQRDLQQRDHQQO-AWEZNQCLSA-N 1 0 300.471 4.290 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000325478836 1055403959 /nfs/dbraw/zinc/40/39/59/1055403959.db2.gz BHWUFNPNMKTKQM-FQEVSTJZSA-N 1 0 319.452 4.401 20 10 DICDRO Cc1cc(C)c(C[NH+]2CCC3(Cc4ccccc4N3)CC2)c(O)c1 ZINC001237344850 1055433919 /nfs/dbraw/zinc/43/39/19/1055433919.db2.gz BCZQGBYFZRLALZ-UHFFFAOYSA-N 1 0 322.452 4.012 20 10 DICDRO COc1ccccc1C1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000765538071 1055437074 /nfs/dbraw/zinc/43/70/74/1055437074.db2.gz GRNAUWOGPMWDNP-MRXNPFEDSA-N 1 0 324.468 4.144 20 10 DICDRO COc1ccccc1C1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000765538067 1055438065 /nfs/dbraw/zinc/43/80/65/1055438065.db2.gz GRNAUWOGPMWDNP-INIZCTEOSA-N 1 0 324.468 4.144 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000083551354 1055449247 /nfs/dbraw/zinc/44/92/47/1055449247.db2.gz WMMDNITYPMOEKP-UHFFFAOYSA-N 1 0 315.722 4.354 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC001237483966 1055457916 /nfs/dbraw/zinc/45/79/16/1055457916.db2.gz WQRCHNAUJMLSDB-OAQYLSRUSA-N 1 0 318.420 4.107 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCSC[C@@H]1c1ccc(F)cc1 ZINC001237486667 1055459683 /nfs/dbraw/zinc/45/96/83/1055459683.db2.gz APEJXARJUSREIN-QGZVFWFLSA-N 1 0 317.429 4.130 20 10 DICDRO COc1cccc([C@H]2CCC[N@H+](Cc3c(C)cccc3O)C2)c1 ZINC001237495351 1055461107 /nfs/dbraw/zinc/46/11/07/1055461107.db2.gz QIFNUOGSBOSURQ-KRWDZBQOSA-N 1 0 311.425 4.089 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCc3c2cccc3OC)cc1 ZINC001620841453 1055470207 /nfs/dbraw/zinc/47/02/07/1055470207.db2.gz IHPVDFOVTWRTQO-HXUWFJFHSA-N 1 0 324.468 4.319 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCc3c2cccc3OC)cc1 ZINC001620841452 1055471186 /nfs/dbraw/zinc/47/11/86/1055471186.db2.gz IHPVDFOVTWRTQO-FQEVSTJZSA-N 1 0 324.468 4.319 20 10 DICDRO CC1(C)C[C@H]([NH2+]Cc2cc(F)cc(F)c2[O-])c2ccccc21 ZINC001620847452 1055474316 /nfs/dbraw/zinc/47/43/16/1055474316.db2.gz WRZUBYSLLOCBAS-INIZCTEOSA-N 1 0 303.352 4.183 20 10 DICDRO C[N@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)C1CC(F)(F)C1 ZINC001237640414 1055491008 /nfs/dbraw/zinc/49/10/08/1055491008.db2.gz BAAORNFFOPJCBO-UHFFFAOYSA-N 1 0 321.342 4.428 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@](C)(C(F)(F)F)C2)cc1Cl ZINC001621511089 1055492476 /nfs/dbraw/zinc/49/24/76/1055492476.db2.gz QROKGNGEQOKGGO-CYBMUJFWSA-N 1 0 307.743 4.128 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+](C)CCc2cccc(F)c2)c1O ZINC001237689787 1055502009 /nfs/dbraw/zinc/50/20/09/1055502009.db2.gz PZEFUKBAIWILRS-UHFFFAOYSA-N 1 0 307.796 4.168 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+](C)CCc2ccccc2F)c1O ZINC001237688998 1055502067 /nfs/dbraw/zinc/50/20/67/1055502067.db2.gz LKIVGRFLNQZJON-UHFFFAOYSA-N 1 0 307.796 4.168 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](C)c2nc(C)cs2)cc1 ZINC001620895928 1055520739 /nfs/dbraw/zinc/52/07/39/1055520739.db2.gz TXEVKHNWISQSPQ-CQSZACIVSA-N 1 0 317.502 4.191 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H](C)c2nc(C)cs2)cc1 ZINC001620895927 1055521456 /nfs/dbraw/zinc/52/14/56/1055521456.db2.gz TXEVKHNWISQSPQ-AWEZNQCLSA-N 1 0 317.502 4.191 20 10 DICDRO CO[C@@H](C)CC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765632207 1055529635 /nfs/dbraw/zinc/52/96/35/1055529635.db2.gz YCEHEETYGPGJCR-DLBZAZTESA-N 1 0 304.478 4.143 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CC2(SC)CC2)cc1 ZINC001620917552 1055538962 /nfs/dbraw/zinc/53/89/62/1055538962.db2.gz JHFQARBEATXSKZ-UHFFFAOYSA-N 1 0 306.519 4.298 20 10 DICDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001237950624 1055564376 /nfs/dbraw/zinc/56/43/76/1055564376.db2.gz YNJKZQRQYJYHSB-LBPRGKRZSA-N 1 0 323.770 4.313 20 10 DICDRO c1ccc([C@@H]2CCC[C@H]2C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001620950292 1055565172 /nfs/dbraw/zinc/56/51/72/1055565172.db2.gz WDPMYZNBKZBNOA-PMACEKPBSA-N 1 0 307.437 4.295 20 10 DICDRO c1ccc([C@@H]2CCC[C@@H]2C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001620950293 1055565770 /nfs/dbraw/zinc/56/57/70/1055565770.db2.gz WDPMYZNBKZBNOA-UXHICEINSA-N 1 0 307.437 4.295 20 10 DICDRO Cc1cc(F)cc(C[NH+]2CCC3(C=Cc4ccccc43)CC2)c1O ZINC001238060928 1055597800 /nfs/dbraw/zinc/59/78/00/1055597800.db2.gz JMKXNBPEZLMIGR-UHFFFAOYSA-N 1 0 323.411 4.400 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1O ZINC001238062835 1055598716 /nfs/dbraw/zinc/59/87/16/1055598716.db2.gz SLHZVMBOLMGVLT-QGZVFWFLSA-N 1 0 317.429 4.130 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)c(Cl)c1 ZINC001238404222 1055653511 /nfs/dbraw/zinc/65/35/11/1055653511.db2.gz WTSUXPYRPHOWLR-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO CCN(CC)C[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765764830 1055769891 /nfs/dbraw/zinc/76/98/91/1055769891.db2.gz BJEUSICOJYWETE-MSOLQXFVSA-N 1 0 317.521 4.058 20 10 DICDRO CCN(CC)C[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765764835 1055770197 /nfs/dbraw/zinc/77/01/97/1055770197.db2.gz BJEUSICOJYWETE-ROUUACIJSA-N 1 0 317.521 4.058 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](C)c2ccc(SC)cc2)c1 ZINC000282191125 1055783960 /nfs/dbraw/zinc/78/39/60/1055783960.db2.gz KULZIKGXCNAEFO-CYBMUJFWSA-N 1 0 317.454 4.364 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)cc1 ZINC000765770105 1055909855 /nfs/dbraw/zinc/90/98/55/1055909855.db2.gz WJKCWCBNRDPZCJ-JKSUJKDBSA-N 1 0 312.457 4.130 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)cc1 ZINC000765770100 1055914796 /nfs/dbraw/zinc/91/47/96/1055914796.db2.gz WJKCWCBNRDPZCJ-CVEARBPZSA-N 1 0 312.457 4.130 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2c3ccccc3CC[C@H]2C)c1 ZINC000186196834 1055924600 /nfs/dbraw/zinc/92/46/00/1055924600.db2.gz WWCOYMBTXBVPQA-CKNLXJGOSA-N 1 0 311.425 4.375 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C(C)(C)c1ccccc1 ZINC001620765434 1055935853 /nfs/dbraw/zinc/93/58/53/1055935853.db2.gz DQUPHVVXGUVSBQ-OAHLLOKOSA-N 1 0 314.448 4.348 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C/C=C/c2ccc(F)cc2F)c1 ZINC001620989577 1055962490 /nfs/dbraw/zinc/96/24/90/1055962490.db2.gz HMUARQQAQSLZII-AAOUONPWSA-N 1 0 319.351 4.043 20 10 DICDRO C[C@H]1CC(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C[C@H](C)C1 ZINC001620999416 1055966790 /nfs/dbraw/zinc/96/67/90/1055966790.db2.gz QAOZRDRQMUVVCX-MBZYTVFJSA-N 1 0 300.490 4.428 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccnc(-c2ccccc2)c1 ZINC001621025239 1055990175 /nfs/dbraw/zinc/99/01/75/1055990175.db2.gz GRNDTGLDWBAALQ-UHFFFAOYSA-N 1 0 324.811 4.397 20 10 DICDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)s1 ZINC001620803759 1055999193 /nfs/dbraw/zinc/99/91/93/1055999193.db2.gz DYBNIMHIEJLWBS-LLVKDONJSA-N 1 0 324.440 4.122 20 10 DICDRO C[C@@H](C[NH2+]Cc1cc(F)c(N(C)C)cc1F)Cc1cccs1 ZINC001620821392 1056223394 /nfs/dbraw/zinc/22/33/94/1056223394.db2.gz VRHZRXOTCCQCMM-GFCCVEGCSA-N 1 0 324.440 4.061 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)c(O)c1 ZINC000765824671 1056275384 /nfs/dbraw/zinc/27/53/84/1056275384.db2.gz VVOCFCGBODEKCV-RHSMWYFYSA-N 1 0 313.445 4.206 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1cccc(Cl)c1Cl)CC2 ZINC000693667632 1056553336 /nfs/dbraw/zinc/55/33/36/1056553336.db2.gz DDQKNPVXAPDAIR-CYBMUJFWSA-N 1 0 308.208 4.476 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2O)CCO1 ZINC000186502086 1056560617 /nfs/dbraw/zinc/56/06/17/1056560617.db2.gz RGOLTODVSCZZHD-QOKNQOGYSA-N 1 0 305.462 4.335 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2cc3ccccc3o2)ccc1N(C)C ZINC001615826813 1056580641 /nfs/dbraw/zinc/58/06/41/1056580641.db2.gz WAYZGIBAJNUYOC-UHFFFAOYSA-N 1 0 308.425 4.439 20 10 DICDRO C[N@@H+](Cc1ccccc1O)C[C@H]1CCC[C@@H](c2ccccc2)O1 ZINC001615930750 1056598240 /nfs/dbraw/zinc/59/82/40/1056598240.db2.gz DCKMKMXPWJCGRO-QUCCMNQESA-N 1 0 311.425 4.134 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1 ZINC001615960703 1056601508 /nfs/dbraw/zinc/60/15/08/1056601508.db2.gz KDIYIVFWFKNTIE-HXUWFJFHSA-N 1 0 323.484 4.219 20 10 DICDRO C[C@@H]([NH2+]CC1CCSCC1)c1ccc(N2CCCCC2)cc1 ZINC000765961498 1056659067 /nfs/dbraw/zinc/65/90/67/1056659067.db2.gz NPKUISDTAJSRDE-MRXNPFEDSA-N 1 0 318.530 4.471 20 10 DICDRO COc1ccc(N(CCC(C)C)CCC2CCOCC2)cc1 ZINC001617713390 1056871618 /nfs/dbraw/zinc/87/16/18/1056871618.db2.gz QGKRONOYIHZYKK-UHFFFAOYSA-N 1 0 305.462 4.364 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@H]1Cc2cccc(Cl)c2C1 ZINC001168703667 1056883783 /nfs/dbraw/zinc/88/37/83/1056883783.db2.gz JBUUHBAAZJVVAD-KRWDZBQOSA-N 1 0 323.823 4.456 20 10 DICDRO CC(C)OCCCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000186530054 1057025393 /nfs/dbraw/zinc/02/53/93/1057025393.db2.gz DDRAHDVJXXKVNX-OAHLLOKOSA-N 1 0 305.462 4.127 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](c2ccccn2)C2CC2)cc1 ZINC000922585066 1057036583 /nfs/dbraw/zinc/03/65/83/1057036583.db2.gz HZPMDRAVCVTOTC-FQEVSTJZSA-N 1 0 309.457 4.169 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C)ccc1O)c1cc(F)ccc1OC ZINC000922620405 1057040644 /nfs/dbraw/zinc/04/06/44/1057040644.db2.gz BFDQLFIQYQPUOO-MRXNPFEDSA-N 1 0 303.377 4.089 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1nccs1 ZINC000186740280 1057106465 /nfs/dbraw/zinc/10/64/65/1057106465.db2.gz IRYSMMLKDQLZFZ-STQMWFEESA-N 1 0 316.470 4.182 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1cc2c(s1)CCC2 ZINC000766028721 1057126756 /nfs/dbraw/zinc/12/67/56/1057126756.db2.gz DROGMKYHJWFHHK-CQSZACIVSA-N 1 0 314.498 4.462 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccc(F)cc1 ZINC000766028808 1057127541 /nfs/dbraw/zinc/12/75/41/1057127541.db2.gz GSWJGHPNRYYQDQ-IBGZPJMESA-N 1 0 300.421 4.441 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000766027931 1057128423 /nfs/dbraw/zinc/12/84/23/1057128423.db2.gz BFXFWGCMCGGEPI-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000766030650 1057131826 /nfs/dbraw/zinc/13/18/26/1057131826.db2.gz VMNWVGUOENBTEB-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC000766029923 1057132604 /nfs/dbraw/zinc/13/26/04/1057132604.db2.gz QAOPGOFPZYKRGV-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000766030040 1057132918 /nfs/dbraw/zinc/13/29/18/1057132918.db2.gz STWKLDNFXLZBNH-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO C[C@H]([NH2+]C[C@H](c1ccccc1)C(F)(F)F)c1ccccc1O ZINC000186852517 1057135620 /nfs/dbraw/zinc/13/56/20/1057135620.db2.gz OFGFSSSWLXLUEC-SWLSCSKDSA-N 1 0 309.331 4.389 20 10 DICDRO C[C@@H]([NH2+]C[C@H](c1ccccc1)C(F)(F)F)c1ccccc1O ZINC000186852536 1057135912 /nfs/dbraw/zinc/13/59/12/1057135912.db2.gz OFGFSSSWLXLUEC-IUODEOHRSA-N 1 0 309.331 4.389 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2cc(OC)ccc2O)CCCCC1 ZINC000186886585 1057143839 /nfs/dbraw/zinc/14/38/39/1057143839.db2.gz IEJRCFPYXKYMQN-HNNXBMFYSA-N 1 0 321.461 4.038 20 10 DICDRO Cc1cc(Br)cc([C@@H](C)[NH2+]C/C=C/C2CC2)c1O ZINC001117749826 1057160743 /nfs/dbraw/zinc/16/07/43/1057160743.db2.gz CEGVITSKOSAOFU-PGLGOXFNSA-N 1 0 310.235 4.080 20 10 DICDRO Cn1ccc2c1cccc2-c1cnccc1C[NH+]1CCCCC1 ZINC001241822719 1057176209 /nfs/dbraw/zinc/17/62/09/1057176209.db2.gz BOGUYPPMCCQIPX-UHFFFAOYSA-N 1 0 305.425 4.226 20 10 DICDRO Cc1cc(C)c(O)c(C[N@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000164472886 1057188587 /nfs/dbraw/zinc/18/85/87/1057188587.db2.gz NXGVTLAZZRBVCB-UHFFFAOYSA-N 1 0 301.352 4.173 20 10 DICDRO C[C@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000766062159 1057266844 /nfs/dbraw/zinc/26/68/44/1057266844.db2.gz VJCYFFWYXXYGQK-LPHOPBHVSA-N 1 0 318.505 4.125 20 10 DICDRO CO[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@@H](C)C1 ZINC000282522669 1057281923 /nfs/dbraw/zinc/28/19/23/1057281923.db2.gz ZTJLTPCGRLBZDQ-KXBFYZLASA-N 1 0 311.425 4.059 20 10 DICDRO CSCCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766070304 1057284594 /nfs/dbraw/zinc/28/45/94/1057284594.db2.gz BVGBLTIOJNXQDC-MRXNPFEDSA-N 1 0 306.519 4.471 20 10 DICDRO CC[C@@H]([NH2+]CCCSc1nccs1)c1cccc(OC)c1 ZINC000766074242 1057286124 /nfs/dbraw/zinc/28/61/24/1057286124.db2.gz VAIRMZOLNDWVNE-OAHLLOKOSA-N 1 0 322.499 4.375 20 10 DICDRO C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CCCSc1nccs1 ZINC000766072758 1057286197 /nfs/dbraw/zinc/28/61/97/1057286197.db2.gz MPISEVWQFJDBBV-SWLSCSKDSA-N 1 0 304.484 4.148 20 10 DICDRO CC[C@@H]([NH2+]CCCCCC[NH3+])c1cc(Cl)cc(Cl)c1[O-] ZINC000843340667 1057379151 /nfs/dbraw/zinc/37/91/51/1057379151.db2.gz DHEDGFRHWYCJSU-CQSZACIVSA-N 1 0 319.276 4.259 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc3cc[nH]c32)cc1 ZINC000727467374 1057655649 /nfs/dbraw/zinc/65/56/49/1057655649.db2.gz UWGWQNQUVWOPMT-UHFFFAOYSA-N 1 0 307.441 4.304 20 10 DICDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000727645348 1057662135 /nfs/dbraw/zinc/66/21/35/1057662135.db2.gz XLMKTYTVAMSORK-FQEVSTJZSA-N 1 0 306.453 4.155 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(C)c(C)cc1O ZINC000727826701 1057675387 /nfs/dbraw/zinc/67/53/87/1057675387.db2.gz XUZMFXBPQLQCID-GOSISDBHSA-N 1 0 311.425 4.355 20 10 DICDRO CCC[N@H+](CCO[C@@H]1CCCC[C@H]1C)Cc1ccccc1O ZINC000727830635 1057676295 /nfs/dbraw/zinc/67/62/95/1057676295.db2.gz FBRGVIPZRXBTLU-VQIMIIECSA-N 1 0 305.462 4.200 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C)cc2)cc1F ZINC000731360960 1057742511 /nfs/dbraw/zinc/74/25/11/1057742511.db2.gz RHGBRSLPZCBPJL-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO CC(C)n1ccnc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000732204682 1057770610 /nfs/dbraw/zinc/77/06/10/1057770610.db2.gz ALUAGGLIJPGBRT-UHFFFAOYSA-N 1 0 313.445 4.114 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000732233191 1057771645 /nfs/dbraw/zinc/77/16/45/1057771645.db2.gz XLYMVTASYOGUPM-DLBZAZTESA-N 1 0 301.817 4.472 20 10 DICDRO Cn1ccc2c1cc[nH+]c2-c1cnc(F)c(-c2ccccc2)c1 ZINC001243882277 1057798207 /nfs/dbraw/zinc/79/82/07/1057798207.db2.gz FNJLOZJFVJIHNZ-UHFFFAOYSA-N 1 0 303.340 4.441 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccnc(Oc3ccccc3)c2)c1 ZINC000733324120 1057811849 /nfs/dbraw/zinc/81/18/49/1057811849.db2.gz IHCMNDJVIBUJGM-UHFFFAOYSA-N 1 0 320.392 4.178 20 10 DICDRO C[C@H](CCc1ccccc1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733321426 1057812129 /nfs/dbraw/zinc/81/21/29/1057812129.db2.gz CFJBCPAXBZVKGW-OAHLLOKOSA-N 1 0 300.421 4.003 20 10 DICDRO C[C@@H](CSc1ccc(Cl)cc1)[NH2+]Cc1ccc(N)cc1 ZINC001246170393 1058712966 /nfs/dbraw/zinc/71/29/66/1058712966.db2.gz KHJNQPJRJJCDRE-LBPRGKRZSA-N 1 0 306.862 4.193 20 10 DICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCC(C)(C)CO1 ZINC001559492684 1059271850 /nfs/dbraw/zinc/27/18/50/1059271850.db2.gz ZNLIKCOGXTZGEZ-LJQANCHMSA-N 1 0 318.505 4.168 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)ccc1N(C)C ZINC001559561071 1059380561 /nfs/dbraw/zinc/38/05/61/1059380561.db2.gz YFBDSZSWNPIPSZ-FQEVSTJZSA-N 1 0 308.469 4.126 20 10 DICDRO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)ccc1N(C)C ZINC001559589608 1059422405 /nfs/dbraw/zinc/42/24/05/1059422405.db2.gz ATUHFWOPHGNNMF-HXUWFJFHSA-N 1 0 311.473 4.127 20 10 DICDRO CCC1(CC)[C@H](OC)C[C@@H]1[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC001559612367 1059442601 /nfs/dbraw/zinc/44/26/01/1059442601.db2.gz ULUTVUORQBHSMD-RBUKOAKNSA-N 1 0 318.505 4.087 20 10 DICDRO C[C@@H]1CCC[C@H](C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)C1 ZINC001559635145 1059462989 /nfs/dbraw/zinc/46/29/89/1059462989.db2.gz LYWDYRFCVQSETL-AOIWGVFYSA-N 1 0 317.473 4.200 20 10 DICDRO CCC[C@H]([NH2+]C)c1nc(-c2ccc(-n3c(C)ccc3C)cc2)no1 ZINC001247627167 1059577022 /nfs/dbraw/zinc/57/70/22/1059577022.db2.gz REQHTQZVFXQKAC-KRWDZBQOSA-N 1 0 324.428 4.205 20 10 DICDRO C[C@H]([NH2+]CCc1ccccc1Cl)c1ccc(N(C)C)cc1 ZINC001559767106 1059604966 /nfs/dbraw/zinc/60/49/66/1059604966.db2.gz SPXMNYIYAUENDM-AWEZNQCLSA-N 1 0 302.849 4.299 20 10 DICDRO CCCC[N@H+](CCc1ccccc1F)Cc1ccccc1O ZINC001559790249 1059624516 /nfs/dbraw/zinc/62/45/16/1059624516.db2.gz MVMMFASARXZHEX-UHFFFAOYSA-N 1 0 301.405 4.376 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H]2COc2ccccc2)ccc1N(C)C ZINC001559868607 1059688068 /nfs/dbraw/zinc/68/80/68/1059688068.db2.gz VNDAPWRVQFPIGF-IBGZPJMESA-N 1 0 324.468 4.104 20 10 DICDRO CCc1ccc([C@@H]2CC[N@H+](Cc3ccc(N(C)C)cc3)C2)cc1 ZINC001559871642 1059693299 /nfs/dbraw/zinc/69/32/99/1059693299.db2.gz ZZHPDYHOXCXQQO-HXUWFJFHSA-N 1 0 308.469 4.305 20 10 DICDRO CN(CCC[NH+]1CCCCC1)c1ccc(-c2nccs2)cc1 ZINC001559896272 1059714911 /nfs/dbraw/zinc/71/49/11/1059714911.db2.gz HGCVGISAJFFNFG-UHFFFAOYSA-N 1 0 315.486 4.122 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCSc3ccccc32)cc1F ZINC001560250540 1060019110 /nfs/dbraw/zinc/01/91/10/1060019110.db2.gz XWDWOVURQDDBHU-MRXNPFEDSA-N 1 0 316.445 4.218 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC001560283141 1060061265 /nfs/dbraw/zinc/06/12/65/1060061265.db2.gz ZOMSFRFPUDBUAX-WLMCBFPDSA-N 1 0 310.441 4.125 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC001560283138 1060061804 /nfs/dbraw/zinc/06/18/04/1060061804.db2.gz ZOMSFRFPUDBUAX-FYCOFBDGSA-N 1 0 310.441 4.125 20 10 DICDRO Cc1cc(Cl)cc(C)c1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001560298773 1060083621 /nfs/dbraw/zinc/08/36/21/1060083621.db2.gz SCQCDXBNRLGYFC-UHFFFAOYSA-N 1 0 320.839 4.452 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCCc2cccc(F)c2)cc1 ZINC001560313973 1060102030 /nfs/dbraw/zinc/10/20/30/1060102030.db2.gz DMSWMSZBTSULJG-DAXSKMNVSA-N 1 0 312.432 4.127 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)c2cccc(F)c2)c(Cl)c1 ZINC001560317672 1060104843 /nfs/dbraw/zinc/10/48/43/1060104843.db2.gz ZWRBINDDANSBEQ-GFCCVEGCSA-N 1 0 307.796 4.386 20 10 DICDRO CC[C@H](C[NH2+]Cc1ccc(OC)c(C)c1)Oc1cccc(F)c1 ZINC001560366142 1060151087 /nfs/dbraw/zinc/15/10/87/1060151087.db2.gz SVIZHKYXCAQUCA-QGZVFWFLSA-N 1 0 317.404 4.090 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCCC[C@@](C)(F)C3)ccc2O1 ZINC001249223793 1060193013 /nfs/dbraw/zinc/19/30/13/1060193013.db2.gz MTZUHUDGVNSSKD-LJQANCHMSA-N 1 0 319.420 4.291 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[NH+]3CCC4(CCC4)CC3)ccc2O1 ZINC001249230655 1060196305 /nfs/dbraw/zinc/19/63/05/1060196305.db2.gz OXCBDMWWIDZAEX-UHFFFAOYSA-N 1 0 313.441 4.343 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CC[C@@H]4CCC[C@H]4C3)ccc2O1 ZINC001249230503 1060197671 /nfs/dbraw/zinc/19/76/71/1060197671.db2.gz JNQPJRMZROURFC-GJZGRUSLSA-N 1 0 313.441 4.198 20 10 DICDRO CCc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC001560425720 1060211933 /nfs/dbraw/zinc/21/19/33/1060211933.db2.gz XQHMIYCWLYRMTQ-AWEZNQCLSA-N 1 0 300.421 4.305 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCc2ccccc2F)c(Cl)c1 ZINC001560460766 1060252734 /nfs/dbraw/zinc/25/27/34/1060252734.db2.gz XOLHQYHIHLDXDD-UHFFFAOYSA-N 1 0 307.796 4.216 20 10 DICDRO COc1cccc(C2([NH2+]C/C=C\c3ccc(N(C)C)cc3)CC2)c1 ZINC001560470567 1060260146 /nfs/dbraw/zinc/26/01/46/1060260146.db2.gz ZPXOZKRXADQDAO-WAYWQWQTSA-N 1 0 322.452 4.053 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H]2CCO[C@@H](C(C)C)C2)cc1C ZINC001560479186 1060268543 /nfs/dbraw/zinc/26/85/43/1060268543.db2.gz ZQUFSWHXVKDBSL-AZUAARDMSA-N 1 0 319.489 4.325 20 10 DICDRO CC(C)(C)C1CC([NH2+]Cc2c(O)cccc2Br)C1 ZINC001560486997 1060279690 /nfs/dbraw/zinc/27/96/90/1060279690.db2.gz YKZPPFNLFJCUHT-UHFFFAOYSA-N 1 0 312.251 4.069 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2C[C@H](C)O[C@H]2C)cc1 ZINC001560508001 1060303090 /nfs/dbraw/zinc/30/30/90/1060303090.db2.gz IGHOOXJSOOIYMF-LNLFQRSKSA-N 1 0 318.505 4.216 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](COC)CC(C)(C)C)cc1F ZINC001560517351 1060315562 /nfs/dbraw/zinc/31/55/62/1060315562.db2.gz JTJKYLYRFJELIY-INIZCTEOSA-N 1 0 324.484 4.213 20 10 DICDRO Cc1ccc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)cc1C ZINC001560527053 1060326933 /nfs/dbraw/zinc/32/69/33/1060326933.db2.gz RDDOJBPRHXWDMO-UHFFFAOYSA-N 1 0 308.469 4.236 20 10 DICDRO CC[C@H](C)CC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001560527047 1060327796 /nfs/dbraw/zinc/32/77/96/1060327796.db2.gz QZGOAHZQNLLTTD-LBPRGKRZSA-N 1 0 302.384 4.297 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cccc(OC)c2C)cc1C ZINC001560539870 1060346046 /nfs/dbraw/zinc/34/60/46/1060346046.db2.gz SPKMCJRRJBEQTP-UHFFFAOYSA-N 1 0 313.441 4.391 20 10 DICDRO CC(C)[C@@](C)(Cc1ccccc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001560558691 1060370577 /nfs/dbraw/zinc/37/05/77/1060370577.db2.gz GZVULFGSZDUVID-OAQYLSRUSA-N 1 0 309.453 4.369 20 10 DICDRO CCCOc1ccc(C[NH2+]C2(CO)CCCCCCC2)cc1C ZINC001560563669 1060371623 /nfs/dbraw/zinc/37/16/23/1060371623.db2.gz RNPMGLGUSOTVPV-UHFFFAOYSA-N 1 0 319.489 4.349 20 10 DICDRO CCC(CC)(C[NH2+]Cc1ccc(N(C)C)c(F)c1)C(F)(F)F ZINC001560563663 1060372679 /nfs/dbraw/zinc/37/26/79/1060372679.db2.gz RIYOQFWBDQUBCK-UHFFFAOYSA-N 1 0 320.374 4.350 20 10 DICDRO Fc1cccc2c1CC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001560593796 1060407951 /nfs/dbraw/zinc/40/79/51/1060407951.db2.gz OQPXIUNYKXRCRZ-HXUWFJFHSA-N 1 0 310.416 4.203 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCSC(C)(C)C2)cc1 ZINC001560602481 1060416817 /nfs/dbraw/zinc/41/68/17/1060416817.db2.gz RKBBYAFEPOOMCX-OGZRUICASA-N 1 0 304.503 4.030 20 10 DICDRO CCC[N@H+](CC)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560627070 1060437050 /nfs/dbraw/zinc/43/70/50/1060437050.db2.gz NAVMFXZPNHYVQX-UHFFFAOYSA-N 1 0 308.469 4.481 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCc3ccccc3[C@H]2C(C)C)c1 ZINC001560637733 1060452904 /nfs/dbraw/zinc/45/29/04/1060452904.db2.gz NJJHYORRNRHCSU-HXUWFJFHSA-N 1 0 311.425 4.156 20 10 DICDRO CCc1cccc(C[N@@H+]2CCSC3(CCCCC3)C2)c1O ZINC001560661747 1060487085 /nfs/dbraw/zinc/48/70/85/1060487085.db2.gz HTVFTWROLJOVIF-UHFFFAOYSA-N 1 0 305.487 4.206 20 10 DICDRO Oc1ccc(F)cc1C[N@H+](Cc1ccccc1F)C1CCC1 ZINC001560670985 1060502079 /nfs/dbraw/zinc/50/20/79/1060502079.db2.gz RHFAKECFGOJUPB-UHFFFAOYSA-N 1 0 303.352 4.225 20 10 DICDRO CC(C)C[N@H+](C)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560683023 1060525911 /nfs/dbraw/zinc/52/59/11/1060525911.db2.gz MOMHUAQOCOLWCM-UHFFFAOYSA-N 1 0 308.469 4.337 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC001560728623 1060592162 /nfs/dbraw/zinc/59/21/62/1060592162.db2.gz ZIXFBXRJXLKTQJ-MOVYNIQHSA-N 1 0 320.480 4.473 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCc3cccc(C)c3C2)cc1Cl ZINC001560754619 1060621133 /nfs/dbraw/zinc/62/11/33/1060621133.db2.gz NNAWBORNIKJHBI-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1cc(C[N@@H+](C)C2CCCCC2)c(O)cc1Br ZINC001250117770 1060622860 /nfs/dbraw/zinc/62/28/60/1060622860.db2.gz QSAJHEFPDHIQTF-UHFFFAOYSA-N 1 0 312.251 4.228 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](CC(F)(F)F)C(C)C)cc1Cl ZINC001560764802 1060629929 /nfs/dbraw/zinc/62/99/29/1060629929.db2.gz QLLSQQWSDADRDS-GFCCVEGCSA-N 1 0 309.759 4.421 20 10 DICDRO COc1cc(C)c(C[NH2+][C@H]2CCCc3ccc(F)cc32)c(O)c1 ZINC001560799268 1060660714 /nfs/dbraw/zinc/66/07/14/1060660714.db2.gz ZYQQYPMQDAPMJF-SFHVURJKSA-N 1 0 315.388 4.016 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCc2ccc(F)cc2)c1 ZINC001560814610 1060673714 /nfs/dbraw/zinc/67/37/14/1060673714.db2.gz COTMQODYJFTAAB-KGLIPLIRSA-N 1 0 317.404 4.212 20 10 DICDRO CCc1cccc(C[N@@H+]2CCc3cccc(Cl)c3C2)c1O ZINC001560880214 1060740571 /nfs/dbraw/zinc/74/05/71/1060740571.db2.gz YSKVFQRDHORCKX-UHFFFAOYSA-N 1 0 301.817 4.166 20 10 DICDRO CC[C@]1(C)CCC[C@@H]1[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001560899125 1060761379 /nfs/dbraw/zinc/76/13/79/1060761379.db2.gz YIGBJBXXQWUFPO-LSTHTHJFSA-N 1 0 316.489 4.080 20 10 DICDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)c1cc2cnccc2o1 ZINC001560913784 1060774780 /nfs/dbraw/zinc/77/47/80/1060774780.db2.gz QKTQMBUUMROEQT-JTQLQIEISA-N 1 0 302.761 4.038 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)[C@H](C)C2 ZINC001560930905 1060795166 /nfs/dbraw/zinc/79/51/66/1060795166.db2.gz RWTYVVYVZATPND-IERDGZPVSA-N 1 0 308.469 4.393 20 10 DICDRO COc1ccc2c(c1)CC[N@@H+](Cc1cc(C(C)C)ccc1O)C2 ZINC001560933728 1060796440 /nfs/dbraw/zinc/79/64/40/1060796440.db2.gz YBCBKKUDZPQXKE-UHFFFAOYSA-N 1 0 311.425 4.083 20 10 DICDRO CC[C@@H](Cc1cn(C)c2ccccc12)[NH2+]Cc1ccc(C)cc1O ZINC001560961286 1060826993 /nfs/dbraw/zinc/82/69/93/1060826993.db2.gz DUQPOPNOIDCQGF-SFHVURJKSA-N 1 0 322.452 4.303 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@@H]1CCCC12CC2 ZINC001560961335 1060828380 /nfs/dbraw/zinc/82/83/80/1060828380.db2.gz FVDGTZARYHVZEM-HXUWFJFHSA-N 1 0 323.436 4.394 20 10 DICDRO Cc1cc(C[NH2+]C[C@@H]2CCC=CO2)c(C)n1-c1cccc(C)c1 ZINC001560964396 1060829268 /nfs/dbraw/zinc/82/92/68/1060829268.db2.gz LIMGRNHJRQKYAJ-FQEVSTJZSA-N 1 0 310.441 4.185 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CC[C@@H]2CCC3(CCC3)O2)c1 ZINC001561019152 1060876163 /nfs/dbraw/zinc/87/61/63/1060876163.db2.gz UNTFRBRPESMKIT-KRWDZBQOSA-N 1 0 303.446 4.097 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@H]2c2ccc(F)cc2)cc1 ZINC001561034948 1060888207 /nfs/dbraw/zinc/88/82/07/1060888207.db2.gz IDBUYAPIYBRMOJ-YADGQWAMSA-N 1 0 310.416 4.352 20 10 DICDRO CSc1ccc(CC[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC001462162720 1060983588 /nfs/dbraw/zinc/98/35/88/1060983588.db2.gz GSHDGQBKACXVKT-UHFFFAOYSA-N 1 0 314.498 4.115 20 10 DICDRO Cc1ccc(F)c(CC[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC001462245951 1061050282 /nfs/dbraw/zinc/05/02/82/1061050282.db2.gz IEFXPRLHWHXDJW-UHFFFAOYSA-N 1 0 309.384 4.325 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]Cc1cc(C2CC2)ccc1F ZINC001462283058 1061076040 /nfs/dbraw/zinc/07/60/40/1061076040.db2.gz ZNKPFQIWTYSTSV-UHFFFAOYSA-N 1 0 305.780 4.352 20 10 DICDRO Cc1ccc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c(O)c1 ZINC001462294088 1061084555 /nfs/dbraw/zinc/08/45/55/1061084555.db2.gz JKTDUWNJKIIXRR-UHFFFAOYSA-N 1 0 306.409 4.061 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@@H](C(C)(C)C)C[C@H]2C)cc1OC ZINC001462315178 1061100997 /nfs/dbraw/zinc/10/09/97/1061100997.db2.gz NKGMWSURHYLTBL-UKRRQHHQSA-N 1 0 321.461 4.056 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC(C)(C)C[C@@H]2c2ccccc2)c1 ZINC001462375966 1061136477 /nfs/dbraw/zinc/13/64/77/1061136477.db2.gz PRDXFNWERWKLQD-GOSISDBHSA-N 1 0 311.425 4.374 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1O)C(C)(C)C ZINC001462395405 1061148439 /nfs/dbraw/zinc/14/84/39/1061148439.db2.gz IYCYVCWXYIBZAG-OAHLLOKOSA-N 1 0 313.441 4.495 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(OC)c(C)c2)C12CCCCC2 ZINC001473446324 1061163300 /nfs/dbraw/zinc/16/33/00/1061163300.db2.gz CGPZHBUIHWINBH-RBUKOAKNSA-N 1 0 317.473 4.221 20 10 DICDRO Oc1c(C[NH2+]C[C@H]2CCN2C2CCCCC2)ccc2ccccc21 ZINC001462433907 1061172624 /nfs/dbraw/zinc/17/26/24/1061172624.db2.gz ARGAHAOYUGVYTD-LJQANCHMSA-N 1 0 324.468 4.042 20 10 DICDRO COc1cc(C)cc(C[NH2+]C2CCC(C3CCC3)CC2)c1O ZINC001462449211 1061182294 /nfs/dbraw/zinc/18/22/94/1061182294.db2.gz BLQGXDBUUHHJFO-UHFFFAOYSA-N 1 0 303.446 4.158 20 10 DICDRO COc1cc(O)c(C[N@H+](C)C[C@@H](C)C2CCCCC2)cc1OC ZINC001462494581 1061209608 /nfs/dbraw/zinc/20/96/08/1061209608.db2.gz KDUFXQZZXKOUGT-CQSZACIVSA-N 1 0 321.461 4.058 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CCc3cccnc32)c(C)n1-c1ccccc1 ZINC001462505616 1061217188 /nfs/dbraw/zinc/21/71/88/1061217188.db2.gz IWPIMWVNVTXTAZ-HXUWFJFHSA-N 1 0 317.436 4.266 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CCCSCC2)c(C)n1-c1ccccc1 ZINC001462513810 1061223758 /nfs/dbraw/zinc/22/37/58/1061223758.db2.gz ZRVKUZMAUUHDBP-GOSISDBHSA-N 1 0 314.498 4.469 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2ccc(N3CCCCC3)c(C)c2)n1 ZINC001473553896 1061242297 /nfs/dbraw/zinc/24/22/97/1061242297.db2.gz SKDZMPHMRBWGNK-UHFFFAOYSA-N 1 0 323.484 4.321 20 10 DICDRO C[C@@H](COCC1CCCCC1)[NH2+]Cc1ccc(Cl)cc1O ZINC001462585841 1061280035 /nfs/dbraw/zinc/28/00/35/1061280035.db2.gz BVZCIKUHYPSGNG-ZDUSSCGKSA-N 1 0 311.853 4.121 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2CCOC23CCCCC3)c1 ZINC001462624674 1061305046 /nfs/dbraw/zinc/30/50/46/1061305046.db2.gz RDWWNYVNKXQEEO-GOSISDBHSA-N 1 0 303.446 4.097 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCO[C@@H](c2ccccc2)CC1 ZINC001462681739 1061338124 /nfs/dbraw/zinc/33/81/24/1061338124.db2.gz YWSJGQXASGJSSS-OAQYLSRUSA-N 1 0 324.468 4.025 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)cc1 ZINC001473683312 1061342097 /nfs/dbraw/zinc/34/20/97/1061342097.db2.gz NDNCEHOXGBJNPA-IBGZPJMESA-N 1 0 309.457 4.121 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(OC)cc1 ZINC001473915121 1061462982 /nfs/dbraw/zinc/46/29/82/1061462982.db2.gz HHJBPCKDXDBVQA-IBGZPJMESA-N 1 0 311.425 4.261 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(OC)c(F)c2)cc1C ZINC001473919944 1061468671 /nfs/dbraw/zinc/46/86/71/1061468671.db2.gz WZWGFRHBSKFEDG-UHFFFAOYSA-N 1 0 317.404 4.221 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001473980506 1061522815 /nfs/dbraw/zinc/52/28/15/1061522815.db2.gz FPKKCQUPBZYBTM-UHFFFAOYSA-N 1 0 309.453 4.387 20 10 DICDRO CC1(C)C[C@H]1C[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001473995926 1061540597 /nfs/dbraw/zinc/54/05/97/1061540597.db2.gz OCJXYWWERGDXGK-FQEVSTJZSA-N 1 0 320.480 4.385 20 10 DICDRO CCS[C@@H]1CCC[C@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC001474038399 1061583389 /nfs/dbraw/zinc/58/33/89/1061583389.db2.gz PVTQFZHTZUHCFR-LOYZYROESA-N 1 0 318.530 4.420 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(F)cc1F ZINC001474039818 1061586307 /nfs/dbraw/zinc/58/63/07/1061586307.db2.gz YJIYJBDSOSZAII-GFCCVEGCSA-N 1 0 303.352 4.141 20 10 DICDRO Cc1cc(F)ccc1CC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001474043810 1061587817 /nfs/dbraw/zinc/58/78/17/1061587817.db2.gz UHKZECQWKYNCJR-PLNGDYQASA-N 1 0 312.432 4.046 20 10 DICDRO Cc1cccc(C)c1CC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001474045726 1061591113 /nfs/dbraw/zinc/59/11/13/1061591113.db2.gz LDVLQENRYMURAI-UHFFFAOYSA-N 1 0 308.469 4.236 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1NCc1ccc(N2CCCC2)cc1 ZINC001474055906 1061603352 /nfs/dbraw/zinc/60/33/52/1061603352.db2.gz WYXSLJGUFSACMI-UHFFFAOYSA-N 1 0 323.484 4.269 20 10 DICDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCCO3)CCC2 ZINC001474095133 1061642765 /nfs/dbraw/zinc/64/27/65/1061642765.db2.gz HAOBZQGDXBWPSK-HXUWFJFHSA-N 1 0 323.436 4.187 20 10 DICDRO C[C@]1(C[NH2+]Cc2ccc3c(c2)CCO3)CCCc2ccccc21 ZINC001474098679 1061645668 /nfs/dbraw/zinc/64/56/68/1061645668.db2.gz LBCIBONGBOSCRL-OAQYLSRUSA-N 1 0 307.437 4.005 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCCc3sccc32)cc1 ZINC001474102765 1061651485 /nfs/dbraw/zinc/65/14/85/1061651485.db2.gz OAXZNEVQJZMNEL-XDXAGZTOSA-N 1 0 312.482 4.495 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCCSC2)cc1 ZINC001474161128 1061704450 /nfs/dbraw/zinc/70/44/50/1061704450.db2.gz WIZHNXFHKCGHKM-KRWDZBQOSA-N 1 0 306.519 4.298 20 10 DICDRO CCOCc1cc(C[NH2+]CC2(C)CCCCC2)ccc1OC ZINC001474165893 1061709419 /nfs/dbraw/zinc/70/94/19/1061709419.db2.gz JZBNVIRMDHSLPF-UHFFFAOYSA-N 1 0 305.462 4.292 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)c(F)c1 ZINC001474185595 1061732866 /nfs/dbraw/zinc/73/28/66/1061732866.db2.gz UKGNVFOFJQPEHN-MRXNPFEDSA-N 1 0 314.448 4.229 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)CC2 ZINC001474198031 1061749098 /nfs/dbraw/zinc/74/90/98/1061749098.db2.gz VBMLGLPJPQZIHN-FNEOHHHZSA-N 1 0 306.453 4.351 20 10 DICDRO Cc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001474220358 1061778006 /nfs/dbraw/zinc/77/80/06/1061778006.db2.gz DYUFWPWVFZELDB-FQEVSTJZSA-N 1 0 307.437 4.487 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC001474255998 1061824082 /nfs/dbraw/zinc/82/40/82/1061824082.db2.gz CLAFOZUUQKWNPO-CQSZACIVSA-N 1 0 323.396 4.246 20 10 DICDRO Cc1cc(F)c(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)c(F)c1 ZINC001474278712 1061848258 /nfs/dbraw/zinc/84/82/58/1061848258.db2.gz RSTDXSZVLFISEL-SNAWJCMRSA-N 1 0 316.395 4.142 20 10 DICDRO CCC[N@H+](Cc1cccc(CC)c1O)[C@@H]1C[C@H](OCC)C1(C)C ZINC001474316372 1061884713 /nfs/dbraw/zinc/88/47/13/1061884713.db2.gz AGZLHRLAJGFCPH-MSOLQXFVSA-N 1 0 319.489 4.370 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@H]2Cc2ccc(F)cc2)c1O ZINC001474329168 1061918826 /nfs/dbraw/zinc/91/88/26/1061918826.db2.gz BGRGEIMXOQSIDB-IBGZPJMESA-N 1 0 313.416 4.301 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@H](C)Cc1ccsc1 ZINC001474344740 1061944864 /nfs/dbraw/zinc/94/48/64/1061944864.db2.gz RZHOCVIUIJTSKX-OAHLLOKOSA-N 1 0 302.487 4.186 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@@H](C)Cc1ccsc1 ZINC001474344739 1061945787 /nfs/dbraw/zinc/94/57/87/1061945787.db2.gz RZHOCVIUIJTSKX-HNNXBMFYSA-N 1 0 302.487 4.186 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCOc3ccccc3[C@H]2C)cc1Cl ZINC001474363754 1061989845 /nfs/dbraw/zinc/98/98/45/1061989845.db2.gz KZRNDPYDEOXYSO-CYBMUJFWSA-N 1 0 317.816 4.310 20 10 DICDRO c1ccc(CN2CCc3cc(C[N@H+]4CC=CCC4)ccc32)cc1 ZINC001474393761 1062048047 /nfs/dbraw/zinc/04/80/47/1062048047.db2.gz XXXKJLHHKQRMRT-UHFFFAOYSA-N 1 0 304.437 4.011 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)c1O ZINC001474407764 1062069406 /nfs/dbraw/zinc/06/94/06/1062069406.db2.gz HSOBLHYAIOGJKS-ZDUSSCGKSA-N 1 0 303.377 4.041 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)ccc1NC ZINC001474409022 1062073794 /nfs/dbraw/zinc/07/37/94/1062073794.db2.gz MURAKCLQACYPCD-UHFFFAOYSA-N 1 0 311.473 4.125 20 10 DICDRO CC(C)(C)Oc1ccc(CC[NH2+]Cc2cc(F)ccc2O)cc1 ZINC001254314074 1062076171 /nfs/dbraw/zinc/07/61/71/1062076171.db2.gz QFOZHHZYPJKVSV-UHFFFAOYSA-N 1 0 317.404 4.041 20 10 DICDRO CNc1ccc(C)cc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001474414498 1062080913 /nfs/dbraw/zinc/08/09/13/1062080913.db2.gz HLZZFHIFBJVJLL-UHFFFAOYSA-N 1 0 323.484 4.267 20 10 DICDRO CC[N@H+](CCC1CC1)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001474419964 1062091234 /nfs/dbraw/zinc/09/12/34/1062091234.db2.gz UCTPXIROBYZJCN-UHFFFAOYSA-N 1 0 314.395 4.393 20 10 DICDRO CCC[N@H+](CCc1cccs1)Cc1cccc(CC)c1O ZINC001474422723 1062093773 /nfs/dbraw/zinc/09/37/73/1062093773.db2.gz VXVQODPALQOENQ-UHFFFAOYSA-N 1 0 303.471 4.471 20 10 DICDRO Cc1ccc([C@@H]([NH2+]Cc2ccc(C)cc2O)c2ccccn2)cc1 ZINC001474493718 1062174033 /nfs/dbraw/zinc/17/40/33/1062174033.db2.gz XMOLACWSVZTVJV-OAQYLSRUSA-N 1 0 318.420 4.283 20 10 DICDRO CCC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1C[C@H](OCC)C1(C)C ZINC001459528411 1062185754 /nfs/dbraw/zinc/18/57/54/1062185754.db2.gz IROJBJQLAQUWNP-OALUTQOASA-N 1 0 318.505 4.168 20 10 DICDRO Cc1cc2cc(C[NH2+]Cc3ccc(Cl)cc3O)ccc2[nH]1 ZINC001474507598 1062191982 /nfs/dbraw/zinc/19/19/82/1062191982.db2.gz QFRZAMTVQOXMOB-UHFFFAOYSA-N 1 0 300.789 4.125 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2ccc(C)c3ccccc23)c1O ZINC001474582454 1062291731 /nfs/dbraw/zinc/29/17/31/1062291731.db2.gz XYWQXGGUUSMZKX-UHFFFAOYSA-N 1 0 321.420 4.461 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)C1CCSCC1 ZINC001474585383 1062292198 /nfs/dbraw/zinc/29/21/98/1062292198.db2.gz RRKSLHHGLHYXIU-HZPDHXFCSA-N 1 0 320.546 4.113 20 10 DICDRO CC[C@@H]1CCC[C@@H](C[N@H+](C)CCN(C)c2ccc(OC)cc2)C1 ZINC001474612428 1062329952 /nfs/dbraw/zinc/32/99/52/1062329952.db2.gz IAKNIIUAXZTLAM-QZTJIDSGSA-N 1 0 318.505 4.280 20 10 DICDRO CCCC[C@@H](CC)C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC001459745920 1062353513 /nfs/dbraw/zinc/35/35/13/1062353513.db2.gz BOUZRFODGSMEIU-MRXNPFEDSA-N 1 0 322.468 4.173 20 10 DICDRO CO[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)C1CCCCC1 ZINC001474646558 1062369835 /nfs/dbraw/zinc/36/98/35/1062369835.db2.gz SZPAFXNZETXIIZ-IBGZPJMESA-N 1 0 313.441 4.230 20 10 DICDRO CCCCC[C@@H]1CCC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC001459769619 1062380567 /nfs/dbraw/zinc/38/05/67/1062380567.db2.gz SLCSNNVZMYRTCZ-LJQANCHMSA-N 1 0 316.489 4.068 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CC(C)(C)[C@@H]2CCCCO2)c1 ZINC001474656244 1062386126 /nfs/dbraw/zinc/38/61/26/1062386126.db2.gz FDZDUSCQHARNSM-SFHVURJKSA-N 1 0 305.462 4.201 20 10 DICDRO CO[C@@H](C[NH2+]Cc1cc(C)n(-c2ccccc2)c1C)CC(C)C ZINC001474662330 1062392711 /nfs/dbraw/zinc/39/27/11/1062392711.db2.gz FACMWOSRHNAFER-HXUWFJFHSA-N 1 0 314.473 4.245 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@]2(O)CCCC(C)(C)CC2)c1 ZINC001474664435 1062395178 /nfs/dbraw/zinc/39/51/78/1062395178.db2.gz YDVXFAQZYGZQEU-FQEVSTJZSA-N 1 0 319.489 4.327 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H]3[C@@H](C2)C3(F)F)ccc1N1CCCCC1 ZINC001459796609 1062408123 /nfs/dbraw/zinc/40/81/23/1062408123.db2.gz JTUSWFFZWBXNNR-DLBZAZTESA-N 1 0 320.427 4.072 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cc(O)ccc2Cl)cc1Cl ZINC001474685871 1062416811 /nfs/dbraw/zinc/41/68/11/1062416811.db2.gz FGEZBBZAPNWSRT-UHFFFAOYSA-N 1 0 312.196 4.003 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1Cl ZINC001474703429 1062429150 /nfs/dbraw/zinc/42/91/50/1062429150.db2.gz DWCVINRJNCXNBS-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO O=C(CN1CC=CCC1)Nc1ccc(N=Nc2ccccc2)cc1 ZINC001459866252 1062457261 /nfs/dbraw/zinc/45/72/61/1062457261.db2.gz XPEPRZVCAMRPBE-UHFFFAOYSA-N 1 0 320.396 4.302 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H](C3CCCC3)C2)cc1F ZINC001474751312 1062462408 /nfs/dbraw/zinc/46/24/08/1062462408.db2.gz BEVBIGHCUPBQPS-HNNXBMFYSA-N 1 0 322.443 4.433 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1CCOC(C)(C)C1 ZINC001255534669 1062475140 /nfs/dbraw/zinc/47/51/40/1062475140.db2.gz GYUIVBUCZNUKHW-KSSFIOAISA-N 1 0 317.473 4.180 20 10 DICDRO Cc1ccc(SC[C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC001255755355 1062575767 /nfs/dbraw/zinc/57/57/67/1062575767.db2.gz KEOACPGKTNZTQK-INIZCTEOSA-N 1 0 314.498 4.331 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)ccc1N(C)C ZINC001460024581 1062579984 /nfs/dbraw/zinc/57/99/84/1062579984.db2.gz XGLSFTGZYLCXHN-FQEVSTJZSA-N 1 0 312.432 4.132 20 10 DICDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001255774059 1062596752 /nfs/dbraw/zinc/59/67/52/1062596752.db2.gz UWKKXNDSTAPHDU-GOSISDBHSA-N 1 0 308.469 4.316 20 10 DICDRO C[C@H](Cc1ccccc1F)[NH2+]Cc1cc2ccccc2cc1O ZINC001255840796 1062627626 /nfs/dbraw/zinc/62/76/26/1062627626.db2.gz JEBCBLROVNVXSM-CQSZACIVSA-N 1 0 309.384 4.405 20 10 DICDRO CCC[C@@]1([NH2+]Cc2ccc(N3CCCCC3)c(C)c2)CCOC1 ZINC001460095096 1062631219 /nfs/dbraw/zinc/63/12/19/1062631219.db2.gz ANVCLBAEOVMLSE-HXUWFJFHSA-N 1 0 316.489 4.034 20 10 DICDRO CCC[C@]1([NH2+]Cc2ccc(N3CCCCC3)c(C)c2)CCOC1 ZINC001460095093 1062631919 /nfs/dbraw/zinc/63/19/19/1062631919.db2.gz ANVCLBAEOVMLSE-FQEVSTJZSA-N 1 0 316.489 4.034 20 10 DICDRO C[C@H](Cc1ccc(F)cc1)[NH2+]Cc1cc2ccccc2cc1O ZINC001255864138 1062642247 /nfs/dbraw/zinc/64/22/47/1062642247.db2.gz WSUVTLVICICTRM-CQSZACIVSA-N 1 0 309.384 4.405 20 10 DICDRO Oc1cccc2c1C[N@@H+]([C@H]1CCC[C@H](c3ccccc3)C1)CC2 ZINC001256121219 1062720570 /nfs/dbraw/zinc/72/05/70/1062720570.db2.gz NODMFLYAYNZYMR-OALUTQOASA-N 1 0 307.437 4.477 20 10 DICDRO Oc1cccc2c1C[N@@H+]([C@@H]1CCC[C@H](c3ccccc3)C1)CC2 ZINC001256121220 1062721184 /nfs/dbraw/zinc/72/11/84/1062721184.db2.gz NODMFLYAYNZYMR-RBUKOAKNSA-N 1 0 307.437 4.477 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H](C)Cc1ccncc1 ZINC001256732266 1062957473 /nfs/dbraw/zinc/95/74/73/1062957473.db2.gz CXISUKYXBHLBCJ-YWZLYKJASA-N 1 0 324.468 4.248 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)cc1C ZINC001256800110 1062988775 /nfs/dbraw/zinc/98/87/75/1062988775.db2.gz YURJGYUMLWFWFI-QUCCMNQESA-N 1 0 311.425 4.014 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC001257086213 1063109664 /nfs/dbraw/zinc/10/96/64/1063109664.db2.gz FTKCTJUNAALOEY-NXEZDXNNSA-N 1 0 317.473 4.178 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC001257086214 1063110160 /nfs/dbraw/zinc/11/01/60/1063110160.db2.gz FTKCTJUNAALOEY-YGTYGHESSA-N 1 0 317.473 4.178 20 10 DICDRO COc1cc(C[NH2+][C@@H]2CCCC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001461002117 1063177596 /nfs/dbraw/zinc/17/75/96/1063177596.db2.gz QQSDHYVXZFBKER-CXAGYDPISA-N 1 0 305.462 4.367 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2CCCCC2)c(C(F)(F)F)c1 ZINC001461000616 1063178611 /nfs/dbraw/zinc/17/86/11/1063178611.db2.gz ODFHIHQVSXZPES-UHFFFAOYSA-N 1 0 300.368 4.194 20 10 DICDRO COc1cc(C[NH2+]Cc2cccc(C)c2)c(O)c(C(C)(C)C)c1 ZINC001461023471 1063196169 /nfs/dbraw/zinc/19/61/69/1063196169.db2.gz OPHACEUJLLRJOM-UHFFFAOYSA-N 1 0 313.441 4.297 20 10 DICDRO Cc1ccc([C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C2CC2)cc1 ZINC001461025561 1063197368 /nfs/dbraw/zinc/19/73/68/1063197368.db2.gz ZXIHQSFYQFVYBX-FQEVSTJZSA-N 1 0 312.432 4.441 20 10 DICDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC001461051923 1063218400 /nfs/dbraw/zinc/21/84/00/1063218400.db2.gz BNZGCSZUWBNOPR-WMZOPIPTSA-N 1 0 318.530 4.156 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(F)c(F)c2)cc1C ZINC001461106229 1063256230 /nfs/dbraw/zinc/25/62/30/1063256230.db2.gz NNBDTQLQMOVBKE-UHFFFAOYSA-N 1 0 305.368 4.352 20 10 DICDRO CN1CCCc2cc(C[NH2+]C[C@@H]3CCCC(C)(C)C3)ccc21 ZINC001461112414 1063262109 /nfs/dbraw/zinc/26/21/09/1063262109.db2.gz MSRWRDDZNSCCOK-QGZVFWFLSA-N 1 0 300.490 4.375 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc2cccnc12 ZINC001461122062 1063272524 /nfs/dbraw/zinc/27/25/24/1063272524.db2.gz YMFYDAMBMHRKJH-UHFFFAOYSA-N 1 0 323.415 4.038 20 10 DICDRO CCC[C@H](C)CC[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001257463765 1063286496 /nfs/dbraw/zinc/28/64/96/1063286496.db2.gz PXIYGBJPHBPTQB-ROUUACIJSA-N 1 0 318.505 4.218 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@H](SC)C2)cc1F ZINC001461184502 1063316601 /nfs/dbraw/zinc/31/66/01/1063316601.db2.gz ZRCBSIDQNKWYHG-HOTGVXAUSA-N 1 0 324.509 4.436 20 10 DICDRO CCCCCC(CCCCC)[NH2+]C[C@@H](O)c1ccc(O)c(O)c1 ZINC001257550923 1063333318 /nfs/dbraw/zinc/33/33/18/1063333318.db2.gz XSLCQGYOAUYARY-LJQANCHMSA-N 1 0 323.477 4.250 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(Cl)c1 ZINC001473108201 1063406655 /nfs/dbraw/zinc/40/66/55/1063406655.db2.gz PGBPZTADHHIEMO-UHFFFAOYSA-N 1 0 302.849 4.428 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@H](OC)C2(CC)CC)cc1 ZINC001461372954 1063453971 /nfs/dbraw/zinc/45/39/71/1063453971.db2.gz HWTYZVPMTIXARL-MOPGFXCFSA-N 1 0 318.505 4.216 20 10 DICDRO Oc1cccc2c1C[N@@H+](C1CCC(c3ccccc3)CC1)CC2 ZINC001257998484 1063456282 /nfs/dbraw/zinc/45/62/82/1063456282.db2.gz GBOZNNDOMKEMEH-UHFFFAOYSA-N 1 0 307.437 4.477 20 10 DICDRO Cc1cc(C[N@H+](Cc2ccccc2O)C2CCCC2)sn1 ZINC001473153795 1063460027 /nfs/dbraw/zinc/46/00/27/1063460027.db2.gz IHLLCWIQYDPKCD-UHFFFAOYSA-N 1 0 302.443 4.102 20 10 DICDRO CC(C)C[C@H](C)C[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001258052521 1063486039 /nfs/dbraw/zinc/48/60/39/1063486039.db2.gz QGCOOPDEQNOKJH-ROUUACIJSA-N 1 0 318.505 4.074 20 10 DICDRO CS[C@H](C[NH2+]Cc1c(C)c2ccccc2n1C)C(C)(C)C ZINC001461432090 1063499165 /nfs/dbraw/zinc/49/91/65/1063499165.db2.gz QVVVWPWSQZCJJY-QGZVFWFLSA-N 1 0 304.503 4.354 20 10 DICDRO CC(C)C[C@@H](C)C[C@H](C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001258076216 1063503995 /nfs/dbraw/zinc/50/39/95/1063503995.db2.gz YAUPKRDOWWKAQZ-CABCVRRESA-N 1 0 305.462 4.307 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2(C(F)(F)F)CC2)cc1C ZINC001461497480 1063538827 /nfs/dbraw/zinc/53/88/27/1063538827.db2.gz QEPOPYOFCJJIQD-UHFFFAOYSA-N 1 0 301.352 4.216 20 10 DICDRO CSCC[C@H](C)[NH2+][C@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001258213551 1063561856 /nfs/dbraw/zinc/56/18/56/1063561856.db2.gz RPBNDMFHQYVWHL-GUYCJALGSA-N 1 0 307.503 4.364 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)cc1F ZINC001461541332 1063569623 /nfs/dbraw/zinc/56/96/23/1063569623.db2.gz RRFKFLRFZPGNHX-AWEZNQCLSA-N 1 0 314.395 4.197 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CC2(OC)CCCC2)cc1 ZINC001461545382 1063572088 /nfs/dbraw/zinc/57/20/88/1063572088.db2.gz CGJFCJRLCZEKQS-UHFFFAOYSA-N 1 0 318.505 4.362 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c(Cl)c1 ZINC001461599014 1063603906 /nfs/dbraw/zinc/60/39/06/1063603906.db2.gz DPZRDHDOXDAXQN-GJZGRUSLSA-N 1 0 301.817 4.247 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@@]2(C)C[C@@]2(F)Cl)cc1 ZINC001461616570 1063614462 /nfs/dbraw/zinc/61/44/62/1063614462.db2.gz QEULFHXDMRZSFS-IRXDYDNUSA-N 1 0 312.860 4.327 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)c(C(F)(F)F)c1 ZINC001461622182 1063619546 /nfs/dbraw/zinc/61/95/46/1063619546.db2.gz WTGVKDMEBRGAJN-FPMFFAJLSA-N 1 0 312.379 4.050 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCSC(C)(C)C1 ZINC001461784782 1063716245 /nfs/dbraw/zinc/71/62/45/1063716245.db2.gz BJKCWWWIMZJNFG-AWEZNQCLSA-N 1 0 302.487 4.251 20 10 DICDRO c1cc(CCC[NH2+]Cc2ccc(N3CCCC3)cc2)cs1 ZINC001461834305 1063740395 /nfs/dbraw/zinc/74/03/95/1063740395.db2.gz YPGXBUIFONWWJC-UHFFFAOYSA-N 1 0 300.471 4.071 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2C[C@H]2C2CCCC2)ccc1OC ZINC001461830699 1063741061 /nfs/dbraw/zinc/74/10/61/1063741061.db2.gz NEGHVQRQJKQVMK-HKUYNNGSSA-N 1 0 317.473 4.148 20 10 DICDRO CCCC[C@@H](Cc1ccccc1)[NH2+]CCc1ccc(O)c(O)c1 ZINC001258705805 1063763486 /nfs/dbraw/zinc/76/34/86/1063763486.db2.gz LITJNHXUCHFEPX-SFHVURJKSA-N 1 0 313.441 4.031 20 10 DICDRO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1ccc(C)cc1O)CCC2 ZINC001461918198 1063800693 /nfs/dbraw/zinc/80/06/93/1063800693.db2.gz FSJNJGQLDJSEKD-OAHLLOKOSA-N 1 0 316.470 4.229 20 10 DICDRO CCCC[C@H](CCC)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258762935 1063806589 /nfs/dbraw/zinc/80/65/89/1063806589.db2.gz FRYVGIVKJGNYRV-IBGZPJMESA-N 1 0 318.505 4.314 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCCC[C@H]2CCC(C)C)c(O)c1 ZINC001461930154 1063816800 /nfs/dbraw/zinc/81/68/00/1063816800.db2.gz STQYTTMXDMSNNT-INIZCTEOSA-N 1 0 305.462 4.500 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2cc(C(C)C)ccc2O)cc1F ZINC001461935197 1063820178 /nfs/dbraw/zinc/82/01/78/1063820178.db2.gz SCBGHAYZSUOXMY-UHFFFAOYSA-N 1 0 317.404 4.295 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1O ZINC001461988004 1063861430 /nfs/dbraw/zinc/86/14/30/1063861430.db2.gz LCVAQAUEOVKUKR-TYNCELHUSA-N 1 0 309.837 4.207 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)cc(OC)c1O)c1ccc(C)c(F)c1 ZINC001462003895 1063874099 /nfs/dbraw/zinc/87/40/99/1063874099.db2.gz ZBOLRJPLEIYMAZ-KRWDZBQOSA-N 1 0 317.404 4.398 20 10 DICDRO Cc1ccccc1OCC[N@@H+](C)Cc1cc(Cl)cc(F)c1[O-] ZINC001462028807 1063889213 /nfs/dbraw/zinc/88/92/13/1063889213.db2.gz YKJAMURMIWHETJ-UHFFFAOYSA-N 1 0 323.795 4.004 20 10 DICDRO Cc1ccc(C[NH2+]C[C@@H](c2ccccc2)C(F)(F)F)c(O)c1 ZINC001462107657 1063932491 /nfs/dbraw/zinc/93/24/91/1063932491.db2.gz XATACWRGYPHJFQ-HNNXBMFYSA-N 1 0 309.331 4.136 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](C1CCC1)[C@@H]1CCOC1 ZINC001261852402 1063950021 /nfs/dbraw/zinc/95/00/21/1063950021.db2.gz BLFKIHBDCKLKBL-BCEDRHLLSA-N 1 0 315.457 4.044 20 10 DICDRO Oc1cccc(Cl)c1CNc1cccc(C[NH+]2CCCC2)c1 ZINC000378899683 1063980221 /nfs/dbraw/zinc/98/02/21/1063980221.db2.gz WGJQJVPKWFQLAR-UHFFFAOYSA-N 1 0 316.832 4.254 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@H]2CC3CCC2CC3)c1O ZINC000381984361 1063996731 /nfs/dbraw/zinc/99/67/31/1063996731.db2.gz WWJUNTPQFKILPF-NEQJSVFRSA-N 1 0 323.864 4.359 20 10 DICDRO CCCC(C)(C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000732229485 1064517933 /nfs/dbraw/zinc/51/79/33/1064517933.db2.gz ATZDBZKNXONTOO-UHFFFAOYSA-N 1 0 319.449 4.253 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000743870538 1064975845 /nfs/dbraw/zinc/97/58/45/1064975845.db2.gz WRDZGGYSBYWMDU-AWEZNQCLSA-N 1 0 314.385 4.274 20 10 DICDRO Clc1cnc(S[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC001307377632 1065361740 /nfs/dbraw/zinc/36/17/40/1065361740.db2.gz PTXHHLXDVUMKLB-GFCCVEGCSA-N 1 0 310.875 4.163 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cc1 ZINC001307425416 1065386918 /nfs/dbraw/zinc/38/69/18/1065386918.db2.gz FLHWKTHRDVCFET-HXUWFJFHSA-N 1 0 312.432 4.099 20 10 DICDRO CC(C)C[C@@H](C)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC001307566734 1065486431 /nfs/dbraw/zinc/48/64/31/1065486431.db2.gz LSSSYKRWGLPQCL-SJLPKXTDSA-N 1 0 305.462 4.055 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCC2(CCC2)O1 ZINC001307722725 1065586057 /nfs/dbraw/zinc/58/60/57/1065586057.db2.gz YJIVASKRNJBVEX-QGZVFWFLSA-N 1 0 303.446 4.096 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)CC1(O)CCCCCC1 ZINC001307721719 1065586473 /nfs/dbraw/zinc/58/64/73/1065586473.db2.gz MUSSFEQQCFVHFG-UHFFFAOYSA-N 1 0 305.462 4.080 20 10 DICDRO COc1ccc2c(c1)C[C@@H](C(C)C)CN2CCCCCCCO ZINC001307864098 1065658017 /nfs/dbraw/zinc/65/80/17/1065658017.db2.gz OGUHOBDHPOETBE-GOSISDBHSA-N 1 0 319.489 4.273 20 10 DICDRO C[C@H]([NH2+]CCSc1ccc(F)cc1F)c1ccccc1O ZINC001308009656 1065722998 /nfs/dbraw/zinc/72/29/98/1065722998.db2.gz BUYOEXKFPXHHDI-NSHDSACASA-N 1 0 309.381 4.113 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2ccc(Cl)cc2n1)c1ccccc1O ZINC001308010518 1065723638 /nfs/dbraw/zinc/72/36/38/1065723638.db2.gz QQNBEUBFSOZXRI-LBPRGKRZSA-N 1 0 312.800 4.445 20 10 DICDRO Cc1cc(Cl)ccc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001308230689 1065836409 /nfs/dbraw/zinc/83/64/09/1065836409.db2.gz CTLNDGZDZGJSHK-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO CCCOc1ccc(C[NH2+]CCOC2CCCCC2)cc1C ZINC001308249899 1065854663 /nfs/dbraw/zinc/85/46/63/1065854663.db2.gz NZJCLEDPDHATCU-UHFFFAOYSA-N 1 0 305.462 4.223 20 10 DICDRO Cc1cccc([C@@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1C ZINC001308261221 1065862999 /nfs/dbraw/zinc/86/29/99/1065862999.db2.gz PJFJONVGSHEYEC-CQSZACIVSA-N 1 0 318.411 4.498 20 10 DICDRO Cc1c2ccccc2oc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001308265511 1065865357 /nfs/dbraw/zinc/86/53/57/1065865357.db2.gz FYKFGZVRIRNGQV-UHFFFAOYSA-N 1 0 312.388 4.236 20 10 DICDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(C)c1 ZINC001308270200 1065870299 /nfs/dbraw/zinc/87/02/99/1065870299.db2.gz UHGFSFVCWFAIKN-MRXNPFEDSA-N 1 0 314.448 4.229 20 10 DICDRO Cc1ccc([C@@H](C)C[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001308275861 1065874226 /nfs/dbraw/zinc/87/42/26/1065874226.db2.gz HIPVQZQHJLOCCG-XFHJGTJQSA-N 1 0 308.469 4.468 20 10 DICDRO Cc1cccc(O[C@H](C)C[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC001308275334 1065874679 /nfs/dbraw/zinc/87/46/79/1065874679.db2.gz QXYRALMPASUGOC-XOWYPZSQSA-N 1 0 324.468 4.131 20 10 DICDRO CCc1ccc(CC[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001308278702 1065878568 /nfs/dbraw/zinc/87/85/68/1065878568.db2.gz DMMYZJSZYVYNGM-WAYWQWQTSA-N 1 0 308.469 4.161 20 10 DICDRO CCCCO[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1(C)C ZINC001308303369 1065899795 /nfs/dbraw/zinc/89/97/95/1065899795.db2.gz OGDUFBRBFMIYIK-MOPGFXCFSA-N 1 0 317.473 4.085 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c(C)c1 ZINC001308377398 1065950671 /nfs/dbraw/zinc/95/06/71/1065950671.db2.gz YXPICWBNUAXEPD-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC1CCC(F)(F)CC1 ZINC001308384165 1065955719 /nfs/dbraw/zinc/95/57/19/1065955719.db2.gz UEXFWTLLHUOOHZ-UHFFFAOYSA-N 1 0 306.400 4.402 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](C)CCC=C(C)C)ccc1OC ZINC001308411451 1065970157 /nfs/dbraw/zinc/97/01/57/1065970157.db2.gz QAXVEHBYLZDLHW-MRXNPFEDSA-N 1 0 305.462 4.456 20 10 DICDRO Clc1cccc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCC2)c1 ZINC001308444039 1065992561 /nfs/dbraw/zinc/99/25/61/1065992561.db2.gz FYOMYXOJHOXHFR-UHFFFAOYSA-N 1 0 313.828 4.444 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](CC)[C@H]2CCCCO2)cc1C ZINC001308451202 1065996898 /nfs/dbraw/zinc/99/68/98/1065996898.db2.gz VOSYFFBPJHRSCM-PKOBYXMFSA-N 1 0 305.462 4.221 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(Cl)c2C)c1 ZINC001308450648 1065997229 /nfs/dbraw/zinc/99/72/29/1065997229.db2.gz PCGMIUAXIXTLSL-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC(C)(C)c1ccc(C)cn1 ZINC001308467050 1066007471 /nfs/dbraw/zinc/00/74/71/1066007471.db2.gz UFMSFTRORDUNIV-UHFFFAOYSA-N 1 0 321.468 4.258 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC23CCCCC3)cc1F ZINC001308477139 1066016698 /nfs/dbraw/zinc/01/66/98/1066016698.db2.gz AODCFFMJBIBEHU-GOSISDBHSA-N 1 0 304.453 4.484 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H](OC)C2CCCCC2)cc1 ZINC001308477455 1066017621 /nfs/dbraw/zinc/01/76/21/1066017621.db2.gz KOFQVSGGRUPHOQ-FQEVSTJZSA-N 1 0 318.505 4.218 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2ccnc(F)c2)cc1 ZINC001308481465 1066020627 /nfs/dbraw/zinc/02/06/27/1066020627.db2.gz UKJOEPVRRDKXKA-UHFFFAOYSA-N 1 0 315.436 4.137 20 10 DICDRO Clc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308488088 1066022828 /nfs/dbraw/zinc/02/28/28/1066022828.db2.gz SLZJXONFZOGZLK-SFHVURJKSA-N 1 0 313.828 4.442 20 10 DICDRO CCC(F)(F)C(C)(C)C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001308488984 1066023159 /nfs/dbraw/zinc/02/31/59/1066023159.db2.gz KUOXFHNUFGJSHJ-FPLPWBNLSA-N 1 0 310.432 4.427 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@@H](C)CC2CCC2)c1O ZINC001474651779 1066027676 /nfs/dbraw/zinc/02/76/76/1066027676.db2.gz ZUVHWJJOVACBBX-NSHDSACASA-N 1 0 312.251 4.131 20 10 DICDRO COc1cc(C[NH2+]C[C@@H]2C[C@@H]2[C@H]2C[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308521368 1066041946 /nfs/dbraw/zinc/04/19/46/1066041946.db2.gz BQEYUHVGPHVFLL-OQUILHJVSA-N 1 0 317.473 4.080 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCCc2cccnc21 ZINC001308538840 1066054989 /nfs/dbraw/zinc/05/49/89/1066054989.db2.gz ALTIDDSDVJFMNT-KRWDZBQOSA-N 1 0 305.425 4.049 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCCc2ccsc2)cc1 ZINC001308556048 1066066663 /nfs/dbraw/zinc/06/66/63/1066066663.db2.gz RHGKADSIWOTCAE-HYXAFXHYSA-N 1 0 300.471 4.050 20 10 DICDRO CCc1cccc(C[NH+]2CCC(OCC3CCCC3)CC2)c1O ZINC001308576317 1066091065 /nfs/dbraw/zinc/09/10/65/1066091065.db2.gz OZJZDNJLWDKHNW-UHFFFAOYSA-N 1 0 317.473 4.126 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)Cc2cccs2)cc1Cl ZINC001308594808 1066107260 /nfs/dbraw/zinc/10/72/60/1066107260.db2.gz MHKVLJKXHOLXNK-LBPRGKRZSA-N 1 0 309.862 4.479 20 10 DICDRO CCC[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001308630321 1066126020 /nfs/dbraw/zinc/12/60/20/1066126020.db2.gz CYQDHFAQEWSVNY-GFCCVEGCSA-N 1 0 302.384 4.392 20 10 DICDRO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC001308629839 1066126352 /nfs/dbraw/zinc/12/63/52/1066126352.db2.gz YUPDHCRJRSUPBB-RTRPANQVSA-N 1 0 324.468 4.034 20 10 DICDRO C[C@H](Cc1ccc(O)cc1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC001308629837 1066126925 /nfs/dbraw/zinc/12/69/25/1066126925.db2.gz YUPDHCRJRSUPBB-KEGWNNHHSA-N 1 0 324.468 4.034 20 10 DICDRO C[C@@H]1CCC[N@@H+]1Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001308629094 1066126977 /nfs/dbraw/zinc/12/69/77/1066126977.db2.gz INGIGIMUEPUCDK-QGZVFWFLSA-N 1 0 306.453 4.234 20 10 DICDRO C[C@@H]1C[N@H+](Cc2c(O)cccc2Br)[C@H]2CCCC[C@H]12 ZINC001308637664 1066131814 /nfs/dbraw/zinc/13/18/14/1066131814.db2.gz PLYFWTLMQUYJJC-JMSVASOKSA-N 1 0 324.262 4.165 20 10 DICDRO CN(C)c1cc(F)c(C[N@H+](C)[C@H]2CCc3ccccc32)cc1F ZINC001308661141 1066141640 /nfs/dbraw/zinc/14/16/40/1066141640.db2.gz YFDCFWGQOORJBV-SFHVURJKSA-N 1 0 316.395 4.150 20 10 DICDRO CCc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(CC)c1O)CCO2 ZINC001308667190 1066145673 /nfs/dbraw/zinc/14/56/73/1066145673.db2.gz GQOVPPCLKDVJBB-SFHVURJKSA-N 1 0 311.425 4.130 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCC3(CCCCC3)O2)cc1Cl ZINC001308686451 1066154692 /nfs/dbraw/zinc/15/46/92/1066154692.db2.gz PNIPWBDWOMTRRA-HNNXBMFYSA-N 1 0 323.864 4.326 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCC3(CCCCC3)CC2)c1 ZINC001308691494 1066183981 /nfs/dbraw/zinc/18/39/81/1066183981.db2.gz AWALDFFSSKUCED-UHFFFAOYSA-N 1 0 303.446 4.337 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCO[C@H]2CC(C)C)cc1Cl ZINC001308710196 1066192844 /nfs/dbraw/zinc/19/28/44/1066192844.db2.gz DAXVVWSOMPRWKT-WBVHZDCISA-N 1 0 311.853 4.037 20 10 DICDRO Cc1ccc(CNc2ccc(C[NH+](C)C)c(Cl)c2)c(O)c1 ZINC001308729596 1066204034 /nfs/dbraw/zinc/20/40/34/1066204034.db2.gz WALYZZMNABOPDV-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO COc1cc(C)c(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2)c(O)c1 ZINC001308753235 1066227272 /nfs/dbraw/zinc/22/72/72/1066227272.db2.gz MOBDIDUZNXQABI-IFXJQAMLSA-N 1 0 311.425 4.292 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)c(O)c1 ZINC001308792334 1066268282 /nfs/dbraw/zinc/26/82/82/1066268282.db2.gz IPEDCAJDDBARTJ-QGZVFWFLSA-N 1 0 303.352 4.146 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)C2CCC(F)(F)CC2)cc1Cl ZINC001308794831 1066270206 /nfs/dbraw/zinc/27/02/06/1066270206.db2.gz NXBIXFMYXIPVCA-UHFFFAOYSA-N 1 0 303.780 4.364 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC001308824982 1066300284 /nfs/dbraw/zinc/30/02/84/1066300284.db2.gz KVSRKIYRSLBBQA-RBDMOPTHSA-N 1 0 322.496 4.385 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC001308824983 1066302666 /nfs/dbraw/zinc/30/26/66/1066302666.db2.gz KVSRKIYRSLBBQA-UCNVEGJOSA-N 1 0 322.496 4.385 20 10 DICDRO C[C@]1(C[NH2+]Cc2cc(Cl)ccc2O)C[C@@H]1c1ccccc1 ZINC001308845165 1066319699 /nfs/dbraw/zinc/31/96/99/1066319699.db2.gz DZGGQNSIASBAOH-SJLPKXTDSA-N 1 0 301.817 4.329 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCc2cccc(Cl)c2C1 ZINC001308846727 1066322288 /nfs/dbraw/zinc/32/22/88/1066322288.db2.gz USFCOBDIEMGKJD-CQSZACIVSA-N 1 0 322.235 4.346 20 10 DICDRO CCC[C@@H]([NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)C1CCCC1 ZINC001308860209 1066341804 /nfs/dbraw/zinc/34/18/04/1066341804.db2.gz QDJCCJYLPHRZQH-YLJYHZDGSA-N 1 0 316.489 4.222 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@@]23C[C@@H]2CCCC3)c1O ZINC001308899080 1066377687 /nfs/dbraw/zinc/37/76/87/1066377687.db2.gz ORHZHZLQQPSIJU-BTJLNZGRSA-N 1 0 309.837 4.113 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]C[C@@H]1C=CCC1 ZINC001308918403 1066397928 /nfs/dbraw/zinc/39/79/28/1066397928.db2.gz LAZBEMRKYZNKFZ-MRXNPFEDSA-N 1 0 309.409 4.027 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C2CC(Nc3ccccc3)C2)c1 ZINC001308933639 1066406619 /nfs/dbraw/zinc/40/66/19/1066406619.db2.gz RPGJBMMNBJMOCB-UHFFFAOYSA-N 1 0 310.441 4.248 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC001308974638 1066427907 /nfs/dbraw/zinc/42/79/07/1066427907.db2.gz JYDGBJIOUJHDMZ-MSOLQXFVSA-N 1 0 317.473 4.154 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC001308974639 1066428181 /nfs/dbraw/zinc/42/81/81/1066428181.db2.gz JYDGBJIOUJHDMZ-QZTJIDSGSA-N 1 0 317.473 4.154 20 10 DICDRO CCOc1cccc(C[N@H+]([C@H](C)c2ccco2)C2CC2)c1O ZINC000092483680 185321580 /nfs/dbraw/zinc/32/15/80/185321580.db2.gz KTLGUYIOWUJQQV-CYBMUJFWSA-N 1 0 301.386 4.110 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)c1nccs1 ZINC000186740125 200001784 /nfs/dbraw/zinc/00/17/84/200001784.db2.gz FBPNUEYFRLTPOG-STQMWFEESA-N 1 0 312.438 4.456 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)c1O ZINC000021044160 182262767 /nfs/dbraw/zinc/26/27/67/182262767.db2.gz CPSYPTPQEXAXKN-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(OC)c1O)c1ccc(Cl)cc1 ZINC000036979279 182858490 /nfs/dbraw/zinc/85/84/90/182858490.db2.gz YNDJEIIMOUFQGD-HNNXBMFYSA-N 1 0 305.805 4.295 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3sccc32)c1 ZINC000061331113 184168927 /nfs/dbraw/zinc/16/89/27/184168927.db2.gz IOXNZUPELPKYAO-XHDPSFHLSA-N 1 0 303.427 4.191 20 10 DICDRO C[C@H]([NH2+]C1CCN(C2CCC2)CC1)c1ccc2ccccc2c1O ZINC000273366815 130113065 /nfs/dbraw/zinc/11/30/65/130113065.db2.gz BRBMRGZGPLLGEM-HNNXBMFYSA-N 1 0 324.468 4.213 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(C)o1 ZINC000273389624 130115965 /nfs/dbraw/zinc/11/59/65/130115965.db2.gz DHKLZPVZPMQACE-HOCLYGCPSA-N 1 0 303.402 4.030 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c(O)c1C ZINC000273470694 130125312 /nfs/dbraw/zinc/12/53/12/130125312.db2.gz JNWOVDUQTAQRHJ-GUYCJALGSA-N 1 0 315.388 4.323 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)cc2SC)c1 ZINC000273469261 130125468 /nfs/dbraw/zinc/12/54/68/130125468.db2.gz FJXHAQXADONZCK-ZDUSSCGKSA-N 1 0 317.454 4.282 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000273505258 130129286 /nfs/dbraw/zinc/12/92/86/130129286.db2.gz QXOVAMYVYOHMQK-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCOC)c1ccc(C)o1)c1ccccc1O ZINC000274807679 130263921 /nfs/dbraw/zinc/26/39/21/130263921.db2.gz XDJZLLKXUBLYQX-CVEARBPZSA-N 1 0 303.402 4.112 20 10 DICDRO CC[C@H]([NH2+][C@H](CCOC)c1ccc(C)o1)c1ccccc1O ZINC000274808329 130264083 /nfs/dbraw/zinc/26/40/83/130264083.db2.gz XDJZLLKXUBLYQX-JKSUJKDBSA-N 1 0 303.402 4.112 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccc(C)cc1O ZINC000280013083 130775963 /nfs/dbraw/zinc/77/59/63/130775963.db2.gz GWFGGRXEWFSNFK-IRXDYDNUSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000284966655 131127417 /nfs/dbraw/zinc/12/74/17/131127417.db2.gz FQWGCYMFKLQGSI-CHWSQXEVSA-N 1 0 302.418 4.068 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2O)c(C)c1OC ZINC000287190810 131268208 /nfs/dbraw/zinc/26/82/08/131268208.db2.gz VUUSNFDBSGKRBD-UONOGXRCSA-N 1 0 315.413 4.130 20 10 DICDRO COc1cccc(C[NH2+]Cc2ccc(C(C)(C)C)s2)c1O ZINC000289473756 131388984 /nfs/dbraw/zinc/38/89/84/131388984.db2.gz PTFRBAPDLAPKQV-UHFFFAOYSA-N 1 0 305.443 4.050 20 10 DICDRO Cc1cc(Br)cc([C@H](C)[NH2+]CCC(C)(F)F)c1O ZINC000297278133 132006785 /nfs/dbraw/zinc/00/67/85/132006785.db2.gz LDTMTYWBEOVOQB-VIFPVBQESA-N 1 0 322.193 4.159 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccc(N2CCCC2)c1 ZINC000297909129 132039990 /nfs/dbraw/zinc/03/99/90/132039990.db2.gz WNWKDLMTOQRLFM-BEFAXECRSA-N 1 0 322.452 4.331 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccc(N2CCCC2)c1 ZINC000297909149 132040190 /nfs/dbraw/zinc/04/01/90/132040190.db2.gz WNWKDLMTOQRLFM-KXBFYZLASA-N 1 0 322.452 4.331 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1 ZINC000119652623 132135306 /nfs/dbraw/zinc/13/53/06/132135306.db2.gz QWMBHMODQYPIPA-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c(F)c2)c1 ZINC000121505301 132156269 /nfs/dbraw/zinc/15/62/69/132156269.db2.gz ZLSKOCYZKAUVNH-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO COc1ccc(C[NH2+]Cc2cccc(Br)c2)cc1C ZINC000048818242 332305686 /nfs/dbraw/zinc/30/56/86/332305686.db2.gz NXBXCDCZAUKRJL-UHFFFAOYSA-N 1 0 320.230 4.056 20 10 DICDRO CCOCc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1 ZINC000184989973 333203272 /nfs/dbraw/zinc/20/32/72/333203272.db2.gz HVVDTFMAQDWMIJ-CYBMUJFWSA-N 1 0 319.832 4.433 20 10 DICDRO Cc1noc(C)c1CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185395961 333208236 /nfs/dbraw/zinc/20/82/36/333208236.db2.gz FWKBYGSGCOWGCB-LBPRGKRZSA-N 1 0 310.397 4.044 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c1 ZINC000019999491 333296061 /nfs/dbraw/zinc/29/60/61/333296061.db2.gz VSTSFPMGENVLBU-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C)cc1O ZINC000280231524 334115602 /nfs/dbraw/zinc/11/56/02/334115602.db2.gz VIUSEIODYFKSPR-DYVFJYSZSA-N 1 0 314.385 4.411 20 10 DICDRO C[C@H]([NH2+][C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccccc1O ZINC000367828747 336830255 /nfs/dbraw/zinc/83/02/55/336830255.db2.gz WCUSRLFQNMGRFI-LRDDRELGSA-N 1 0 315.388 4.484 20 10 DICDRO Cc1ccc([C@@H]([NH2+]Cc2cc(C)ccc2O)c2ccccn2)cc1 ZINC000369546461 336866741 /nfs/dbraw/zinc/86/67/41/336866741.db2.gz ORLQSYKLFCYWRS-OAQYLSRUSA-N 1 0 318.420 4.283 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cnn(C(C)C)c32)c(O)c1 ZINC000375170606 337005107 /nfs/dbraw/zinc/00/51/07/337005107.db2.gz HTOFNPHODIUEKS-RHSMWYFYSA-N 1 0 313.445 4.206 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccccc1O ZINC000375345466 337008661 /nfs/dbraw/zinc/00/86/61/337008661.db2.gz ROOIOHGLZDVDHO-JKSUJKDBSA-N 1 0 301.361 4.096 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(N(C)C)cc1 ZINC000193901856 337079915 /nfs/dbraw/zinc/07/99/15/337079915.db2.gz CRWSVMUIGDGVID-KGLIPLIRSA-N 1 0 313.401 4.073 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(O)c1 ZINC000193902983 337079959 /nfs/dbraw/zinc/07/99/59/337079959.db2.gz HWBQQVPKURBHOF-QWHCGFSZSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(O)c1 ZINC000193902997 337079989 /nfs/dbraw/zinc/07/99/89/337079989.db2.gz HWBQQVPKURBHOF-STQMWFEESA-N 1 0 300.358 4.021 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccccc1O ZINC000183450692 337191788 /nfs/dbraw/zinc/19/17/88/337191788.db2.gz NATYWRNDXBSRIU-QRWLVFNGSA-N 1 0 304.393 4.227 20 10 DICDRO C[C@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1ccccc1O ZINC000183634190 337193948 /nfs/dbraw/zinc/19/39/48/337193948.db2.gz LQUGNEGHXWYURB-XOBRGWDASA-N 1 0 322.383 4.367 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCOc3cc(F)ccc32)c(O)c1 ZINC000186374488 337256876 /nfs/dbraw/zinc/25/68/76/337256876.db2.gz AGXGASAAVBYJKV-GUYCJALGSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccncc1Cl ZINC000421863962 337656411 /nfs/dbraw/zinc/65/64/11/337656411.db2.gz ZCJSVRIXLZSXEJ-ZDUSSCGKSA-N 1 0 313.832 4.386 20 10 DICDRO COc1cc(C)ccc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC000449293113 338610137 /nfs/dbraw/zinc/61/01/37/338610137.db2.gz GKKMSDVSFQGAFX-UHFFFAOYSA-N 1 0 308.425 4.094 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cccc2[nH]ccc21 ZINC000475202068 339441364 /nfs/dbraw/zinc/44/13/64/339441364.db2.gz BUJPSNDFQIVJDY-UHFFFAOYSA-N 1 0 303.409 4.258 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1 ZINC000237093016 341207187 /nfs/dbraw/zinc/20/71/87/341207187.db2.gz JRGBDQVKFXSSKA-KRWDZBQOSA-N 1 0 317.816 4.221 20 10 DICDRO CCOc1cc(C[NH2+][C@@H](CC)c2ccccc2O)ccc1OC ZINC000155839225 520728758 /nfs/dbraw/zinc/72/87/58/520728758.db2.gz AEUZBLWYCJQXSC-INIZCTEOSA-N 1 0 315.413 4.040 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cncc(F)c2)cc1F ZINC000158714021 520910377 /nfs/dbraw/zinc/91/03/77/520910377.db2.gz LIGXDSHOJVOMEE-CYBMUJFWSA-N 1 0 319.399 4.057 20 10 DICDRO CCOC1CC(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)C1 ZINC000189266854 521646478 /nfs/dbraw/zinc/64/64/78/521646478.db2.gz HWYHCZIGMSSNLF-HPUBIQBYSA-N 1 0 313.441 4.401 20 10 DICDRO CCC[N@H+](Cc1csc(C2CC2)n1)Cc1ccccc1O ZINC000161530581 521693011 /nfs/dbraw/zinc/69/30/11/521693011.db2.gz KRUZYZLFVNROMQ-UHFFFAOYSA-N 1 0 302.443 4.138 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1ccccc1O ZINC000364903626 522655911 /nfs/dbraw/zinc/65/59/11/522655911.db2.gz FFPVJSHXJXEMIC-IBGZPJMESA-N 1 0 321.424 4.034 20 10 DICDRO CC[C@H]([NH2+][C@H](C)Cc1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000152131748 522735791 /nfs/dbraw/zinc/73/57/91/522735791.db2.gz QPGSTQBLWSJROL-YJYMSZOUSA-N 1 0 315.461 4.029 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCc2nc(C)sc21)c1ccccc1O ZINC000364361892 522753072 /nfs/dbraw/zinc/75/30/72/522753072.db2.gz WXJGZDZPMOFBAC-ZFWWWQNUSA-N 1 0 302.443 4.275 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(OCC(F)F)c1)c1ccccc1O ZINC000156493871 522885012 /nfs/dbraw/zinc/88/50/12/522885012.db2.gz GTKSOUZPZKGQNI-MRXNPFEDSA-N 1 0 321.367 4.277 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1O ZINC000156145744 522910724 /nfs/dbraw/zinc/91/07/24/522910724.db2.gz RYXLPUQXBCAFOL-HNAYVOBHSA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1-n1cccn1)c1ccccc1O ZINC000156350970 522938551 /nfs/dbraw/zinc/93/85/51/522938551.db2.gz XPHQVQGPEZVBIR-CRAIPNDOSA-N 1 0 321.424 4.380 20 10 DICDRO C[C@H]([NH2+][C@@H](C)C1CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC000126089399 525523984 /nfs/dbraw/zinc/52/39/84/525523984.db2.gz DMGRXDMGRPOCLH-IRXDYDNUSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(N2CCCCC2)cc1 ZINC000158551271 525538054 /nfs/dbraw/zinc/53/80/54/525538054.db2.gz GAGJYJAOWWGIHD-IRXDYDNUSA-N 1 0 309.457 4.484 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000158129579 525574800 /nfs/dbraw/zinc/57/48/00/525574800.db2.gz YSPWOLNXFIPPTH-SCWSEQNSSA-N 1 0 324.468 4.324 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@H](C2CC2)C1)c1ccc2ccccc2c1O ZINC000157635055 525624964 /nfs/dbraw/zinc/62/49/64/525624964.db2.gz ZWVVJKVWGMBIFS-AXHNFQJDSA-N 1 0 311.425 4.154 20 10 DICDRO CC[C@@H]([NH2+]CCc1nc2c(cccc2C)o1)c1ccccc1O ZINC000274883345 535804211 /nfs/dbraw/zinc/80/42/11/535804211.db2.gz HVXGYEQEJHVMJH-OAHLLOKOSA-N 1 0 310.397 4.125 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1nccn1-c1ccccc1)c1ccccc1O ZINC000287936551 535808878 /nfs/dbraw/zinc/80/88/78/535808878.db2.gz XEZIALFELZJTBV-CRAIPNDOSA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cccc(Cl)c1[O-] ZINC000287882790 535894905 /nfs/dbraw/zinc/89/49/05/535894905.db2.gz YMGNDJHDSLDPGM-KRWDZBQOSA-N 1 0 322.880 4.103 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(C)cc1O ZINC000280001491 535947182 /nfs/dbraw/zinc/94/71/82/535947182.db2.gz FXZQSHUFJCBDBD-RDJZCZTQSA-N 1 0 303.446 4.233 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccc(C)o1 ZINC000272706390 536817931 /nfs/dbraw/zinc/81/79/31/536817931.db2.gz ZUFKNTJFIHXVEE-QAPCUYQASA-N 1 0 316.445 4.082 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(C)o1 ZINC000273389626 536818218 /nfs/dbraw/zinc/81/82/18/536818218.db2.gz DHKLZPVZPMQACE-ZBFHGGJFSA-N 1 0 303.402 4.030 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(OC)c1O)c1cccc(Cl)c1 ZINC000036921467 1035885298 /nfs/dbraw/zinc/88/52/98/1035885298.db2.gz LGDVTTUAIUOHGZ-OAHLLOKOSA-N 1 0 305.805 4.295 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCSc2ccc(F)cc21)c1ccccc1O ZINC000036968711 1035910783 /nfs/dbraw/zinc/91/07/83/1035910783.db2.gz XHOVFKLGRWPOLP-XHDPSFHLSA-N 1 0 303.402 4.419 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cc(C)sc2C)c1 ZINC000037122971 1035941847 /nfs/dbraw/zinc/94/18/47/1035941847.db2.gz QJSOQUNJLMPZQO-NEPJUHHUSA-N 1 0 305.443 4.491 20 10 DICDRO COc1ccc(N2CCC[N@H+](C[C@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC001167107685 1036093064 /nfs/dbraw/zinc/09/30/64/1036093064.db2.gz GRUQKKJSWLZDIS-MSOLQXFVSA-N 1 0 316.489 4.034 20 10 DICDRO CN(Cc1nc2ccccc2s1)Cc1c(O)cccc1Cl ZINC000120795733 1036169491 /nfs/dbraw/zinc/16/94/91/1036169491.db2.gz SMLYLGANRQIJNG-UHFFFAOYSA-N 1 0 318.829 4.287 20 10 DICDRO CC[C@@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccccc1O ZINC000155265241 1036220531 /nfs/dbraw/zinc/22/05/31/1036220531.db2.gz HRKDXVGJDTXVQN-LJQANCHMSA-N 1 0 310.441 4.102 20 10 DICDRO C[C@@H](Cc1ccccc1Cl)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001648816663 1036575434 /nfs/dbraw/zinc/57/54/34/1036575434.db2.gz DBTTXZIPRSJGSN-ZDUSSCGKSA-N 1 0 320.839 4.266 20 10 DICDRO C[C@H](Cc1ccccc1Cl)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001648816662 1036575544 /nfs/dbraw/zinc/57/55/44/1036575544.db2.gz DBTTXZIPRSJGSN-CYBMUJFWSA-N 1 0 320.839 4.266 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C/C=C\c2cccc(F)c2)cc1 ZINC001648832569 1036611197 /nfs/dbraw/zinc/61/11/97/1036611197.db2.gz BJJIYVYHJKDMGQ-VURMDHGXSA-N 1 0 312.432 4.475 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3c(c2)C[C@@H](C)O3)cc1 ZINC001648832961 1036612810 /nfs/dbraw/zinc/61/28/10/1036612810.db2.gz UZWYPZUCUSOZQI-MRXNPFEDSA-N 1 0 324.468 4.146 20 10 DICDRO Cc1ccc(C)c(C[N@H+](C)CCc2cccc(Cl)c2)c1O ZINC001140182368 1036619798 /nfs/dbraw/zinc/61/97/98/1036619798.db2.gz QWIHSJKVGFLCDL-UHFFFAOYSA-N 1 0 303.833 4.337 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](C)Cc2ccsc2)ccc1OC ZINC001648895482 1036675389 /nfs/dbraw/zinc/67/53/89/1036675389.db2.gz PWNSRTKBRCUWFG-CQSZACIVSA-N 1 0 319.470 4.014 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(OC(F)F)c1 ZINC000074336403 1036697692 /nfs/dbraw/zinc/69/76/92/1036697692.db2.gz IDPODLZWGQHNQD-ZDUSSCGKSA-N 1 0 320.383 4.205 20 10 DICDRO CC(C)(C)OC1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000160403000 1036982878 /nfs/dbraw/zinc/98/28/78/1036982878.db2.gz BFUOWVLNGRAHPH-UHFFFAOYSA-N 1 0 317.473 4.051 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)CCCO2 ZINC000160543818 1037198221 /nfs/dbraw/zinc/19/82/21/1037198221.db2.gz MHTBXEOGIOPPGD-IBGZPJMESA-N 1 0 310.441 4.065 20 10 DICDRO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000160555448 1037210647 /nfs/dbraw/zinc/21/06/47/1037210647.db2.gz HZEGDEVQWRGNPF-CYBMUJFWSA-N 1 0 318.848 4.265 20 10 DICDRO CC[N@H+](Cc1cc(Br)cc(C)c1O)[C@H](C)C(C)C ZINC000706654003 1037239757 /nfs/dbraw/zinc/23/97/57/1037239757.db2.gz SNLYMUZSLCKMFE-GFCCVEGCSA-N 1 0 314.267 4.330 20 10 DICDRO Cc1csc(CCCC[NH2+][C@H](C)c2ccc(N(C)C)cc2)n1 ZINC000160658427 1037323322 /nfs/dbraw/zinc/32/33/22/1037323322.db2.gz TZMIBQKGXNERCL-OAHLLOKOSA-N 1 0 317.502 4.191 20 10 DICDRO CC(C)CCC[C@H](C)[NH2+]Cc1c(O)cccc1Br ZINC000706804372 1037450106 /nfs/dbraw/zinc/45/01/06/1037450106.db2.gz JJUFKNLADPZSCL-LBPRGKRZSA-N 1 0 314.267 4.459 20 10 DICDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1c(O)cccc1Br ZINC000706833839 1037480129 /nfs/dbraw/zinc/48/01/29/1037480129.db2.gz JUXMGXHDJTXPCB-VXGBXAGGSA-N 1 0 312.251 4.071 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001140341354 1037482807 /nfs/dbraw/zinc/48/28/07/1037482807.db2.gz JGLGIVCHKQFBCC-CYBMUJFWSA-N 1 0 305.780 4.174 20 10 DICDRO CC(C)c1nc(CC[NH2+][C@H](C)c2ccc(N(C)C)cc2)cs1 ZINC000156963358 1037499605 /nfs/dbraw/zinc/49/96/05/1037499605.db2.gz GZDVGMWJRSTLLU-CQSZACIVSA-N 1 0 317.502 4.226 20 10 DICDRO C[C@@H]1CC[C@@H]([NH2+]Cc2c(O)cccc2Br)C[C@@H]1C ZINC000706843693 1037503020 /nfs/dbraw/zinc/50/30/20/1037503020.db2.gz WTLKAFWGNQEHJP-GRYCIOLGSA-N 1 0 312.251 4.069 20 10 DICDRO Cc1cc(Br)cc(C[NH+]2C3CCCC2CCC3)c1O ZINC000707157151 1037846089 /nfs/dbraw/zinc/84/60/89/1037846089.db2.gz VFQVUQFHVFVJLM-UHFFFAOYSA-N 1 0 324.262 4.370 20 10 DICDRO CC[C@@H](CC(F)(F)F)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835047322 1038251468 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ZINC000393564337 1038699414 /nfs/dbraw/zinc/69/94/14/1038699414.db2.gz YSMQWLDBNUAIIO-UHFFFAOYSA-N 1 0 318.848 4.331 20 10 DICDRO C[C@H]([NH2+][C@@H](C)[C@@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000119675729 1038940807 /nfs/dbraw/zinc/94/08/07/1038940807.db2.gz ZRCUCOBPIYVFGK-JENIJYKNSA-N 1 0 316.489 4.143 20 10 DICDRO CCOC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCCC1 ZINC000323941855 1038967413 /nfs/dbraw/zinc/96/74/13/1038967413.db2.gz KCTQURQIFKLIRR-UHFFFAOYSA-N 1 0 316.489 4.116 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1CCC(F)(F)CC1 ZINC001207349221 1039101944 /nfs/dbraw/zinc/10/19/44/1039101944.db2.gz LLSCATQICZZIOU-UHFFFAOYSA-N 1 0 310.432 4.400 20 10 DICDRO C[C@H]1CC[C@H](C)[NH+]1Cc1cc(Cl)cc(Br)c1[O-] ZINC000708214541 1039158730 /nfs/dbraw/zinc/15/87/30/1039158730.db2.gz BVFFVFWVAKLSOU-IUCAKERBSA-N 1 0 318.642 4.181 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CC=CCC1)c1cc(Br)ccc1O ZINC000088747606 1039597204 /nfs/dbraw/zinc/59/72/04/1039597204.db2.gz MPMVVCNMLIOWLH-OCCSQVGLSA-N 1 0 310.235 4.304 20 10 DICDRO CCC[C@@H](CCO)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152404208 1040068377 /nfs/dbraw/zinc/06/83/77/1040068377.db2.gz PFFQZVMWOBAAIV-MSOLQXFVSA-N 1 0 318.505 4.126 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(F)c(Cl)cc1F ZINC001140702420 1040146882 /nfs/dbraw/zinc/14/68/82/1040146882.db2.gz OUAJHODMVJBQIW-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CCC[NH+](CC)CC)c1ccc(F)cc1[O-] ZINC000796663666 1040210984 /nfs/dbraw/zinc/21/09/84/1040210984.db2.gz OKDYAPFCELMUNP-PBHICJAKSA-N 1 0 310.457 4.083 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1F ZINC000176984565 1040311085 /nfs/dbraw/zinc/31/10/85/1040311085.db2.gz WZVLRSSMXBDUAH-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000310156510 1040448751 /nfs/dbraw/zinc/44/87/51/1040448751.db2.gz HELAYVPAJJJTDL-ABSDTBQOSA-N 1 0 324.468 4.014 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Br)c(F)c1)c1ccccc1O ZINC000179900059 1040613132 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Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cc(C(C)C)no2)c1O ZINC000808697216 1041009137 /nfs/dbraw/zinc/00/91/37/1041009137.db2.gz ZCSTVFHUCOFAJI-LLVKDONJSA-N 1 0 308.809 4.316 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)Cc2ccncc2)c1O ZINC000808701477 1041010587 /nfs/dbraw/zinc/01/05/87/1041010587.db2.gz ZBKPFFONPKJZPY-CHWSQXEVSA-N 1 0 304.821 4.031 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](C)c2ccncc2)c1O ZINC000808701514 1041011005 /nfs/dbraw/zinc/01/10/05/1041011005.db2.gz ZOIZIPSLXCKDEW-QWHCGFSZSA-N 1 0 304.821 4.203 20 10 DICDRO Cc1ccccc1[C@H](CO)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808700732 1041011855 /nfs/dbraw/zinc/01/18/55/1041011855.db2.gz PKIIVTMIALSFKJ-DYVFJYSZSA-N 1 0 319.832 4.047 20 10 DICDRO CC[N@H+](Cc1ccncc1)Cc1ccc(N2CCCCC2)cc1 ZINC000809726758 1041222688 /nfs/dbraw/zinc/22/26/88/1041222688.db2.gz NNJJLSQZFFXFBF-UHFFFAOYSA-N 1 0 309.457 4.094 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2c2cccnc2)c1O ZINC000809728550 1041224643 /nfs/dbraw/zinc/22/46/43/1041224643.db2.gz BBVMXTFUMHVZJE-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(C(F)(F)F)c1)c1cc(F)ccc1O ZINC000176980495 1041227173 /nfs/dbraw/zinc/22/71/73/1041227173.db2.gz STXBWSDGRFZEQX-SNVBAGLBSA-N 1 0 313.294 4.401 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)[C@H](C)c2ccc(Cl)cc2)c1O ZINC000809739900 1041239442 /nfs/dbraw/zinc/23/94/42/1041239442.db2.gz GEJVBZPPPVJUTI-STQMWFEESA-N 1 0 319.832 4.336 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CC[C@](C)(c3ccccc3)C2)c1O ZINC000809739636 1041240385 /nfs/dbraw/zinc/24/03/85/1041240385.db2.gz ADJDJGNETWSMOX-XLIONFOSSA-N 1 0 311.425 4.001 20 10 DICDRO CC[N@H+](Cc1cc(Cl)cc(C)c1O)[C@H](C)c1cccnc1 ZINC000809765746 1041250499 /nfs/dbraw/zinc/25/04/99/1041250499.db2.gz PVHFHOUCESVGOM-CYBMUJFWSA-N 1 0 304.821 4.332 20 10 DICDRO c1ccc(C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C2CC2)nc1 ZINC000809762875 1041252088 /nfs/dbraw/zinc/25/20/88/1041252088.db2.gz CQSUJKBOLOQJSD-UHFFFAOYSA-N 1 0 321.468 4.237 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)SC)c1ccc(C(F)(F)F)cc1O ZINC000810228003 1041341225 /nfs/dbraw/zinc/34/12/25/1041341225.db2.gz OZLRQYBKFHBRAM-SKDRFNHKSA-N 1 0 307.381 4.203 20 10 DICDRO CSc1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)s1 ZINC000810138361 1041319452 /nfs/dbraw/zinc/31/94/52/1041319452.db2.gz PTEUSOFFEDIUIN-UHFFFAOYSA-N 1 0 318.511 4.142 20 10 DICDRO CSc1ccc(C[NH2+]CCCSc2nccs2)s1 ZINC000810146487 1041323701 /nfs/dbraw/zinc/32/37/01/1041323701.db2.gz RTXSYZPTBMBMDH-UHFFFAOYSA-N 1 0 316.542 4.199 20 10 DICDRO CC[C@H]([NH2+]CC(O)(CC)CC)c1ccc(C(F)(F)F)cc1O ZINC000810215235 1041337624 /nfs/dbraw/zinc/33/76/24/1041337624.db2.gz UHUFTUAQSNUCHV-ZDUSSCGKSA-N 1 0 319.367 4.003 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](OC)C(C)C)c1ccc(C(F)(F)F)cc1O ZINC000810221517 1041339819 /nfs/dbraw/zinc/33/98/19/1041339819.db2.gz QHPOKBCBLCBBHC-UKRRQHHQSA-N 1 0 319.367 4.123 20 10 DICDRO CC[C@H]([NH2+]CCC(F)(F)F)c1ccc(C(F)(F)F)cc1O ZINC000810221631 1041339912 /nfs/dbraw/zinc/33/99/12/1041339912.db2.gz INXHTEXWQPZZAA-JTQLQIEISA-N 1 0 315.257 4.404 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)SC)c1ccc(C(F)(F)F)cc1O ZINC000810228001 1041342065 /nfs/dbraw/zinc/34/20/65/1041342065.db2.gz OZLRQYBKFHBRAM-CABZTGNLSA-N 1 0 307.381 4.203 20 10 DICDRO CC[C@H]([NH2+]CCc1ccco1)c1ccc(C(F)(F)F)cc1O ZINC000810207814 1041346904 /nfs/dbraw/zinc/34/69/04/1041346904.db2.gz ONBRJFIUTBCAMZ-AWEZNQCLSA-N 1 0 313.319 4.287 20 10 DICDRO CC[C@@H](C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)OC ZINC000810261061 1041349122 /nfs/dbraw/zinc/34/91/22/1041349122.db2.gz SVQSFIFBRIIMFC-APWZRJJASA-N 1 0 304.478 4.143 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCSC1)c1ccc(C(F)(F)F)cc1O ZINC000810236889 1041352712 /nfs/dbraw/zinc/35/27/12/1041352712.db2.gz BFVKLCHDXVJCGO-ZWNOBZJWSA-N 1 0 319.392 4.205 20 10 DICDRO CC[C@H]([NH2+]C1CC(F)(F)C1)c1ccc(C(F)(F)F)cc1O ZINC000810236827 1041352839 /nfs/dbraw/zinc/35/28/39/1041352839.db2.gz AONZDXBCIBSYCI-NSHDSACASA-N 1 0 309.278 4.249 20 10 DICDRO CC[C@H]([NH2+][C@H]1CSC[C@@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000810241778 1041355176 /nfs/dbraw/zinc/35/51/76/1041355176.db2.gz YOJJHAVATBJBAV-XDTLVQLUSA-N 1 0 319.392 4.203 20 10 DICDRO CC(C)OCCCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000782973890 1041358319 /nfs/dbraw/zinc/35/83/19/1041358319.db2.gz KECIQVMJGPBZDX-UHFFFAOYSA-N 1 0 313.441 4.354 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)cc1C(C)C ZINC000811781194 1041566449 /nfs/dbraw/zinc/56/64/49/1041566449.db2.gz ZTTBZELGLPIOED-MOPGFXCFSA-N 1 0 317.473 4.213 20 10 DICDRO CC[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000183989434 1041589746 /nfs/dbraw/zinc/58/97/46/1041589746.db2.gz KLEZIMRHMWZJCS-RBUKOAKNSA-N 1 0 304.478 4.143 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)c(O)c1 ZINC000185302203 1041610926 /nfs/dbraw/zinc/61/09/26/1041610926.db2.gz TUMMYCDNEFWIJQ-AWEZNQCLSA-N 1 0 308.381 4.206 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](O)c2ccc3ccccc3c2)c1 ZINC000185406602 1041613796 /nfs/dbraw/zinc/61/37/96/1041613796.db2.gz FZWWIUGDONNKGE-YCRPNKLZSA-N 1 0 321.420 4.238 20 10 DICDRO CC[N@@H+](Cc1cc2oc3ccccc3c2cc1O)C[C@@H](C)OC ZINC000812303158 1041614976 /nfs/dbraw/zinc/61/49/76/1041614976.db2.gz MJJYWYLVEXYJJF-CYBMUJFWSA-N 1 0 313.397 4.148 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCO[C@@H]2C(C)(C)C)c1 ZINC000185488698 1041615487 /nfs/dbraw/zinc/61/54/87/1041615487.db2.gz CXDNIASFCGAGHY-MPGHIAIKSA-N 1 0 305.462 4.193 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185566527 1041617017 /nfs/dbraw/zinc/61/70/17/1041617017.db2.gz PRZLERJAZMZMCO-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C)cs2)cc1 ZINC000162325863 1041617971 /nfs/dbraw/zinc/61/79/71/1041617971.db2.gz CBYWZVPCEITVFM-KBPBESRZSA-N 1 0 303.475 4.319 20 10 DICDRO COc1ccccc1C[N@H+](Cc1cc2c(cc1O)CCC2)C1CC1 ZINC000747789010 1041618740 /nfs/dbraw/zinc/61/87/40/1041618740.db2.gz PWICJANQRFCZKR-UHFFFAOYSA-N 1 0 323.436 4.054 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC(C)(C)c3ccccc32)c1 ZINC000186138665 1041626900 /nfs/dbraw/zinc/62/69/00/1041626900.db2.gz IZCWAXQLOBVICG-SCLBCKFNSA-N 1 0 311.425 4.474 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3ccc(C)cc32)c1 ZINC000186200047 1041627034 /nfs/dbraw/zinc/62/70/34/1041627034.db2.gz DBVKAYHCUUCSRX-LIRRHRJNSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000310156520 1041635027 /nfs/dbraw/zinc/63/50/27/1041635027.db2.gz HELAYVPAJJJTDL-ZWOKBUDYSA-N 1 0 324.468 4.014 20 10 DICDRO C=Cc1ccc(CC[NH2+]Cc2cc(Cl)cc(OC)c2O)cc1 ZINC000812772274 1041645378 /nfs/dbraw/zinc/64/53/78/1041645378.db2.gz CUDKDDJWOMDJDU-UHFFFAOYSA-N 1 0 317.816 4.030 20 10 DICDRO CC(C)[N@H+](Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CCOC1 ZINC000812776124 1041646002 /nfs/dbraw/zinc/64/60/02/1041646002.db2.gz IVIFOTQATWVTED-LJQANCHMSA-N 1 0 311.425 4.059 20 10 DICDRO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000312496537 1041674862 /nfs/dbraw/zinc/67/48/62/1041674862.db2.gz JTCAAZAWFGWTIX-LBPRGKRZSA-N 1 0 307.743 4.208 20 10 DICDRO Cc1cccc(C[NH2+]C[C@@H](c2ccccc2)C(F)(F)F)c1O ZINC000188661927 1041687971 /nfs/dbraw/zinc/68/79/71/1041687971.db2.gz KATOOOJQRMBAPN-HNNXBMFYSA-N 1 0 309.331 4.136 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H]2CCCc3ccc(C)cc32)c1O ZINC000813790192 1041732189 /nfs/dbraw/zinc/73/21/89/1041732189.db2.gz JMIILUQZQVVHEO-GOSISDBHSA-N 1 0 311.425 4.267 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCCC(F)(F)C2)c1 ZINC000813872479 1041740405 /nfs/dbraw/zinc/74/04/05/1041740405.db2.gz HCEABOOPYZKIGM-OLZOCXBDSA-N 1 0 313.388 4.267 20 10 DICDRO CCSc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000813885533 1041742497 /nfs/dbraw/zinc/74/24/97/1041742497.db2.gz UWMYXOQQBCUBAC-LBPRGKRZSA-N 1 0 305.418 4.494 20 10 DICDRO CCc1nc(C)c(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000813887349 1041742676 /nfs/dbraw/zinc/74/26/76/1041742676.db2.gz GRTMOFGAHNJSLM-SNVBAGLBSA-N 1 0 308.809 4.064 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCc2nc(C)sc21)c1ccccc1O ZINC000364361890 1041762858 /nfs/dbraw/zinc/76/28/58/1041762858.db2.gz WXJGZDZPMOFBAC-HIFRSBDPSA-N 1 0 302.443 4.275 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCc2nc(C)sc21)c1ccccc1O ZINC000364361889 1041763021 /nfs/dbraw/zinc/76/30/21/1041763021.db2.gz WXJGZDZPMOFBAC-DZGCQCFKSA-N 1 0 302.443 4.275 20 10 DICDRO CCCNc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000193363639 1041766977 /nfs/dbraw/zinc/76/69/77/1041766977.db2.gz QCVBXKPNJDBCSX-CYBMUJFWSA-N 1 0 302.393 4.204 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1O ZINC000162696741 1041771494 /nfs/dbraw/zinc/77/14/94/1041771494.db2.gz SHTFLOZKTYNNJR-CQSZACIVSA-N 1 0 303.427 4.190 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C[C@H](c2ccccc2)C2CC2)c1 ZINC000814299107 1041807687 /nfs/dbraw/zinc/80/76/87/1041807687.db2.gz KGQRJGASIUNINI-LJQANCHMSA-N 1 0 311.425 4.074 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000814301364 1041808126 /nfs/dbraw/zinc/80/81/26/1041808126.db2.gz SIJPHCGMMWBOFO-YGUOUDRMSA-N 1 0 305.780 4.221 20 10 DICDRO Cc1cc(C[NH+]2CCC(OCCC(C)C)CC2)ccc1N(C)C ZINC000815018240 1041904237 /nfs/dbraw/zinc/90/42/37/1041904237.db2.gz KCUDXOHRRGJGED-UHFFFAOYSA-N 1 0 318.505 4.088 20 10 DICDRO CCc1ccc(C[N@@H+](C)Cc2ccc(N(CC)CC)cc2)nc1 ZINC000815011269 1041904617 /nfs/dbraw/zinc/90/46/17/1041904617.db2.gz GSVRNVRWGHTUGR-UHFFFAOYSA-N 1 0 311.473 4.122 20 10 DICDRO Cc1cnc([C@H]([NH2+]Cc2ccc(N(C)C)c(C)c2)C2CC2)s1 ZINC000815090189 1041909126 /nfs/dbraw/zinc/90/91/26/1041909126.db2.gz TTXIJMBWGRHDNM-QGZVFWFLSA-N 1 0 315.486 4.067 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)ccc1N(C)C ZINC000815065956 1041909339 /nfs/dbraw/zinc/90/93/39/1041909339.db2.gz TWDQRANMFMIWKQ-HXUWFJFHSA-N 1 0 310.441 4.104 20 10 DICDRO Cc1cc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)ccc1N(C)C ZINC000815083305 1041912408 /nfs/dbraw/zinc/91/24/08/1041912408.db2.gz LRSYBUYFBBFJLJ-UHFFFAOYSA-N 1 0 314.860 4.493 20 10 DICDRO Cc1cc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)ccc1N(C)C ZINC000815086513 1041913743 /nfs/dbraw/zinc/91/37/43/1041913743.db2.gz LBDIOWVPBCCXCN-DZGCQCFKSA-N 1 0 314.395 4.224 20 10 DICDRO Cc1cc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)ccc1N(C)C ZINC000815086517 1041913830 /nfs/dbraw/zinc/91/38/30/1041913830.db2.gz LBDIOWVPBCCXCN-ZFWWWQNUSA-N 1 0 314.395 4.224 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000815124812 1041916223 /nfs/dbraw/zinc/91/62/23/1041916223.db2.gz LQYLGFXDDCGTLN-UHFFFAOYSA-N 1 0 302.849 4.313 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@H]3CCCC3(C)C)CC2)cc1 ZINC000815162029 1041922390 /nfs/dbraw/zinc/92/23/90/1041922390.db2.gz AKKIRGNWVZZQFJ-MRXNPFEDSA-N 1 0 316.489 4.080 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)cc1F ZINC000815141594 1041925094 /nfs/dbraw/zinc/92/50/94/1041925094.db2.gz CKVRTEXYRKBMFO-UHFFFAOYSA-N 1 0 322.374 4.293 20 10 DICDRO C[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1cc[nH]c(=O)c1 ZINC000815147436 1041926119 /nfs/dbraw/zinc/92/61/19/1041926119.db2.gz AJJBWNRWIHEZJG-AWEZNQCLSA-N 1 0 320.392 4.011 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccn(-c3ccccc3)n2)c(O)c1 ZINC000815570281 1041964189 /nfs/dbraw/zinc/96/41/89/1041964189.db2.gz YDAJEVUHWDCKCZ-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ccc(F)cc2F)c(O)c1 ZINC000815579966 1041965695 /nfs/dbraw/zinc/96/56/95/1041965695.db2.gz ZQSXIFVMBSAPLN-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000815580546 1041965871 /nfs/dbraw/zinc/96/58/71/1041965871.db2.gz MGTSTIKGQISDNL-QZTJIDSGSA-N 1 0 324.468 4.329 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCOc3ccccc32)c(O)c1 ZINC000815578339 1041966317 /nfs/dbraw/zinc/96/63/17/1041966317.db2.gz MIUSZAQCYHLVEI-HOTGVXAUSA-N 1 0 311.425 4.226 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](O)c2ccccc2Cl)c(O)c1 ZINC000815594052 1041969539 /nfs/dbraw/zinc/96/95/39/1041969539.db2.gz DTIWOOPAVSGDTI-CXAGYDPISA-N 1 0 319.832 4.047 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CC(C)(C)[C@@H]2CCCCO2)c(O)c1 ZINC000815596223 1041970469 /nfs/dbraw/zinc/97/04/69/1041970469.db2.gz NUQZZKGZJLYRHD-WBVHZDCISA-N 1 0 305.462 4.255 20 10 DICDRO CCCCn1cc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c(C)n1 ZINC000815600318 1041971740 /nfs/dbraw/zinc/97/17/40/1041971740.db2.gz QLHYRLIMEIJXOH-MRXNPFEDSA-N 1 0 315.461 4.165 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CC1=CCCOC1 ZINC000815626439 1041977442 /nfs/dbraw/zinc/97/74/42/1041977442.db2.gz DEJRFEHYMUMEOU-HXUWFJFHSA-N 1 0 323.436 4.002 20 10 DICDRO CC[C@H](C[NH2+][C@H](CCc1ccccc1)c1ccccc1O)OC ZINC000815628319 1041978347 /nfs/dbraw/zinc/97/83/47/1041978347.db2.gz XPQCNHCTOWJBTO-IEBWSBKVSA-N 1 0 313.441 4.081 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1cc(F)ccc1O ZINC000815632165 1041979878 /nfs/dbraw/zinc/97/98/78/1041979878.db2.gz FHBMTZTUUSVBPH-RBOXIYTFSA-N 1 0 303.352 4.267 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1cc[nH]c(=O)c1 ZINC000815642991 1041983003 /nfs/dbraw/zinc/98/30/03/1041983003.db2.gz QJUIXCOOBXGCSS-STQMWFEESA-N 1 0 308.381 4.058 20 10 DICDRO CCOC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000815644594 1041983267 /nfs/dbraw/zinc/98/32/67/1041983267.db2.gz GTWUTPINIRHZPI-OCCSQVGLSA-N 1 0 307.409 4.019 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)C1CC1 ZINC000815651004 1041985757 /nfs/dbraw/zinc/98/57/57/1041985757.db2.gz HGPSOZMTKGOSOY-UZLBHIALSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000756766163 1041997561 /nfs/dbraw/zinc/99/75/61/1041997561.db2.gz WAFVBJXARLRCGY-IUODEOHRSA-N 1 0 309.400 4.500 20 10 DICDRO Oc1c(C[N@@H+]2CCO[C@H](c3ccccc3)C2)ccc2ccccc21 ZINC000816484378 1042055745 /nfs/dbraw/zinc/05/57/45/1042055745.db2.gz ZTUSESGMOVATQS-FQEVSTJZSA-N 1 0 319.404 4.119 20 10 DICDRO C[N@H+](Cc1ccc2ccccc2c1O)[C@H](CCO)c1ccccc1 ZINC000816512299 1042062327 /nfs/dbraw/zinc/06/23/27/1042062327.db2.gz DYJMKGJBHYGIAX-HXUWFJFHSA-N 1 0 321.420 4.101 20 10 DICDRO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc2ccccc2c1O ZINC000816544720 1042063700 /nfs/dbraw/zinc/06/37/00/1042063700.db2.gz QOTIYTXAHZKMCV-LJQANCHMSA-N 1 0 319.404 4.467 20 10 DICDRO C[C@H](C[C@H](O)c1ccccc1)[NH2+]Cc1ccc2ccccc2c1O ZINC000816559173 1042067812 /nfs/dbraw/zinc/06/78/12/1042067812.db2.gz ALAWLMFLVDSMPU-QRWLVFNGSA-N 1 0 321.420 4.147 20 10 DICDRO Oc1c(C[NH2+]C[C@@H]2CCCC(F)(F)C2)ccc2ccccc21 ZINC000816599269 1042071220 /nfs/dbraw/zinc/07/12/20/1042071220.db2.gz HQXHNKASLWBZIG-CYBMUJFWSA-N 1 0 305.368 4.461 20 10 DICDRO CC(C)c1ncc(C[N@H+](C)Cc2ccc3ccccc3c2O)cn1 ZINC000816599292 1042071417 /nfs/dbraw/zinc/07/14/17/1042071417.db2.gz IFWROQSIEHKZQK-UHFFFAOYSA-N 1 0 321.424 4.091 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@H]2c2ccncc2)ccc2ccccc21 ZINC000816610640 1042073456 /nfs/dbraw/zinc/07/34/56/1042073456.db2.gz SBDLNATZGNBOAR-IBGZPJMESA-N 1 0 304.393 4.278 20 10 DICDRO C[C@@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816608788 1042073579 /nfs/dbraw/zinc/07/35/79/1042073579.db2.gz JOOGWWKMFIIWLZ-QAPCUYQASA-N 1 0 313.441 4.061 20 10 DICDRO CN(C)c1ccccc1C[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816613314 1042073779 /nfs/dbraw/zinc/07/37/79/1042073779.db2.gz PUXHABIWMDGJKW-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)c1 ZINC000816666659 1042077209 /nfs/dbraw/zinc/07/72/09/1042077209.db2.gz SQXZRKIHUISRTA-MQMHXKEQSA-N 1 0 317.816 4.090 20 10 DICDRO CCc1nc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)cs1 ZINC000185397172 1042098904 /nfs/dbraw/zinc/09/89/04/1042098904.db2.gz VOXHGDQAIFXAPO-GFCCVEGCSA-N 1 0 312.438 4.415 20 10 DICDRO COc1cccc(C[N@H+](C(C)C)[C@H](C)c2ccsc2)c1O ZINC000817416096 1042108280 /nfs/dbraw/zinc/10/82/80/1042108280.db2.gz IKYAXZJSUPMQIJ-CYBMUJFWSA-N 1 0 305.443 4.434 20 10 DICDRO COc1ccc(O)c(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)c1 ZINC000817416143 1042108496 /nfs/dbraw/zinc/10/84/96/1042108496.db2.gz LJAJFAQUKYRJQF-ZDUSSCGKSA-N 1 0 305.443 4.434 20 10 DICDRO CC(C)[N@H+](Cc1cc2c(cc1O)OCO2)[C@@H](C)c1ccsc1 ZINC000817416203 1042108649 /nfs/dbraw/zinc/10/86/49/1042108649.db2.gz QMXSMIWQILYTHR-LBPRGKRZSA-N 1 0 319.426 4.154 20 10 DICDRO Cc1cc(Br)c([O-])c(C[N@H+]2CCC[C@H]2C(C)C)c1 ZINC001204657557 1042123639 /nfs/dbraw/zinc/12/36/39/1042123639.db2.gz IFXRKVGLVOAARD-AWEZNQCLSA-N 1 0 312.251 4.084 20 10 DICDRO C[C@H]([NH2+]CC1([NH3+])CCCCC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817938534 1042129735 /nfs/dbraw/zinc/12/97/35/1042129735.db2.gz MPRKLYBFCXSFSZ-JTQLQIEISA-N 1 0 317.260 4.011 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1OC(F)(F)F ZINC000817955494 1042131214 /nfs/dbraw/zinc/13/12/14/1042131214.db2.gz CDBJRWJASQUBKG-GFCCVEGCSA-N 1 0 324.346 4.061 20 10 DICDRO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817956067 1042131437 /nfs/dbraw/zinc/13/14/37/1042131437.db2.gz PUGOGBVFIZQJHP-ZDUSSCGKSA-N 1 0 318.848 4.214 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](N)c2ccc(C(C)C)cc2)c(O)c1 ZINC000817954140 1042131700 /nfs/dbraw/zinc/13/17/00/1042131700.db2.gz VIEOPGSSGPYGHQ-DNVCBOLYSA-N 1 0 312.457 4.175 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](N)c2ccc(C(C)C)cc2)c1 ZINC000817952208 1042131765 /nfs/dbraw/zinc/13/17/65/1042131765.db2.gz CUCBOXZABXQAIA-DNVCBOLYSA-N 1 0 312.457 4.175 20 10 DICDRO CC(C)[C@H]([NH2+]CCc1ccc(N)cc1)c1cc(F)ccc1F ZINC000817958485 1042132289 /nfs/dbraw/zinc/13/22/89/1042132289.db2.gz WIOVFNQPIPOURE-SFHVURJKSA-N 1 0 304.384 4.076 20 10 DICDRO CSc1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1F ZINC000817956439 1042132440 /nfs/dbraw/zinc/13/24/40/1042132440.db2.gz YZEXVEULFQHBLA-GFCCVEGCSA-N 1 0 304.434 4.023 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@@H](C)c1ccc(Cl)cc1 ZINC000817957850 1042132800 /nfs/dbraw/zinc/13/28/00/1042132800.db2.gz PUGUNLIQCYUYDD-ZIAGYGMSSA-N 1 0 302.849 4.247 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1 ZINC000817967550 1042133890 /nfs/dbraw/zinc/13/38/90/1042133890.db2.gz KEKWNNFPFXJFFH-YCRPNKLZSA-N 1 0 323.484 4.453 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000817967548 1042134143 /nfs/dbraw/zinc/13/41/43/1042134143.db2.gz KEKWNNFPFXJFFH-VFNWGFHPSA-N 1 0 323.484 4.453 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817969484 1042134906 /nfs/dbraw/zinc/13/49/06/1042134906.db2.gz DPYMRGCYTUIXRB-CWSCBRNRSA-N 1 0 317.260 4.010 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)cc(Cl)c1[O-] ZINC000817970010 1042135237 /nfs/dbraw/zinc/13/52/37/1042135237.db2.gz JMHZLWSMBRYCJP-MJVIPROJSA-N 1 0 317.260 4.010 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1ccc(C)cc1O ZINC000817968120 1042135278 /nfs/dbraw/zinc/13/52/78/1042135278.db2.gz PGOMJZGDRKSGMD-RBUKOAKNSA-N 1 0 310.441 4.401 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1[O-] ZINC000817983352 1042136273 /nfs/dbraw/zinc/13/62/73/1042136273.db2.gz MQNWUTMNGMFYDD-MSOLQXFVSA-N 1 0 316.420 4.052 20 10 DICDRO Cc1cccc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278999863 1042258268 /nfs/dbraw/zinc/25/82/68/1042258268.db2.gz KKPDNNMAOJLRNE-SECBINFHSA-N 1 0 316.348 4.027 20 10 DICDRO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1cc(F)ccc1O ZINC000822504210 1042290245 /nfs/dbraw/zinc/29/02/45/1042290245.db2.gz PESRCKWDJDYSOB-UHFFFAOYSA-N 1 0 323.795 4.218 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Br)cc1)c1cc(F)ccc1O ZINC000094616784 1042324954 /nfs/dbraw/zinc/32/49/54/1042324954.db2.gz WWYJCUHEGPAORM-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cc2cccnc2o1)C1CCCC1 ZINC000823447265 1042326888 /nfs/dbraw/zinc/32/68/88/1042326888.db2.gz GACOYITZDMTLMN-UHFFFAOYSA-N 1 0 322.408 4.478 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1OC)c1ccc(C)cc1O ZINC000279988692 1042561238 /nfs/dbraw/zinc/56/12/38/1042561238.db2.gz FDZXEPGSVLLKPL-MRXNPFEDSA-N 1 0 303.377 4.089 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccc(C)cc1O ZINC000280272601 1042569095 /nfs/dbraw/zinc/56/90/95/1042569095.db2.gz YAKYTMNENCXERN-WBMJQRKESA-N 1 0 302.418 4.150 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000280754447 1042579635 /nfs/dbraw/zinc/57/96/35/1042579635.db2.gz BZWOTIRZYFCGSG-VIFPVBQESA-N 1 0 313.294 4.108 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccccc1OC ZINC000319682374 1042678839 /nfs/dbraw/zinc/67/88/39/1042678839.db2.gz VQMXEXDEBJEEEN-GUYCJALGSA-N 1 0 315.413 4.211 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@H]2OCCc3sccc32)c1 ZINC000291945156 1042883823 /nfs/dbraw/zinc/88/38/23/1042883823.db2.gz QEKHYEFUFIXRHO-JCGVRSQUSA-N 1 0 317.454 4.115 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H](c3cccc(F)c3)C1)CCC2 ZINC000729468664 1042975525 /nfs/dbraw/zinc/97/55/25/1042975525.db2.gz DKIULOUBDGDLOI-KRWDZBQOSA-N 1 0 311.400 4.010 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccc(C)cc1O ZINC000794805430 1043048749 /nfs/dbraw/zinc/04/87/49/1043048749.db2.gz GPYSZSXWNJDFFW-WMLDXEAASA-N 1 0 301.434 4.280 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](CC)c2ccc(C)cc2O)cc1F ZINC000794805034 1043049545 /nfs/dbraw/zinc/04/95/45/1043049545.db2.gz FHIYTRWMEQYEHO-QGZVFWFLSA-N 1 0 317.404 4.479 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccc(C)cc1O ZINC000794805432 1043049836 /nfs/dbraw/zinc/04/98/36/1043049836.db2.gz GPYSZSXWNJDFFW-YOEHRIQHSA-N 1 0 301.434 4.280 20 10 DICDRO CC(C)[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(F)ccc1F ZINC000794802778 1043050037 /nfs/dbraw/zinc/05/00/37/1043050037.db2.gz GQJHUUHJGSPHFW-IBGZPJMESA-N 1 0 317.379 4.387 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccc(C)cc1O ZINC000794807199 1043050508 /nfs/dbraw/zinc/05/05/08/1043050508.db2.gz WJMVSUYHNOHNNQ-LJQANCHMSA-N 1 0 321.424 4.127 20 10 DICDRO CC[C@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccc(C)cc1O ZINC000794803161 1043051600 /nfs/dbraw/zinc/05/16/00/1043051600.db2.gz PWVSPUZLAIOILH-FQEVSTJZSA-N 1 0 324.468 4.410 20 10 DICDRO CC[C@H]([NH2+]CCc1cccc(F)c1F)c1ccc(C)cc1O ZINC000794808427 1043053051 /nfs/dbraw/zinc/05/30/51/1043053051.db2.gz BJJUMOYYPLLSSZ-INIZCTEOSA-N 1 0 305.368 4.262 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1ccc(C)cc1O ZINC000794811520 1043055766 /nfs/dbraw/zinc/05/57/66/1043055766.db2.gz FHDBTINHDFYWSR-UKBAYJJMSA-N 1 0 315.457 4.089 20 10 DICDRO CC[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccc(C)cc1O ZINC000794814385 1043059134 /nfs/dbraw/zinc/05/91/34/1043059134.db2.gz FHHCYRDJFXXFKP-CABCVRRESA-N 1 0 319.351 4.153 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794811917 1043060307 /nfs/dbraw/zinc/06/03/07/1043060307.db2.gz URMCOFWVTSKZBT-HNNXBMFYSA-N 1 0 302.418 4.054 20 10 DICDRO CC[C@@H]([NH2+]C1(c2ccc(OC)cc2)CC1)c1ccc(C)cc1O ZINC000794812528 1043060640 /nfs/dbraw/zinc/06/06/40/1043060640.db2.gz MBCYBZJFIIEJMA-GOSISDBHSA-N 1 0 311.425 4.439 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12)c1ccc(C)cc1O ZINC000794817738 1043063247 /nfs/dbraw/zinc/06/32/47/1043063247.db2.gz PUCGUVBWPWZPET-FSDCSDTHSA-N 1 0 323.527 4.121 20 10 DICDRO COCCC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccccc1O ZINC000794827499 1043065686 /nfs/dbraw/zinc/06/56/86/1043065686.db2.gz ZJYXGSWWWLUKGV-FUHWJXTLSA-N 1 0 313.441 4.081 20 10 DICDRO CCC[C@H]([NH2+][C@@H](CC)c1ccccc1O)[C@H](O)c1ccccc1 ZINC000794828539 1043065770 /nfs/dbraw/zinc/06/57/70/1043065770.db2.gz BVUKKCALJLIPTR-CMKODMSKSA-N 1 0 313.441 4.335 20 10 DICDRO CC[C@@](C)([NH2+]Cc1cc(C)c(C)cc1O)c1nc(C)cs1 ZINC000174504365 1043067032 /nfs/dbraw/zinc/06/70/32/1043067032.db2.gz ZNOQPSXWHRSAHX-QGZVFWFLSA-N 1 0 304.459 4.189 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2ccc(F)cc21)c1cc(F)ccc1O ZINC000794832189 1043069214 /nfs/dbraw/zinc/06/92/14/1043069214.db2.gz HDRMCJWNNBRXGD-DIFFPNOSSA-N 1 0 303.352 4.399 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cnc2c(F)cccc2c1 ZINC000865466094 1043100639 /nfs/dbraw/zinc/10/06/39/1043100639.db2.gz PYAKRFVKGDIKIZ-UHFFFAOYSA-N 1 0 323.415 4.038 20 10 DICDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CC2 ZINC000177973871 1043119857 /nfs/dbraw/zinc/11/98/57/1043119857.db2.gz YCSCRZDJUHJBSL-NRFANRHFSA-N 1 0 322.452 4.073 20 10 DICDRO Cc1nc(C[N@H+](Cc2ccccc2O)C2CCCC2)cs1 ZINC000120782630 1043143271 /nfs/dbraw/zinc/14/32/71/1043143271.db2.gz YDTBXQNKVJWAJL-UHFFFAOYSA-N 1 0 302.443 4.102 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(F)c2)c1 ZINC000120789277 1043143449 /nfs/dbraw/zinc/14/34/49/1043143449.db2.gz YHQHLSYFXOBXGF-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO COc1cc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1OC ZINC000183418629 1043162992 /nfs/dbraw/zinc/16/29/92/1043162992.db2.gz DSWRJVVBWXMSIA-UONOGXRCSA-N 1 0 315.413 4.130 20 10 DICDRO COc1cc(C)c([C@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1OC ZINC000183418651 1043163506 /nfs/dbraw/zinc/16/35/06/1043163506.db2.gz DSWRJVVBWXMSIA-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO CC(C)[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1nc2ccccc2[nH]1 ZINC000183448034 1043164492 /nfs/dbraw/zinc/16/44/92/1043164492.db2.gz BHMDJJXPZRWJQU-SCLBCKFNSA-N 1 0 309.413 4.316 20 10 DICDRO Cc1ccc(OC(F)F)c(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000183554422 1043166905 /nfs/dbraw/zinc/16/69/05/1043166905.db2.gz AKJPOTQXCPRNGW-GFCCVEGCSA-N 1 0 307.340 4.153 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccccc1O ZINC000183644882 1043169115 /nfs/dbraw/zinc/16/91/15/1043169115.db2.gz WTVSTJUTSZMUPB-ULFGMLNVSA-N 1 0 317.816 4.226 20 10 DICDRO Cc1cncc([C@@H](C)[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c1 ZINC000184351070 1043183515 /nfs/dbraw/zinc/18/35/15/1043183515.db2.gz BSRZMFGOQSEPFW-GOSISDBHSA-N 1 0 323.484 4.477 20 10 DICDRO COc1ccc([C@@H]([NH2+][C@H](C)c2cc(F)ccc2O)C2CC2)cc1 ZINC000184911021 1043190621 /nfs/dbraw/zinc/19/06/21/1043190621.db2.gz WBVDAUVOJHJZSG-BLVKFPJESA-N 1 0 315.388 4.342 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cc(Cl)ccc1O ZINC000185149605 1043196045 /nfs/dbraw/zinc/19/60/45/1043196045.db2.gz GJDNMHONKAVWLU-WDEREUQCSA-N 1 0 320.776 4.366 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+][C@H](C)c2cc(OC)ccc2O)c1 ZINC000185229915 1043196733 /nfs/dbraw/zinc/19/67/33/1043196733.db2.gz IGXLEFMZKFRNKS-UONOGXRCSA-N 1 0 315.413 4.211 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](c2ccccc2)[C@@H]2CCCO2)c(O)c1 ZINC000185225361 1043197540 /nfs/dbraw/zinc/19/75/40/1043197540.db2.gz FJJAIQTZTAGOGV-XPGWFJOJSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc3cccnc3c2)c2c1c(F)ccc2O ZINC000866431534 1043201488 /nfs/dbraw/zinc/20/14/88/1043201488.db2.gz VZQKCZAWDFCWRG-PXAZEXFGSA-N 1 0 322.383 4.418 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2cccnc2c1)c1ccc(C)cc1O ZINC000866431527 1043201739 /nfs/dbraw/zinc/20/17/39/1043201739.db2.gz VOUWNPJQJOMNJD-SFHVURJKSA-N 1 0 306.409 4.490 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2cccnc2c1)c1ccc(C)cc1O ZINC000866431526 1043201803 /nfs/dbraw/zinc/20/18/03/1043201803.db2.gz VOUWNPJQJOMNJD-GOSISDBHSA-N 1 0 306.409 4.490 20 10 DICDRO C[C@@H]([NH2+][C@H](CCCO)c1ccccc1)c1cc(Cl)ccc1O ZINC000185532062 1043202521 /nfs/dbraw/zinc/20/25/21/1043202521.db2.gz ZGEHSNLZTAGABE-CXAGYDPISA-N 1 0 319.832 4.210 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccncc1 ZINC000185541409 1043202757 /nfs/dbraw/zinc/20/27/57/1043202757.db2.gz UKJNQNKKQNMUJO-LIRRHRJNSA-N 1 0 310.441 4.468 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccncc1 ZINC000185541429 1043203162 /nfs/dbraw/zinc/20/31/62/1043203162.db2.gz UKJNQNKKQNMUJO-IFXJQAMLSA-N 1 0 310.441 4.468 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCC(OC(C)(C)C)CC2)c1 ZINC000866451390 1043203527 /nfs/dbraw/zinc/20/35/27/1043203527.db2.gz SKRQMBLNZXMVCZ-WLYUNCDWSA-N 1 0 321.461 4.178 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000185611328 1043203920 /nfs/dbraw/zinc/20/39/20/1043203920.db2.gz FUUNHISLTIUMRX-CVEARBPZSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(-n3cccn3)c2)c(O)c1 ZINC000185616891 1043205023 /nfs/dbraw/zinc/20/50/23/1043205023.db2.gz NKSMUCYJCNFQGT-HZPDHXFCSA-N 1 0 321.424 4.298 20 10 DICDRO C[C@H]([NH2+]Cc1ccnc(F)c1)c1ccc(N2CCCCC2)cc1 ZINC000866473617 1043206514 /nfs/dbraw/zinc/20/65/14/1043206514.db2.gz FHJGZKOQRXHACZ-HNNXBMFYSA-N 1 0 313.420 4.062 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC2([C@H]3CCCCO3)CCC2)c(O)c1 ZINC000866480174 1043209430 /nfs/dbraw/zinc/20/94/30/1043209430.db2.gz AFKQENVZLXVAMF-MAUKXSAKSA-N 1 0 303.446 4.091 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC2([C@@H]3CCCCO3)CCC2)c(O)c1 ZINC000866480176 1043209446 /nfs/dbraw/zinc/20/94/46/1043209446.db2.gz AFKQENVZLXVAMF-YJBOKZPZSA-N 1 0 303.446 4.091 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c1 ZINC000186009269 1043212579 /nfs/dbraw/zinc/21/25/79/1043212579.db2.gz PNXADIXHINRFIZ-LRDDRELGSA-N 1 0 301.361 4.014 20 10 DICDRO CC[C@H]([NH2+]C[C@H](O)c1ccc2ccccc2c1)c1ccccc1O ZINC000121090099 1043213618 /nfs/dbraw/zinc/21/36/18/1043213618.db2.gz GOYAPIFCTAVKAF-FPOVZHCZSA-N 1 0 321.420 4.320 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc2ccccc2c1)c1ccccc1O ZINC000121090529 1043214120 /nfs/dbraw/zinc/21/41/20/1043214120.db2.gz GOYAPIFCTAVKAF-TZIWHRDSSA-N 1 0 321.420 4.320 20 10 DICDRO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(Cl)ccc1O ZINC000186117265 1043214677 /nfs/dbraw/zinc/21/46/77/1043214677.db2.gz RTGYXONBPQBCBK-VIFPVBQESA-N 1 0 308.834 4.230 20 10 DICDRO COc1ccsc1[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000186105705 1043214768 /nfs/dbraw/zinc/21/47/68/1043214768.db2.gz FTCDNQRVJYBKFK-CQSZACIVSA-N 1 0 316.470 4.208 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CC=CC[C@H]1C(F)(F)F)CC2 ZINC000866536411 1043219067 /nfs/dbraw/zinc/21/90/67/1043219067.db2.gz POYVAOBEZRCRFK-BFHYXJOUSA-N 1 0 311.347 4.114 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC12CCCC2)c1ccc(Br)cc1O ZINC000760039202 1043220163 /nfs/dbraw/zinc/22/01/63/1043220163.db2.gz DERNIJWXSSKUIB-IINYFYTJSA-N 1 0 310.235 4.138 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)c1cc(F)ccc1O ZINC000186477542 1043224207 /nfs/dbraw/zinc/22/42/07/1043224207.db2.gz VISRNYRULYTRRY-ZDUSSCGKSA-N 1 0 302.393 4.074 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C(C)(C)C)o2)c1O ZINC000866573416 1043225640 /nfs/dbraw/zinc/22/56/40/1043225640.db2.gz IVSJDNIRDNRKDZ-LBPRGKRZSA-N 1 0 303.402 4.142 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)c1O ZINC000122179056 1043284857 /nfs/dbraw/zinc/28/48/57/1043284857.db2.gz ULGZEODXFHJGGF-ZDUSSCGKSA-N 1 0 303.377 4.123 20 10 DICDRO C[C@H]([NH2+][C@H](CO)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000268919111 1043342963 /nfs/dbraw/zinc/34/29/63/1043342963.db2.gz OPCOMDVGHIHJJL-LAUBAEHRSA-N 1 0 324.468 4.061 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000271582255 1043439752 /nfs/dbraw/zinc/43/97/52/1043439752.db2.gz WZZRRLNYAXHJCM-ZHALLVOQSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000271585329 1043441126 /nfs/dbraw/zinc/44/11/26/1043441126.db2.gz XMKYUQUHUVYKEY-BFYDXBDKSA-N 1 0 320.452 4.034 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000271585332 1043441231 /nfs/dbraw/zinc/44/12/31/1043441231.db2.gz XMKYUQUHUVYKEY-HLLBOEOZSA-N 1 0 320.452 4.034 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000271625094 1043443747 /nfs/dbraw/zinc/44/37/47/1043443747.db2.gz CBCDAKDCBOQLAF-LJQANCHMSA-N 1 0 315.388 4.089 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(C(F)(F)F)s1)CC2 ZINC000872107844 1043460850 /nfs/dbraw/zinc/46/08/50/1043460850.db2.gz PLHIHFXYDUFUCT-NSHDSACASA-N 1 0 313.344 4.250 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(C(F)(F)F)nc1 ZINC000872129954 1043471318 /nfs/dbraw/zinc/47/13/18/1043471318.db2.gz HTIRKNRFIXTSRT-MNOVXSKESA-N 1 0 310.319 4.218 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(C(F)(F)F)nc1 ZINC000872131461 1043473902 /nfs/dbraw/zinc/47/39/02/1043473902.db2.gz UVESAKOODOCKSS-GXFFZTMASA-N 1 0 322.330 4.144 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1OC(F)F)c1ccc(N(C)C)cc1 ZINC000124010571 1043486584 /nfs/dbraw/zinc/48/65/84/1043486584.db2.gz MQERDDZLDYVSQY-CYBMUJFWSA-N 1 0 320.383 4.205 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](CCO)c2cccs2)cc1C ZINC000873059336 1043514460 /nfs/dbraw/zinc/51/44/60/1043514460.db2.gz PQXFAPOXYBVSQU-INIZCTEOSA-N 1 0 319.470 4.059 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000124414628 1043522546 /nfs/dbraw/zinc/52/25/46/1043522546.db2.gz PMNMTPRUTWPYMC-CHWSQXEVSA-N 1 0 304.384 4.443 20 10 DICDRO C[C@@H](c1ccccc1)[N@H+](CCC(C)(C)O)Cc1ccccc1O ZINC000124557405 1043539191 /nfs/dbraw/zinc/53/91/91/1043539191.db2.gz OJMOSEZEPQWJCD-INIZCTEOSA-N 1 0 313.441 4.116 20 10 DICDRO Cc1[nH+]ccc(N2CC=C(c3c[nH]c4ncccc34)CC2)c1Cl ZINC000350290683 1043541438 /nfs/dbraw/zinc/54/14/38/1043541438.db2.gz UVRDBQVZGLSENN-UHFFFAOYSA-N 1 0 324.815 4.213 20 10 DICDRO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000074336358 1043555891 /nfs/dbraw/zinc/55/58/91/1043555891.db2.gz NMOQEKQCFZSCID-MRXNPFEDSA-N 1 0 312.457 4.391 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)c1cc2cnccc2o1 ZINC000825710357 1043566798 /nfs/dbraw/zinc/56/67/98/1043566798.db2.gz MTCOAPYTTXTSFO-CQSZACIVSA-N 1 0 309.413 4.264 20 10 DICDRO C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc(Cl)cc1O ZINC000926919135 1043656285 /nfs/dbraw/zinc/65/62/85/1043656285.db2.gz LRJWBOQFZJJAQX-JTQLQIEISA-N 1 0 322.861 4.232 20 10 DICDRO CSc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000021520150 1043665184 /nfs/dbraw/zinc/66/51/84/1043665184.db2.gz BJLJDQYVKHKFLE-CQSZACIVSA-N 1 0 300.471 4.325 20 10 DICDRO C[C@H]1C[C@H]([NH2+][C@@H]2CCCc3cccnc32)c2c1c(F)ccc2O ZINC000927061437 1043675309 /nfs/dbraw/zinc/67/53/09/1043675309.db2.gz OAUCJDLOWKJBHR-GLQYFDAESA-N 1 0 312.388 4.142 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1cc(Cl)ccc1O ZINC000927063534 1043678331 /nfs/dbraw/zinc/67/83/31/1043678331.db2.gz FIAZZNCUJUNEFM-NHYWBVRUSA-N 1 0 302.805 4.169 20 10 DICDRO CCc1onc(C)c1C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000927133809 1043695440 /nfs/dbraw/zinc/69/54/40/1043695440.db2.gz DYKHGLRMFZVDDU-JTQLQIEISA-N 1 0 308.809 4.064 20 10 DICDRO CC(C)[N@H+](CCc1cccs1)Cc1ccc(N(C)C)cc1 ZINC000729542875 1043701048 /nfs/dbraw/zinc/70/10/48/1043701048.db2.gz ZCRAREUMOZMKKG-UHFFFAOYSA-N 1 0 302.487 4.267 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1Cl ZINC000825903289 1043711110 /nfs/dbraw/zinc/71/11/10/1043711110.db2.gz BWGWODJMEKBUSW-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO COc1cccc(C[NH2+]Cc2cccc(C3CCCC3)c2)c1O ZINC000825915819 1043712915 /nfs/dbraw/zinc/71/29/15/1043712915.db2.gz BCFGDNIBNIUFAJ-UHFFFAOYSA-N 1 0 311.425 4.348 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2CCSc3ccc(F)cc32)c(O)c1 ZINC000876909372 1043722656 /nfs/dbraw/zinc/72/26/56/1043722656.db2.gz ZGMYPUQMKRQHSN-OAHLLOKOSA-N 1 0 303.402 4.166 20 10 DICDRO Cc1csc(C2([NH2+]Cc3ccc(C)cc3O)CCCC2)n1 ZINC000877041395 1043738242 /nfs/dbraw/zinc/73/82/42/1043738242.db2.gz KGZZRHLDHVWCPF-UHFFFAOYSA-N 1 0 302.443 4.025 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)c(O)c1 ZINC000877094713 1043742862 /nfs/dbraw/zinc/74/28/62/1043742862.db2.gz MPEQDKSDFXCKQM-QGZVFWFLSA-N 1 0 309.409 4.237 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2cccc(N3CCCC3)c2)c(O)c1 ZINC000877109642 1043743874 /nfs/dbraw/zinc/74/38/74/1043743874.db2.gz OIUIEFVOCXCZAR-MRXNPFEDSA-N 1 0 310.441 4.152 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)nc2)c1O ZINC000877828092 1043805687 /nfs/dbraw/zinc/80/56/87/1043805687.db2.gz FYKANIDDCCSFBY-NSHDSACASA-N 1 0 324.346 4.219 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2cc3cc(F)ccc3o2)cc1F ZINC001648965175 1043818245 /nfs/dbraw/zinc/81/82/45/1043818245.db2.gz JNBAGTMFXYTSBS-UHFFFAOYSA-N 1 0 316.351 4.067 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+][C@@H](C)c1ccccc1O)CC3 ZINC000783533733 1043850005 /nfs/dbraw/zinc/85/00/05/1043850005.db2.gz WBFMDEOSSIBPRN-LSDHHAIUSA-N 1 0 320.436 4.390 20 10 DICDRO CCSc1ccccc1C[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000930216515 1043896820 /nfs/dbraw/zinc/89/68/20/1043896820.db2.gz JQUAYCUNUQPHCE-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)cc1 ZINC000127300946 1043915405 /nfs/dbraw/zinc/91/54/05/1043915405.db2.gz BOXCUWBNNRNSOW-SJLPKXTDSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000127422105 1043930641 /nfs/dbraw/zinc/93/06/41/1043930641.db2.gz WAXGCWJPPYXPDA-AEFFLSMTSA-N 1 0 316.489 4.285 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccncc2)c(C)n1-c1ccccc1 ZINC000320343488 1044026371 /nfs/dbraw/zinc/02/63/71/1044026371.db2.gz OSQGJOXYLYJWLP-MRXNPFEDSA-N 1 0 305.425 4.340 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@H]2OCCc3sccc32)c1 ZINC000291945166 1044116960 /nfs/dbraw/zinc/11/69/60/1044116960.db2.gz QEKHYEFUFIXRHO-VEVIJQCQSA-N 1 0 317.454 4.115 20 10 DICDRO Cc1oncc1C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000129593068 1044164860 /nfs/dbraw/zinc/16/48/60/1044164860.db2.gz IQGCBVPOCIJHKN-HNNXBMFYSA-N 1 0 322.408 4.452 20 10 DICDRO CCc1cnc(CC[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)s1 ZINC000130226796 1044196502 /nfs/dbraw/zinc/19/65/02/1044196502.db2.gz XJZANRCPMKUQCE-AWEZNQCLSA-N 1 0 317.502 4.055 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(-c3ccccn3)c2)c1 ZINC000130292275 1044197791 /nfs/dbraw/zinc/19/77/91/1044197791.db2.gz CUMONYAPQWKLCJ-UHFFFAOYSA-N 1 0 304.393 4.052 20 10 DICDRO FC(F)C1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000281894445 1044207244 /nfs/dbraw/zinc/20/72/44/1044207244.db2.gz HIMSKMLZTFEDEA-UHFFFAOYSA-N 1 0 308.416 4.200 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)cc1 ZINC000281917038 1044212540 /nfs/dbraw/zinc/21/25/40/1044212540.db2.gz AHQWHXDTPXOGHY-AWEZNQCLSA-N 1 0 317.864 4.350 20 10 DICDRO CC(F)(F)c1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000292937135 1044231314 /nfs/dbraw/zinc/23/13/14/1044231314.db2.gz JMKBTHPYGCLLSG-UHFFFAOYSA-N 1 0 303.352 4.023 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000883265379 1044253033 /nfs/dbraw/zinc/25/30/33/1044253033.db2.gz ADJCUZHBVMNEPV-AWEZNQCLSA-N 1 0 311.425 4.437 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)[C@H]1CCCOC1 ZINC000883353399 1044281319 /nfs/dbraw/zinc/28/13/19/1044281319.db2.gz UDCDWYOMWYMJDH-ALKREAHSSA-N 1 0 313.441 4.401 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1cc(F)cc(F)c1 ZINC000132237494 1044319639 /nfs/dbraw/zinc/31/96/39/1044319639.db2.gz RHMBUQXXMULFCE-SNVBAGLBSA-N 1 0 314.426 4.254 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000475206407 1044325410 /nfs/dbraw/zinc/32/54/10/1044325410.db2.gz XMZSVEPGJKYBSY-UHFFFAOYSA-N 1 0 303.409 4.258 20 10 DICDRO Cc1cc(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)on1 ZINC000293882876 1044347243 /nfs/dbraw/zinc/34/72/43/1044347243.db2.gz VMOANZVQJKCAKV-IBGZPJMESA-N 1 0 322.408 4.152 20 10 DICDRO CC[C@@](C)([NH2+]Cc1ccc(N(C)C)c(C)c1)c1nc(C)cs1 ZINC000293894243 1044350258 /nfs/dbraw/zinc/35/02/58/1044350258.db2.gz VKEGZEDRFPODQM-GOSISDBHSA-N 1 0 317.502 4.241 20 10 DICDRO FC1(F)CCCC[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001202587944 1044365169 /nfs/dbraw/zinc/36/51/69/1044365169.db2.gz WCKOPICDLOIXGQ-HNNXBMFYSA-N 1 0 309.400 4.317 20 10 DICDRO Cc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000133651346 1044433121 /nfs/dbraw/zinc/43/31/21/1044433121.db2.gz WVCUPTZFCPZOKE-SFHVURJKSA-N 1 0 324.468 4.025 20 10 DICDRO CC[N@H+](CCc1nccs1)Cc1cc(C(C)C)c(C)cc1O ZINC000134047079 1044487212 /nfs/dbraw/zinc/48/72/12/1044487212.db2.gz FIXPJOVNZNGRKX-UHFFFAOYSA-N 1 0 318.486 4.345 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(N2CCCCC2)cc1 ZINC000119301328 1044494323 /nfs/dbraw/zinc/49/43/23/1044494323.db2.gz YTPPUMKSVKZXIU-FUHWJXTLSA-N 1 0 316.489 4.285 20 10 DICDRO CSCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000216483731 1044558149 /nfs/dbraw/zinc/55/81/49/1044558149.db2.gz DZRCTVXNJAAWQW-OAHLLOKOSA-N 1 0 301.455 4.318 20 10 DICDRO CSCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000216483680 1044558744 /nfs/dbraw/zinc/55/87/44/1044558744.db2.gz DZRCTVXNJAAWQW-HNNXBMFYSA-N 1 0 301.455 4.318 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2(c3ccc(F)cc3F)CCC2)c1 ZINC000136135010 1044587591 /nfs/dbraw/zinc/58/75/91/1044587591.db2.gz BESNGCNLCQUNAD-UHFFFAOYSA-N 1 0 303.352 4.148 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCCO[C@@H]1c1ccccc1)CC2 ZINC000296170459 1044595460 /nfs/dbraw/zinc/59/54/60/1044595460.db2.gz XQIDVCXPHWDWSK-DBXWQHBBSA-N 1 0 323.436 4.137 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCCO[C@H]1c1ccccc1)CC2 ZINC000296170466 1044596362 /nfs/dbraw/zinc/59/63/62/1044596362.db2.gz XQIDVCXPHWDWSK-UEXGIBASSA-N 1 0 323.436 4.137 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(C(F)(F)F)n2)c(O)c1C ZINC000296337307 1044610809 /nfs/dbraw/zinc/61/08/09/1044610809.db2.gz HRJYULXNXJVRBI-LBPRGKRZSA-N 1 0 324.346 4.274 20 10 DICDRO Cc1ncsc1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000155241124 1044688479 /nfs/dbraw/zinc/68/84/79/1044688479.db2.gz QNCJUCPHLXXTEM-UHFFFAOYSA-N 1 0 315.486 4.074 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2cccc3ccccc32)c1O ZINC000140402485 1044759878 /nfs/dbraw/zinc/75/98/78/1044759878.db2.gz ZNSUBYPSVCDYPB-AWEZNQCLSA-N 1 0 307.393 4.405 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(OC)nc2ccccc12)c1ccccc1O ZINC000156065241 1044760167 /nfs/dbraw/zinc/76/01/67/1044760167.db2.gz KLVABZMWQLAACT-QGZVFWFLSA-N 1 0 322.408 4.190 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(OC)nc2ccccc12)c1ccccc1O ZINC000156065140 1044760832 /nfs/dbraw/zinc/76/08/32/1044760832.db2.gz KLVABZMWQLAACT-KRWDZBQOSA-N 1 0 322.408 4.190 20 10 DICDRO CC[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(Cl)c1[O-] ZINC000368575881 1044781906 /nfs/dbraw/zinc/78/19/06/1044781906.db2.gz PBEWXXJGMUCLCD-KVULBXGLSA-N 1 0 322.880 4.103 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)Cc1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000152131654 1045036109 /nfs/dbraw/zinc/03/61/09/1045036109.db2.gz QPGSTQBLWSJROL-ORAYPTAESA-N 1 0 315.461 4.029 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(c2c[nH]c3ccccc32)CC1 ZINC000778994295 1045109196 /nfs/dbraw/zinc/10/91/96/1045109196.db2.gz JFIRFGOUFXTPEX-UHFFFAOYSA-N 1 0 324.399 4.392 20 10 DICDRO Cc1cc(CC[NH2+][C@@H](C)c2c[nH]nc2C)c(C)n1-c1ccccc1 ZINC000779001268 1045115774 /nfs/dbraw/zinc/11/57/74/1045115774.db2.gz DGMRUZDKZLGNEJ-HNNXBMFYSA-N 1 0 322.456 4.019 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(c2ccccc2F)CC1 ZINC000779019524 1045143457 /nfs/dbraw/zinc/14/34/57/1045143457.db2.gz MGCPSMNRHSQNQZ-UHFFFAOYSA-N 1 0 303.352 4.050 20 10 DICDRO Cc1cc(Br)cc([C@H](C)[NH2+][C@@H]2CC=CCC2)c1O ZINC000779032276 1045177011 /nfs/dbraw/zinc/17/70/11/1045177011.db2.gz OHDSVHSLAQZSAG-WCQYABFASA-N 1 0 310.235 4.222 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(-c2ccccc2)no1 ZINC000924575683 1045178420 /nfs/dbraw/zinc/17/84/20/1045178420.db2.gz ZXIAEMZSUMGELL-OAHLLOKOSA-N 1 0 321.424 4.258 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000779035361 1045186690 /nfs/dbraw/zinc/18/66/90/1045186690.db2.gz ZBLWGCZYSILBHU-QGZVFWFLSA-N 1 0 303.352 4.398 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@H]2c2cccs2)c(O)cc1C ZINC000159492611 1045195581 /nfs/dbraw/zinc/19/55/81/1045195581.db2.gz CUCAXPUWGJQKMF-AWEZNQCLSA-N 1 0 303.427 4.108 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(-c2ccccc2)no1 ZINC000924901640 1045210147 /nfs/dbraw/zinc/21/01/47/1045210147.db2.gz SKBBZFNIVOQALO-CQSZACIVSA-N 1 0 320.392 4.127 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000779054029 1045218370 /nfs/dbraw/zinc/21/83/70/1045218370.db2.gz OTZNUQORVUITSW-QMTHXVAHSA-N 1 0 319.351 4.017 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2Br)c(O)c1 ZINC000048819820 1045276938 /nfs/dbraw/zinc/27/69/38/1045276938.db2.gz CFRDXFMSBHYJPF-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCN1C1CCCC1)c1ccc2ccccc2c1O ZINC000528005413 1045293659 /nfs/dbraw/zinc/29/36/59/1045293659.db2.gz ZXFRWXJLEAEZKK-MAUKXSAKSA-N 1 0 324.468 4.213 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(CSC)c1)c1ccccc1O ZINC000188715495 1045338709 /nfs/dbraw/zinc/33/87/09/1045338709.db2.gz OTLPLBGTKBZVBN-KRWDZBQOSA-N 1 0 301.455 4.496 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000779178510 1045349023 /nfs/dbraw/zinc/34/90/23/1045349023.db2.gz QRLQUZAIYKWTMZ-ZTNFWEORSA-N 1 0 318.505 4.387 20 10 DICDRO CCOc1cccc(C[N@H+](CC)[C@@H](C)Cc2ccsc2)c1O ZINC000779216261 1045371900 /nfs/dbraw/zinc/37/19/00/1045371900.db2.gz QWSVQZVZFJYTHH-AWEZNQCLSA-N 1 0 319.470 4.306 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@H]2CC3CCC2CC3)c1 ZINC000381908448 1045584673 /nfs/dbraw/zinc/58/46/73/1045584673.db2.gz NDMNVOMUHFSJMS-SALKPKHPSA-N 1 0 303.446 4.266 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000800238831 1045590688 /nfs/dbraw/zinc/59/06/88/1045590688.db2.gz JXFYWXGAFPMOHO-PXNSSMCTSA-N 1 0 323.484 4.272 20 10 DICDRO C[C@@H]1CCCN(c2ccc(C[NH2+]Cc3ccoc3)cc2Cl)C1 ZINC000800275352 1045601074 /nfs/dbraw/zinc/60/10/74/1045601074.db2.gz AFSJBQBFUCOEHD-CQSZACIVSA-N 1 0 318.848 4.459 20 10 DICDRO C[C@H]1CCCN(c2ccc(C[NH2+]Cc3ccco3)cc2Cl)C1 ZINC000800276595 1045601823 /nfs/dbraw/zinc/60/18/23/1045601823.db2.gz OZQZDHRKXNRMMM-AWEZNQCLSA-N 1 0 318.848 4.459 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2O)ccc1Br ZINC000800368988 1045611940 /nfs/dbraw/zinc/61/19/40/1045611940.db2.gz HNKFLMRSSYEATP-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](c1ccc(F)cn1)C(C)C ZINC000779349201 1045620995 /nfs/dbraw/zinc/62/09/95/1045620995.db2.gz WXNXHWUODBOGCS-IBGZPJMESA-N 1 0 315.436 4.082 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000783674203 1045641504 /nfs/dbraw/zinc/64/15/04/1045641504.db2.gz VRVXJKUTYLBKIT-SFHVURJKSA-N 1 0 319.408 4.119 20 10 DICDRO COc1ccc(C[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)cc1C ZINC000752266996 1045669764 /nfs/dbraw/zinc/66/97/64/1045669764.db2.gz UPKBWVAGFNEWSR-ZFWWWQNUSA-N 1 0 315.379 4.462 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2ccc(OC)c(C)c2)C2CC2)cc1 ZINC000078303017 1045674942 /nfs/dbraw/zinc/67/49/42/1045674942.db2.gz OKDUNUZWAYXOPX-HXUWFJFHSA-N 1 0 311.425 4.253 20 10 DICDRO Cc1c([C@H](C)[NH2+]CCCSc2nccs2)cnn1C(C)C ZINC000191296829 1045676530 /nfs/dbraw/zinc/67/65/30/1045676530.db2.gz RCUSAOQYZOMXPP-LBPRGKRZSA-N 1 0 324.519 4.062 20 10 DICDRO Cc1cc(C)cc([C@H](O)C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000800992855 1045678227 /nfs/dbraw/zinc/67/82/27/1045678227.db2.gz UIYWYPDUZYJPRY-SCLBCKFNSA-N 1 0 319.832 4.047 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](O)c1cc(C)cc(C)c1)c1ccc(C)cc1O ZINC000800991361 1045678517 /nfs/dbraw/zinc/67/85/17/1045678517.db2.gz FXQPQDFRSUVTEA-AZUAARDMSA-N 1 0 313.441 4.092 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2cc(F)c(OC)cc21)c1ccccc1O ZINC000800994510 1045680542 /nfs/dbraw/zinc/68/05/42/1045680542.db2.gz VGBJADWFOICRRB-IRXDYDNUSA-N 1 0 315.388 4.268 20 10 DICDRO CC[N@H+](Cc1ccccn1)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000753101273 1045725872 /nfs/dbraw/zinc/72/58/72/1045725872.db2.gz YXXPZGUHZMRECO-UHFFFAOYSA-N 1 0 312.457 4.415 20 10 DICDRO CCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1O ZINC000801595783 1045747925 /nfs/dbraw/zinc/74/79/25/1045747925.db2.gz TYOMAQALKUJZCB-UHFFFAOYSA-N 1 0 314.385 4.103 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1cccnc1Cl ZINC000801595807 1045748366 /nfs/dbraw/zinc/74/83/66/1045748366.db2.gz JDXXMNVAHQQMBV-UHFFFAOYSA-N 1 0 304.821 4.243 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H](O)c1ccccc1C ZINC000801594902 1045750203 /nfs/dbraw/zinc/75/02/03/1045750203.db2.gz CTDREGBHDYLFKT-FQEVSTJZSA-N 1 0 313.441 4.036 20 10 DICDRO CCCC[N@H+](CCCC1CCOCC1)Cc1ccccc1O ZINC000801596728 1045750261 /nfs/dbraw/zinc/75/02/61/1045750261.db2.gz LZXJOOPBHLBPJM-UHFFFAOYSA-N 1 0 305.462 4.201 20 10 DICDRO CCCC[N@H+](Cc1nc2ccccc2n1C)Cc1ccccc1O ZINC000801596780 1045752179 /nfs/dbraw/zinc/75/21/79/1045752179.db2.gz OUIJUYQIKOZZAI-UHFFFAOYSA-N 1 0 323.440 4.081 20 10 DICDRO C[N@H+](Cc1ccco1)Cc1ccc(OCc2ccccc2)cc1O ZINC000753540827 1045758171 /nfs/dbraw/zinc/75/81/71/1045758171.db2.gz VMJFLTHRDOWVLM-UHFFFAOYSA-N 1 0 323.392 4.196 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1O)C1(C)CC1 ZINC000753551575 1045760929 /nfs/dbraw/zinc/76/09/29/1045760929.db2.gz NTLXSDWSNXRSKW-OAHLLOKOSA-N 1 0 311.425 4.249 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000753857044 1045813892 /nfs/dbraw/zinc/81/38/92/1045813892.db2.gz CVMPCNQFWYPLKD-GOSISDBHSA-N 1 0 316.395 4.116 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc3ccccc3s2)c1 ZINC000754139756 1045852833 /nfs/dbraw/zinc/85/28/33/1045852833.db2.gz HNIUCFLXHFRTPM-GFCCVEGCSA-N 1 0 313.422 4.466 20 10 DICDRO COc1cc(C)cc(C[N@H+](Cc2ccccc2F)C(C)C)c1O ZINC000754720312 1045918632 /nfs/dbraw/zinc/91/86/32/1045918632.db2.gz PGSJBRVWCKYIGG-UHFFFAOYSA-N 1 0 317.404 4.259 20 10 DICDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000828614540 1045921540 /nfs/dbraw/zinc/92/15/40/1045921540.db2.gz QCDSHJHMYHYWJB-FUHWJXTLSA-N 1 0 316.489 4.065 20 10 DICDRO COc1cc(C[N@@H+]2CCS[C@@H](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000754870662 1045935813 /nfs/dbraw/zinc/93/58/13/1045935813.db2.gz BESVMEALOTUMLW-ZDUSSCGKSA-N 1 0 323.502 4.026 20 10 DICDRO CC(C)N1CCC([NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000192950400 1045956536 /nfs/dbraw/zinc/95/65/36/1045956536.db2.gz WWOMAZGOIIJXHM-HNNXBMFYSA-N 1 0 312.457 4.069 20 10 DICDRO Cc1cc(C)c(O)c(C[NH+]2CCC(C(=O)c3ccccc3)CC2)c1 ZINC000192961263 1045956678 /nfs/dbraw/zinc/95/66/78/1045956678.db2.gz LUFYVOLSPFRVNU-UHFFFAOYSA-N 1 0 323.436 4.104 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)CCCC(F)(F)F)c(O)c1 ZINC000755224031 1045965066 /nfs/dbraw/zinc/96/50/66/1045965066.db2.gz XOPGQTCYURSFTA-NSHDSACASA-N 1 0 305.340 4.002 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@]3(C2)CCCOC3)c(C)n1-c1ccccc1 ZINC001137859164 1045987022 /nfs/dbraw/zinc/98/70/22/1045987022.db2.gz LXPOXEORDZUTQZ-NRFANRHFSA-N 1 0 324.468 4.097 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2ccc(C)nc2)c(C)n1-c1ccccc1 ZINC001137859328 1045987508 /nfs/dbraw/zinc/98/75/08/1045987508.db2.gz UABBLEJVRUGBMI-UHFFFAOYSA-N 1 0 319.452 4.430 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c(C)n1-c1ccccc1 ZINC001137856317 1045988185 /nfs/dbraw/zinc/98/81/85/1045988185.db2.gz YVWVKAKUVDIHJA-NBHGPNQESA-N 1 0 324.468 4.093 20 10 DICDRO COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(C)n(-c2ccccc2)c1C ZINC001137859120 1045988345 /nfs/dbraw/zinc/98/83/45/1045988345.db2.gz JPNRHCWLZLPTPO-WCRBZPEASA-N 1 0 324.468 4.236 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1cc(F)ccc1O ZINC000802657561 1046028386 /nfs/dbraw/zinc/02/83/86/1046028386.db2.gz IXGPPZQHJLOZED-UHFFFAOYSA-N 1 0 303.377 4.039 20 10 DICDRO CCCC[N@H+](CCCc1ccc(C)nc1)Cc1ccccc1O ZINC000802657970 1046029276 /nfs/dbraw/zinc/02/92/76/1046029276.db2.gz XNVVIBHODJPGKW-UHFFFAOYSA-N 1 0 312.457 4.331 20 10 DICDRO C[C@]1(c2ccccc2)CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000755932120 1046030894 /nfs/dbraw/zinc/03/08/94/1046030894.db2.gz RCDVFAKTQMCZHF-NRFANRHFSA-N 1 0 318.420 4.104 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)CCS1 ZINC000756147530 1046056285 /nfs/dbraw/zinc/05/62/85/1046056285.db2.gz SOIWRMNLKANBGM-MRXNPFEDSA-N 1 0 304.503 4.004 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2)c2c1c(F)ccc2O ZINC000756339522 1046066827 /nfs/dbraw/zinc/06/68/27/1046066827.db2.gz BCBDEVRMYBJMOF-IAQYHMDHSA-N 1 0 303.352 4.051 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCSCc2ccccc2F)c(O)c1 ZINC000756354736 1046068041 /nfs/dbraw/zinc/06/80/41/1046068041.db2.gz CDKRDZPNKVKILL-AWEZNQCLSA-N 1 0 319.445 4.424 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)c2c1c(F)ccc2O ZINC000756357177 1046069963 /nfs/dbraw/zinc/06/99/63/1046069963.db2.gz CJRGKZYYNCXKIO-IAQYHMDHSA-N 1 0 303.352 4.051 20 10 DICDRO C[C@H](CCc1ccco1)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756356646 1046070367 /nfs/dbraw/zinc/07/03/67/1046070367.db2.gz HDPOQMOPGHRGJK-YWPYICTPSA-N 1 0 303.377 4.284 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(OC(F)F)cc2)c(O)c1 ZINC000756362789 1046070522 /nfs/dbraw/zinc/07/05/22/1046070522.db2.gz LUUCQYSLEISCIS-ZDUSSCGKSA-N 1 0 321.367 4.195 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2cccs2)C2CC2)c1 ZINC000756362735 1046070625 /nfs/dbraw/zinc/07/06/25/1046070625.db2.gz CGGLALDXXWVFAV-PIGZYNQJSA-N 1 0 303.427 4.264 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCSCc2ccccc2F)c1 ZINC000756355721 1046070674 /nfs/dbraw/zinc/07/06/74/1046070674.db2.gz RMXWIPGBWMGMHC-CQSZACIVSA-N 1 0 319.445 4.424 20 10 DICDRO Cc1cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)ccc1F ZINC000756367228 1046072905 /nfs/dbraw/zinc/07/29/05/1046072905.db2.gz YHGLWQQXSDWCLC-NHYWBVRUSA-N 1 0 303.352 4.317 20 10 DICDRO C[C@H](Cc1ccco1)[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000756381099 1046074119 /nfs/dbraw/zinc/07/41/19/1046074119.db2.gz WXBDPWFXNMETLX-GHMZBOCLSA-N 1 0 324.218 4.030 20 10 DICDRO CC(C)Oc1ccc(CC[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756383967 1046074424 /nfs/dbraw/zinc/07/44/24/1046074424.db2.gz MBQZJFPVONQWGA-CQSZACIVSA-N 1 0 317.404 4.212 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)Cc1ccco1)c1cc(Br)ccc1O ZINC000756379308 1046074850 /nfs/dbraw/zinc/07/48/50/1046074850.db2.gz NCHKTSQWDAOSPM-WDEREUQCSA-N 1 0 324.218 4.030 20 10 DICDRO C[C@H](Cc1cccs1)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756379745 1046074875 /nfs/dbraw/zinc/07/48/75/1046074875.db2.gz QBLQDFWHMSHUGD-JTNHKYCSSA-N 1 0 305.418 4.362 20 10 DICDRO C[C@@H]([NH2+]CCCCOc1ccc(F)cc1)c1cc(F)ccc1O ZINC000756402604 1046076959 /nfs/dbraw/zinc/07/69/59/1046076959.db2.gz VTICUGMSGZACDP-CYBMUJFWSA-N 1 0 321.367 4.180 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCO3)c(O)c1C ZINC000756396879 1046077215 /nfs/dbraw/zinc/07/72/15/1046077215.db2.gz MWKASRMDMFAJLC-KGLIPLIRSA-N 1 0 313.397 4.150 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCN(c3ccccc3)C2)c(O)c1C ZINC000756400784 1046077263 /nfs/dbraw/zinc/07/72/63/1046077263.db2.gz FFLXCISNYHKZTH-QZTJIDSGSA-N 1 0 324.468 4.186 20 10 DICDRO C[C@H]([NH2+]CCN1CCCC[C@H]1C)c1ccc2ccccc2c1O ZINC000756419462 1046078903 /nfs/dbraw/zinc/07/89/03/1046078903.db2.gz UQPHAYIFUHABKS-CVEARBPZSA-N 1 0 312.457 4.070 20 10 DICDRO CC(C)Oc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000756428137 1046080159 /nfs/dbraw/zinc/08/01/59/1046080159.db2.gz CESWJLJUXBXLPH-ZDUSSCGKSA-N 1 0 303.377 4.169 20 10 DICDRO CC(C)COc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756455654 1046083620 /nfs/dbraw/zinc/08/36/20/1046083620.db2.gz AOXSVDKTCDDCCB-CQSZACIVSA-N 1 0 317.404 4.417 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1cc2c(cc1O)CCCC2 ZINC000756459760 1046083705 /nfs/dbraw/zinc/08/37/05/1046083705.db2.gz WYFVKGHIQNMVGJ-GFCCVEGCSA-N 1 0 317.379 4.400 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCc2nc3ccccc3[nH]2)c(O)c1C ZINC000756454529 1046084603 /nfs/dbraw/zinc/08/46/03/1046084603.db2.gz FZYQIMAIGUFECZ-OAHLLOKOSA-N 1 0 323.440 4.169 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2COC(C)C)c1 ZINC000756463876 1046085690 /nfs/dbraw/zinc/08/56/90/1046085690.db2.gz FIYGEBDUMOXOLL-INIZCTEOSA-N 1 0 313.441 4.476 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCOc2cccc(Cl)c2)c(O)c1 ZINC000756476978 1046085975 /nfs/dbraw/zinc/08/59/75/1046085975.db2.gz ULZTUVRQADREFK-CYBMUJFWSA-N 1 0 305.805 4.084 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc3c(s2)CCCC3)c1 ZINC000756482459 1046087637 /nfs/dbraw/zinc/08/76/37/1046087637.db2.gz IOFNIWKGYIHFER-ZDUSSCGKSA-N 1 0 301.455 4.492 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOc2ccc(Cl)cc2)c1 ZINC000756472201 1046087807 /nfs/dbraw/zinc/08/78/07/1046087807.db2.gz YOLDDBNMDLXKCO-CYBMUJFWSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CSCc2ccccc21)c1cc(F)ccc1O ZINC000756490051 1046088216 /nfs/dbraw/zinc/08/82/16/1046088216.db2.gz SMTPPOZNDLZRQV-BDJLRTHQSA-N 1 0 303.402 4.170 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCOC2CCCCC2)c2c1c(F)ccc2O ZINC000756490709 1046088661 /nfs/dbraw/zinc/08/86/61/1046088661.db2.gz RHLZLGYGYVUBKD-SWLSCSKDSA-N 1 0 307.409 4.019 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCc3cc(F)ccc32)c2c1c(F)ccc2O ZINC000756489257 1046090000 /nfs/dbraw/zinc/09/00/00/1046090000.db2.gz HTIDWKSRHQOLDD-VFVAKGGASA-N 1 0 315.363 4.496 20 10 DICDRO COc1ccccc1C(C)(C)C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756494768 1046091481 /nfs/dbraw/zinc/09/14/81/1046091481.db2.gz GSHAYIWORYRFRO-CYBMUJFWSA-N 1 0 317.404 4.168 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@@H](C)c3ccc(C)cc3O)c[nH]c2c1 ZINC000756515781 1046093481 /nfs/dbraw/zinc/09/34/81/1046093481.db2.gz FSWQRBVLSVLCCN-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)c2ccc(F)cc2)c1 ZINC000756540009 1046098026 /nfs/dbraw/zinc/09/80/26/1046098026.db2.gz ZXVWDTAIXUACRS-CYBMUJFWSA-N 1 0 317.404 4.168 20 10 DICDRO CCN1CCCC[C@@H]1C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756563024 1046099905 /nfs/dbraw/zinc/09/99/05/1046099905.db2.gz LAZKFDODJIVUHV-DOTOQJQBSA-N 1 0 312.457 4.070 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000756555655 1046100153 /nfs/dbraw/zinc/10/01/53/1046100153.db2.gz UHOMJAYNSZSMJM-OAHLLOKOSA-N 1 0 314.429 4.044 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@H]2c2ccccc2)c1 ZINC000756568675 1046100825 /nfs/dbraw/zinc/10/08/25/1046100825.db2.gz HQVVGQHUAUSNGU-FNHZYXHNSA-N 1 0 311.425 4.388 20 10 DICDRO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cn1 ZINC000756572550 1046101880 /nfs/dbraw/zinc/10/18/80/1046101880.db2.gz GPHVHWBQWUOETD-NEPJUHHUSA-N 1 0 307.825 4.235 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2c[nH]c3ccc(F)cc23)c(O)c1 ZINC000756589279 1046104288 /nfs/dbraw/zinc/10/42/88/1046104288.db2.gz LMENBFCZZFLSFT-ZDUSSCGKSA-N 1 0 312.388 4.214 20 10 DICDRO Cc1cccc(F)c1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756608358 1046108657 /nfs/dbraw/zinc/10/86/57/1046108657.db2.gz KUDJSRXIBBEJED-NHYWBVRUSA-N 1 0 303.352 4.317 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccncc1 ZINC000756608672 1046108699 /nfs/dbraw/zinc/10/86/99/1046108699.db2.gz QOQHYGDHNWEKRF-UGFHNGPFSA-N 1 0 300.377 4.216 20 10 DICDRO COc1ccc([C@H](C)CC[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756613060 1046109760 /nfs/dbraw/zinc/10/97/60/1046109760.db2.gz NMKAWLNKXQINPE-KGLIPLIRSA-N 1 0 317.404 4.384 20 10 DICDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000756611586 1046110164 /nfs/dbraw/zinc/11/01/64/1046110164.db2.gz UAKTVIUQBSBWFQ-APHBMKBZSA-N 1 0 305.487 4.206 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(C)cc2O)C12CCCC2 ZINC000756618008 1046110518 /nfs/dbraw/zinc/11/05/18/1046110518.db2.gz MXGYLKHLIYKCBU-FHLIZLRMSA-N 1 0 303.446 4.089 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)cc2O)C12CCCC2 ZINC000756618011 1046110911 /nfs/dbraw/zinc/11/09/11/1046110911.db2.gz MXGYLKHLIYKCBU-JCGIZDLHSA-N 1 0 303.446 4.089 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)C(C)(C)C ZINC000756627123 1046111632 /nfs/dbraw/zinc/11/16/32/1046111632.db2.gz QTDLBGISAOKOCW-GUYCJALGSA-N 1 0 301.430 4.257 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccc2ccccc2c1O ZINC000756637021 1046114668 /nfs/dbraw/zinc/11/46/68/1046114668.db2.gz YVQVACSLPUSPOB-HUUCEWRRSA-N 1 0 306.409 4.395 20 10 DICDRO COCCC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000756648156 1046116228 /nfs/dbraw/zinc/11/62/28/1046116228.db2.gz ZCADYHIGVBLDTB-UKRRQHHQSA-N 1 0 321.436 4.266 20 10 DICDRO COc1ccc(CC[NH2+][C@H](C)c2cc(C)ccc2O)c(Cl)c1 ZINC000756646780 1046116311 /nfs/dbraw/zinc/11/63/11/1046116311.db2.gz PHLBBJXNEKZJQG-CYBMUJFWSA-N 1 0 319.832 4.256 20 10 DICDRO COCCC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000756648154 1046116521 /nfs/dbraw/zinc/11/65/21/1046116521.db2.gz ZCADYHIGVBLDTB-HIFRSBDPSA-N 1 0 321.436 4.266 20 10 DICDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc3ccccc3c2O)CCO1 ZINC000756663504 1046117458 /nfs/dbraw/zinc/11/74/58/1046117458.db2.gz JWHFBAJKMUNNDO-QOKNQOGYSA-N 1 0 313.441 4.400 20 10 DICDRO C[C@@H]([NH2+][C@H](CCO)C1CCCCC1)c1cc(Cl)ccc1O ZINC000756661748 1046117841 /nfs/dbraw/zinc/11/78/41/1046117841.db2.gz VEZYNWWXTIUZGO-MLGOLLRUSA-N 1 0 311.853 4.028 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H](CCO)C2CCCCC2)c2c1c(F)ccc2O ZINC000756659868 1046117992 /nfs/dbraw/zinc/11/79/92/1046117992.db2.gz GZBDQLKKYZLPDZ-DAXOMENPSA-N 1 0 321.436 4.001 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756671358 1046118254 /nfs/dbraw/zinc/11/82/54/1046118254.db2.gz GWRMDJQABHYHLE-WFASDCNBSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccccc2)c(O)c1C ZINC000756674820 1046120558 /nfs/dbraw/zinc/12/05/58/1046120558.db2.gz BNWSYXRIVAPMON-QOKNQOGYSA-N 1 0 313.441 4.172 20 10 DICDRO CCC1(O)CCC([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000756677649 1046120610 /nfs/dbraw/zinc/12/06/10/1046120610.db2.gz RVWJNMUGTLWKKM-JTOQLSFASA-N 1 0 317.473 4.005 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccc(F)c2F)c(O)c1C ZINC000756713723 1046122735 /nfs/dbraw/zinc/12/27/35/1046122735.db2.gz YAHVVSYSXILNBN-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO c1coc(C[N@H+](Cc2ccc(N3CCCCC3)cc2)C2CC2)c1 ZINC001138220976 1046123216 /nfs/dbraw/zinc/12/32/16/1046123216.db2.gz VUNTVVWTUNTOOM-UHFFFAOYSA-N 1 0 310.441 4.435 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)Oc2ccccc2Cl)c1 ZINC000756733879 1046123989 /nfs/dbraw/zinc/12/39/89/1046123989.db2.gz SZIAKQKSGMRGBR-KBPBESRZSA-N 1 0 319.832 4.472 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1cccc(Cl)c1 ZINC000756731187 1046124440 /nfs/dbraw/zinc/12/44/40/1046124440.db2.gz FNJQKJKBXFZOOC-SCLBCKFNSA-N 1 0 319.832 4.392 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1cccc(Cl)c1 ZINC000756731183 1046124550 /nfs/dbraw/zinc/12/45/50/1046124550.db2.gz FNJQKJKBXFZOOC-ACJLOTCBSA-N 1 0 319.832 4.392 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000756755601 1046125456 /nfs/dbraw/zinc/12/54/56/1046125456.db2.gz BGODSHPGSZNUOP-WBMJQRKESA-N 1 0 311.853 4.292 20 10 DICDRO Cc1cccc(NCC[NH2+][C@H](C)c2ccc3ccccc3c2O)n1 ZINC000756747503 1046126066 /nfs/dbraw/zinc/12/60/66/1046126066.db2.gz PQNIXQRCOOHFAL-OAHLLOKOSA-N 1 0 321.424 4.012 20 10 DICDRO C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cc(Cl)ccc1O ZINC000756757742 1046127683 /nfs/dbraw/zinc/12/76/83/1046127683.db2.gz BJCXBNQDCDMTEO-OTYXRUKQSA-N 1 0 324.207 4.483 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c(F)c1 ZINC000756759709 1046127708 /nfs/dbraw/zinc/12/77/08/1046127708.db2.gz XMJKIISWNYBTQV-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)[C@@H]2CCCCO2)c(O)c1C ZINC000756758173 1046127725 /nfs/dbraw/zinc/12/77/25/1046127725.db2.gz SNAZEVUBLFSEPT-RDJZCZTQSA-N 1 0 305.462 4.255 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@H](C)c3c1c(O)ccc3F)CO2 ZINC000756758316 1046128217 /nfs/dbraw/zinc/12/82/17/1046128217.db2.gz DDZSGZAXYDYJCZ-TUKIKUTGSA-N 1 0 313.372 4.111 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cc3c(cc1O)CCCC3)CO2 ZINC000756757793 1046128511 /nfs/dbraw/zinc/12/85/11/1046128511.db2.gz BWVCWNCZUULNLT-LIRRHRJNSA-N 1 0 323.436 4.364 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)CO2 ZINC000756758468 1046128515 /nfs/dbraw/zinc/12/85/15/1046128515.db2.gz FSYKVWXUGYHKGR-XHDPSFHLSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1c(C[NH+]2CCC3(CC(F)(F)C3)CC2)c2ccccc2n1C ZINC001138253728 1046129299 /nfs/dbraw/zinc/12/92/99/1046129299.db2.gz DVLGPCKIQILCMC-UHFFFAOYSA-N 1 0 318.411 4.498 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c(O)c1C ZINC000756763591 1046129877 /nfs/dbraw/zinc/12/98/77/1046129877.db2.gz XIWSKIMVKUUBCQ-GAZPGATBSA-N 1 0 307.437 4.246 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c2ccccc2n1C ZINC001138257174 1046131190 /nfs/dbraw/zinc/13/11/90/1046131190.db2.gz ZCSNWKGAWOJFJT-LJQANCHMSA-N 1 0 305.425 4.219 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c2ccccc2n1C ZINC001138257195 1046131259 /nfs/dbraw/zinc/13/12/59/1046131259.db2.gz ZZRJXAQLKNMXOQ-KRWDZBQOSA-N 1 0 319.452 4.261 20 10 DICDRO CCCCCn1cc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c(C)n1 ZINC000756779402 1046131741 /nfs/dbraw/zinc/13/17/41/1046131741.db2.gz KPWPFJCFTYAFTQ-AWEZNQCLSA-N 1 0 319.424 4.077 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)c1 ZINC000756774591 1046131888 /nfs/dbraw/zinc/13/18/88/1046131888.db2.gz KFHQMQIMKMPDEF-AWEZNQCLSA-N 1 0 314.429 4.124 20 10 DICDRO Cc1c(C[NH+]2CCC(c3ccncc3)CC2)c2ccccc2n1C ZINC001138256986 1046132588 /nfs/dbraw/zinc/13/25/88/1046132588.db2.gz RFGFYQDYHBHWGQ-UHFFFAOYSA-N 1 0 319.452 4.261 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)c2ccc(C)cc2)c1O ZINC000228671504 1046133136 /nfs/dbraw/zinc/13/31/36/1046133136.db2.gz SLJWWOBZCVLMSX-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1O ZINC000193901162 1046136493 /nfs/dbraw/zinc/13/64/93/1046136493.db2.gz RZZJKBHRXHHCAO-LRDDRELGSA-N 1 0 300.358 4.102 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C2(c3cccc(F)c3)CC2)c2c1c(F)ccc2O ZINC000756831986 1046140329 /nfs/dbraw/zinc/14/03/29/1046140329.db2.gz CPOIJBBASBOIJJ-IAQYHMDHSA-N 1 0 315.363 4.498 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2cc(F)cc(F)c2O)c1 ZINC000756857480 1046146007 /nfs/dbraw/zinc/14/60/07/1046146007.db2.gz JYKWALSYJLXNEG-LBPRGKRZSA-N 1 0 320.383 4.214 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc3c(c2)CCCN3C)cc1 ZINC001138356500 1046154724 /nfs/dbraw/zinc/15/47/24/1046154724.db2.gz PLXGLYXCXTXYOM-MRXNPFEDSA-N 1 0 324.468 4.271 20 10 DICDRO C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000757277509 1046172615 /nfs/dbraw/zinc/17/26/15/1046172615.db2.gz QGVOFBWPYMPOBR-LPHOPBHVSA-N 1 0 311.425 4.134 20 10 DICDRO C[C@H]([NH2+]Cc1nc2c(s1)CCC2)c1ccc2ccccc2c1O ZINC000903190570 1046187642 /nfs/dbraw/zinc/18/76/42/1046187642.db2.gz AUAVUBIMUVHGLF-LBPRGKRZSA-N 1 0 324.449 4.341 20 10 DICDRO Cc1ccc(O)c([C@@H](C)Nc2ccc(C[NH+](C)C)c(F)c2)c1 ZINC000757613547 1046193000 /nfs/dbraw/zinc/19/30/00/1046193000.db2.gz MNLIUZQVRWLQMV-CYBMUJFWSA-N 1 0 302.393 4.074 20 10 DICDRO Cc1ccc([C@H](C)Nc2ccc(C[NH+](C)C)c(F)c2)c(O)c1 ZINC000757614619 1046193081 /nfs/dbraw/zinc/19/30/81/1046193081.db2.gz PZXSTBWCOMBCPO-ZDUSSCGKSA-N 1 0 302.393 4.074 20 10 DICDRO Cc1cc(C[N@H+](C)CCC2CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000757611835 1046193701 /nfs/dbraw/zinc/19/37/01/1046193701.db2.gz WCDSADCNTJCTEL-UHFFFAOYSA-N 1 0 319.489 4.247 20 10 DICDRO COc1ccc(C)cc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001138485851 1046199196 /nfs/dbraw/zinc/19/91/96/1046199196.db2.gz ARWSYHLOTLUNOF-UHFFFAOYSA-N 1 0 324.468 4.236 20 10 DICDRO CC[C@H]([NH2+]Cc1c[nH]c(=O)c2ccccc12)c1ccc(C)cc1O ZINC000903234694 1046202636 /nfs/dbraw/zinc/20/26/36/1046202636.db2.gz LMUXKKOHLJKPBC-SFHVURJKSA-N 1 0 322.408 4.195 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)s1 ZINC000757703528 1046203428 /nfs/dbraw/zinc/20/34/28/1046203428.db2.gz VOKKENNRTVJXNA-OPQQBVKSSA-N 1 0 320.433 4.238 20 10 DICDRO COc1c(Cl)cccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000903245300 1046206181 /nfs/dbraw/zinc/20/61/81/1046206181.db2.gz DEDKATYWIRTZGL-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H](CC(F)(F)F)C(C)C)c1O ZINC000783739595 1046229647 /nfs/dbraw/zinc/22/96/47/1046229647.db2.gz BGUGVXRMUAYBEH-GFCCVEGCSA-N 1 0 309.759 4.421 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(C)cc(CO)cc1C)c1ccc(C)cc1O ZINC000903302890 1046230674 /nfs/dbraw/zinc/23/06/74/1046230674.db2.gz HMQZEQFOWRFVJH-LJQANCHMSA-N 1 0 313.441 4.051 20 10 DICDRO C[C@@H]1CCC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000088698664 1046238717 /nfs/dbraw/zinc/23/87/17/1046238717.db2.gz GCTXGUYFYQMVHL-DYVFJYSZSA-N 1 0 324.415 4.035 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccn2)C2CC2)c2c1c(F)ccc2O ZINC000903335908 1046247469 /nfs/dbraw/zinc/24/74/69/1046247469.db2.gz UPHWRILDPCMNOP-VWCVUJCZSA-N 1 0 312.388 4.216 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1cc(Cl)ccc1O ZINC000903335734 1046249344 /nfs/dbraw/zinc/24/93/44/1046249344.db2.gz STTXFNLKJLHWEC-PIGZYNQJSA-N 1 0 302.805 4.243 20 10 DICDRO CC[C@@H]([NH2+]C[C@]12C[C@H]1COC21CCC1)c1cc(Cl)ccc1O ZINC000903364153 1046256585 /nfs/dbraw/zinc/25/65/85/1046256585.db2.gz UWMAFHUAGATXKT-XGWLTEMNSA-N 1 0 321.848 4.046 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cc(F)ccc1OC ZINC000903371170 1046260100 /nfs/dbraw/zinc/26/01/00/1046260100.db2.gz PPUJYFICRYXBIJ-JKSUJKDBSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1ccsc1Cl ZINC001202859213 1046278572 /nfs/dbraw/zinc/27/85/72/1046278572.db2.gz DBKZSVBPEMCTGE-ZDUSSCGKSA-N 1 0 322.905 4.497 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903430335 1046279050 /nfs/dbraw/zinc/27/90/50/1046279050.db2.gz YUOAISLYCDPCBX-PMACEKPBSA-N 1 0 309.457 4.340 20 10 DICDRO Cc1cc([C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CC2)ccc1F ZINC000758644675 1046282913 /nfs/dbraw/zinc/28/29/13/1046282913.db2.gz SHOZAMPRSLZTMB-FQEVSTJZSA-N 1 0 311.400 4.310 20 10 DICDRO COc1cccc(C[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)c1O ZINC000758645187 1046283674 /nfs/dbraw/zinc/28/36/74/1046283674.db2.gz XXQREWRUJJLYCJ-SFHVURJKSA-N 1 0 315.388 4.089 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)c(C)c1 ZINC001202861305 1046287290 /nfs/dbraw/zinc/28/72/90/1046287290.db2.gz ZIXWPEQQVPWCOG-SFHVURJKSA-N 1 0 310.485 4.399 20 10 DICDRO CC[C@H]([NH2+]CCc1cccc2cccnc21)c1ccccc1O ZINC000321610668 1046338121 /nfs/dbraw/zinc/33/81/21/1046338121.db2.gz VGWLJINXBDZNAP-SFHVURJKSA-N 1 0 306.409 4.224 20 10 DICDRO CCn1ccc2c1cccc2C[N@H+](CC)Cc1ccccc1O ZINC001139158177 1046397316 /nfs/dbraw/zinc/39/73/16/1046397316.db2.gz FSHAXOYVVIFLNY-UHFFFAOYSA-N 1 0 308.425 4.389 20 10 DICDRO CC[C@@H]1C[C@H](C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)CCO1 ZINC000780754402 1046403242 /nfs/dbraw/zinc/40/32/42/1046403242.db2.gz OKZWIUQHHFHWSS-UYAOXDASSA-N 1 0 318.505 4.168 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)c1O ZINC000780792084 1046405023 /nfs/dbraw/zinc/40/50/23/1046405023.db2.gz STHQXKJNCRMFMG-HHNLSAEISA-N 1 0 309.409 4.079 20 10 DICDRO CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 ZINC001202913402 1046418547 /nfs/dbraw/zinc/41/85/47/1046418547.db2.gz KDRRUSRONVYBCS-SQNIBIBYSA-N 1 0 316.489 4.080 20 10 DICDRO C[C@H]([NH2+][C@@H](C)C1CCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000749130104 1046432356 /nfs/dbraw/zinc/43/23/56/1046432356.db2.gz OZBZAOKKVWHVIY-IRXDYDNUSA-N 1 0 316.489 4.143 20 10 DICDRO CC[N@H+](Cc1ccc2cc(O)ccc2c1)Cc1ccccc1O ZINC001139339941 1046433001 /nfs/dbraw/zinc/43/30/01/1046433001.db2.gz CSFMZYMLNFDGGD-UHFFFAOYSA-N 1 0 307.393 4.273 20 10 DICDRO CCN(Cc1ccccc1O)Cc1cc(Cl)cnc1Cl ZINC001139356392 1046436489 /nfs/dbraw/zinc/43/64/89/1046436489.db2.gz FYGUVSRYDCOFFR-UHFFFAOYSA-N 1 0 311.212 4.116 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2cc(Cl)cnc2Cl)cc1 ZINC001139356840 1046436973 /nfs/dbraw/zinc/43/69/73/1046436973.db2.gz JBVJNKAPFNNKQO-UHFFFAOYSA-N 1 0 324.255 4.086 20 10 DICDRO Cc1ccc(-c2ncc(C[N@@H+](C)Cc3ccccc3O)s2)cc1 ZINC000091974739 1046491072 /nfs/dbraw/zinc/49/10/72/1046491072.db2.gz PKRBUGMTXZZHFP-UHFFFAOYSA-N 1 0 324.449 4.456 20 10 DICDRO C[N@H+](Cc1ccc(-c2cccnc2)cc1)Cc1ccccc1O ZINC001139644439 1046493448 /nfs/dbraw/zinc/49/34/48/1046493448.db2.gz HGYMNRZYEHQQSH-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO Cc1cc(CN2Cc3ccc(Cl)cc3C2)ccc1N(C)C ZINC001139674145 1046497002 /nfs/dbraw/zinc/49/70/02/1046497002.db2.gz RBRKMTZNQUIKMZ-UHFFFAOYSA-N 1 0 300.833 4.230 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccc(C)s2)C(C)C)c1O ZINC000092485307 1046520715 /nfs/dbraw/zinc/52/07/15/1046520715.db2.gz FOEPNDJDXSZQFO-UHFFFAOYSA-N 1 0 305.443 4.181 20 10 DICDRO CCOc1ccc(O)c(C[N@H+]([C@H](C)c2ccco2)C2CC2)c1 ZINC000092484131 1046521584 /nfs/dbraw/zinc/52/15/84/1046521584.db2.gz BOCPFKHCDSHEAN-CYBMUJFWSA-N 1 0 301.386 4.110 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(Cl)cc1F ZINC000782529033 1046533484 /nfs/dbraw/zinc/53/34/84/1046533484.db2.gz DDIMDMXCNWHLPH-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO Cc1cc(C)c(O)c(C[NH+]2CCC(c3ccc(C)nc3)CC2)c1 ZINC000782940737 1046546673 /nfs/dbraw/zinc/54/66/73/1046546673.db2.gz HXDDOHMWJULXCP-UHFFFAOYSA-N 1 0 310.441 4.092 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(OC3CCCCC3)CC2)cc1 ZINC000092735931 1046563926 /nfs/dbraw/zinc/56/39/26/1046563926.db2.gz RFEFXIILBNLGDK-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC=CO1)c1ccc(N2CCCCCC2)cc1 ZINC000783307896 1046576713 /nfs/dbraw/zinc/57/67/13/1046576713.db2.gz BGSICQBLQGDGJN-FXAWDEMLSA-N 1 0 314.473 4.410 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C(F)F)c2)c1 ZINC000783310614 1046578370 /nfs/dbraw/zinc/57/83/70/1046578370.db2.gz QBDVBMNNYPOZFQ-LLVKDONJSA-N 1 0 307.340 4.189 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC=CO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000783309699 1046578612 /nfs/dbraw/zinc/57/86/12/1046578612.db2.gz JOXTTWMKLQDAOM-DOTOQJQBSA-N 1 0 318.436 4.159 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C(F)F)c2)c1 ZINC000783310616 1046579024 /nfs/dbraw/zinc/57/90/24/1046579024.db2.gz QBDVBMNNYPOZFQ-NSHDSACASA-N 1 0 307.340 4.189 20 10 DICDRO Oc1ccc(F)cc1CN1CCC[C@@H]1c1c(F)cccc1F ZINC001140060205 1046579598 /nfs/dbraw/zinc/57/95/98/1046579598.db2.gz PEXPEVRZSNGABI-OAHLLOKOSA-N 1 0 307.315 4.147 20 10 DICDRO C[C@H]([NH2+][C@H]1CC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000783309760 1046579515 /nfs/dbraw/zinc/57/95/15/1046579515.db2.gz MYXJKVONHXGSEC-ILXRZTDVSA-N 1 0 322.880 4.016 20 10 DICDRO CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000783330339 1046582736 /nfs/dbraw/zinc/58/27/36/1046582736.db2.gz LZELFUXCWBMSDS-WFASDCNBSA-N 1 0 302.384 4.380 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cccc(Cl)c1OC ZINC001140062332 1046582569 /nfs/dbraw/zinc/58/25/69/1046582569.db2.gz STTBXXNVKOBWML-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccc(F)cc1)[C@H]1CCCO1)c1ccccc1O ZINC000783504665 1046601829 /nfs/dbraw/zinc/60/18/29/1046601829.db2.gz IJRNYXOHBYIZCT-MJXNMMHHSA-N 1 0 315.388 4.102 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000841744256 1046602182 /nfs/dbraw/zinc/60/21/82/1046602182.db2.gz GNDLQHCFWOBNGZ-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO CSCc1cc(F)ccc1C[NH2+][C@H](C)c1ccccc1O ZINC000783519979 1046603461 /nfs/dbraw/zinc/60/34/61/1046603461.db2.gz ODYUORHZRMQXQA-GFCCVEGCSA-N 1 0 305.418 4.245 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3ncsc3C2)c(O)c(C(C)(C)C)c1 ZINC000783544388 1046605209 /nfs/dbraw/zinc/60/52/09/1046605209.db2.gz ZMGUVVUBDXWLJZ-UHFFFAOYSA-N 1 0 316.470 4.013 20 10 DICDRO CC(C)Oc1ncccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841746278 1046605567 /nfs/dbraw/zinc/60/55/67/1046605567.db2.gz XGSLAZAWRNFVLX-LBPRGKRZSA-N 1 0 320.820 4.079 20 10 DICDRO CCOc1ccccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841746271 1046605852 /nfs/dbraw/zinc/60/58/52/1046605852.db2.gz XGJYQVXABIHCQE-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO COc1cccc(CCC[N@H+](C)Cc2c(C)ccc(C)c2O)c1 ZINC001140184228 1046609280 /nfs/dbraw/zinc/60/92/80/1046609280.db2.gz NXBAGBMZPNJWFJ-UHFFFAOYSA-N 1 0 313.441 4.082 20 10 DICDRO Cc1ccc(C)c(C[NH+]2CCC3(CC2)OCc2ccccc23)c1O ZINC001140182688 1046609538 /nfs/dbraw/zinc/60/95/38/1046609538.db2.gz XIBMYWQABPXQOV-UHFFFAOYSA-N 1 0 323.436 4.031 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(C)ccc(C)c1O ZINC001140182259 1046610244 /nfs/dbraw/zinc/61/02/44/1046610244.db2.gz MVPVJEPSKMJIBJ-GOSISDBHSA-N 1 0 311.425 4.355 20 10 DICDRO CCCCOc1cccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000834513638 1046625225 /nfs/dbraw/zinc/62/52/25/1046625225.db2.gz NSLXIJDBYQWFJC-GOSISDBHSA-N 1 0 311.425 4.348 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCCOc3ccc(F)cc31)CC2 ZINC000834540511 1046628233 /nfs/dbraw/zinc/62/82/33/1046628233.db2.gz BMZPOEDYFRSNLJ-HOTGVXAUSA-N 1 0 313.372 4.022 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCOc3c(F)cccc32)c1O ZINC000783739748 1046629525 /nfs/dbraw/zinc/62/95/25/1046629525.db2.gz CNJMELHWVCQYBN-OAHLLOKOSA-N 1 0 321.779 4.107 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CC3(CCC3)Oc3ccccc31)CC2 ZINC000834619075 1046639730 /nfs/dbraw/zinc/63/97/30/1046639730.db2.gz AWFQHPQEBHPMMZ-IAGOWNOFSA-N 1 0 321.420 4.416 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)C1)CC2 ZINC000834615705 1046639934 /nfs/dbraw/zinc/63/99/34/1046639934.db2.gz IAPTYYUGJDFPOE-MRVWCRGKSA-N 1 0 313.363 4.338 20 10 DICDRO Oc1cccc2c1[C@H](Nc1cccc(C[NH+]3CCCCC3)c1)CC2 ZINC000834709760 1046653916 /nfs/dbraw/zinc/65/39/16/1046653916.db2.gz NAWLUZHZYQSXJC-LJQANCHMSA-N 1 0 322.452 4.478 20 10 DICDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)c1 ZINC001140341594 1046667425 /nfs/dbraw/zinc/66/74/25/1046667425.db2.gz YLJVRZMUZZBLJC-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]C[C@H](c1ccccc1)C(F)(F)F)CC2 ZINC000834774434 1046668743 /nfs/dbraw/zinc/66/87/43/1046668743.db2.gz PCFHFHMKAJKPDH-CABCVRRESA-N 1 0 321.342 4.315 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2c(F)cc(F)cc21)c1ccccc1O ZINC000834814094 1046673929 /nfs/dbraw/zinc/67/39/29/1046673929.db2.gz FCASJHXRIGMDGZ-APPDUMDISA-N 1 0 303.352 4.399 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3ccc(Cl)cc32)c1 ZINC000784267015 1046677377 /nfs/dbraw/zinc/67/73/77/1046677377.db2.gz UXFIVCQOAWVMLP-GTNSWQLSSA-N 1 0 317.816 4.392 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Br)cc1)c1cc(F)ccc1O ZINC000094616783 1046678607 /nfs/dbraw/zinc/67/86/07/1046678607.db2.gz WWYJCUHEGPAORM-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO C[C@@H](CCO)CC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834832882 1046681111 /nfs/dbraw/zinc/68/11/11/1046681111.db2.gz SOTZELKDJADDIP-QZTJIDSGSA-N 1 0 318.505 4.126 20 10 DICDRO CC[C@H](COCC(F)(F)F)[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000834843799 1046684229 /nfs/dbraw/zinc/68/42/29/1046684229.db2.gz LZTTVGNVSRUWGU-TZMCWYRMSA-N 1 0 319.367 4.099 20 10 DICDRO CC[C@H](COCC(F)(F)F)[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000834843805 1046684541 /nfs/dbraw/zinc/68/45/41/1046684541.db2.gz MCVKLMJTUPTRMH-QWHCGFSZSA-N 1 0 319.367 4.017 20 10 DICDRO C[C@H](CCCO)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834870149 1046690407 /nfs/dbraw/zinc/69/04/07/1046690407.db2.gz GZIPHCSRVUQVCT-QZTJIDSGSA-N 1 0 318.505 4.126 20 10 DICDRO C[C@@H](CCCO)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834870150 1046690627 /nfs/dbraw/zinc/69/06/27/1046690627.db2.gz GZIPHCSRVUQVCT-ROUUACIJSA-N 1 0 318.505 4.126 20 10 DICDRO C[C@H](CC(C)(C)O)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000834880424 1046694843 /nfs/dbraw/zinc/69/48/43/1046694843.db2.gz ZGCSFJFMEHQQJZ-CABCVRRESA-N 1 0 322.468 4.016 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CC(C)(C)O)c1ccc(N2CCCCC2)c(F)c1 ZINC000834880427 1046694957 /nfs/dbraw/zinc/69/49/57/1046694957.db2.gz ZGCSFJFMEHQQJZ-LSDHHAIUSA-N 1 0 322.468 4.016 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1COCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000841762546 1046695544 /nfs/dbraw/zinc/69/55/44/1046695544.db2.gz XHUULARMYSQVHL-WOJBJXKFSA-N 1 0 310.441 4.065 20 10 DICDRO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841762972 1046695584 /nfs/dbraw/zinc/69/55/84/1046695584.db2.gz LBHMKRJONVARIC-RYUDHWBXSA-N 1 0 307.825 4.235 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCCC[C@H]1CC(F)(F)F)CC2 ZINC000834879345 1046695719 /nfs/dbraw/zinc/69/57/19/1046695719.db2.gz YCWVJUAXQCQDTJ-MELADBBJSA-N 1 0 313.363 4.480 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCOC3(CCC3)C2)c2c1c(F)ccc2O ZINC000834883521 1046696300 /nfs/dbraw/zinc/69/63/00/1046696300.db2.gz QPCOOWZFKVHBPD-NFAWXSAZSA-N 1 0 319.420 4.019 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1cc(Cl)ccc1O ZINC000834884564 1046696652 /nfs/dbraw/zinc/69/66/52/1046696652.db2.gz NNWRIUGOAMKMQE-UFBFGSQYSA-N 1 0 308.636 4.280 20 10 DICDRO COC[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000834885781 1046698854 /nfs/dbraw/zinc/69/88/54/1046698854.db2.gz YAWVBWMXBHKYQC-UKRRQHHQSA-N 1 0 319.832 4.126 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc2ccccc2c1O ZINC000834892649 1046702965 /nfs/dbraw/zinc/70/29/65/1046702965.db2.gz CEEQGGHASXPYPX-GDZNZVCISA-N 1 0 307.397 4.099 20 10 DICDRO C[C@H]([NH2+]CC[C@]1(C)CC1(Cl)Cl)c1cc(F)ccc1O ZINC000834894376 1046704617 /nfs/dbraw/zinc/70/46/17/1046704617.db2.gz RRMBTDIAWHGCIP-TVQRCGJNSA-N 1 0 306.208 4.156 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@]2(C)CC2(Cl)Cl)c1 ZINC000834895270 1046706720 /nfs/dbraw/zinc/70/67/20/1046706720.db2.gz XRPKNEIOTHMBIA-BXUZGUMPSA-N 1 0 302.245 4.325 20 10 DICDRO CCCc1ncc(C[NH2+][C@H](CC)c2cc(Cl)ccc2O)o1 ZINC000834901073 1046712602 /nfs/dbraw/zinc/71/26/02/1046712602.db2.gz WJEQISUHHJTWCX-CQSZACIVSA-N 1 0 308.809 4.227 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1ccccc1O ZINC000834903972 1046715444 /nfs/dbraw/zinc/71/54/44/1046715444.db2.gz MQPMYDHIKYEOKD-WOSRLPQWSA-N 1 0 303.427 4.025 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CCC[NH+](CC)CC)c1ccc(F)cc1[O-] ZINC000796663674 1046716416 /nfs/dbraw/zinc/71/64/16/1046716416.db2.gz OKDYAPFCELMUNP-YOEHRIQHSA-N 1 0 310.457 4.083 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccc2ccccc2c1O ZINC000834911115 1046718001 /nfs/dbraw/zinc/71/80/01/1046718001.db2.gz RSOHKPVWDJOOED-GJZGRUSLSA-N 1 0 313.441 4.401 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccccc1-c1nccs1)CC2 ZINC001140453304 1046730632 /nfs/dbraw/zinc/73/06/32/1046730632.db2.gz QJJKJLJLCINJNI-UHFFFAOYSA-N 1 0 322.433 4.074 20 10 DICDRO CC[C@@H]([NH2+]CCC[NH+](C(C)C)C(C)C)c1ccc(F)cc1[O-] ZINC000796779441 1046732531 /nfs/dbraw/zinc/73/25/31/1046732531.db2.gz MJYRHRYFMUAXAG-QGZVFWFLSA-N 1 0 310.457 4.081 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2O)cc1 ZINC001140466625 1046737679 /nfs/dbraw/zinc/73/76/79/1046737679.db2.gz ILUDCZGQKDDEBQ-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2O)c1 ZINC001140466140 1046739262 /nfs/dbraw/zinc/73/92/62/1046739262.db2.gz YNBNMGQDNCHHOB-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO Oc1ccc(C2CC[NH+](Cc3ccc(Cl)cc3O)CC2)cc1 ZINC001140464661 1046739369 /nfs/dbraw/zinc/73/93/69/1046739369.db2.gz ZDUNOJZRJUCNSA-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH+]2CCC(c3ccccn3)CC2)cc1 ZINC000835029271 1046743553 /nfs/dbraw/zinc/74/35/53/1046743553.db2.gz WARXKUCIAUGDPN-WAYWQWQTSA-N 1 0 321.468 4.040 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835042395 1046746599 /nfs/dbraw/zinc/74/65/99/1046746599.db2.gz HKJWNLRKYYFITA-WLMCBFPDSA-N 1 0 309.457 4.074 20 10 DICDRO CC[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000835041482 1046746806 /nfs/dbraw/zinc/74/68/06/1046746806.db2.gz MEJHTSBCFIGCRV-ZEVQVBBLSA-N 1 0 313.445 4.112 20 10 DICDRO CC[C@@](C)([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1nccs1 ZINC000835040611 1046747294 /nfs/dbraw/zinc/74/72/94/1046747294.db2.gz QMHIQIXUUYNTCY-IPLHWJFFSA-N 1 0 315.486 4.137 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH+]2CCC(c3cccnc3)CC2)cc1 ZINC000835053982 1046751551 /nfs/dbraw/zinc/75/15/51/1046751551.db2.gz QRBCSHVYNWFTOZ-SNAWJCMRSA-N 1 0 321.468 4.040 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000797007893 1046771523 /nfs/dbraw/zinc/77/15/23/1046771523.db2.gz JCMRPIGQRMPXPJ-GFCCVEGCSA-N 1 0 305.418 4.412 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(C(F)(F)F)CC2)cc1 ZINC000797068627 1046784388 /nfs/dbraw/zinc/78/43/88/1046784388.db2.gz AMOZTNAERMGYBZ-LBPRGKRZSA-N 1 0 300.368 4.136 20 10 DICDRO CC[C@@H]([NH2+]CC1(c2ccccn2)CCC1)c1ccc(N(C)C)cc1 ZINC000797097794 1046790034 /nfs/dbraw/zinc/79/00/34/1046790034.db2.gz CLCLCMOTGLMPDA-LJQANCHMSA-N 1 0 323.484 4.310 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1O ZINC001140746210 1046882627 /nfs/dbraw/zinc/88/26/27/1046882627.db2.gz WAPUSUDBHAKHSA-INIZCTEOSA-N 1 0 319.351 4.022 20 10 DICDRO C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000237419210 1046901153 /nfs/dbraw/zinc/90/11/53/1046901153.db2.gz BCEMFISKKPHZAG-CPUCHLNUSA-N 1 0 324.415 4.035 20 10 DICDRO CSc1ccc(CC[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000797999418 1046917686 /nfs/dbraw/zinc/91/76/86/1046917686.db2.gz RGMQNWYYBNNTDN-CQSZACIVSA-N 1 0 301.455 4.316 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN2C2CCCCC2)c(O)c1 ZINC000798002299 1046920241 /nfs/dbraw/zinc/92/02/41/1046920241.db2.gz CTCSEUMOALKHKS-WMZOPIPTSA-N 1 0 316.489 4.148 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](CC)Cc2cccs2)c(O)c1 ZINC001140856470 1046933111 /nfs/dbraw/zinc/93/31/11/1046933111.db2.gz CEMGWTQFRPVVCG-UHFFFAOYSA-N 1 0 318.486 4.322 20 10 DICDRO CSc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000798502331 1046960066 /nfs/dbraw/zinc/96/00/66/1046960066.db2.gz NBDHZXUUQLXBQQ-ZDUSSCGKSA-N 1 0 318.461 4.464 20 10 DICDRO Cc1ccc(C[NH+]2CCC3(CC2)O[C@H](C)c2ccccc23)c(O)c1 ZINC001140954288 1046960216 /nfs/dbraw/zinc/96/02/16/1046960216.db2.gz OQPVSVYTAJQDEX-MRXNPFEDSA-N 1 0 323.436 4.283 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c(O)c1 ZINC001140957545 1046962696 /nfs/dbraw/zinc/96/26/96/1046962696.db2.gz DDQAJGPDELNQJD-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000798925375 1046985671 /nfs/dbraw/zinc/98/56/71/1046985671.db2.gz ACPLOQWNWBBMNR-MOPGFXCFSA-N 1 0 323.484 4.272 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1 ZINC000798936255 1046990316 /nfs/dbraw/zinc/99/03/16/1046990316.db2.gz BHCPIZLCJCZLGK-BZUAXINKSA-N 1 0 311.425 4.306 20 10 DICDRO CSCCC[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000798963457 1046992399 /nfs/dbraw/zinc/99/23/99/1046992399.db2.gz FDLAXZVTSOLKGU-UHFFFAOYSA-N 1 0 301.455 4.244 20 10 DICDRO c1cc2c(s1)CC[N@@H+](Cc1cc3c4c(c1)CCCN4CCC3)C2 ZINC001141075521 1046998535 /nfs/dbraw/zinc/99/85/35/1046998535.db2.gz SOFUKCIADITGOJ-UHFFFAOYSA-N 1 0 324.493 4.005 20 10 DICDRO c1cc2c(s1)C[N@H+](Cc1cc3c4c(c1)CCCN4CCC3)CC2 ZINC001141076637 1047000968 /nfs/dbraw/zinc/00/09/68/1047000968.db2.gz YEKISGGKAMOIGF-UHFFFAOYSA-N 1 0 324.493 4.005 20 10 DICDRO c1coc(C[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)C2CC2)c1 ZINC001141078501 1047001541 /nfs/dbraw/zinc/00/15/41/1047001541.db2.gz YLYROLZKLIIIBF-UHFFFAOYSA-N 1 0 322.452 4.143 20 10 DICDRO CO[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000799351929 1047021819 /nfs/dbraw/zinc/02/18/19/1047021819.db2.gz KDNPWTVAAPBTSK-ICSRJNTNSA-N 1 0 311.425 4.106 20 10 DICDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC001141158593 1047029832 /nfs/dbraw/zinc/02/98/32/1047029832.db2.gz FZWQCWYALRAOLP-INIZCTEOSA-N 1 0 303.789 4.088 20 10 DICDRO C[N@H+](Cc1cc(Cl)cc(Cl)c1)Cc1cc(O)ccc1O ZINC001141163317 1047031689 /nfs/dbraw/zinc/03/16/89/1047031689.db2.gz ZMOGSEZOCYYSQZ-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO Cc1csc(C(C)(C)[NH2+]Cc2ccc(N3CCCC3)cc2)n1 ZINC001116082180 1047105815 /nfs/dbraw/zinc/10/58/15/1047105815.db2.gz BJIUUZJILDKHRD-UHFFFAOYSA-N 1 0 315.486 4.077 20 10 DICDRO Cc1ccccc1O[C@@H](C)C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001116139702 1047112834 /nfs/dbraw/zinc/11/28/34/1047112834.db2.gz SRUHSQYECBVHIV-SFHVURJKSA-N 1 0 324.468 4.152 20 10 DICDRO c1ccc(C[C@H]2CC[N@@H+]2Cc2ccc(N3CCCC3)cc2)cc1 ZINC001116444937 1047142089 /nfs/dbraw/zinc/14/20/89/1047142089.db2.gz IGNOIWZXIAKBDP-OAQYLSRUSA-N 1 0 306.453 4.104 20 10 DICDRO Cc1cccc(CC[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)n1 ZINC000827719514 1047149969 /nfs/dbraw/zinc/14/99/69/1047149969.db2.gz KWXVUDRQWGMGRT-UHFFFAOYSA-N 1 0 323.484 4.055 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)cc1F ZINC001116565175 1047156957 /nfs/dbraw/zinc/15/69/57/1047156957.db2.gz JXPWPPWRVLCPAG-WFASDCNBSA-N 1 0 315.388 4.186 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)c1ccc(F)cc1 ZINC001116567450 1047158456 /nfs/dbraw/zinc/15/84/56/1047158456.db2.gz GBTFKMITNTXCET-KDOFPFPSSA-N 1 0 317.404 4.186 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1ccc(F)cc1 ZINC001116567448 1047158681 /nfs/dbraw/zinc/15/86/81/1047158681.db2.gz GBTFKMITNTXCET-KBXCAEBGSA-N 1 0 317.404 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)COc2ccccc2F)c(O)c1C ZINC001116584495 1047159925 /nfs/dbraw/zinc/15/99/25/1047159925.db2.gz GWWSMNVHZDGELG-ZFWWWQNUSA-N 1 0 317.404 4.266 20 10 DICDRO COCCC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CCCC1 ZINC001116584376 1047160010 /nfs/dbraw/zinc/16/00/10/1047160010.db2.gz FDHPZJGQGDOQKU-HZPDHXFCSA-N 1 0 317.473 4.435 20 10 DICDRO C[C@H](CCCc1cccnc1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000839150973 1047198982 /nfs/dbraw/zinc/19/89/82/1047198982.db2.gz PLAXYAIGESEUNL-AHKGRUIUSA-N 1 0 323.484 4.162 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]C2CCC(C(F)F)CC2)c1O ZINC000839179488 1047202661 /nfs/dbraw/zinc/20/26/61/1047202661.db2.gz JVNRZVZDCPGJQB-UHFFFAOYSA-N 1 0 303.780 4.268 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCCC1CCOCC1 ZINC001117831494 1047248300 /nfs/dbraw/zinc/24/83/00/1047248300.db2.gz PASGSWDXZRHMOH-HOCLYGCPSA-N 1 0 303.446 4.045 20 10 DICDRO CCc1nocc1C[N@H+](C)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000840087927 1047288061 /nfs/dbraw/zinc/28/80/61/1047288061.db2.gz DUYZNQVVWXRSTH-UHFFFAOYSA-N 1 0 316.445 4.181 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)COCc1ccccc1 ZINC000389907199 1047292552 /nfs/dbraw/zinc/29/25/52/1047292552.db2.gz HOQSWCOVPRXJCZ-HUUCEWRRSA-N 1 0 317.404 4.035 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)COCc1ccccc1 ZINC000389907197 1047292607 /nfs/dbraw/zinc/29/26/07/1047292607.db2.gz HOQSWCOVPRXJCZ-CABCVRRESA-N 1 0 317.404 4.035 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CCOCc1ccccc1)c1ccccc1O ZINC000389952065 1047293049 /nfs/dbraw/zinc/29/30/49/1047293049.db2.gz XJGKZDWVCJWALP-QFBILLFUSA-N 1 0 313.441 4.428 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)COCc1ccccc1)c1ccccc1O ZINC000389902844 1047293386 /nfs/dbraw/zinc/29/33/86/1047293386.db2.gz DIYMYHGICAGFFQ-VQIMIIECSA-N 1 0 313.441 4.286 20 10 DICDRO C[C@H](CCOCc1ccccc1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000389927839 1047293596 /nfs/dbraw/zinc/29/35/96/1047293596.db2.gz FQZTYRSRLVFCEN-CABCVRRESA-N 1 0 317.404 4.177 20 10 DICDRO C[C@H](CCOCc1ccccc1)[NH2+]Cc1cc(Cl)ccc1O ZINC000389905846 1047293895 /nfs/dbraw/zinc/29/38/95/1047293895.db2.gz GPIAOQFLCBFWBK-CQSZACIVSA-N 1 0 319.832 4.131 20 10 DICDRO C[C@@H]([NH2+]CC1(O)CCCCCC1)c1ccc2ccccc2c1O ZINC000390166477 1047295805 /nfs/dbraw/zinc/29/58/05/1047295805.db2.gz NGWBZLYHMWTBMJ-OAHLLOKOSA-N 1 0 313.441 4.281 20 10 DICDRO CCN(CC)[C@H](C[NH2+][C@H](C)c1ccccc1O)c1ccccc1 ZINC000390364172 1047296682 /nfs/dbraw/zinc/29/66/82/1047296682.db2.gz RVGQXSUYRXALDY-VQIMIIECSA-N 1 0 312.457 4.126 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCN1Cc1ccccc1)c1ccccc1O ZINC000390569508 1047296777 /nfs/dbraw/zinc/29/67/77/1047296777.db2.gz RWAXVYHONHRBLQ-ICSRJNTNSA-N 1 0 324.468 4.098 20 10 DICDRO C[C@H]([NH2+]CC1(N(C)C)CCCC1)c1ccc2ccccc2c1O ZINC000391185312 1047303673 /nfs/dbraw/zinc/30/36/73/1047303673.db2.gz MOCHSFPGZGUTIV-HNNXBMFYSA-N 1 0 312.457 4.070 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001118813065 1047311730 /nfs/dbraw/zinc/31/17/30/1047311730.db2.gz SJTVSQZLOWJRDU-WBMJQRKESA-N 1 0 315.388 4.186 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]Cc1cccc(F)c1 ZINC000725845136 1047320220 /nfs/dbraw/zinc/32/02/20/1047320220.db2.gz NTPBLSTWKVOKTK-UHFFFAOYSA-N 1 0 307.368 4.488 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2cc3ccccc3s2)c1 ZINC000725848580 1047322365 /nfs/dbraw/zinc/32/23/65/1047322365.db2.gz XHIWBKJYBSOTGV-UHFFFAOYSA-N 1 0 313.422 4.295 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cnn(CC2CCC2)c1)c1ccccc1O ZINC000898181548 1047325073 /nfs/dbraw/zinc/32/50/73/1047325073.db2.gz JQQPNAPGYYZMEG-RDTXWAMCSA-N 1 0 313.445 4.191 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000398235217 1047326457 /nfs/dbraw/zinc/32/64/57/1047326457.db2.gz YMIIBIGUCGYBRO-ZIFCJYIRSA-N 1 0 324.468 4.014 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)[C@H]1CCCOC1 ZINC001119345603 1047329861 /nfs/dbraw/zinc/32/98/61/1047329861.db2.gz XLLCGDGXSGCOSH-FXUDXRNXSA-N 1 0 303.446 4.044 20 10 DICDRO Cc1ncc(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)o1 ZINC000840795425 1047335372 /nfs/dbraw/zinc/33/53/72/1047335372.db2.gz ZPELBSVZGNGDJO-IBGZPJMESA-N 1 0 322.408 4.152 20 10 DICDRO C[C@H]([NH2+][C@H]1CS[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000840854991 1047346444 /nfs/dbraw/zinc/34/64/44/1047346444.db2.gz ILJHSYWZKWFJDA-HLLBOEOZSA-N 1 0 304.503 4.222 20 10 DICDRO Cc1ccc(Br)c(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000840874140 1047351089 /nfs/dbraw/zinc/35/10/89/1047351089.db2.gz XBFMNRMHRLHQDF-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO COCC1CCC([NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000840882533 1047353270 /nfs/dbraw/zinc/35/32/70/1047353270.db2.gz WFJFFCLWJFGFKQ-UQPPLGOBSA-N 1 0 313.441 4.401 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC(C)(C)c2cccnc2)cc1 ZINC000840891527 1047354197 /nfs/dbraw/zinc/35/41/97/1047354197.db2.gz IDLXDDGBMSURHX-INIZCTEOSA-N 1 0 311.473 4.166 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccccc1O ZINC000840888668 1047355023 /nfs/dbraw/zinc/35/50/23/1047355023.db2.gz MTMJTJFZRIEWDV-SNRMKQJTSA-N 1 0 311.425 4.245 20 10 DICDRO COc1cccc([C@@H]2C[C@H]2C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000840888692 1047355413 /nfs/dbraw/zinc/35/54/13/1047355413.db2.gz NEGBDYFACFVJQU-ALKREAHSSA-N 1 0 311.425 4.164 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccccc1O ZINC000840888670 1047355585 /nfs/dbraw/zinc/35/55/85/1047355585.db2.gz MTMJTJFZRIEWDV-ZYSHUDEJSA-N 1 0 311.425 4.245 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)CCC(F)(F)F ZINC000840895479 1047357158 /nfs/dbraw/zinc/35/71/58/1047357158.db2.gz YNSZRRGDRQYWRI-KGLIPLIRSA-N 1 0 316.411 4.313 20 10 DICDRO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C ZINC000840894716 1047357299 /nfs/dbraw/zinc/35/72/99/1047357299.db2.gz SDEKRFAWORJPAP-DLBZAZTESA-N 1 0 311.473 4.046 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](c1ccccc1)[C@@H]1CCCO1 ZINC000840929974 1047360973 /nfs/dbraw/zinc/36/09/73/1047360973.db2.gz DZWPJGMAXSOKKZ-LEWJYISDSA-N 1 0 324.468 4.071 20 10 DICDRO Cc1cccnc1[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)C(C)C ZINC000840934665 1047361624 /nfs/dbraw/zinc/36/16/24/1047361624.db2.gz UVLWJCPLDIILDN-LJQANCHMSA-N 1 0 311.473 4.251 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)c(Cl)c1 ZINC000840936618 1047361660 /nfs/dbraw/zinc/36/16/60/1047361660.db2.gz MRASLDCJJAURCJ-ZIAGYGMSSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2C)cs1 ZINC000840936714 1047361805 /nfs/dbraw/zinc/36/18/05/1047361805.db2.gz DBHQEINVHSKQGN-GOSISDBHSA-N 1 0 315.486 4.163 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)c(Cl)c1 ZINC000840942145 1047363765 /nfs/dbraw/zinc/36/37/65/1047363765.db2.gz UGRFAMMCHLRTFE-JTQLQIEISA-N 1 0 307.743 4.128 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c(Cl)c1 ZINC000840946025 1047364213 /nfs/dbraw/zinc/36/42/13/1047364213.db2.gz GFIDMEXETUFFOO-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1cccc(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)c1O ZINC000840963873 1047366304 /nfs/dbraw/zinc/36/63/04/1047366304.db2.gz QXCXPGQIFTXKHE-HXUWFJFHSA-N 1 0 323.436 4.054 20 10 DICDRO Oc1ccc2ccccc2c1C[NH+]1CCc2ccccc2CC1 ZINC000322396855 1047366174 /nfs/dbraw/zinc/36/61/74/1047366174.db2.gz RYUOSMHSCVHHMZ-UHFFFAOYSA-N 1 0 303.405 4.146 20 10 DICDRO CN(C(=O)Nc1ccc(N=Nc2ccccc2)cc1)C1CC([NH3+])C1 ZINC000841004757 1047369641 /nfs/dbraw/zinc/36/96/41/1047369641.db2.gz PUJIZLMDTNVOSY-UHFFFAOYSA-N 1 0 323.400 4.055 20 10 DICDRO C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCc1ccc(N)cc1 ZINC000841036466 1047373666 /nfs/dbraw/zinc/37/36/66/1047373666.db2.gz SITGWFVEMHRABL-ZDUSSCGKSA-N 1 0 322.374 4.051 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000841034651 1047374094 /nfs/dbraw/zinc/37/40/94/1047374094.db2.gz JBEIQJQUAOUHLW-RTBURBONSA-N 1 0 314.860 4.391 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1 ZINC000841058685 1047376183 /nfs/dbraw/zinc/37/61/83/1047376183.db2.gz QUBQOZFMCSNEPA-OAQYLSRUSA-N 1 0 323.484 4.282 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3)cc1 ZINC000841069750 1047378400 /nfs/dbraw/zinc/37/84/00/1047378400.db2.gz DATSKRWESIDXMA-UHFFFAOYSA-N 1 0 323.484 4.181 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2cccc3c2CCCN3)c1O ZINC000841082990 1047381687 /nfs/dbraw/zinc/38/16/87/1047381687.db2.gz LANJVAJZMSGEJS-UHFFFAOYSA-N 1 0 316.832 4.002 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2SCCc3ccccc32)cc1C ZINC000749293563 1047406484 /nfs/dbraw/zinc/40/64/84/1047406484.db2.gz AXSMJXCLMNCNFO-LJQANCHMSA-N 1 0 313.466 4.129 20 10 DICDRO C[C@@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1ccc(Cl)cc1O ZINC000841744466 1047446995 /nfs/dbraw/zinc/44/69/95/1047446995.db2.gz OJKWJNHBNYGLOH-IAQYHMDHSA-N 1 0 324.877 4.061 20 10 DICDRO CC(C)Oc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841744353 1047447246 /nfs/dbraw/zinc/44/72/46/1047447246.db2.gz HBKMZAJHMZVVCI-LBPRGKRZSA-N 1 0 320.820 4.079 20 10 DICDRO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1[O-] ZINC000841744130 1047448101 /nfs/dbraw/zinc/44/81/01/1047448101.db2.gz MBIQDDRVXXTTRT-ZIAGYGMSSA-N 1 0 312.885 4.207 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000841744258 1047448483 /nfs/dbraw/zinc/44/84/83/1047448483.db2.gz GNDLQHCFWOBNGZ-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841744189 1047448815 /nfs/dbraw/zinc/44/88/15/1047448815.db2.gz MSJBCFCDSKSZKP-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO COc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841744188 1047448939 /nfs/dbraw/zinc/44/89/39/1047448939.db2.gz MSJBCFCDSKSZKP-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO CC(C)OC1CCC([NH2+][C@@H](C)c2ccc(Cl)cc2[O-])CC1 ZINC000841747490 1047449082 /nfs/dbraw/zinc/44/90/82/1047449082.db2.gz BQVBBDWHBXLBAY-GRTSSRMGSA-N 1 0 311.853 4.432 20 10 DICDRO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(Cl)cc1O ZINC000841751134 1047450099 /nfs/dbraw/zinc/45/00/99/1047450099.db2.gz LFMDUKHPVFNFBK-GFCCVEGCSA-N 1 0 319.836 4.208 20 10 DICDRO C[C@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccc(Cl)cc1O ZINC000841750239 1047450158 /nfs/dbraw/zinc/45/01/58/1047450158.db2.gz WEPOQWRZRHZPCZ-KPZWWZAWSA-N 1 0 317.816 4.010 20 10 DICDRO CCCCn1cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c(C)n1 ZINC000841752993 1047452581 /nfs/dbraw/zinc/45/25/81/1047452581.db2.gz WUYUDTGOYMZMKM-ZDUSSCGKSA-N 1 0 321.852 4.201 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841758484 1047453980 /nfs/dbraw/zinc/45/39/80/1047453980.db2.gz GUFQRWDBJGNQIW-CYBMUJFWSA-N 1 0 318.848 4.353 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+](Cc2ccc(C)nc2)CC2CC2)c1 ZINC000842630574 1047492812 /nfs/dbraw/zinc/49/28/12/1047492812.db2.gz IADUPKZYXXMZEA-UHFFFAOYSA-N 1 0 310.441 4.125 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2(c3ccccc3Cl)CC2)c1 ZINC000842724615 1047499179 /nfs/dbraw/zinc/49/91/79/1047499179.db2.gz ADFIGZGVJAMBFO-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2(c3cccc(F)c3)CCC2)c1 ZINC000842743267 1047501864 /nfs/dbraw/zinc/50/18/64/1047501864.db2.gz BXHAOLGKLOYFJL-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO CC[N@H+](Cc1cccc(-c2ccccn2)c1)Cc1ccccc1O ZINC001142849009 1047503334 /nfs/dbraw/zinc/50/33/34/1047503334.db2.gz ILWKLKKTHKQWOI-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO COCC1(CC[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000842894245 1047511770 /nfs/dbraw/zinc/51/17/70/1047511770.db2.gz NREOXDGURSBVSG-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(CO)cc1)c1ccc(N2CCCCC2)cc1 ZINC000842892865 1047512198 /nfs/dbraw/zinc/51/21/98/1047512198.db2.gz HHJWYVNNUGUIOS-QGZVFWFLSA-N 1 0 324.468 4.020 20 10 DICDRO COc1ccccc1C1([NH2+][C@H](C)c2ccc(Cl)cc2O)CC1 ZINC000842902153 1047512210 /nfs/dbraw/zinc/51/22/10/1047512210.db2.gz MESZZGDUDSAKMP-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(c3ccccc3F)CCC2)c1 ZINC000842905782 1047513578 /nfs/dbraw/zinc/51/35/78/1047513578.db2.gz LXYHFLYUKAVUGT-CYBMUJFWSA-N 1 0 315.388 4.270 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCS[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000842928419 1047513588 /nfs/dbraw/zinc/51/35/88/1047513588.db2.gz KDKFDSSCXJUTMF-RLFYNMQTSA-N 1 0 304.503 4.222 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c1O ZINC001143110430 1047531776 /nfs/dbraw/zinc/53/17/76/1047531776.db2.gz FYQFHBAIIQYEGI-SFHVURJKSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)c1O ZINC001143104571 1047532009 /nfs/dbraw/zinc/53/20/09/1047532009.db2.gz VITIUMWNHVSIGI-WBVHZDCISA-N 1 0 315.457 4.023 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)c1O ZINC001143104569 1047532125 /nfs/dbraw/zinc/53/21/25/1047532125.db2.gz VITIUMWNHVSIGI-RDJZCZTQSA-N 1 0 315.457 4.023 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCc3ccsc3C2)c1O ZINC001143110576 1047532383 /nfs/dbraw/zinc/53/23/83/1047532383.db2.gz JYFAJWAFLCAKCU-UHFFFAOYSA-N 1 0 301.455 4.310 20 10 DICDRO CC(C)(C)c1cccc(C[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c1O ZINC001143105261 1047532434 /nfs/dbraw/zinc/53/24/34/1047532434.db2.gz OZSVLGGGVKBDHR-DOMZBBRYSA-N 1 0 309.400 4.167 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H]2c2ccncc2)c1O ZINC001143110279 1047532614 /nfs/dbraw/zinc/53/26/14/1047532614.db2.gz BCOXQVOPDHZUKX-SFHVURJKSA-N 1 0 310.441 4.422 20 10 DICDRO Cc1c[nH+]c(NCc2cc(Cl)c3cccnc3c2O)cc1C ZINC001157726834 1047751748 /nfs/dbraw/zinc/75/17/48/1047751748.db2.gz BCNGLDQMGZAHHS-UHFFFAOYSA-N 1 0 313.788 4.218 20 10 DICDRO C[C@H]([NH2+][C@H]1CCS[C@H](C)C1)c1ccc2ccccc2c1O ZINC000927035073 1047765072 /nfs/dbraw/zinc/76/50/72/1047765072.db2.gz ZYUUVIWTHYTHJX-IPYPFGDCSA-N 1 0 301.455 4.480 20 10 DICDRO c1cc(C2CC[NH2+]CC2)ccc1Nc1ccc2c(c1)CCCN2 ZINC001159597047 1047876036 /nfs/dbraw/zinc/87/60/36/1047876036.db2.gz TWMPCRJCLPOLAM-UHFFFAOYSA-N 1 0 307.441 4.255 20 10 DICDRO Nc1ccc(N(c2ccccc2)c2ccc3c(c2)C[NH2+]C3)cc1 ZINC001159703459 1047904692 /nfs/dbraw/zinc/90/46/92/1047904692.db2.gz JXPCCGSXSDHENW-UHFFFAOYSA-N 1 0 301.393 4.342 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2C[C@@H](C(C)C)c3ccccc32)c1 ZINC001183293261 1047915697 /nfs/dbraw/zinc/91/56/97/1047915697.db2.gz WWMUFFHQRHDBHI-OALUTQOASA-N 1 0 311.425 4.375 20 10 DICDRO CSc1ccccc1C[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC001183355191 1047918956 /nfs/dbraw/zinc/91/89/56/1047918956.db2.gz NIDVNZDUNREKRN-ZIAGYGMSSA-N 1 0 301.455 4.396 20 10 DICDRO CCc1cc(C[N@H+]2CC=C(COC)CC2)c(O)c(C(C)(C)C)c1 ZINC000774643793 1047940978 /nfs/dbraw/zinc/94/09/78/1047940978.db2.gz CVWSFPYNXVVUSF-UHFFFAOYSA-N 1 0 317.473 4.031 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]Cc2cc(O)ccc2Cl)c1 ZINC001183532547 1047943119 /nfs/dbraw/zinc/94/31/19/1047943119.db2.gz DBUSNFCZHQLCQZ-UHFFFAOYSA-N 1 0 305.805 4.164 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)cc2cccnc21)c1ccc(N(C)C)cc1 ZINC000775834305 1047943411 /nfs/dbraw/zinc/94/34/11/1047943411.db2.gz QSZCOCGAQWWSJQ-CQSZACIVSA-N 1 0 323.415 4.291 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]Cc2c(F)cc(F)cc2F)c1 ZINC001183738883 1047961148 /nfs/dbraw/zinc/96/11/48/1047961148.db2.gz JHLPTXJKJNKVOZ-UHFFFAOYSA-N 1 0 309.331 4.223 20 10 DICDRO CC(C)Nc1ccc(Nc2ccc(N3CCC[C@H]([NH3+])C3)cc2)cc1 ZINC001159982507 1047963591 /nfs/dbraw/zinc/96/35/91/1047963591.db2.gz UIAKWPIZJDEDLR-INIZCTEOSA-N 1 0 324.472 4.178 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2C[C@H]3C[C@@]3(c3ccccc3)C2)c1 ZINC001183799026 1047966052 /nfs/dbraw/zinc/96/60/52/1047966052.db2.gz IXKSQHPSUQPDGG-CTNGQTDRSA-N 1 0 307.437 4.289 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C[C@@H](C)C(C)(C)C)c1O ZINC001183843805 1047970361 /nfs/dbraw/zinc/97/03/61/1047970361.db2.gz JTOZZAIQJBDWNF-LLVKDONJSA-N 1 0 314.267 4.235 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c1 ZINC001183896896 1047977854 /nfs/dbraw/zinc/97/78/54/1047977854.db2.gz JWWCNTCTHDMMBU-LJQANCHMSA-N 1 0 317.473 4.345 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@]3(C2)OCc2ccccc23)c1 ZINC000774699655 1047978857 /nfs/dbraw/zinc/97/88/57/1047978857.db2.gz AGVZOHCKKWMQNH-OAQYLSRUSA-N 1 0 323.436 4.031 20 10 DICDRO Oc1c(C[NH2+][C@@H]2CCc3cc(F)ccc32)ccc2ccccc21 ZINC001184135723 1047999402 /nfs/dbraw/zinc/99/94/02/1047999402.db2.gz USWQHWCXVNWCSS-LJQANCHMSA-N 1 0 307.368 4.462 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CCc2ccco2)cc1 ZINC001198943322 1048015628 /nfs/dbraw/zinc/01/56/28/1048015628.db2.gz WTJHMADBKPIXFJ-UHFFFAOYSA-N 1 0 300.446 4.238 20 10 DICDRO Cc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)c1 ZINC001199093995 1048035203 /nfs/dbraw/zinc/03/52/03/1048035203.db2.gz SPBSFBXCOXKGRH-UHFFFAOYSA-N 1 0 322.374 4.370 20 10 DICDRO CC1(C)CCNc2ccc(Nc3ccc4c(c3)CC[NH2+]C4)cc21 ZINC001160332056 1048036095 /nfs/dbraw/zinc/03/60/95/1048036095.db2.gz GPLDCFWOHDRNDP-UHFFFAOYSA-N 1 0 307.441 4.169 20 10 DICDRO Cc1cc(C)c2c(c1)CC[N@@H+](Cc1ccc(N(C)C)cc1C)C2 ZINC001184417851 1048037090 /nfs/dbraw/zinc/03/70/90/1048037090.db2.gz INEFCXOXQMUZOO-UHFFFAOYSA-N 1 0 308.469 4.236 20 10 DICDRO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000776013772 1048089596 /nfs/dbraw/zinc/08/95/96/1048089596.db2.gz OFOWCYOZAOIYDA-SKDRFNHKSA-N 1 0 307.743 4.208 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC1(c2ccc(F)cc2)CC1 ZINC000776017904 1048091088 /nfs/dbraw/zinc/09/10/88/1048091088.db2.gz BRXCRDCTAIGLOU-UHFFFAOYSA-N 1 0 305.780 4.006 20 10 DICDRO CC[C@@H]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC001199830342 1048107981 /nfs/dbraw/zinc/10/79/81/1048107981.db2.gz JAOIRNWSBCJWKG-SJORKVTESA-N 1 0 300.490 4.375 20 10 DICDRO CCC[C@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)c1ccccc1 ZINC000774816465 1048124283 /nfs/dbraw/zinc/12/42/83/1048124283.db2.gz YMGUYLRBUAAKMX-SFHVURJKSA-N 1 0 315.388 4.365 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1Cl ZINC000774835741 1048139292 /nfs/dbraw/zinc/13/92/92/1048139292.db2.gz JMHPMDFBHQBEAT-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO CCS[C@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001200921057 1048156242 /nfs/dbraw/zinc/15/62/42/1048156242.db2.gz CJLMOBNHIDJAPI-IRXDYDNUSA-N 1 0 305.487 4.166 20 10 DICDRO COc1ccc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2)c(O)c1 ZINC001203629379 1048240629 /nfs/dbraw/zinc/24/06/29/1048240629.db2.gz YYYHYOHGACQKQH-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO COc1ccccc1C(C)(C)[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000776167935 1048264264 /nfs/dbraw/zinc/26/42/64/1048264264.db2.gz OTXPEEJHJXWSKO-UHFFFAOYSA-N 1 0 319.832 4.388 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)c(Br)c1 ZINC001175418381 1048299158 /nfs/dbraw/zinc/29/91/58/1048299158.db2.gz IEEMLWHSSHDIQA-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H](c2ccccc2)O1)c1ccccc1O ZINC001175418918 1048300688 /nfs/dbraw/zinc/30/06/88/1048300688.db2.gz PWNJAZLTHSKGLR-VPWXQRGCSA-N 1 0 311.425 4.353 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ncc(-c2ccccc2)o1 ZINC001175419507 1048301225 /nfs/dbraw/zinc/30/12/25/1048301225.db2.gz WEILOMZOXZRZRL-ZIAGYGMSSA-N 1 0 308.381 4.459 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](c2ccccc2)O1)c1ccccc1O ZINC001175418913 1048301625 /nfs/dbraw/zinc/30/16/25/1048301625.db2.gz PWNJAZLTHSKGLR-KNBMTAEXSA-N 1 0 311.425 4.353 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)CCO1 ZINC001201742293 1048362143 /nfs/dbraw/zinc/36/21/43/1048362143.db2.gz MOEUKYRHRMZGNU-ICSRJNTNSA-N 1 0 317.473 4.085 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCc3ccccc3C2)cc1 ZINC001201733814 1048373290 /nfs/dbraw/zinc/37/32/90/1048373290.db2.gz BZLSNNCJATUCAG-VOFKWLDRSA-N 1 0 320.480 4.161 20 10 DICDRO COc1ccc(C[NH2+][C@H](Cc2cccnc2)C2CCCC2)cc1C ZINC001175610071 1048393764 /nfs/dbraw/zinc/39/37/64/1048393764.db2.gz DLDWTIVHZUUHCE-HXUWFJFHSA-N 1 0 324.468 4.290 20 10 DICDRO CCCN(Cc1cnc(C2CCC2)s1)c1ccc(C[NH3+])cc1 ZINC000775139726 1048427866 /nfs/dbraw/zinc/42/78/66/1048427866.db2.gz GAWLFXGVWJHQHE-UHFFFAOYSA-N 1 0 315.486 4.286 20 10 DICDRO c1ccc(C[C@@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001202058936 1048433821 /nfs/dbraw/zinc/43/38/21/1048433821.db2.gz SMJIORWNAUCVMC-PXNSSMCTSA-N 1 0 307.437 4.123 20 10 DICDRO C[C@@H]([NH2+]Cc1cc2ccccc2n1C)c1ccc(N(C)C)cc1 ZINC001202066263 1048437190 /nfs/dbraw/zinc/43/71/90/1048437190.db2.gz RKWLXGKSBBVOHS-OAHLLOKOSA-N 1 0 307.441 4.095 20 10 DICDRO CCOc1cccc(C[N@H+](C)Cc2cc(Cl)ccc2F)c1O ZINC000775155293 1048454466 /nfs/dbraw/zinc/45/44/66/1048454466.db2.gz XXJIIIXSVWFOKH-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]C2CCC(OC(C)C)CC2)c1O ZINC000776252886 1048467200 /nfs/dbraw/zinc/46/72/00/1048467200.db2.gz IZXZATOHRRLLCP-UHFFFAOYSA-N 1 0 311.853 4.180 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCOC3(CCCCC3)C2)c1O ZINC000776249716 1048473039 /nfs/dbraw/zinc/47/30/39/1048473039.db2.gz VSJXJNBJXFUCAW-INIZCTEOSA-N 1 0 323.864 4.326 20 10 DICDRO c1csc(SCc2ccc(C[NH+]3CCCCC3)cc2)n1 ZINC001188659946 1048536095 /nfs/dbraw/zinc/53/60/95/1048536095.db2.gz HYWFQWNBDRTPQF-UHFFFAOYSA-N 1 0 304.484 4.421 20 10 DICDRO Cc1cc(Nc2ccccc2Cc2ccc(N)cc2)cc(C)[nH+]1 ZINC001176056931 1048554970 /nfs/dbraw/zinc/55/49/70/1048554970.db2.gz IEFSOKHGEOGLEW-UHFFFAOYSA-N 1 0 303.409 4.037 20 10 DICDRO CCO[C@@H](C[NH2+]Cc1cc(Cl)cc(C)c1O)c1ccccc1 ZINC000775199439 1048555697 /nfs/dbraw/zinc/55/56/97/1048555697.db2.gz CRWQNBPSCYRECF-KRWDZBQOSA-N 1 0 319.832 4.221 20 10 DICDRO Cc1cc(C[NH2+][C@@H](Cc2ccccc2)C(C)C)ccc1N(C)C ZINC001176129576 1048578631 /nfs/dbraw/zinc/57/86/31/1048578631.db2.gz FGVFWOMULPYVLW-FQEVSTJZSA-N 1 0 310.485 4.418 20 10 DICDRO C[C@H]([NH2+]Cc1cc2ccncc2s1)c1ccc(N(C)C)cc1 ZINC000850251931 1048629033 /nfs/dbraw/zinc/62/90/33/1048629033.db2.gz IWWDXQHTZSUNSG-ZDUSSCGKSA-N 1 0 311.454 4.213 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCc3ccc(O)cc32)cc1 ZINC000850386665 1048646616 /nfs/dbraw/zinc/64/66/16/1048646616.db2.gz LAXMERFOXRCMPL-HXUWFJFHSA-N 1 0 310.441 4.016 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C2CCC3(CC3(F)F)CC2)cc1 ZINC000850391779 1048646908 /nfs/dbraw/zinc/64/69/08/1048646908.db2.gz ZBSULZZMOWQTMM-ARJAWSKDSA-N 1 0 320.427 4.323 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)c1O ZINC000850386608 1048646997 /nfs/dbraw/zinc/64/69/97/1048646997.db2.gz MTJWTGZHNKBTTN-IFXJQAMLSA-N 1 0 311.425 4.122 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2c1cc(F)cc2F ZINC000121371376 1048657092 /nfs/dbraw/zinc/65/70/92/1048657092.db2.gz PCHJTOUTGVDSSA-LJQANCHMSA-N 1 0 316.395 4.116 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)c1ccc(N(C)C)cc1 ZINC000850462728 1048664961 /nfs/dbraw/zinc/66/49/61/1048664961.db2.gz QCBZNFYSQKWXLN-KGLIPLIRSA-N 1 0 309.413 4.306 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)c1ccsc1 ZINC000850485720 1048670911 /nfs/dbraw/zinc/67/09/11/1048670911.db2.gz BABWDHQOXGOMSP-CRAIPNDOSA-N 1 0 316.470 4.076 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2noc3ccccc23)cc1 ZINC000850483678 1048671242 /nfs/dbraw/zinc/67/12/42/1048671242.db2.gz QSGMPIIOWJRXQM-OAHLLOKOSA-N 1 0 323.440 4.177 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1ccc2ccccc2c1O ZINC000850491885 1048671266 /nfs/dbraw/zinc/67/12/66/1048671266.db2.gz BBCZSSGOKFTYBF-GDBMZVCRSA-N 1 0 312.457 4.069 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)CC2 ZINC000850482355 1048671282 /nfs/dbraw/zinc/67/12/82/1048671282.db2.gz ROUJAUIRKXIBHP-AWEZNQCLSA-N 1 0 308.208 4.476 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)c1ccsc1 ZINC000850485722 1048671345 /nfs/dbraw/zinc/67/13/45/1048671345.db2.gz BABWDHQOXGOMSP-QAPCUYQASA-N 1 0 316.470 4.076 20 10 DICDRO CC[C@H]([NH2+]CCc1noc2ccccc12)c1ccc(C)cc1O ZINC000850483173 1048671477 /nfs/dbraw/zinc/67/14/77/1048671477.db2.gz OERQYDQHSUUFLH-INIZCTEOSA-N 1 0 310.397 4.125 20 10 DICDRO Cn1c(-c2ccccc2)cnc1SCCC[NH+]1CCCCC1 ZINC001165274979 1048672627 /nfs/dbraw/zinc/67/26/27/1048672627.db2.gz FPZUEFAFNOXRPH-UHFFFAOYSA-N 1 0 315.486 4.055 20 10 DICDRO CSCC1(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000850506121 1048672768 /nfs/dbraw/zinc/67/27/68/1048672768.db2.gz FWJHEKFTMMTRKE-WCQYABFASA-N 1 0 309.450 4.203 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@@H](O)c2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000850530514 1048683049 /nfs/dbraw/zinc/68/30/49/1048683049.db2.gz ZGYWPIBFRJKFCF-JBZDTAIVSA-N 1 0 323.436 4.100 20 10 DICDRO COCc1csc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000850532747 1048685063 /nfs/dbraw/zinc/68/50/63/1048685063.db2.gz ONRYHETWNCJPON-IINYFYTJSA-N 1 0 321.417 4.077 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cc(Cl)ccc1O ZINC000850543079 1048686806 /nfs/dbraw/zinc/68/68/06/1048686806.db2.gz XZPJESPLFRHQTD-IAGOWNOFSA-N 1 0 317.816 4.479 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc(Cl)cc1O ZINC000850542171 1048687354 /nfs/dbraw/zinc/68/73/54/1048687354.db2.gz ISULCAOYSQJKBY-HWPZZCPQSA-N 1 0 303.789 4.089 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H](O)C(C)C)c1 ZINC000850554793 1048688826 /nfs/dbraw/zinc/68/88/26/1048688826.db2.gz KZUYHNOFXGUAOL-RYGJVYDSSA-N 1 0 313.441 4.109 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc2ccccc2c1O ZINC000850553095 1048689583 /nfs/dbraw/zinc/68/95/83/1048689583.db2.gz RSBLZAZPVFMOCD-ABAIWWIYSA-N 1 0 305.368 4.487 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2nsc3ccccc23)c(O)c1 ZINC000850562756 1048693197 /nfs/dbraw/zinc/69/31/97/1048693197.db2.gz YAZDJMSPTVMGJU-CYBMUJFWSA-N 1 0 312.438 4.204 20 10 DICDRO C[C@@H]([NH2+]CCCc1ccco1)c1ccc(Br)cc1O ZINC000850569315 1048696929 /nfs/dbraw/zinc/69/69/29/1048696929.db2.gz ADIOOFOUUDDKKG-LLVKDONJSA-N 1 0 324.218 4.031 20 10 DICDRO COc1cccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c1C ZINC000850579184 1048700127 /nfs/dbraw/zinc/70/01/27/1048700127.db2.gz TVCIQLUJGORVPF-ABAIWWIYSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](c2ccccc2)[C@H](C)O)c1O ZINC000850582385 1048700728 /nfs/dbraw/zinc/70/07/28/1048700728.db2.gz FNAOVISMMXDPSC-DCGLDWPTSA-N 1 0 319.832 4.127 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2cccnc2c1)c1ccc(N(C)C)cc1 ZINC000775361857 1048703907 /nfs/dbraw/zinc/70/39/07/1048703907.db2.gz GHGHOFHZGAIFKU-HNNXBMFYSA-N 1 0 305.425 4.152 20 10 DICDRO COc1c(C)cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1C ZINC000775363281 1048704294 /nfs/dbraw/zinc/70/42/94/1048704294.db2.gz MEFCMFWCORQXIK-INIZCTEOSA-N 1 0 312.457 4.229 20 10 DICDRO COc1ccc2oc(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)cc2c1 ZINC000775363905 1048704915 /nfs/dbraw/zinc/70/49/15/1048704915.db2.gz NJXAFOOZEPPOOH-AWEZNQCLSA-N 1 0 324.424 4.358 20 10 DICDRO C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)s1)c1ccc(N(C)C)cc1 ZINC000775363896 1048705181 /nfs/dbraw/zinc/70/51/81/1048705181.db2.gz NGWLXJWGHYIYQQ-CYBMUJFWSA-N 1 0 317.502 4.357 20 10 DICDRO Oc1cc(Br)ccc1C[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC001206715011 1048749231 /nfs/dbraw/zinc/74/92/31/1048749231.db2.gz NVYGMHCSPDCUOF-CYBMUJFWSA-N 1 0 324.262 4.167 20 10 DICDRO Oc1cc(Br)ccc1C[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC001206715012 1048749539 /nfs/dbraw/zinc/74/95/39/1048749539.db2.gz NVYGMHCSPDCUOF-ZDUSSCGKSA-N 1 0 324.262 4.167 20 10 DICDRO CC[C@@H]([NH2+]CCOc1ccccc1Cl)c1ccccc1O ZINC000775414973 1048790288 /nfs/dbraw/zinc/79/02/88/1048790288.db2.gz NBRBBFRGUMDRRW-OAHLLOKOSA-N 1 0 305.805 4.165 20 10 DICDRO CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000775417514 1048793654 /nfs/dbraw/zinc/79/36/54/1048793654.db2.gz MTOYMPLZUGFXDF-ILZDJORESA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H](C[NH2+]Cc1cc(Br)ccc1O)c1ccccc1 ZINC000110246771 1048806597 /nfs/dbraw/zinc/80/65/97/1048806597.db2.gz IRBSGMNCJCLANY-LBPRGKRZSA-N 1 0 320.230 4.048 20 10 DICDRO Cc1nocc1C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000851878913 1048808321 /nfs/dbraw/zinc/80/83/21/1048808321.db2.gz DDWZOAWUNYYZLS-MRXNPFEDSA-N 1 0 322.408 4.452 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@@]2(C)CC2(F)F)cc1F ZINC001203169413 1048845129 /nfs/dbraw/zinc/84/51/29/1048845129.db2.gz ZIRABCKOFYCBIR-INIZCTEOSA-N 1 0 314.395 4.197 20 10 DICDRO CCC[N@H+](Cc1ccc(OC(F)F)cc1)Cc1ccccc1O ZINC000110732546 1048850733 /nfs/dbraw/zinc/85/07/33/1048850733.db2.gz CDZIKAIAOYIKIF-UHFFFAOYSA-N 1 0 321.367 4.406 20 10 DICDRO COc1cc(C[NH2+][C@H](C)CC2CCC2)c(O)c(C(C)(C)C)c1 ZINC001203288876 1048859105 /nfs/dbraw/zinc/85/91/05/1048859105.db2.gz FQTJJQRSVOVTIJ-CYBMUJFWSA-N 1 0 305.462 4.367 20 10 DICDRO CC[C@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccccc1O ZINC000853241724 1048891189 /nfs/dbraw/zinc/89/11/89/1048891189.db2.gz MUEFDKVAEQUHQV-AWEZNQCLSA-N 1 0 310.319 4.047 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c(O)c1 ZINC000853241614 1048892161 /nfs/dbraw/zinc/89/21/61/1048892161.db2.gz LZLDQHRXBUIYKL-GJZGRUSLSA-N 1 0 311.425 4.437 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)Cc2ccsc2)cc1F ZINC001177442511 1048893991 /nfs/dbraw/zinc/89/39/91/1048893991.db2.gz UFZWHFFTKLYDID-AWEZNQCLSA-N 1 0 320.477 4.454 20 10 DICDRO CCCc1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)s1 ZINC001177529370 1048908530 /nfs/dbraw/zinc/90/85/30/1048908530.db2.gz QFXNNINCZIPUIA-UHFFFAOYSA-N 1 0 314.498 4.373 20 10 DICDRO CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177641943 1048921731 /nfs/dbraw/zinc/92/17/31/1048921731.db2.gz PLABDBHATFFCRW-DYVFJYSZSA-N 1 0 310.432 4.479 20 10 DICDRO CCCOc1ccc(C[NH2+]CCCc2nc(C)cs2)cc1C ZINC001177607876 1048923145 /nfs/dbraw/zinc/92/31/45/1048923145.db2.gz FSUYMANMHOGHLH-UHFFFAOYSA-N 1 0 318.486 4.271 20 10 DICDRO CCOc1ccccc1C[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001203545337 1048923305 /nfs/dbraw/zinc/92/33/05/1048923305.db2.gz IKYWRPSUNGRUHM-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO Cc1ccc(-c2ncc(C[NH2+][C@@H](C)c3ccccc3O)s2)o1 ZINC001203535959 1048924839 /nfs/dbraw/zinc/92/48/39/1048924839.db2.gz BRUNWUFMHCGOHS-LBPRGKRZSA-N 1 0 314.410 4.268 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCC[C@@]2(CCc3c2cccc3F)C1 ZINC001203562265 1048930745 /nfs/dbraw/zinc/93/07/45/1048930745.db2.gz GJEHJSSFYUVAGD-HXUWFJFHSA-N 1 0 311.400 4.011 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccn1 ZINC001177688330 1048933441 /nfs/dbraw/zinc/93/34/41/1048933441.db2.gz TXAHVIKEECFTFW-LJQANCHMSA-N 1 0 309.457 4.313 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCc3ccccc3[C@@H]2CC)c1O ZINC001203614099 1048941764 /nfs/dbraw/zinc/94/17/64/1048941764.db2.gz OPEGIRWMBZBMKA-SFHVURJKSA-N 1 0 311.425 4.300 20 10 DICDRO COc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)c(O)c1 ZINC001203634417 1048943394 /nfs/dbraw/zinc/94/33/94/1048943394.db2.gz DZKITGBFMQTALR-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)c(O)c1 ZINC001203627623 1048944399 /nfs/dbraw/zinc/94/43/99/1048944399.db2.gz MASFBRYHIMLVKT-ZDUSSCGKSA-N 1 0 323.845 4.453 20 10 DICDRO Cc1ccccc1O[C@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203657519 1048951449 /nfs/dbraw/zinc/95/14/49/1048951449.db2.gz LVXBDWXVCWWZSQ-INIZCTEOSA-N 1 0 317.816 4.007 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1cc2c(cc1O)CCCC2 ZINC000854225493 1048954318 /nfs/dbraw/zinc/95/43/18/1048954318.db2.gz GJZXIUYVMHIJBG-ZUOKHONESA-N 1 0 322.452 4.191 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)cc1 ZINC000854226116 1048955036 /nfs/dbraw/zinc/95/50/36/1048955036.db2.gz NZROFLNHVKGOSA-JLTOFOAXSA-N 1 0 309.457 4.063 20 10 DICDRO Cc1ccc(C[NH2+]CCCSc2nccs2)cc1Cl ZINC001177903943 1048958124 /nfs/dbraw/zinc/95/81/24/1048958124.db2.gz FSLBRPYFZPNJJB-UHFFFAOYSA-N 1 0 312.891 4.377 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001203680285 1048959776 /nfs/dbraw/zinc/95/97/76/1048959776.db2.gz NHTXBSXFNGXZJK-QGZVFWFLSA-N 1 0 319.351 4.016 20 10 DICDRO CC[C@@H]([NH2+]CCSCc1ccccc1)c1ccccc1O ZINC000775485024 1048996804 /nfs/dbraw/zinc/99/68/04/1048996804.db2.gz MXDWLMFLDQLFHB-QGZVFWFLSA-N 1 0 301.455 4.366 20 10 DICDRO CCC(CC)[C@@H](CC[NH2+]Cc1ccc(N2CCCC2)cc1)OC ZINC001178249975 1049001047 /nfs/dbraw/zinc/00/10/47/1049001047.db2.gz YTMOJPUPEBDMEW-HXUWFJFHSA-N 1 0 318.505 4.218 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]CC(C)(C)CO)c(O)c(C(C)(C)C)c1 ZINC001178231578 1049007839 /nfs/dbraw/zinc/00/78/39/1049007839.db2.gz FQZZIVPSKVHQJA-UHFFFAOYSA-N 1 0 321.505 4.095 20 10 DICDRO Oc1ccc2ccncc2c1C[NH+]1CCC(c2ccsc2)CC1 ZINC000776778536 1049009339 /nfs/dbraw/zinc/00/93/39/1049009339.db2.gz WERZFKKYCUAKQN-UHFFFAOYSA-N 1 0 324.449 4.382 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccccc1O ZINC000775489620 1049015025 /nfs/dbraw/zinc/01/50/25/1049015025.db2.gz VVVMOFPFFBIUET-SUMWQHHRSA-N 1 0 324.424 4.079 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3cc(F)cc(Cl)c3)ccc21 ZINC000776800026 1049020231 /nfs/dbraw/zinc/02/02/31/1049020231.db2.gz QAQVPHLZOASDAN-UHFFFAOYSA-N 1 0 318.823 4.151 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccc3ncsc3c2)cc1C ZINC000776807710 1049027376 /nfs/dbraw/zinc/02/73/76/1049027376.db2.gz IJGBOZMMOBUEGH-CYBMUJFWSA-N 1 0 312.438 4.470 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CCC2)cc1 ZINC001203906557 1049027260 /nfs/dbraw/zinc/02/72/60/1049027260.db2.gz HHRCURMDQBDFBM-OAQYLSRUSA-N 1 0 323.436 4.261 20 10 DICDRO C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC001178436646 1049031448 /nfs/dbraw/zinc/03/14/48/1049031448.db2.gz ODMMNULWISUVCR-QVKFZJNVSA-N 1 0 307.437 4.425 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccccc1O ZINC000775499741 1049033056 /nfs/dbraw/zinc/03/30/56/1049033056.db2.gz VECVSRQQVPVPQZ-HQRMLTQVSA-N 1 0 324.468 4.268 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)ccc1OC ZINC001178448723 1049033202 /nfs/dbraw/zinc/03/32/02/1049033202.db2.gz ACUUITIEVSMLTA-RVKKMQEKSA-N 1 0 305.462 4.146 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCN([C@H](C)c2ccccc2)C1)c1ccccc1O ZINC000775499744 1049034452 /nfs/dbraw/zinc/03/44/52/1049034452.db2.gz VECVSRQQVPVPQZ-KPFFTGBYSA-N 1 0 324.468 4.268 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C)C(F)(F)CC2)cc1 ZINC001203937453 1049034864 /nfs/dbraw/zinc/03/48/64/1049034864.db2.gz ZDPLEGJWYKATPD-HNNXBMFYSA-N 1 0 310.432 4.400 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)cc1 ZINC001203936473 1049035782 /nfs/dbraw/zinc/03/57/82/1049035782.db2.gz HCJRCTCXDRITDS-GOSISDBHSA-N 1 0 316.395 4.368 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@H]2CCC=CO2)cc1 ZINC001178497032 1049038650 /nfs/dbraw/zinc/03/86/50/1049038650.db2.gz UQAPIKGYGIFVLL-LJQANCHMSA-N 1 0 302.462 4.095 20 10 DICDRO CC[C@H]([NH2+]CC1(c2ccccc2OC)CC1)c1ccccc1O ZINC000775500547 1049042397 /nfs/dbraw/zinc/04/23/97/1049042397.db2.gz RCJXIWOPRFFNKZ-KRWDZBQOSA-N 1 0 311.425 4.173 20 10 DICDRO CC[C@H]([NH2+]CCc1sc(C)nc1C)c1cc(Cl)ccc1O ZINC000775503872 1049046801 /nfs/dbraw/zinc/04/68/01/1049046801.db2.gz OLESCLSNBMZYSA-AWEZNQCLSA-N 1 0 324.877 4.402 20 10 DICDRO CC[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1cc(Cl)ccc1O ZINC000775510001 1049047954 /nfs/dbraw/zinc/04/79/54/1049047954.db2.gz UGBFWQCCQVNSOG-HNNXBMFYSA-N 1 0 307.825 4.064 20 10 DICDRO CC[C@@H]([NH2+]CC1(CC)CCOCC1)c1cc(Cl)ccc1O ZINC000775513611 1049049067 /nfs/dbraw/zinc/04/90/67/1049049067.db2.gz QLMVCXUEPSAYDX-OAHLLOKOSA-N 1 0 311.853 4.293 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)C[C@H](O)c1ccco1)c1cc(Cl)ccc1O ZINC000775513447 1049049154 /nfs/dbraw/zinc/04/91/54/1049049154.db2.gz JKVCRTCNOGJLII-PJODQICGSA-N 1 0 323.820 4.192 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775508918 1049049568 /nfs/dbraw/zinc/04/95/68/1049049568.db2.gz YIGHGJWWXQZIJD-YMTOWFKASA-N 1 0 308.809 4.452 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)c1cc(Cl)ccc1O ZINC000775509630 1049052149 /nfs/dbraw/zinc/05/21/49/1049052149.db2.gz SYCVNZQQPURUOT-SDNTUTLCSA-N 1 0 323.864 4.290 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1SCCc2ccccc21)c1ccccc1O ZINC000775512981 1049057743 /nfs/dbraw/zinc/05/77/43/1049057743.db2.gz VHBNPQXKZFYPQK-HKUYNNGSSA-N 1 0 313.466 4.464 20 10 DICDRO CC[C@@H]([NH2+]CC1(CCO)CCCC1)c1cc(Cl)ccc1O ZINC000775514397 1049063540 /nfs/dbraw/zinc/06/35/40/1049063540.db2.gz ZYJDTHFGRXPKMZ-OAHLLOKOSA-N 1 0 311.853 4.029 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775514413 1049064929 /nfs/dbraw/zinc/06/49/29/1049064929.db2.gz ZXDJEJYMWNWMPT-CQSZACIVSA-N 1 0 322.836 4.399 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@H](C(C)C)C1)c1cc(Cl)ccc1O ZINC000775518554 1049075650 /nfs/dbraw/zinc/07/56/50/1049075650.db2.gz CVEDSCZKSVZYOR-QRTARXTBSA-N 1 0 311.853 4.290 20 10 DICDRO CC[C@H]([NH2+]C1CCC(O)(CC)CC1)c1cc(Cl)ccc1O ZINC000775520549 1049082295 /nfs/dbraw/zinc/08/22/95/1049082295.db2.gz SNESZCSCRATERZ-GULBITTBSA-N 1 0 311.853 4.170 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775523521 1049086613 /nfs/dbraw/zinc/08/66/13/1049086613.db2.gz JQCSCTQNOCKFTG-BONVTDFDSA-N 1 0 322.836 4.495 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)c1cccc(OC)c1)c1ccccc1O ZINC000775525089 1049088883 /nfs/dbraw/zinc/08/88/83/1049088883.db2.gz XSGQFWCNGMENRT-SFHVURJKSA-N 1 0 313.441 4.419 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](c2ncccc2C)C(C)C)cc1 ZINC000773772001 1049093565 /nfs/dbraw/zinc/09/35/65/1049093565.db2.gz HXOPWCGNJXRLFA-LJQANCHMSA-N 1 0 311.473 4.333 20 10 DICDRO C[C@H]([NH2+]CCOC(C)(C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000776891683 1049096020 /nfs/dbraw/zinc/09/60/20/1049096020.db2.gz XGETZGWMOQIBPR-HNNXBMFYSA-N 1 0 322.468 4.282 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(C(F)F)c(F)c2)cc1 ZINC001204146050 1049096698 /nfs/dbraw/zinc/09/66/98/1049096698.db2.gz RNPTZCHVBJFHJX-UHFFFAOYSA-N 1 0 322.374 4.461 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc[nH]1)c1cc(Br)ccc1O ZINC000775527412 1049098747 /nfs/dbraw/zinc/09/87/47/1049098747.db2.gz XJWPZDMCFLOCRO-MFKMUULPSA-N 1 0 323.234 4.285 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@H](OC)c1ccccc1F)c1ccccc1O ZINC000775531642 1049112493 /nfs/dbraw/zinc/11/24/93/1049112493.db2.gz KCYVOHXFNVJFMM-IXDGSTSKSA-N 1 0 317.404 4.348 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H](OC)c1ccccc1F)c1ccccc1O ZINC000775531641 1049112847 /nfs/dbraw/zinc/11/28/47/1049112847.db2.gz KCYVOHXFNVJFMM-FMEYXAORSA-N 1 0 317.404 4.348 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@H](OC)c1ccccc1F)c1ccccc1O ZINC000775531643 1049112859 /nfs/dbraw/zinc/11/28/59/1049112859.db2.gz KCYVOHXFNVJFMM-SOVGHPHASA-N 1 0 317.404 4.348 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc(F)c(F)c1 ZINC001204223128 1049113506 /nfs/dbraw/zinc/11/35/06/1049113506.db2.gz RJDIBCAZPGUSKS-UHFFFAOYSA-N 1 0 316.395 4.197 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@]3(C2)CCCCO3)c2ccccc21 ZINC001204235156 1049115388 /nfs/dbraw/zinc/11/53/88/1049115388.db2.gz IFEMREGKTBFLPW-NRFANRHFSA-N 1 0 324.468 4.051 20 10 DICDRO CC[C@H]([NH2+]C1(C2CC2)CC1)c1cc(Br)ccc1O ZINC000775534768 1049117940 /nfs/dbraw/zinc/11/79/40/1049117940.db2.gz IECKEQLLFSSSHS-ZDUSSCGKSA-N 1 0 310.235 4.138 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](CF)C2)c2ccccc21 ZINC001204241372 1049118728 /nfs/dbraw/zinc/11/87/28/1049118728.db2.gz FXPDGWACWOGLHT-HNNXBMFYSA-N 1 0 300.421 4.087 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@]1(F)c1ccccc1 ZINC001178998380 1049120423 /nfs/dbraw/zinc/12/04/23/1049120423.db2.gz LPXCBEJDFKLPJR-UXHICEINSA-N 1 0 308.400 4.214 20 10 DICDRO COc1ccc(N2CC[C@@H](C[NH2+]C3CCC(C)(C)CC3)C2)cc1 ZINC001179003267 1049120899 /nfs/dbraw/zinc/12/08/99/1049120899.db2.gz WFOLYANGAQVPIQ-INIZCTEOSA-N 1 0 316.489 4.080 20 10 DICDRO C[C@@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1cc(Cl)ccc1O ZINC000857082560 1049127277 /nfs/dbraw/zinc/12/72/77/1049127277.db2.gz OMRWDRQHJIVUST-BDAKNGLRSA-N 1 0 308.636 4.280 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)cc1 ZINC001204285203 1049127970 /nfs/dbraw/zinc/12/79/70/1049127970.db2.gz PVVWRAGCTKDPCQ-UHFFFAOYSA-N 1 0 306.812 4.177 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@@]1(C)C[C@@]1(F)Cl ZINC001179095002 1049130494 /nfs/dbraw/zinc/13/04/94/1049130494.db2.gz GEUWUOCIZNDPJW-IRXDYDNUSA-N 1 0 308.828 4.281 20 10 DICDRO CC[C@H]([NH2+][C@H](CCOC)c1ccco1)c1cc(Cl)ccc1O ZINC000775546771 1049136599 /nfs/dbraw/zinc/13/65/99/1049136599.db2.gz KZOUZXZWDBSWCI-LSDHHAIUSA-N 1 0 323.820 4.457 20 10 DICDRO Cc1ccc(C[C@@H](C)[N@H+](C)Cc2ccc(Cl)cc2O)cc1 ZINC001204308410 1049139071 /nfs/dbraw/zinc/13/90/71/1049139071.db2.gz SYNDQOYLFIMXKO-CQSZACIVSA-N 1 0 303.833 4.417 20 10 DICDRO c1ccc([C@@H]2CCC[N@@H+](Cc3ccc(N4CCCC4)cc3)C2)nc1 ZINC001204327479 1049141712 /nfs/dbraw/zinc/14/17/12/1049141712.db2.gz VHONXSWDPCRSSR-LJQANCHMSA-N 1 0 321.468 4.061 20 10 DICDRO Fc1ccccc1[C@@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204327514 1049142319 /nfs/dbraw/zinc/14/23/19/1049142319.db2.gz WUHFLTIYQVBSBL-GOSISDBHSA-N 1 0 324.443 4.415 20 10 DICDRO FC(F)(F)[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204327494 1049142332 /nfs/dbraw/zinc/14/23/32/1049142332.db2.gz VYKHZBLXUPYRMI-HNNXBMFYSA-N 1 0 312.379 4.061 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc(N3CCCC3)cc2)cc1 ZINC001204320947 1049142351 /nfs/dbraw/zinc/14/23/51/1049142351.db2.gz DXJVUAFLRJONKL-QGZVFWFLSA-N 1 0 324.468 4.488 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(N3CCCC3)cc2)cc1 ZINC001204320946 1049142433 /nfs/dbraw/zinc/14/24/33/1049142433.db2.gz DXJVUAFLRJONKL-KRWDZBQOSA-N 1 0 324.468 4.488 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)CC)cc1)c1ccccc1OC ZINC000773812488 1049150890 /nfs/dbraw/zinc/15/08/90/1049150890.db2.gz QZEUXWHVCRIYEH-IBGZPJMESA-N 1 0 312.457 4.392 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2[C@@H](C)[C@H](C)O[C@H]2C)cc1 ZINC001179348148 1049154337 /nfs/dbraw/zinc/15/43/37/1049154337.db2.gz POVHKSBEOPFTPO-BOSXTWCSSA-N 1 0 318.505 4.215 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC[C@H]2CCCC2(F)F)cc1 ZINC001179443910 1049166356 /nfs/dbraw/zinc/16/63/56/1049166356.db2.gz WRGVUTCUOMNKKK-DWTRPJMMSA-N 1 0 308.416 4.181 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2([C@H]3CCCCO3)CCC2)cc1 ZINC001179425439 1049167744 /nfs/dbraw/zinc/16/77/44/1049167744.db2.gz FYVYLNAEQNUPQB-LJQANCHMSA-N 1 0 316.489 4.114 20 10 DICDRO C[C@H]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001179598079 1049182205 /nfs/dbraw/zinc/18/22/05/1049182205.db2.gz KLBURLWGTQYISQ-AAEUAGOBSA-N 1 0 300.368 4.050 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)cc1 ZINC000776953537 1049189003 /nfs/dbraw/zinc/18/90/03/1049189003.db2.gz NYNAUCXFQLUDQS-QUCCMNQESA-N 1 0 318.505 4.216 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)c(O)c1C ZINC000775585818 1049192556 /nfs/dbraw/zinc/19/25/56/1049192556.db2.gz KGSHERRAFCFXGZ-CGTJXYLNSA-N 1 0 305.462 4.253 20 10 DICDRO CSCCCCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000775582447 1049192756 /nfs/dbraw/zinc/19/27/56/1049192756.db2.gz TVGFKVXHAKLCTH-CQSZACIVSA-N 1 0 307.503 4.455 20 10 DICDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2ccc(C)cc2O)C12CCCCC2 ZINC001204616372 1049200853 /nfs/dbraw/zinc/20/08/53/1049200853.db2.gz VJTKKKCXZZPTJB-OALUTQOASA-N 1 0 317.473 4.260 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC[C@H]2CCC(F)(F)C2)cc1 ZINC001179758599 1049204830 /nfs/dbraw/zinc/20/48/30/1049204830.db2.gz KJJLGFHWTRAZSD-MJSXRHKHSA-N 1 0 308.416 4.181 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC[C@H]2CCC(F)(F)C2)cc1 ZINC001179758600 1049206203 /nfs/dbraw/zinc/20/62/03/1049206203.db2.gz KJJLGFHWTRAZSD-QDLOVBKTSA-N 1 0 308.416 4.181 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCC3(C2)CCCCCC3)c1 ZINC001179854357 1049216409 /nfs/dbraw/zinc/21/64/09/1049216409.db2.gz FOFQEISMEGPQEY-UHFFFAOYSA-N 1 0 303.446 4.337 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@@H](c2cccs2)C2CC2)cc1F ZINC000858089980 1049216592 /nfs/dbraw/zinc/21/65/92/1049216592.db2.gz GXUXUNUENPNXAQ-QGZVFWFLSA-N 1 0 322.424 4.333 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3cc[nH]c3c2)cc1 ZINC000858100986 1049217788 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CN(C)c1ccc(C[N@@H+]2CC(C)(C)C2(C)C)c(C(F)(F)F)c1 ZINC001204775997 1049262175 /nfs/dbraw/zinc/26/21/75/1049262175.db2.gz LAEQBSXLABLHND-UHFFFAOYSA-N 1 0 314.395 4.392 20 10 DICDRO CCCC[N@H+](CCCC(=O)OC(C)(C)C)Cc1ccccc1O ZINC001193838881 1049263147 /nfs/dbraw/zinc/26/31/47/1049263147.db2.gz NUPOYJJVDOLMOF-UHFFFAOYSA-N 1 0 321.461 4.116 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccc(N(C)C)cc1 ZINC000858484274 1049263688 /nfs/dbraw/zinc/26/36/88/1049263688.db2.gz NBMLVOLIVVPABQ-YWZLYKJASA-N 1 0 309.457 4.340 20 10 DICDRO CC(C)CCO[C@H]1CC[C@H]([NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000858508450 1049268910 /nfs/dbraw/zinc/26/89/10/1049268910.db2.gz NSRRMGITQGSBLQ-BZSNNMDCSA-N 1 0 317.473 4.343 20 10 DICDRO Cc1cc(CN[C@@H](C)c2cscn2)c(C)n1-c1ccccc1 ZINC000858543075 1049272491 /nfs/dbraw/zinc/27/24/91/1049272491.db2.gz PUVVREKBCASDCS-AWEZNQCLSA-N 1 0 311.454 4.401 20 10 DICDRO Cc1cc(CN[C@@H]2C[C@@H](C)n3ccnc32)c(C)n1-c1ccccc1 ZINC000858542562 1049273010 /nfs/dbraw/zinc/27/30/10/1049273010.db2.gz MGAJGFSDUGJGOX-AUUYWEPGSA-N 1 0 320.440 4.086 20 10 DICDRO CC(C)CC[C@H]1CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180136835 1049281459 /nfs/dbraw/zinc/28/14/59/1049281459.db2.gz NUWURHCUCCRQSD-OAHLLOKOSA-N 1 0 310.432 4.431 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1CC(F)(F)F)c1ccccc1O ZINC000858591469 1049281993 /nfs/dbraw/zinc/28/19/93/1049281993.db2.gz SUIWVIWTCQMCQC-GFCCVEGCSA-N 1 0 309.331 4.348 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1CC(F)(F)F)c1ccccc1O ZINC000858591471 1049282399 /nfs/dbraw/zinc/28/23/99/1049282399.db2.gz SUIWVIWTCQMCQC-LBPRGKRZSA-N 1 0 309.331 4.348 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1O ZINC000858583112 1049283289 /nfs/dbraw/zinc/28/32/89/1049283289.db2.gz WWRYJHLCJMUPQU-MEDUHNTESA-N 1 0 317.816 4.392 20 10 DICDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2cc(F)ccc2O)C12CCCCC2 ZINC001180099083 1049284759 /nfs/dbraw/zinc/28/47/59/1049284759.db2.gz SNEVWOXJNUFLGM-ZWKOTPCHSA-N 1 0 321.436 4.091 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)CCN(C)c2ccccc2)c1 ZINC001204867138 1049290359 /nfs/dbraw/zinc/29/03/59/1049290359.db2.gz SUWFGGQQCZRXQJ-UHFFFAOYSA-N 1 0 312.457 4.084 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC001204898920 1049303615 /nfs/dbraw/zinc/30/36/15/1049303615.db2.gz NFCZKJQLSUWOQE-LAUBAEHRSA-N 1 0 324.468 4.023 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC001180275223 1049315293 /nfs/dbraw/zinc/31/52/93/1049315293.db2.gz JYDSPOLWCIKWNM-YSSFQJQWSA-N 1 0 300.490 4.462 20 10 DICDRO COc1cc(C[N@@H+]2CCSC(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC001180198593 1049315719 /nfs/dbraw/zinc/31/57/19/1049315719.db2.gz FESHEUJNLOVPHJ-UHFFFAOYSA-N 1 0 323.502 4.026 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc3ccccc3c2O)cc1C ZINC001180284753 1049335383 /nfs/dbraw/zinc/33/53/83/1049335383.db2.gz LWWXMVRMNFZZDE-UHFFFAOYSA-N 1 0 321.420 4.494 20 10 DICDRO Cc1cc(F)ncc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC001180288369 1049337622 /nfs/dbraw/zinc/33/76/22/1049337622.db2.gz FIKWTABGZOVWLS-UHFFFAOYSA-N 1 0 314.404 4.180 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](c2ccccn2)C2CCC2)cc1 ZINC000859568135 1049338847 /nfs/dbraw/zinc/33/88/47/1049338847.db2.gz OHNYCYKNEVDMHC-FQEVSTJZSA-N 1 0 309.457 4.169 20 10 DICDRO C[N@H+](Cc1cc(F)c(F)c(F)c1)Cc1ccc(Cl)cc1O ZINC001180327272 1049345064 /nfs/dbraw/zinc/34/50/64/1049345064.db2.gz WIIRDMFERMBICE-UHFFFAOYSA-N 1 0 315.722 4.095 20 10 DICDRO CCc1onc(C)c1C[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC001205023947 1049345578 /nfs/dbraw/zinc/34/55/78/1049345578.db2.gz JTUOBHWFCBESIK-UHFFFAOYSA-N 1 0 315.461 4.024 20 10 DICDRO Cc1ccc(C[N@H+]2CC=C(c3c[nH]c4ccccc34)CC2)c(O)c1 ZINC001180332822 1049347250 /nfs/dbraw/zinc/34/72/50/1049347250.db2.gz USBOKKLFRHZBGL-UHFFFAOYSA-N 1 0 318.420 4.471 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCCCC[C@H]2C(C)C)c1O ZINC001180332225 1049347355 /nfs/dbraw/zinc/34/73/55/1049347355.db2.gz OXHZKLQHALLJAV-HNNXBMFYSA-N 1 0 311.853 4.455 20 10 DICDRO COc1cc(C[N@H+](C)C2CCCCC2)c(O)c(C(C)(C)C)c1 ZINC001180372063 1049355836 /nfs/dbraw/zinc/35/58/36/1049355836.db2.gz IIGOJXJDGOKBHP-UHFFFAOYSA-N 1 0 305.462 4.463 20 10 DICDRO Oc1cc(Cl)ccc1C[N@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC001180462577 1049366886 /nfs/dbraw/zinc/36/68/86/1049366886.db2.gz PFWCVIHIFAWVFS-UHFFFAOYSA-N 1 0 317.791 4.474 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)cc1F ZINC001205081792 1049367632 /nfs/dbraw/zinc/36/76/32/1049367632.db2.gz KVZXPLLEJZNKAV-ZIAGYGMSSA-N 1 0 308.416 4.043 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](Cc1ccccc1F)C1CC1 ZINC001180574574 1049377956 /nfs/dbraw/zinc/37/79/56/1049377956.db2.gz YZMOLSZKHUEEJT-UHFFFAOYSA-N 1 0 312.432 4.365 20 10 DICDRO Cc1ccc2c(c1)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)(C)C2 ZINC001194607984 1049397427 /nfs/dbraw/zinc/39/74/27/1049397427.db2.gz NDSHRGZJCOTKTJ-UHFFFAOYSA-N 1 0 308.469 4.398 20 10 DICDRO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2cc(C(C)C)ccc2O)C1(C)C ZINC001205268919 1049422061 /nfs/dbraw/zinc/42/20/61/1049422061.db2.gz BUOALRQAPZUKLR-QZTJIDSGSA-N 1 0 305.462 4.197 20 10 DICDRO CC[C@@H](C[N@H+](CC)Cc1cc(OC)ccc1O)c1ccccc1 ZINC001181042057 1049429351 /nfs/dbraw/zinc/42/93/51/1049429351.db2.gz BSZYKLUCFIFRLD-INIZCTEOSA-N 1 0 313.441 4.417 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C2(c3cccc(OC)c3)CC2)cc1 ZINC000777157004 1049429847 /nfs/dbraw/zinc/42/98/47/1049429847.db2.gz KSRGNNBAPBVEHR-MRXNPFEDSA-N 1 0 324.468 4.491 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1ccc(OC)cc1F ZINC001181185662 1049449454 /nfs/dbraw/zinc/44/94/54/1049449454.db2.gz UVQOPGXKVANWRG-UHFFFAOYSA-N 1 0 317.404 4.342 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CCC[C@@H](C(C)(C)C)CC2)c1 ZINC001205427746 1049466982 /nfs/dbraw/zinc/46/69/82/1049466982.db2.gz WEXUNMMHEDZKKO-CVEARBPZSA-N 1 0 305.462 4.485 20 10 DICDRO CCc1cccc(C[NH2+]C(C)(C)Cc2ccc(OC)cc2)c1O ZINC001205437436 1049471121 /nfs/dbraw/zinc/47/11/21/1049471121.db2.gz HLACYPAJDRCFCA-UHFFFAOYSA-N 1 0 313.441 4.074 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1cc2ccccc2[nH]1 ZINC000775634301 1049471194 /nfs/dbraw/zinc/47/11/94/1049471194.db2.gz NEFHTEHTOVRQED-OAHLLOKOSA-N 1 0 307.441 4.393 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)Cc1cccc(F)c1 ZINC001181444673 1049477712 /nfs/dbraw/zinc/47/77/12/1049477712.db2.gz FCJQJJVQSVTCFQ-HNNXBMFYSA-N 1 0 300.421 4.132 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)Cc1ccccc1F ZINC001181445751 1049477759 /nfs/dbraw/zinc/47/77/59/1049477759.db2.gz RJXHFYMAJCGWPG-OAHLLOKOSA-N 1 0 300.421 4.132 20 10 DICDRO Cc1ncc(C[N@H+](Cc2ccccc2O)C2CCCCC2)o1 ZINC000862211079 1049478233 /nfs/dbraw/zinc/47/82/33/1049478233.db2.gz DAUZJIDBGGOXMS-UHFFFAOYSA-N 1 0 300.402 4.024 20 10 DICDRO CCCCO[C@H]1C[C@H](N(CCC)c2ccc(C[NH3+])cc2)C1(C)C ZINC001181457070 1049478544 /nfs/dbraw/zinc/47/85/44/1049478544.db2.gz NRZJUKWOOIOQTR-OALUTQOASA-N 1 0 318.505 4.346 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cccc2n[nH]cc21)C1CCCC1 ZINC000862242322 1049480811 /nfs/dbraw/zinc/48/08/11/1049480811.db2.gz CIXZHGMANZWBFD-UHFFFAOYSA-N 1 0 321.424 4.213 20 10 DICDRO Cc1ncc(C[NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)o1 ZINC000862274695 1049485191 /nfs/dbraw/zinc/48/51/91/1049485191.db2.gz TVGNPDDQFDZPCY-UHFFFAOYSA-N 1 0 313.445 4.042 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001205535094 1049492972 /nfs/dbraw/zinc/49/29/72/1049492972.db2.gz DDQZBCLWZKLXAP-GFCCVEGCSA-N 1 0 323.770 4.313 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000862477568 1049495239 /nfs/dbraw/zinc/49/52/39/1049495239.db2.gz LTDIWGUVYYRRHA-HXUWFJFHSA-N 1 0 309.457 4.087 20 10 DICDRO COc1ccc(O)c(C[N@H+](Cc2ccccc2)[C@H](C)C2CC2)c1 ZINC000775643799 1049496480 /nfs/dbraw/zinc/49/64/80/1049496480.db2.gz VNZNEIXAVZNTSW-OAHLLOKOSA-N 1 0 311.425 4.202 20 10 DICDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000862498317 1049498494 /nfs/dbraw/zinc/49/84/94/1049498494.db2.gz DHPCEBJEZPTJNG-UHFFFAOYSA-N 1 0 321.795 4.215 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](c3ccc(C)cc3)C[C@H]2C)c1 ZINC001205568460 1049499245 /nfs/dbraw/zinc/49/92/45/1049499245.db2.gz IOAMXENELUFWMH-NVXWUHKLSA-N 1 0 311.425 4.087 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)Cc2csc3ccccc23)c1 ZINC000775649469 1049509413 /nfs/dbraw/zinc/50/94/13/1049509413.db2.gz RWKPRFWGCBSQJB-UHFFFAOYSA-N 1 0 313.422 4.248 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCCc3ccccc3CC2)cc1Cl ZINC001181819259 1049525780 /nfs/dbraw/zinc/52/57/80/1049525780.db2.gz UHORTKGAXXWGBC-UHFFFAOYSA-N 1 0 315.844 4.345 20 10 DICDRO [O-]c1c(Cl)cccc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000775663110 1049541264 /nfs/dbraw/zinc/54/12/64/1049541264.db2.gz YUYLDPRNIJTOKY-INIZCTEOSA-N 1 0 303.789 4.088 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)C[C@]1(C)CCCS1 ZINC001205708532 1049541544 /nfs/dbraw/zinc/54/15/44/1049541544.db2.gz CJXRQIDMYRLNIS-SFHVURJKSA-N 1 0 304.503 4.004 20 10 DICDRO CCOc1cccc(C[NH2+]C(C)(C)c2cccc(Cl)c2)c1O ZINC000119378803 1049552679 /nfs/dbraw/zinc/55/26/79/1049552679.db2.gz WSBRLCJERZVTIU-UHFFFAOYSA-N 1 0 319.832 4.469 20 10 DICDRO COc1cccc(C2CC[NH+](Cc3cccc(C)c3O)CC2)c1 ZINC000775668905 1049557987 /nfs/dbraw/zinc/55/79/87/1049557987.db2.gz MMMHDVNRIQBZHW-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO c1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163591286 1049570940 /nfs/dbraw/zinc/57/09/40/1049570940.db2.gz AEFBPIRIQSEMBU-FQEVSTJZSA-N 1 0 324.493 4.017 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2cccnc2C)c(C)n1-c1ccccc1 ZINC001137859178 1049577581 /nfs/dbraw/zinc/57/75/81/1049577581.db2.gz MMFHQOMHDIVYKO-UHFFFAOYSA-N 1 0 319.452 4.430 20 10 DICDRO CC[N@H+](Cc1cccs1)Cc1ccc(N2CCCC2)cc1 ZINC001204328854 1049597352 /nfs/dbraw/zinc/59/73/52/1049597352.db2.gz QIAGRCAHTDQKJA-UHFFFAOYSA-N 1 0 300.471 4.370 20 10 DICDRO CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000774113235 1049603073 /nfs/dbraw/zinc/60/30/73/1049603073.db2.gz CNWWGLZLOKZBMM-NSHDSACASA-N 1 0 319.276 4.080 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CSc2ccccc21 ZINC001205952962 1049609580 /nfs/dbraw/zinc/60/95/80/1049609580.db2.gz YFLUKIQBKHEHAJ-MRXNPFEDSA-N 1 0 312.482 4.040 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)Cc3cccs3)cc2)[C@@H]1C ZINC001206016230 1049629104 /nfs/dbraw/zinc/62/91/04/1049629104.db2.gz OYTOXYVSZDATLH-HUUCEWRRSA-N 1 0 300.471 4.225 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000775698261 1049629747 /nfs/dbraw/zinc/62/97/47/1049629747.db2.gz NIZCUANUAOSQJI-MRXNPFEDSA-N 1 0 301.386 4.111 20 10 DICDRO COc1cc(O)c(C[N@H+](C)[C@H]2CCC[C@@H]2C(C)(C)C)cc1OC ZINC001182444037 1049651712 /nfs/dbraw/zinc/65/17/12/1049651712.db2.gz MZBFVCCYKDEFOV-GJZGRUSLSA-N 1 0 321.461 4.056 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+]2CC=C(C(F)(F)F)CC2)c1O ZINC000775716820 1049653290 /nfs/dbraw/zinc/65/32/90/1049653290.db2.gz HFXQLRKAMOSJMF-UHFFFAOYSA-N 1 0 305.727 4.048 20 10 DICDRO CC(C)[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccnc1 ZINC000774383159 1049655486 /nfs/dbraw/zinc/65/54/86/1049655486.db2.gz GGPGKELUVJSQAB-HXUWFJFHSA-N 1 0 309.457 4.169 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@@H](C(C)(C)C)C[C@H]2C)c(O)c1OC ZINC001206116401 1049657760 /nfs/dbraw/zinc/65/77/60/1049657760.db2.gz OEHLKAGZVHPEAK-UKRRQHHQSA-N 1 0 321.461 4.056 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](c1ccc(F)cc1)C1CC1 ZINC000774415947 1049659492 /nfs/dbraw/zinc/65/94/92/1049659492.db2.gz QJAFAJHDPWIFSX-HXUWFJFHSA-N 1 0 312.432 4.441 20 10 DICDRO C[NH+](C)Cc1ccc(NCc2ccc3ccccc3c2O)c(F)c1 ZINC001206271187 1049694252 /nfs/dbraw/zinc/69/42/52/1049694252.db2.gz VHFMCSZUJXDFPM-UHFFFAOYSA-N 1 0 324.399 4.358 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H](O)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000794800669 1049697168 /nfs/dbraw/zinc/69/71/68/1049697168.db2.gz FQDZXOVEQBARIH-XVGQJIODSA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000794800665 1049697288 /nfs/dbraw/zinc/69/72/88/1049697288.db2.gz FQDZXOVEQBARIH-IXDGSTSKSA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1)c1ccc(C)cc1O ZINC000794791890 1049698908 /nfs/dbraw/zinc/69/89/08/1049698908.db2.gz JXXHYLMQJANMJO-SJLPKXTDSA-N 1 0 319.832 4.128 20 10 DICDRO COc1cc(C[NH+](CC2CC2)CC2CC2)c(O)c(C(C)(C)C)c1 ZINC001206714383 1049781826 /nfs/dbraw/zinc/78/18/26/1049781826.db2.gz FMFGLVSIQXQVFR-UHFFFAOYSA-N 1 0 317.473 4.320 20 10 DICDRO Cc1cc(C[NH2+]CCC[C@H]2CCO2)c(C)n1-c1cccc(C)c1 ZINC001207094421 1049834993 /nfs/dbraw/zinc/83/49/93/1049834993.db2.gz REEMPPRTFJLAGI-FQEVSTJZSA-N 1 0 312.457 4.061 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(C(C)(C)C)o1 ZINC001207150490 1049846654 /nfs/dbraw/zinc/84/66/54/1049846654.db2.gz HEWRYDUMGASVTB-UHFFFAOYSA-N 1 0 300.446 4.241 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]CC1(c2cccc(Cl)c2)CCC1 ZINC001207173576 1049851159 /nfs/dbraw/zinc/85/11/59/1049851159.db2.gz ADBTZRCCAITZIV-UHFFFAOYSA-N 1 0 319.807 4.396 20 10 DICDRO C[N@@H+](Cc1ccccc1O)C[C@@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001207194613 1049859102 /nfs/dbraw/zinc/85/91/02/1049859102.db2.gz YCOSPJPMFVJXDE-DOTOQJQBSA-N 1 0 301.817 4.281 20 10 DICDRO C[N@@H+](Cc1ccccc1O)C[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001207194616 1049860912 /nfs/dbraw/zinc/86/09/12/1049860912.db2.gz YCOSPJPMFVJXDE-RDJZCZTQSA-N 1 0 301.817 4.281 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C(C)(C)[C@@H](O)c2ccccc2)c1 ZINC001207283368 1049874578 /nfs/dbraw/zinc/87/45/78/1049874578.db2.gz OOMPFCGIASGIRA-IBGZPJMESA-N 1 0 313.441 4.117 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@@]2(C)CCOc3ccccc32)c1 ZINC001207654266 1049920588 /nfs/dbraw/zinc/92/05/88/1049920588.db2.gz KDZYXIOWWIRWGR-FQEVSTJZSA-N 1 0 311.425 4.303 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@H]2CC(C)(C)OC2(C)C)c1 ZINC001207658399 1049922067 /nfs/dbraw/zinc/92/20/67/1049922067.db2.gz LCQFYVNAQSAXTG-MRXNPFEDSA-N 1 0 305.462 4.199 20 10 DICDRO Oc1c(C[NH2+]C[C@H]2CCCC3(CCC3)O2)ccc2ccccc21 ZINC001207699955 1049928392 /nfs/dbraw/zinc/92/83/92/1049928392.db2.gz JRTJJZGYOXJEPU-QGZVFWFLSA-N 1 0 311.425 4.127 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CCCOc2cccc(F)c2)c1 ZINC001207744014 1049933383 /nfs/dbraw/zinc/93/33/83/1049933383.db2.gz AHEOGHAUEWDGFP-UHFFFAOYSA-N 1 0 317.404 4.213 20 10 DICDRO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1cc(C)cc(C)c1O)CCC2 ZINC000164321131 1049935317 /nfs/dbraw/zinc/93/53/17/1049935317.db2.gz NRLRJWLHNNWJHM-MRXNPFEDSA-N 1 0 316.470 4.283 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c1 ZINC000164497092 1049947365 /nfs/dbraw/zinc/94/73/65/1049947365.db2.gz VIGDKOIIMRCCRR-YOEHRIQHSA-N 1 0 317.454 4.033 20 10 DICDRO CCc1ccc(C[NH2+]Cc2ccc(N(CC)CC)c(F)c2)o1 ZINC000760679498 1049961603 /nfs/dbraw/zinc/96/16/03/1049961603.db2.gz SSHGBWYKPDMADE-UHFFFAOYSA-N 1 0 304.409 4.117 20 10 DICDRO COC(C)(C)CCC[C@H](C)CC[N@H+](C)Cc1ccccc1O ZINC001208220942 1049987406 /nfs/dbraw/zinc/98/74/06/1049987406.db2.gz WALIDZJWRRTIQQ-INIZCTEOSA-N 1 0 307.478 4.446 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCC[C@@H]2OCC[C@H]21 ZINC000760712193 1050003690 /nfs/dbraw/zinc/00/36/90/1050003690.db2.gz CSOMZRWJYWDDPG-ZVDOUQERSA-N 1 0 323.436 4.106 20 10 DICDRO CC[N@@H+](Cc1ccccc1O)CC1CCN(c2ccccc2)CC1 ZINC001208912942 1050022630 /nfs/dbraw/zinc/02/26/30/1050022630.db2.gz XYAJQQGPXGHUOG-UHFFFAOYSA-N 1 0 324.468 4.131 20 10 DICDRO COC1(C)CC[NH+](Cc2ccc(-n3c(C)ccc3C)cc2)CC1 ZINC001209519519 1050065847 /nfs/dbraw/zinc/06/58/47/1050065847.db2.gz WSONLFCWCMYBJA-UHFFFAOYSA-N 1 0 312.457 4.095 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@@]3(CCOC3)C2)cc1 ZINC001209516970 1050066052 /nfs/dbraw/zinc/06/60/52/1050066052.db2.gz VAEZIEFBMKKNSK-OAQYLSRUSA-N 1 0 324.468 4.097 20 10 DICDRO CSC1CC[NH+](Cc2ccc(-n3c(C)ccc3C)cc2)CC1 ZINC001209518129 1050066190 /nfs/dbraw/zinc/06/61/90/1050066190.db2.gz NRONZKYJIMDOEY-UHFFFAOYSA-N 1 0 314.498 4.422 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)cc1 ZINC001209519028 1050066299 /nfs/dbraw/zinc/06/62/99/1050066299.db2.gz QHATWGMVMUHRRQ-TZIWHRDSSA-N 1 0 324.468 4.095 20 10 DICDRO CC[N@H+](Cc1cccc(Br)c1)Cc1ccccc1O ZINC000770508671 1050161903 /nfs/dbraw/zinc/16/19/03/1050161903.db2.gz DEFVKVMMDNRKLR-UHFFFAOYSA-N 1 0 320.230 4.177 20 10 DICDRO C[C@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000716170888 1050170489 /nfs/dbraw/zinc/17/04/89/1050170489.db2.gz NXVHWXPPCNAXLE-YQHFOJDRSA-N 1 0 324.468 4.151 20 10 DICDRO Cc1ccc(SC[C@H](C)[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000770665463 1050181376 /nfs/dbraw/zinc/18/13/76/1050181376.db2.gz DUPGXZNXJNHBEA-ZDUSSCGKSA-N 1 0 305.418 4.110 20 10 DICDRO CC(C)[C@@H](CCO)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766194202 1050186064 /nfs/dbraw/zinc/18/60/64/1050186064.db2.gz UANWQMBBRSWQLP-FXAWDEMLSA-N 1 0 318.505 4.125 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)[C@H](OC)c2ccc(F)cc2)cc1C ZINC000770749684 1050191800 /nfs/dbraw/zinc/19/18/00/1050191800.db2.gz XGNPKNOPWOOKLG-KUHUBIRLSA-N 1 0 317.404 4.009 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)c1O ZINC000378913012 1050194199 /nfs/dbraw/zinc/19/41/99/1050194199.db2.gz UNTXZUCPTNSHTG-GOSISDBHSA-N 1 0 317.404 4.417 20 10 DICDRO CO[C@H](c1ccccc1Cl)[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000760870914 1050196250 /nfs/dbraw/zinc/19/62/50/1050196250.db2.gz UCSDNFCSZSAKIA-VFVRVIDISA-N 1 0 319.832 4.472 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc(Cl)nc2)cc1Cl ZINC000824548471 1050224511 /nfs/dbraw/zinc/22/45/11/1050224511.db2.gz NMDQKZUGUWPSMX-UHFFFAOYSA-N 1 0 311.212 4.034 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2cc(C3CC3)ccc2F)c(O)c1 ZINC000824548282 1050225952 /nfs/dbraw/zinc/22/59/52/1050225952.db2.gz DPMBXBZFRAHIKG-UHFFFAOYSA-N 1 0 315.388 4.097 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F ZINC000824654300 1050229858 /nfs/dbraw/zinc/22/98/58/1050229858.db2.gz MJPFXDYUSCYDIX-GWCFXTLKSA-N 1 0 305.315 4.132 20 10 DICDRO CCC[N@H+](Cc1cc(COC)cs1)Cc1ccccc1O ZINC000824649254 1050231188 /nfs/dbraw/zinc/23/11/88/1050231188.db2.gz CCIONRJASFBKOB-UHFFFAOYSA-N 1 0 305.443 4.012 20 10 DICDRO Oc1ccccc1C[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171063944 1050238166 /nfs/dbraw/zinc/23/81/66/1050238166.db2.gz PJTFMWKUMJHEOQ-CQSZACIVSA-N 1 0 322.235 4.346 20 10 DICDRO CC[C@H](CC(F)(F)F)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000760903249 1050238405 /nfs/dbraw/zinc/23/84/05/1050238405.db2.gz PPMMTROSVLEPRI-NGZCFLSTSA-N 1 0 305.315 4.400 20 10 DICDRO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000824798520 1050244030 /nfs/dbraw/zinc/24/40/30/1050244030.db2.gz DCPCMQFCVQGFTK-HNAYVOBHSA-N 1 0 313.441 4.086 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)cc1C ZINC000825045622 1050268357 /nfs/dbraw/zinc/26/83/57/1050268357.db2.gz IDGASGSXBOXKJC-CQSZACIVSA-N 1 0 321.342 4.203 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCCN(C)c3ccccc32)cc1C ZINC000825110451 1050277209 /nfs/dbraw/zinc/27/72/09/1050277209.db2.gz FZLRPSYWQTUDIF-GOSISDBHSA-N 1 0 310.441 4.065 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000825133948 1050278356 /nfs/dbraw/zinc/27/83/56/1050278356.db2.gz RABKHGMJXZMJRG-OAQYLSRUSA-N 1 0 323.436 4.062 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000825125109 1050279858 /nfs/dbraw/zinc/27/98/58/1050279858.db2.gz GYZZLHFDUGDSNT-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@]3(CCSC3)C2)ccc2ccccc21 ZINC000825215262 1050285920 /nfs/dbraw/zinc/28/59/20/1050285920.db2.gz JPNWZNNNSASWHD-LJQANCHMSA-N 1 0 313.466 4.265 20 10 DICDRO Cc1nc(C(C)(C)[NH2+]Cc2cc(Cl)c(C)cc2O)sc1C ZINC000825288232 1050291492 /nfs/dbraw/zinc/29/14/92/1050291492.db2.gz PKIBBQBLGLPFFR-UHFFFAOYSA-N 1 0 324.877 4.452 20 10 DICDRO Cc1csc([C@H]([NH2+]Cc2cc(Cl)c(C)cc2O)C2CC2)n1 ZINC000825320896 1050293451 /nfs/dbraw/zinc/29/34/51/1050293451.db2.gz PRYZXTMLLAAIJJ-OAHLLOKOSA-N 1 0 322.861 4.360 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2cccc(F)c2F)cc1Cl ZINC000825375185 1050301013 /nfs/dbraw/zinc/30/10/13/1050301013.db2.gz JJKDAFUBOWYKRY-JTQLQIEISA-N 1 0 311.759 4.483 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825405033 1050302689 /nfs/dbraw/zinc/30/26/89/1050302689.db2.gz ARDGYHSCZSBQIP-GFCCVEGCSA-N 1 0 304.821 4.162 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)cc1Cl ZINC000825391562 1050302718 /nfs/dbraw/zinc/30/27/18/1050302718.db2.gz YEMGBWHQXOHOEN-BBRMVZONSA-N 1 0 311.853 4.037 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825405034 1050303584 /nfs/dbraw/zinc/30/35/84/1050303584.db2.gz ARDGYHSCZSBQIP-LBPRGKRZSA-N 1 0 304.821 4.162 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)CCC2 ZINC000825469441 1050309322 /nfs/dbraw/zinc/30/93/22/1050309322.db2.gz XZRGHYKDVYHOOU-CYBMUJFWSA-N 1 0 322.861 4.286 20 10 DICDRO CCOc1ccc(C[NH2+][C@]2(C)CCCc3ccccc32)c(O)c1 ZINC000734843360 1050324764 /nfs/dbraw/zinc/32/47/64/1050324764.db2.gz LAANMOQPISQHGS-HXUWFJFHSA-N 1 0 311.425 4.132 20 10 DICDRO C[C@H]([NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)C(C)(C)O ZINC000734841868 1050325565 /nfs/dbraw/zinc/32/55/65/1050325565.db2.gz ZCIQQJMYYSXMPU-ZDUSSCGKSA-N 1 0 321.505 4.236 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000772453710 1050357755 /nfs/dbraw/zinc/35/77/55/1050357755.db2.gz FBRSJZYNXHWGHI-SFHVURJKSA-N 1 0 323.484 4.477 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cscc2C)cc1F ZINC000785522737 1050385228 /nfs/dbraw/zinc/38/52/28/1050385228.db2.gz UJLXFEFPARVDLV-UHFFFAOYSA-N 1 0 306.450 4.332 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCC[C@@H](C)CC3)CC2)cc1 ZINC000785570425 1050395481 /nfs/dbraw/zinc/39/54/81/1050395481.db2.gz QZZAIUSCPHYMMN-IAGOWNOFSA-N 1 0 316.489 4.222 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CSc3ccccc32)cc1 ZINC000735508658 1050401991 /nfs/dbraw/zinc/40/19/91/1050401991.db2.gz JSFJSBHXRKEUMR-SFHVURJKSA-N 1 0 312.482 4.469 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)ccc1O)c1ccc(Br)cc1 ZINC000226582282 1050491036 /nfs/dbraw/zinc/49/10/36/1050491036.db2.gz PKNRPZWAMYDEQG-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO CC[C@H]([NH2+]CCc1sc(C)nc1C)c1ccc(N(C)C)cc1 ZINC000157949152 1050496582 /nfs/dbraw/zinc/49/65/82/1050496582.db2.gz MPYBYXJVAXRNKT-KRWDZBQOSA-N 1 0 317.502 4.109 20 10 DICDRO CO[C@@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000786576467 1050498292 /nfs/dbraw/zinc/49/82/92/1050498292.db2.gz UVNVINYQIHGRHP-ULQDDVLXSA-N 1 0 304.478 4.141 20 10 DICDRO CN(C)c1ccc(CNc2ccc(Cl)c(C[NH+](C)C)c2)cc1 ZINC000798503186 1050519733 /nfs/dbraw/zinc/51/97/33/1050519733.db2.gz DNJAGEJPTQZKNY-UHFFFAOYSA-N 1 0 317.864 4.080 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2c(C)noc2C)cc1 ZINC000168178737 1050523178 /nfs/dbraw/zinc/52/31/78/1050523178.db2.gz ARFVXRCBXHHLPS-OLZOCXBDSA-N 1 0 301.434 4.159 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)cc1C ZINC000738241169 1050532175 /nfs/dbraw/zinc/53/21/75/1050532175.db2.gz QPFAXZQGGDFOPQ-LJQANCHMSA-N 1 0 313.466 4.299 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(F)c(F)c1)c1cc(Cl)ccc1O ZINC000786936882 1050535163 /nfs/dbraw/zinc/53/51/63/1050535163.db2.gz CFXLPUJXISOHEV-SNVBAGLBSA-N 1 0 311.759 4.217 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@H]1CCSC1)C1CCCCC1 ZINC000787049468 1050545771 /nfs/dbraw/zinc/54/57/71/1050545771.db2.gz ADJIQPVCLGIWGP-OAHLLOKOSA-N 1 0 305.487 4.280 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCC1 ZINC000766237143 1050554053 /nfs/dbraw/zinc/55/40/53/1050554053.db2.gz JETPTTPKOZOVMU-DZGCQCFKSA-N 1 0 324.415 4.035 20 10 DICDRO CCC[C@H](C)[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766238707 1050560865 /nfs/dbraw/zinc/56/08/65/1050560865.db2.gz XRUJCDVNUKSUGZ-KBPBESRZSA-N 1 0 312.404 4.035 20 10 DICDRO CCC[C@@H](C)[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766238708 1050561184 /nfs/dbraw/zinc/56/11/84/1050561184.db2.gz XRUJCDVNUKSUGZ-KGLIPLIRSA-N 1 0 312.404 4.035 20 10 DICDRO COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cc(F)ccc1O ZINC000787330232 1050586803 /nfs/dbraw/zinc/58/68/03/1050586803.db2.gz DGTLKOUWLNQNBX-INIZCTEOSA-N 1 0 323.795 4.004 20 10 DICDRO Cc1cc(C)c(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1C ZINC000746693093 1050611601 /nfs/dbraw/zinc/61/16/01/1050611601.db2.gz IIEGSLLOKXMHGU-UHFFFAOYSA-N 1 0 300.421 4.107 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2cc3cnccc3o2)C2CC2)cc1 ZINC000845903365 1050633184 /nfs/dbraw/zinc/63/31/84/1050633184.db2.gz XMSGZAADAYHCNI-UHFFFAOYSA-N 1 0 321.424 4.058 20 10 DICDRO C[C@H](CO)[C@H](C)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000740898720 1050638541 /nfs/dbraw/zinc/63/85/41/1050638541.db2.gz WYBBKBSMNHUVHB-KGLIPLIRSA-N 1 0 321.505 4.094 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(F)cc(C)cc2Cl)c1 ZINC000845972533 1050639208 /nfs/dbraw/zinc/63/92/08/1050639208.db2.gz RLMMRTRPYYVLAM-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO CC[C@H](Cc1cccs1)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000845970854 1050640131 /nfs/dbraw/zinc/64/01/31/1050640131.db2.gz DHKUABNBDCQBER-QWHCGFSZSA-N 1 0 305.443 4.134 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)c2cc(F)cc(F)c2)c1 ZINC000845971117 1050640143 /nfs/dbraw/zinc/64/01/43/1050640143.db2.gz HEFCWQJQXHBFCT-VXGBXAGGSA-N 1 0 321.367 4.133 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2CCC3(CCCO3)CC2)cc1 ZINC000788250157 1050660179 /nfs/dbraw/zinc/66/01/79/1050660179.db2.gz VSBIOZSJKKIHBK-UHFFFAOYSA-N 1 0 316.489 4.114 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000846055879 1050660505 /nfs/dbraw/zinc/66/05/05/1050660505.db2.gz RETCXAHBSGZVIY-UHFFFAOYSA-N 1 0 317.816 4.124 20 10 DICDRO CS[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000227378100 1050666153 /nfs/dbraw/zinc/66/61/53/1050666153.db2.gz BKRBSQOTJVDHNJ-SJLPKXTDSA-N 1 0 304.503 4.051 20 10 DICDRO CCO[C@@H](CC[NH2+][C@@H](C)c1cccc(OC)c1O)C1CCCC1 ZINC000846148883 1050672666 /nfs/dbraw/zinc/67/26/66/1050672666.db2.gz UGMCBNMIFQOZBN-YOEHRIQHSA-N 1 0 321.461 4.037 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](Cc2ccccc2)C2CC2)c1O ZINC000846156946 1050674971 /nfs/dbraw/zinc/67/49/71/1050674971.db2.gz ZQJWRUQUFVTGGK-RDTXWAMCSA-N 1 0 311.425 4.073 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)c1O ZINC000846157908 1050675186 /nfs/dbraw/zinc/67/51/86/1050675186.db2.gz PGIHBNCFQZSISJ-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](CC(F)(F)F)C(C)C)c1O ZINC000846162495 1050676517 /nfs/dbraw/zinc/67/65/17/1050676517.db2.gz CCEWYOYXBBNRRI-CMPLNLGQSA-N 1 0 305.340 4.028 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)c1O ZINC000846167984 1050678489 /nfs/dbraw/zinc/67/84/89/1050678489.db2.gz PSUQSIPSVSTAJQ-NOLJZWGESA-N 1 0 315.388 4.137 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(OC)c2O)CCO1 ZINC000846163934 1050678541 /nfs/dbraw/zinc/67/85/41/1050678541.db2.gz SYRISSYLMHTFCH-YEWWUXTCSA-N 1 0 321.461 4.035 20 10 DICDRO CC[C@H](C[NH2+][C@H](C)c1cccc(OC)c1O)CC(F)(F)F ZINC000846170545 1050679877 /nfs/dbraw/zinc/67/98/77/1050679877.db2.gz AYGATDJKDAKVBJ-MNOVXSKESA-N 1 0 305.340 4.030 20 10 DICDRO CC[C@@H](C[NH2+][C@H](C)c1cccc(OC)c1O)CC(F)(F)F ZINC000846170542 1050680040 /nfs/dbraw/zinc/68/00/40/1050680040.db2.gz AYGATDJKDAKVBJ-GHMZBOCLSA-N 1 0 305.340 4.030 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1O ZINC000846168136 1050680700 /nfs/dbraw/zinc/68/07/00/1050680700.db2.gz RDGXNMOGLABHDW-BZUAXINKSA-N 1 0 311.425 4.306 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C[C@H]2CCCCC(F)(F)C2)c1O ZINC000846168648 1050680745 /nfs/dbraw/zinc/68/07/45/1050680745.db2.gz BTTQLNIHGPHPML-OLZOCXBDSA-N 1 0 313.388 4.267 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2c(F)cccc2SC)c1O ZINC000846169442 1050680753 /nfs/dbraw/zinc/68/07/53/1050680753.db2.gz DOTUZYJBTNHLOQ-NSHDSACASA-N 1 0 321.417 4.113 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(c3cccc(C)c3)CCC2)c1O ZINC000846171444 1050680852 /nfs/dbraw/zinc/68/08/52/1050680852.db2.gz GVOGVGGRDFRAEN-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2cc(C3CC3)ccc2F)c1O ZINC000846168587 1050680862 /nfs/dbraw/zinc/68/08/62/1050680862.db2.gz AYNLNUYBIZUQDQ-GFCCVEGCSA-N 1 0 315.388 4.268 20 10 DICDRO CCSc1cccc(C[NH2+][C@@H](C)c2cccc(OC)c2O)c1 ZINC000846171073 1050680964 /nfs/dbraw/zinc/68/09/64/1050680964.db2.gz QYLRCRFYKYTGEU-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC[C@H]2CCc3ccccc32)c1O ZINC000846171005 1050680988 /nfs/dbraw/zinc/68/09/88/1050680988.db2.gz QGQHQLKBBFWBIA-GDBMZVCRSA-N 1 0 311.425 4.172 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCCSc2ccccc2)c1O ZINC000846135981 1050682219 /nfs/dbraw/zinc/68/22/19/1050682219.db2.gz FVSNIBCFPPXXLR-CQSZACIVSA-N 1 0 317.454 4.234 20 10 DICDRO CCS[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846143972 1050683572 /nfs/dbraw/zinc/68/35/72/1050683572.db2.gz BSVNXBDKDXPEQV-JGGQBBKZSA-N 1 0 309.475 4.116 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1O ZINC000846145746 1050683671 /nfs/dbraw/zinc/68/36/71/1050683671.db2.gz QBHCMLAOTQFMAM-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)c1O ZINC000846142860 1050683913 /nfs/dbraw/zinc/68/39/13/1050683913.db2.gz WPQJUCMNOOMMJM-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccc(F)cc1F ZINC000846145284 1050686550 /nfs/dbraw/zinc/68/65/50/1050686550.db2.gz NQARCVVQGWBSDC-ZBEGNZNMSA-N 1 0 321.367 4.481 20 10 DICDRO C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)c1cc(Cl)ccc1O ZINC000846185836 1050688484 /nfs/dbraw/zinc/68/84/84/1050688484.db2.gz SWQQVHGCORVARR-FZZIBODNSA-N 1 0 306.208 4.401 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000846189740 1050690041 /nfs/dbraw/zinc/69/00/41/1050690041.db2.gz RYZOKGLNFNHNNK-MOXGXCLJSA-N 1 0 313.441 4.038 20 10 DICDRO CC[C@@H]([NH2+][C@H](C1CC1)C1CCOCC1)c1cc(Cl)ccc1O ZINC000846189886 1050691042 /nfs/dbraw/zinc/69/10/42/1050691042.db2.gz VQFFPDFIXGUSNB-SJLPKXTDSA-N 1 0 323.864 4.292 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CC(C)(C)Oc2ccc(F)cc21)c1ccccc1O ZINC000846197688 1050694911 /nfs/dbraw/zinc/69/49/11/1050694911.db2.gz VODUHPJIFJDBAQ-MLGOLLRUSA-N 1 0 315.388 4.484 20 10 DICDRO CSC1(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CCC1 ZINC000788606833 1050712954 /nfs/dbraw/zinc/71/29/54/1050712954.db2.gz QZKBCSRAWJONTN-ZDUSSCGKSA-N 1 0 305.487 4.207 20 10 DICDRO COCc1cc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)ccc1F ZINC000788604660 1050714742 /nfs/dbraw/zinc/71/47/42/1050714742.db2.gz VFGOCSVLWGKEFR-CQSZACIVSA-N 1 0 317.404 4.145 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C(C)C)[C@H](O)c2ccccc2)c(O)c1 ZINC000788618547 1050718043 /nfs/dbraw/zinc/71/80/43/1050718043.db2.gz AUBFYOGDWXXJNX-CWFSZBLJSA-N 1 0 313.441 4.109 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)c(Cl)cc2F)c1 ZINC000788621420 1050720291 /nfs/dbraw/zinc/72/02/91/1050720291.db2.gz XPDFHFKEUGVGDY-JTQLQIEISA-N 1 0 311.759 4.483 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@H]2c2ccccc2)c1O ZINC000761184987 1050743779 /nfs/dbraw/zinc/74/37/79/1050743779.db2.gz RQNRXRWOQPVICG-HNNXBMFYSA-N 1 0 303.789 4.001 20 10 DICDRO Cc1cc(C)cc([C@@H](O)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788820325 1050756800 /nfs/dbraw/zinc/75/68/00/1050756800.db2.gz UQHAKZBBWNSPFW-APWZRJJASA-N 1 0 313.441 4.010 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2c(O)cccc2Cl)c(C)c1 ZINC000788970941 1050767020 /nfs/dbraw/zinc/76/70/20/1050767020.db2.gz XYULUXJHLJKYDJ-UHFFFAOYSA-N 1 0 319.832 4.433 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cc(C)c(C)cc2O)c(C)c1 ZINC000788968886 1050767587 /nfs/dbraw/zinc/76/75/87/1050767587.db2.gz COTKYXFSWBPBJX-UHFFFAOYSA-N 1 0 313.441 4.396 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCOc3c(C)cccc32)cc1 ZINC000788971103 1050768027 /nfs/dbraw/zinc/76/80/27/1050768027.db2.gz FZWSLZBFHXQVBK-HXUWFJFHSA-N 1 0 324.468 4.455 20 10 DICDRO CCOC[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C(C)C ZINC000788985189 1050771393 /nfs/dbraw/zinc/77/13/93/1050771393.db2.gz ONTDWRUXBFGECY-PXNSSMCTSA-N 1 0 318.505 4.389 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000788987375 1050774033 /nfs/dbraw/zinc/77/40/33/1050774033.db2.gz LHQYZQKOEPZFLL-AWEZNQCLSA-N 1 0 310.432 4.365 20 10 DICDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000772956226 1050780484 /nfs/dbraw/zinc/78/04/84/1050780484.db2.gz AIGYXLNDLFTESH-KXBFYZLASA-N 1 0 310.441 4.154 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000772961413 1050808236 /nfs/dbraw/zinc/80/82/36/1050808236.db2.gz QKLCWYUJXOMWDP-FOIQADDNSA-N 1 0 324.468 4.489 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)cc1C ZINC000742367855 1050822683 /nfs/dbraw/zinc/82/26/83/1050822683.db2.gz LWLNJZIFEVDHKE-QGZVFWFLSA-N 1 0 315.388 4.152 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@H](SC)C2)cc1F ZINC000742383768 1050827582 /nfs/dbraw/zinc/82/75/82/1050827582.db2.gz TXCHLXZLLDURHL-GJZGRUSLSA-N 1 0 310.482 4.046 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1F ZINC000742390747 1050830888 /nfs/dbraw/zinc/83/08/88/1050830888.db2.gz MRJKDZUYDXLSMK-LBPRGKRZSA-N 1 0 322.374 4.063 20 10 DICDRO c1ccc(C[C@@H]2C[C@H]2[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000742375020 1050835218 /nfs/dbraw/zinc/83/52/18/1050835218.db2.gz KXZHAYWRFFTIKI-IFMALSPDSA-N 1 0 320.480 4.398 20 10 DICDRO COc1ccc(C[NH2+][C@@H](c2nc(C)cs2)C2CC2)cc1C ZINC000742377718 1050836576 /nfs/dbraw/zinc/83/65/76/1050836576.db2.gz QQJUDNNEFHGDQG-MRXNPFEDSA-N 1 0 302.443 4.009 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](CC2CC2)c2ccccc2)c(O)c1 ZINC000742378818 1050837963 /nfs/dbraw/zinc/83/79/63/1050837963.db2.gz ZKOTYXBWDIIPHE-IBGZPJMESA-N 1 0 311.425 4.422 20 10 DICDRO CCCCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)CC)cc2)C1(C)C ZINC001170118108 1050884302 /nfs/dbraw/zinc/88/43/02/1050884302.db2.gz PBXWUQCNTXIEAQ-RTBURBONSA-N 1 0 318.505 4.216 20 10 DICDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)ccc1F ZINC000772995463 1050975707 /nfs/dbraw/zinc/97/57/07/1050975707.db2.gz DEDQCQCIUQMPQR-OAHLLOKOSA-N 1 0 300.421 4.359 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@](C)(O)C2CCCCC2)c2c1c(F)ccc2O ZINC000790704039 1050986624 /nfs/dbraw/zinc/98/66/24/1050986624.db2.gz XDLBGCXHBPVWPD-PEELUZDISA-N 1 0 321.436 4.001 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@@](C)(O)C2CCCCC2)c2c1c(F)ccc2O ZINC000790704038 1050986977 /nfs/dbraw/zinc/98/69/77/1050986977.db2.gz XDLBGCXHBPVWPD-KPAZRMRSSA-N 1 0 321.436 4.001 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000282739225 1050990336 /nfs/dbraw/zinc/99/03/36/1050990336.db2.gz NAPALWCHFXQEEM-CYBMUJFWSA-N 1 0 304.821 4.217 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)c1 ZINC000772999439 1051013652 /nfs/dbraw/zinc/01/36/52/1051013652.db2.gz LDYMYNAFRJUUGI-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1ccc(OC)cc1 ZINC000772999539 1051014568 /nfs/dbraw/zinc/01/45/68/1051014568.db2.gz MIBZSARHRHGPHP-IBGZPJMESA-N 1 0 312.457 4.311 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cc1F ZINC000773001096 1051015998 /nfs/dbraw/zinc/01/59/98/1051015998.db2.gz QKSIAXWKTSIILY-OAHLLOKOSA-N 1 0 300.421 4.359 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cc1F ZINC000773001090 1051016058 /nfs/dbraw/zinc/01/60/58/1051016058.db2.gz QKSIAXWKTSIILY-HNNXBMFYSA-N 1 0 300.421 4.359 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000773000416 1051016323 /nfs/dbraw/zinc/01/63/23/1051016323.db2.gz PIRBQMNPJUYAJN-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccccc2N(C)C)cc1 ZINC000773003574 1051017270 /nfs/dbraw/zinc/01/72/70/1051017270.db2.gz FEGOPQWAGZCIOO-MRXNPFEDSA-N 1 0 311.473 4.060 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCOC[C@H]1c1ccccc1 ZINC000743403967 1051023288 /nfs/dbraw/zinc/02/32/88/1051023288.db2.gz YNUSTTVMRCTBDU-FQEVSTJZSA-N 1 0 319.404 4.119 20 10 DICDRO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccc(N(C)C)cc1 ZINC000773039417 1051036132 /nfs/dbraw/zinc/03/61/32/1051036132.db2.gz GKZLQTDKDYXNBI-SJCJKPOMSA-N 1 0 316.832 4.190 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(F)n1)c1ccc(N2CCCCC2)cc1 ZINC000773089478 1051058453 /nfs/dbraw/zinc/05/84/53/1051058453.db2.gz QZVRPXJAZKNAMY-HNNXBMFYSA-N 1 0 313.420 4.062 20 10 DICDRO CC(C)C[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000773092897 1051058733 /nfs/dbraw/zinc/05/87/33/1051058733.db2.gz NOFJQHSUCMDINW-LSDHHAIUSA-N 1 0 324.896 4.262 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(C)cc(OC)c2)cc1 ZINC000773091573 1051058774 /nfs/dbraw/zinc/05/87/74/1051058774.db2.gz ITJVRVPZZRBXFX-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)C1CC1 ZINC000773090868 1051059123 /nfs/dbraw/zinc/05/91/23/1051059123.db2.gz GHIFWVYVBOZYLI-JXFKEZNVSA-N 1 0 316.489 4.143 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](c2cccnc2)C2CC2)cc1 ZINC000773117568 1051066546 /nfs/dbraw/zinc/06/65/46/1051066546.db2.gz IZUNCFCTEPTLRS-QRWLVFNGSA-N 1 0 309.457 4.340 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](c2cccnc2)C2CC2)cc1 ZINC000773117571 1051067014 /nfs/dbraw/zinc/06/70/14/1051067014.db2.gz IZUNCFCTEPTLRS-YWZLYKJASA-N 1 0 309.457 4.340 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccc(Cl)n2)cc1 ZINC000743839554 1051069389 /nfs/dbraw/zinc/06/93/89/1051069389.db2.gz KIRNVGYKMYCPFC-UHFFFAOYSA-N 1 0 317.864 4.213 20 10 DICDRO Fc1cccc2c1CC[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)C2 ZINC001171395463 1051080771 /nfs/dbraw/zinc/08/07/71/1051080771.db2.gz FJKPFSKQQDCGJR-SFHVURJKSA-N 1 0 324.443 4.073 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCSc2ccccc21 ZINC000037128116 1051113792 /nfs/dbraw/zinc/11/37/92/1051113792.db2.gz ZNKAHZQSROOZDA-CQSZACIVSA-N 1 0 305.830 4.372 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)c1 ZINC000792187976 1051124828 /nfs/dbraw/zinc/12/48/28/1051124828.db2.gz JIHKSDOXGXTQHO-AWEZNQCLSA-N 1 0 301.352 4.111 20 10 DICDRO Cc1ccc(CCC[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cn1 ZINC000792779496 1051212156 /nfs/dbraw/zinc/21/21/56/1051212156.db2.gz FJWOOEGLCUUCBA-UHFFFAOYSA-N 1 0 323.484 4.053 20 10 DICDRO Cc1ccncc1C[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000792940835 1051226996 /nfs/dbraw/zinc/22/69/96/1051226996.db2.gz RSLVVFHATFBMFL-UHFFFAOYSA-N 1 0 323.484 4.449 20 10 DICDRO CSCC[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792991560 1051235700 /nfs/dbraw/zinc/23/57/00/1051235700.db2.gz JKQBLVXWXFWAQL-NSHDSACASA-N 1 0 320.424 4.003 20 10 DICDRO CCCN(Cc1ccc(C(F)F)cc1)c1ccc(C[NH3+])cc1 ZINC000793192039 1051259901 /nfs/dbraw/zinc/25/99/01/1051259901.db2.gz OVGBOTWYLYXJRI-UHFFFAOYSA-N 1 0 304.384 4.500 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c1O ZINC000793230022 1051263640 /nfs/dbraw/zinc/26/36/40/1051263640.db2.gz CLBWGRVCCGQXQX-CABZTGNLSA-N 1 0 307.743 4.127 20 10 DICDRO CCC[C@H]([NH2+]Cc1cc(C)c(C)cc1O)[C@H](O)c1ccccc1 ZINC000793236752 1051268198 /nfs/dbraw/zinc/26/81/98/1051268198.db2.gz DJYIYBXYQGSGPH-AZUAARDMSA-N 1 0 313.441 4.001 20 10 DICDRO CCC[C@H]([NH2+]Cc1cc(Cl)ccc1O)[C@@H](O)c1ccccc1 ZINC000793241503 1051272072 /nfs/dbraw/zinc/27/20/72/1051272072.db2.gz PBZYWYUVODNEEI-WMZOPIPTSA-N 1 0 319.832 4.038 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2cccnc2F)cc1 ZINC000793288074 1051276142 /nfs/dbraw/zinc/27/61/42/1051276142.db2.gz CHIWDODMEDZQNL-UHFFFAOYSA-N 1 0 315.436 4.137 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3ccc(F)cc32)cc1F ZINC000793307929 1051277684 /nfs/dbraw/zinc/27/76/84/1051277684.db2.gz AHKVFZODKQMILC-SFHVURJKSA-N 1 0 316.395 4.198 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000793385396 1051293425 /nfs/dbraw/zinc/29/34/25/1051293425.db2.gz BAFXCQRQJPBBNV-SAZUREKKSA-N 1 0 317.816 4.090 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)[C@@H](C)c2ccc(Cl)cc2)c(O)c1 ZINC000793386534 1051293574 /nfs/dbraw/zinc/29/35/74/1051293574.db2.gz VRUQBMVAUWZOQV-OLZOCXBDSA-N 1 0 319.832 4.336 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(C(C)(C)C)s2)c(O)c1 ZINC000793389574 1051295574 /nfs/dbraw/zinc/29/55/74/1051295574.db2.gz JWYDFZGCJHYHMQ-UHFFFAOYSA-N 1 0 305.443 4.050 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c(O)c(C(C)(C)C)c1 ZINC000793547423 1051316018 /nfs/dbraw/zinc/31/60/18/1051316018.db2.gz TWXYEJVYUVSJNI-MAUKXSAKSA-N 1 0 323.427 4.475 20 10 DICDRO CC[N@H+](CCc1cccs1)Cc1c(O)ccc2ccncc21 ZINC000746070677 1051316997 /nfs/dbraw/zinc/31/69/97/1051316997.db2.gz VQEXEJGKFFWLJN-UHFFFAOYSA-N 1 0 312.438 4.067 20 10 DICDRO C[C@]12CC[N@H+](Cc3c(O)cccc3Cl)C[C@H]1C2(Cl)Cl ZINC000793618623 1051329004 /nfs/dbraw/zinc/32/90/04/1051329004.db2.gz WAEGYQASPHISFW-OLZOCXBDSA-N 1 0 320.647 4.061 20 10 DICDRO CSC[C@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000793798734 1051339286 /nfs/dbraw/zinc/33/92/86/1051339286.db2.gz ZCKCFJYHXWXBTB-AWEZNQCLSA-N 1 0 301.455 4.120 20 10 DICDRO Cc1ccncc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000746292330 1051339999 /nfs/dbraw/zinc/33/99/99/1051339999.db2.gz BLSRFCIZFMDTHY-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO CC[C@H](C)OCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172340506 1051362376 /nfs/dbraw/zinc/36/23/76/1051362376.db2.gz KJGMQKGWTLWTRK-MSOLQXFVSA-N 1 0 318.505 4.312 20 10 DICDRO CCc1nc(C)c(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000794276482 1051366344 /nfs/dbraw/zinc/36/63/44/1051366344.db2.gz UESAEMFLLQQVJL-UHFFFAOYSA-N 1 0 315.461 4.022 20 10 DICDRO CCOCC[C@H](C)[NH2+][C@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001172422581 1051384666 /nfs/dbraw/zinc/38/46/66/1051384666.db2.gz GDMOIADNYNKLAY-KSSFIOAISA-N 1 0 305.462 4.037 20 10 DICDRO CC(C)COCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172468567 1051400134 /nfs/dbraw/zinc/40/01/34/1051400134.db2.gz LSNSEPWZYMJBEY-GOSISDBHSA-N 1 0 318.505 4.170 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H](C)CCOC(C)C ZINC001172441159 1051408104 /nfs/dbraw/zinc/40/81/04/1051408104.db2.gz TYLBAVMKHTZVRZ-BEFAXECRSA-N 1 0 319.489 4.426 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C(C)(C)C ZINC000766370412 1051411994 /nfs/dbraw/zinc/41/19/94/1051411994.db2.gz TYOMNJGUUJDWOX-VQIMIIECSA-N 1 0 318.505 4.389 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCOCc2ccccc2)cc1 ZINC000766405161 1051414733 /nfs/dbraw/zinc/41/47/33/1051414733.db2.gz XPAMQXKSCLJLSP-KRWDZBQOSA-N 1 0 312.457 4.010 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCOCc2ccccc2)cc1 ZINC000766405162 1051415233 /nfs/dbraw/zinc/41/52/33/1051415233.db2.gz XPAMQXKSCLJLSP-QGZVFWFLSA-N 1 0 312.457 4.010 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCSC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766447716 1051421242 /nfs/dbraw/zinc/42/12/42/1051421242.db2.gz ZZELDBVNYDULDJ-GDBMZVCRSA-N 1 0 322.493 4.362 20 10 DICDRO C[C@@H](Cc1ccncc1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766490351 1051432713 /nfs/dbraw/zinc/43/27/13/1051432713.db2.gz UEGAPYZHRBUHTG-ROUUACIJSA-N 1 0 323.484 4.354 20 10 DICDRO C[C@@H]([NH2+]C[C@]1(C)CCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766558753 1051481438 /nfs/dbraw/zinc/48/14/38/1051481438.db2.gz HJXKKGTZTAELBT-BEFAXECRSA-N 1 0 320.452 4.036 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CCCO1)c1ccc(N2CCCCCC2)cc1 ZINC000766561778 1051484522 /nfs/dbraw/zinc/48/45/22/1051484522.db2.gz XMXNIKIFIIXHLK-FXAWDEMLSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@@H](Cc1ccc(F)cc1Cl)[N@H+](C)Cc1ccccc1O ZINC001172870621 1051555235 /nfs/dbraw/zinc/55/52/35/1051555235.db2.gz BAXOBPLPYICWJP-LBPRGKRZSA-N 1 0 307.796 4.248 20 10 DICDRO c1ccc(OC2CCC([NH2+]Cc3ccc4c(c3)CCO4)CC2)cc1 ZINC001173197544 1051628565 /nfs/dbraw/zinc/62/85/65/1051628565.db2.gz HRDHHTJCKZYRLE-UHFFFAOYSA-N 1 0 323.436 4.101 20 10 DICDRO CCSC[C@@H](C)[NH2+][C@@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001173302313 1051679948 /nfs/dbraw/zinc/67/99/48/1051679948.db2.gz QJWQTGYPMXAQLT-CXAGYDPISA-N 1 0 307.503 4.364 20 10 DICDRO CCSC[C@@H](C)[NH2+][C@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001173302316 1051679980 /nfs/dbraw/zinc/67/99/80/1051679980.db2.gz QJWQTGYPMXAQLT-DYVFJYSZSA-N 1 0 307.503 4.364 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H]3CC[C@H]3C(C)(C)C)CC2)cc1 ZINC000806137853 1051736328 /nfs/dbraw/zinc/73/63/28/1051736328.db2.gz SQAPSQXFTFAZNH-MOPGFXCFSA-N 1 0 316.489 4.078 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1cccc(Cl)c1[O-] ZINC000806136662 1051736347 /nfs/dbraw/zinc/73/63/47/1051736347.db2.gz BBNFWTMNJTYZNQ-RHSMWYFYSA-N 1 0 324.896 4.207 20 10 DICDRO CC[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1cccc(Cl)c1[O-] ZINC000806129810 1051743272 /nfs/dbraw/zinc/74/32/72/1051743272.db2.gz KCZWSBJHQSJVBG-QGZVFWFLSA-N 1 0 324.896 4.207 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@@H]1C(F)F)c1ccc(N2CCCCC2)c(F)c1 ZINC000806170012 1051746998 /nfs/dbraw/zinc/74/69/98/1051746998.db2.gz UXSTTZQDBDNKKT-ZLDLUXBVSA-N 1 0 312.379 4.120 20 10 DICDRO COc1ccc(C[NH2+]CCSCc2ccccc2)cc1C ZINC000806682242 1051841635 /nfs/dbraw/zinc/84/16/35/1051841635.db2.gz WEVCXTRJACTNOL-UHFFFAOYSA-N 1 0 301.455 4.027 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2c(c1)CCCO2 ZINC000768088809 1051878566 /nfs/dbraw/zinc/87/85/66/1051878566.db2.gz BDORQUQGKRMPGI-HXUWFJFHSA-N 1 0 324.468 4.319 20 10 DICDRO CCOc1cccc(C[N@H+](C)Cc2ccccc2Cl)c1O ZINC000768169769 1051891411 /nfs/dbraw/zinc/89/14/11/1051891411.db2.gz JLEGDHTXUPCBEW-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO C[C@H]1C[N@H+](Cc2cccc(Cl)c2[O-])CCc2ccccc21 ZINC000404801295 1051892085 /nfs/dbraw/zinc/89/20/85/1051892085.db2.gz UPKFIDSXRUXITK-ZDUSSCGKSA-N 1 0 301.817 4.207 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2)c(O)c1 ZINC000768170805 1051892859 /nfs/dbraw/zinc/89/28/59/1051892859.db2.gz VKHFVTMBXGZUIR-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)c(O)c1 ZINC000768195060 1051901694 /nfs/dbraw/zinc/90/16/94/1051901694.db2.gz KDZGAYJFACCSFS-OAHLLOKOSA-N 1 0 303.427 4.190 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@H](C)c2ccc(F)cc2)c(O)c1 ZINC000768215350 1051902941 /nfs/dbraw/zinc/90/29/41/1051902941.db2.gz DMPRHCZAJQEUIS-CYBMUJFWSA-N 1 0 303.377 4.123 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1O ZINC000768228098 1051907346 /nfs/dbraw/zinc/90/73/46/1051907346.db2.gz YAQQLJWHFAQCIN-KRWDZBQOSA-N 1 0 315.388 4.267 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2cccc3cc[nH]c32)C2CC2)cc1 ZINC000768257121 1051909964 /nfs/dbraw/zinc/90/99/64/1051909964.db2.gz GOFYICHWQUVYSO-UHFFFAOYSA-N 1 0 319.452 4.399 20 10 DICDRO COCc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC000768258946 1051910003 /nfs/dbraw/zinc/91/00/03/1051910003.db2.gz ZJLDZJZDHMXZOK-UHFFFAOYSA-N 1 0 324.468 4.064 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@H](C)c2ccccc2F)c(O)c1 ZINC000768264530 1051911192 /nfs/dbraw/zinc/91/11/92/1051911192.db2.gz RAELIOZZUNSOGY-CYBMUJFWSA-N 1 0 303.377 4.123 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000768319538 1051916825 /nfs/dbraw/zinc/91/68/25/1051916825.db2.gz PNQULRITOJSLCW-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2ccccc2F)C(C)C)c1O ZINC000768334980 1051918002 /nfs/dbraw/zinc/91/80/02/1051918002.db2.gz RDQHDVQGGGROPX-UHFFFAOYSA-N 1 0 317.404 4.341 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1 ZINC000768330410 1051919262 /nfs/dbraw/zinc/91/92/62/1051919262.db2.gz RDYHLJSKPHQAGF-SFHVURJKSA-N 1 0 315.388 4.267 20 10 DICDRO Oc1cc2c(cc1C[NH2+]C1(c3ccccc3)CCC1)CCCC2 ZINC000768443310 1051930817 /nfs/dbraw/zinc/93/08/17/1051930817.db2.gz FDAHGARPORFUKH-UHFFFAOYSA-N 1 0 307.437 4.440 20 10 DICDRO COc1cc(C[N@H+](Cc2ccc(F)cc2)C2CC2)c(O)cc1C ZINC000768442495 1051931866 /nfs/dbraw/zinc/93/18/66/1051931866.db2.gz REUUSKWHXRMQGR-UHFFFAOYSA-N 1 0 315.388 4.013 20 10 DICDRO CCCCC[NH+](CCCCC)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768438544 1051932307 /nfs/dbraw/zinc/93/23/07/1051932307.db2.gz BKLRLNIABLIXGG-SFHVURJKSA-N 1 0 321.461 4.000 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(O)cc1C ZINC000768443823 1051932364 /nfs/dbraw/zinc/93/23/64/1051932364.db2.gz UOKGNQTUIBTEHN-KRWDZBQOSA-N 1 0 315.388 4.185 20 10 DICDRO COc1cc(C[N@H+](C)Cc2cc3ccccc3o2)c(O)cc1C ZINC000768464915 1051934332 /nfs/dbraw/zinc/93/43/32/1051934332.db2.gz CEBMHRBGLNTPFD-UHFFFAOYSA-N 1 0 311.381 4.087 20 10 DICDRO Oc1cccc(Cl)c1C[NH+]1CCC(Oc2ccccc2)CC1 ZINC000768528428 1051939296 /nfs/dbraw/zinc/93/92/96/1051939296.db2.gz SBBSPRWFXIALIQ-UHFFFAOYSA-N 1 0 317.816 4.089 20 10 DICDRO CC[C@@H](c1ccccc1)[N@H+](CC)Cc1cc2c(cc1O)OCO2 ZINC000768514486 1051943121 /nfs/dbraw/zinc/94/31/21/1051943121.db2.gz JXJDTMTWODONLO-INIZCTEOSA-N 1 0 313.397 4.094 20 10 DICDRO COCC[N@H+](Cc1cc(C)c(C)cc1O)[C@@H](C)c1ccccc1 ZINC000768598481 1051946403 /nfs/dbraw/zinc/94/64/03/1051946403.db2.gz ZBFVIPWSRIGQDY-KRWDZBQOSA-N 1 0 313.441 4.219 20 10 DICDRO C[N@H+](Cc1ccc(-c2ccc(F)cc2)o1)Cc1ccccc1O ZINC000768872134 1051974295 /nfs/dbraw/zinc/97/42/95/1051974295.db2.gz DIZAYMOCAAITEH-UHFFFAOYSA-N 1 0 311.356 4.423 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(C)c(C)c2)c1O ZINC000768983480 1051987161 /nfs/dbraw/zinc/98/71/61/1051987161.db2.gz NSEGBPRFOYTMKP-SFHVURJKSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(C)c(C)c2)c1O ZINC000768983474 1051987388 /nfs/dbraw/zinc/98/73/88/1051987388.db2.gz NSEGBPRFOYTMKP-GOSISDBHSA-N 1 0 311.425 4.355 20 10 DICDRO C[C@H](c1ccco1)[N@H+](Cc1ccc(N(C)C)c(F)c1)C1CC1 ZINC000769101366 1051996994 /nfs/dbraw/zinc/99/69/94/1051996994.db2.gz DOZPJNOFJOVWIW-CYBMUJFWSA-N 1 0 302.393 4.210 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCC(OC)CC2)cc1)CC(C)(C)C ZINC000769141060 1052000990 /nfs/dbraw/zinc/00/09/90/1052000990.db2.gz HUFVYQJOGBUNLA-UHFFFAOYSA-N 1 0 318.505 4.170 20 10 DICDRO COc1cccc(O)c1C[N@H+](Cc1ccc(C)s1)C(C)C ZINC000769102981 1052001354 /nfs/dbraw/zinc/00/13/54/1052001354.db2.gz QHMSCXUCHLLIRT-UHFFFAOYSA-N 1 0 305.443 4.181 20 10 DICDRO Cc1ccc(C)n1C1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000769208580 1052008664 /nfs/dbraw/zinc/00/86/64/1052008664.db2.gz JROYFHYHKNFRKY-UHFFFAOYSA-N 1 0 318.848 4.301 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)c1O ZINC000769309135 1052021673 /nfs/dbraw/zinc/02/16/73/1052021673.db2.gz REWGNSWFTVVJOR-QGZVFWFLSA-N 1 0 311.425 4.171 20 10 DICDRO COC[C@H]([NH2+]Cc1ccc(OC)c(C)c1)c1cccc(Cl)c1 ZINC000808454789 1052025619 /nfs/dbraw/zinc/02/56/19/1052025619.db2.gz SVNNPISCKAGBSN-KRWDZBQOSA-N 1 0 319.832 4.134 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1CCCSC1 ZINC000808431250 1052030420 /nfs/dbraw/zinc/03/04/20/1052030420.db2.gz YCQGLNNVZKEWKW-HNNXBMFYSA-N 1 0 313.466 4.292 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1coc(C2CC2)n1)C1CCCC1 ZINC000769382960 1052037616 /nfs/dbraw/zinc/03/76/16/1052037616.db2.gz DFMKQLGZRJGCAQ-UHFFFAOYSA-N 1 0 312.413 4.202 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c1O ZINC000769426920 1052045286 /nfs/dbraw/zinc/04/52/86/1052045286.db2.gz KUNVMIOAJKVPHF-IBGZPJMESA-N 1 0 301.430 4.113 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)c1O ZINC000769457040 1052058733 /nfs/dbraw/zinc/05/87/33/1052058733.db2.gz NGZZMBFOBHISRE-SUMWQHHRSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c1O ZINC000808685787 1052061268 /nfs/dbraw/zinc/06/12/68/1052061268.db2.gz CUCHAVZLXXNJMO-LBPRGKRZSA-N 1 0 317.816 4.140 20 10 DICDRO c1ccc2c(c1)[nH]c1c2CCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000808688619 1052061494 /nfs/dbraw/zinc/06/14/94/1052061494.db2.gz SVSQSAXMZBCEMQ-IBGZPJMESA-N 1 0 318.420 4.270 20 10 DICDRO COc1cccc(C[N@@H+]2CCCCC[C@H]2c2ccc(C)o2)c1O ZINC000769462187 1052061876 /nfs/dbraw/zinc/06/18/76/1052061876.db2.gz CAOPMZANCKPFGK-INIZCTEOSA-N 1 0 315.413 4.420 20 10 DICDRO CCCN(CCC)c1ccc(CN(C)Cc2nccs2)cc1 ZINC000769468982 1052062167 /nfs/dbraw/zinc/06/21/67/1052062167.db2.gz RNSPBSUMUYLUGY-UHFFFAOYSA-N 1 0 317.502 4.402 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O)c1ccccc1 ZINC000808679680 1052067281 /nfs/dbraw/zinc/06/72/81/1052067281.db2.gz WXMOSVQKVUFTTF-CXAGYDPISA-N 1 0 319.832 4.392 20 10 DICDRO Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cc1 ZINC000808679449 1052067704 /nfs/dbraw/zinc/06/77/04/1052067704.db2.gz PPNHBMZLWXEMQP-GUYCJALGSA-N 1 0 319.832 4.047 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2cc(C)ccc2C)c1O ZINC000769503776 1052069460 /nfs/dbraw/zinc/06/94/60/1052069460.db2.gz LUDWACIAQLYNRV-GOSISDBHSA-N 1 0 311.425 4.355 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)CO2 ZINC000808706675 1052069607 /nfs/dbraw/zinc/06/96/07/1052069607.db2.gz QTLAXGWQDPYUJV-BLLLJJGKSA-N 1 0 317.816 4.447 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000769504799 1052069629 /nfs/dbraw/zinc/06/96/29/1052069629.db2.gz ZQCZVGMQZFNOOO-QGZVFWFLSA-N 1 0 316.832 4.122 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccccc2N(C)C)c1O ZINC000808707151 1052070769 /nfs/dbraw/zinc/07/07/69/1052070769.db2.gz FONVSKKAGJXOFK-CYBMUJFWSA-N 1 0 318.848 4.271 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](CSc3ccccc3)C2)c1 ZINC000769513012 1052070980 /nfs/dbraw/zinc/07/09/80/1052070980.db2.gz WUMJFMOGVLHBPO-INIZCTEOSA-N 1 0 313.466 4.315 20 10 DICDRO CSC[C@@H]1CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000769516042 1052072813 /nfs/dbraw/zinc/07/28/13/1052072813.db2.gz NTJRWIQURKHFOL-SFHVURJKSA-N 1 0 304.503 4.004 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CCCCN2C2CC2)c1O ZINC000808715296 1052075120 /nfs/dbraw/zinc/07/51/20/1052075120.db2.gz CKRSUHKIFCYXMM-XJKSGUPXSA-N 1 0 322.880 4.022 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CCCCN2C2CC2)c1O ZINC000808715295 1052076277 /nfs/dbraw/zinc/07/62/77/1052076277.db2.gz CKRSUHKIFCYXMM-CZUORRHYSA-N 1 0 322.880 4.022 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H](O)c1ccccc1)c1cc(Cl)ccc1O ZINC000808720833 1052079686 /nfs/dbraw/zinc/07/96/86/1052079686.db2.gz ZMBMHSQNSDLYLC-PZPSRYQVSA-N 1 0 319.832 4.208 20 10 DICDRO CCCC([NH3+])(CCC)c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217734775 1052128419 /nfs/dbraw/zinc/12/84/19/1052128419.db2.gz SJIXMIZDCYAXMW-UHFFFAOYSA-N 1 0 324.428 4.282 20 10 DICDRO C[C@H](CCSc1ccccc1)[N@H+](C)Cc1ccccc1O ZINC000770168044 1052155742 /nfs/dbraw/zinc/15/57/42/1052155742.db2.gz RCKKSSKSMJFLOY-OAHLLOKOSA-N 1 0 301.455 4.395 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@@H]1C[NH2+]C[C@H]1C ZINC001218034404 1052188022 /nfs/dbraw/zinc/18/80/22/1052188022.db2.gz RQQTXEOLZWODOF-AUUYWEPGSA-N 1 0 324.428 4.436 20 10 DICDRO C[C@@H]1C[C@@H](Oc2ccc(/N=N/c3ccc(N(C)C)cc3)cc2)C[NH2+]1 ZINC001218040160 1052188623 /nfs/dbraw/zinc/18/86/23/1052188623.db2.gz UDKUUDPUAUKHCP-TXLATXGESA-N 1 0 324.428 4.297 20 10 DICDRO Cc1ccc(O[C@@H]2CC[NH2+]C[C@H]2F)c(/N=N/c2ccccc2)c1 ZINC001218072582 1052191795 /nfs/dbraw/zinc/19/17/95/1052191795.db2.gz SEPXFTGFAHZIQB-MOHPWDLQSA-N 1 0 313.376 4.489 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2CC[C@]23CC[NH2+]C3)=C1 ZINC001218120048 1052198998 /nfs/dbraw/zinc/19/89/98/1052198998.db2.gz SDVDPFICNHGEDY-QZDOXPCSSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)=C1 ZINC001218186650 1052204836 /nfs/dbraw/zinc/20/48/36/1052204836.db2.gz UNNCIEIFTUMHIN-HEUVYFRZSA-N 1 0 323.396 4.469 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@@H](C)C1C[NH2+]C1 ZINC001218198856 1052207406 /nfs/dbraw/zinc/20/74/06/1052207406.db2.gz TVEFRPDLWJQLQK-AWEZNQCLSA-N 1 0 324.428 4.436 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CCC2(C[NH2+]C2)C1 ZINC001218234812 1052210298 /nfs/dbraw/zinc/21/02/98/1052210298.db2.gz KYDOHRLFEZBFPX-CTBAPTLKSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1C[C@@H]2CC[NH2+][C@H]2C1 ZINC001218253120 1052213411 /nfs/dbraw/zinc/21/34/11/1052213411.db2.gz WWBDZUKFDXCXTO-NZQMBSAGSA-N 1 0 323.396 4.327 20 10 DICDRO C[C@@H]1[NH2+]C[C@@H]1Oc1ccc2ccccc2c1/N=N/c1nccs1 ZINC001218387521 1052233367 /nfs/dbraw/zinc/23/33/67/1052233367.db2.gz QCSFKGVOPHTZFE-DOPBYDGESA-N 1 0 324.409 4.451 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CC[C@@H]4C[NH2+]C[C@@H]34)cc2)C=C1 ZINC001218468538 1052242547 /nfs/dbraw/zinc/24/25/47/1052242547.db2.gz SEFSQMQBLZPWNZ-UPRAQXHNSA-N 1 0 323.396 4.184 20 10 DICDRO Cc1ccccc1/N=N/c1ccc(NC(=O)C2([NH3+])CC2)c(C)c1 ZINC001219203857 1052277464 /nfs/dbraw/zinc/27/74/64/1052277464.db2.gz PBIYYAUPDXSWNM-QURGRASLSA-N 1 0 308.385 4.149 20 10 DICDRO Cc1ccc(C)c(C[N@@H+](C)Cc2c(O)ccc3ccncc32)c1 ZINC000762050611 1052294310 /nfs/dbraw/zinc/29/43/10/1052294310.db2.gz RLANQCFSBUPAAW-UHFFFAOYSA-N 1 0 306.409 4.189 20 10 DICDRO C[C@H]([NH2+]C[C@H]1Cc2ccccc2O1)c1ccc2ccccc2c1O ZINC000324389263 1052308509 /nfs/dbraw/zinc/30/85/09/1052308509.db2.gz PPKXUAOBSOMOTK-WMLDXEAASA-N 1 0 319.404 4.200 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1ccc(N(C)C)cc1 ZINC000315409078 1052337239 /nfs/dbraw/zinc/33/72/39/1052337239.db2.gz IQJQZKFNJFXFKP-OLZOCXBDSA-N 1 0 304.384 4.443 20 10 DICDRO Cc1cc(C[NH2+]Cc2scnc2C)c(C)n1-c1ccccc1 ZINC000316182269 1052364572 /nfs/dbraw/zinc/36/45/72/1052364572.db2.gz VPWPZPOLDBFBMO-UHFFFAOYSA-N 1 0 311.454 4.149 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCCOc2ccc(F)cc2)cc1C ZINC000915207698 1052367684 /nfs/dbraw/zinc/36/76/84/1052367684.db2.gz LJUBPOMAGYTTPN-UHFFFAOYSA-N 1 0 317.404 4.049 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000316882853 1052375819 /nfs/dbraw/zinc/37/58/19/1052375819.db2.gz APPIWKOOQFPLBW-CHWSQXEVSA-N 1 0 303.377 4.342 20 10 DICDRO CSC1(C[NH2+]Cc2cc(C)n(-c3ccccc3)c2C)CCC1 ZINC000318420837 1052406696 /nfs/dbraw/zinc/40/66/96/1052406696.db2.gz MJNYAZZWIMYNMR-UHFFFAOYSA-N 1 0 314.498 4.469 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CC(C)(C)Cc3oc(C)cc32)c1O ZINC000237423337 1052440765 /nfs/dbraw/zinc/44/07/65/1052440765.db2.gz DAWGLJBTIPICSM-HNNXBMFYSA-N 1 0 315.413 4.106 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc(OC(F)F)cc2)cc1C ZINC000915810813 1052481505 /nfs/dbraw/zinc/48/15/05/1052481505.db2.gz LEGHCXLXXZEOCK-UHFFFAOYSA-N 1 0 321.367 4.242 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)Cc2ccc(C(C)C)cc2)c1O ZINC000915811944 1052484186 /nfs/dbraw/zinc/48/41/86/1052484186.db2.gz CIDNHPTWXWCXDR-UHFFFAOYSA-N 1 0 313.441 4.465 20 10 DICDRO CCOC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CCCC1 ZINC000320289614 1052498575 /nfs/dbraw/zinc/49/85/75/1052498575.db2.gz BGERBBVFELPMRM-LSDHHAIUSA-N 1 0 303.446 4.188 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)cc1 ZINC000324511057 1052552537 /nfs/dbraw/zinc/55/25/37/1052552537.db2.gz MUQVEZZDUODSMI-INIZCTEOSA-N 1 0 324.468 4.319 20 10 DICDRO CC(C)[N@H+](Cc1ccc(F)cc1)Cc1ccc(N(C)C)cc1 ZINC000917074599 1052690829 /nfs/dbraw/zinc/69/08/29/1052690829.db2.gz BWFOARZUBUDRFQ-UHFFFAOYSA-N 1 0 300.421 4.302 20 10 DICDRO Cc1cccc(C[N@@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)c1 ZINC000917482110 1052729407 /nfs/dbraw/zinc/72/94/07/1052729407.db2.gz CAPZOEJQHZDZKC-UHFFFAOYSA-N 1 0 313.441 4.336 20 10 DICDRO Cc1cc(C[N@@H+]2CCO[C@H]3CCCC[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC000917473599 1052729705 /nfs/dbraw/zinc/72/97/05/1052729705.db2.gz QYVYJKPHTNGGMH-ROUUACIJSA-N 1 0 317.473 4.142 20 10 DICDRO Cc1ccc(N2CCC[N@H+](Cc3cc(C)c(C)cc3O)CC2)cc1 ZINC000917485763 1052730641 /nfs/dbraw/zinc/73/06/41/1052730641.db2.gz RSRLUOGPZSLCDR-UHFFFAOYSA-N 1 0 324.468 4.030 20 10 DICDRO COc1ccc(C[NH2+]CCCCN(C)c2ccccc2)cc1C ZINC000920180603 1052925340 /nfs/dbraw/zinc/92/53/40/1052925340.db2.gz PNDUJRUTCCFHNO-UHFFFAOYSA-N 1 0 312.457 4.010 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)c2cc3ccccc3o2)c1 ZINC000179665396 1053022268 /nfs/dbraw/zinc/02/22/68/1053022268.db2.gz RTPGRVYYBFKRSE-CYBMUJFWSA-N 1 0 311.381 4.340 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Oc1ccc(N(C)C)cc1 ZINC001227939256 1053030647 /nfs/dbraw/zinc/03/06/47/1053030647.db2.gz QBJONMJUMNGKGR-LAUBAEHRSA-N 1 0 324.468 4.042 20 10 DICDRO Cc1[nH]c2ccccc2c1CC[NH2+]Cc1cc(C)c(C)cc1O ZINC000237860794 1053034287 /nfs/dbraw/zinc/03/42/87/1053034287.db2.gz WRENAOBSTYBECS-UHFFFAOYSA-N 1 0 308.425 4.131 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2csc3ccccc23)c1O ZINC000179989707 1053040688 /nfs/dbraw/zinc/04/06/88/1053040688.db2.gz UOFCVYJSIXMHDS-UHFFFAOYSA-N 1 0 313.422 4.248 20 10 DICDRO CC[N@@H+]1CC[C@H](Oc2ccccc2NN=C2C=CC=CC2=O)C1 ZINC001228418605 1053098338 /nfs/dbraw/zinc/09/83/38/1053098338.db2.gz JSFVJFQOLDBSQD-YISVQYQQSA-N 1 0 311.385 4.281 20 10 DICDRO Cc1ccc(OCCC[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001318346460 1053163665 /nfs/dbraw/zinc/16/36/65/1053163665.db2.gz KLBCVMRAYQPREY-UHFFFAOYSA-N 1 0 324.468 4.154 20 10 DICDRO C[N@H+](Cc1cc(Cl)c(F)c(Cl)c1)Cc1ccccc1O ZINC001236660188 1053179429 /nfs/dbraw/zinc/17/94/29/1053179429.db2.gz WNKQSJASMVXKOP-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)CCC(F)(F)F)cc1F ZINC001319705323 1053263580 /nfs/dbraw/zinc/26/35/80/1053263580.db2.gz IRAZMICCUWUJPP-UHFFFAOYSA-N 1 0 306.347 4.056 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](CCO)C1CCCCC1 ZINC001320124814 1053307271 /nfs/dbraw/zinc/30/72/71/1053307271.db2.gz MOSRYFVXIFNIAF-HYVNUMGLSA-N 1 0 317.473 4.170 20 10 DICDRO Cc1nc(C)c(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC001320119074 1053307905 /nfs/dbraw/zinc/30/79/05/1053307905.db2.gz WJOVYVZFXYUVLX-SMDDNHRTSA-N 1 0 316.470 4.155 20 10 DICDRO Cc1nc(C)c(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC001320119072 1053308172 /nfs/dbraw/zinc/30/81/72/1053308172.db2.gz WJOVYVZFXYUVLX-FZMZJTMJSA-N 1 0 316.470 4.155 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCO[C@@H](CC(C)C)C1 ZINC001320133884 1053309636 /nfs/dbraw/zinc/30/96/36/1053309636.db2.gz RQRPEXJSJRKGFH-QZWWFDLISA-N 1 0 317.473 4.432 20 10 DICDRO Cc1nc(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)sc1C ZINC001320249354 1053317309 /nfs/dbraw/zinc/31/73/09/1053317309.db2.gz YENDCERPGMVGLD-SMDDNHRTSA-N 1 0 316.470 4.155 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC001320260386 1053319900 /nfs/dbraw/zinc/31/99/00/1053319900.db2.gz UTLSQSVBKYDNLF-YRGRVCCFSA-N 1 0 316.470 4.407 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CC1(CCO)CCCCC1 ZINC001320410428 1053331403 /nfs/dbraw/zinc/33/14/03/1053331403.db2.gz BFGMZKPBEUXLGT-HOTGVXAUSA-N 1 0 317.473 4.171 20 10 DICDRO CCc1nc(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)cs1 ZINC001320411282 1053333878 /nfs/dbraw/zinc/33/38/78/1053333878.db2.gz LIYZKSFRVGOGJF-JSGCOSHPSA-N 1 0 316.470 4.100 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC001320425061 1053334009 /nfs/dbraw/zinc/33/40/09/1053334009.db2.gz SLSKXWGGSSOUON-BZPMIXESSA-N 1 0 316.470 4.407 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccc3c[nH]nc32)cc1 ZINC001320474902 1053337842 /nfs/dbraw/zinc/33/78/42/1053337842.db2.gz BENDABAGBABXJX-UHFFFAOYSA-N 1 0 322.456 4.041 20 10 DICDRO CO[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC001320779319 1053361805 /nfs/dbraw/zinc/36/18/05/1053361805.db2.gz MPLGTEDRPAJMCB-ILZDJORESA-N 1 0 316.489 4.285 20 10 DICDRO CO[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC001320779325 1053362412 /nfs/dbraw/zinc/36/24/12/1053362412.db2.gz MPLGTEDRPAJMCB-YVWKXTFCSA-N 1 0 316.489 4.285 20 10 DICDRO COc1ccccc1C1([NH2+][C@H](C)c2ccc(C)cc2O)CCC1 ZINC001321037286 1053385259 /nfs/dbraw/zinc/38/52/59/1053385259.db2.gz JOMVPXCZMPSVIV-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCC(F)(F)C1 ZINC000763524219 1053414797 /nfs/dbraw/zinc/41/47/97/1053414797.db2.gz YUJBOAGCIZURDB-MRXNPFEDSA-N 1 0 303.352 4.337 20 10 DICDRO Clc1ccccc1CC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001321649764 1053426019 /nfs/dbraw/zinc/42/60/19/1053426019.db2.gz FIBGFZZXNYESTQ-UHFFFAOYSA-N 1 0 314.860 4.273 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2cc(C)sc2C)c1O ZINC000182755293 1053510117 /nfs/dbraw/zinc/51/01/17/1053510117.db2.gz RZILQIGFPZTDHY-JTQLQIEISA-N 1 0 321.417 4.263 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCc3ccc(F)cc32)cc1 ZINC001200334175 1053568085 /nfs/dbraw/zinc/56/80/85/1053568085.db2.gz QYVWXTCAHQHZJO-FQEVSTJZSA-N 1 0 312.432 4.449 20 10 DICDRO N#Cc1cccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000070975626 1053591249 /nfs/dbraw/zinc/59/12/49/1053591249.db2.gz VYQZRZWVSGUMJP-UHFFFAOYSA-N 1 0 318.376 4.059 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ncc(C)s2)cc1 ZINC000183193652 1053601644 /nfs/dbraw/zinc/60/16/44/1053601644.db2.gz SWXMCYXAWBGWBZ-UKRRQHHQSA-N 1 0 317.502 4.362 20 10 DICDRO Cc1csc(CCC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC001323828427 1053603189 /nfs/dbraw/zinc/60/31/89/1053603189.db2.gz AQHOTCCUGUZNCH-GXFFZTMASA-N 1 0 320.433 4.067 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](c1cccnc1)C1CC1 ZINC001323828843 1053603287 /nfs/dbraw/zinc/60/32/87/1053603287.db2.gz DOLLRSYQADKRIY-OWDMVUQNSA-N 1 0 308.425 4.385 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CC(C)(C)OC1(C)C ZINC001323829242 1053603399 /nfs/dbraw/zinc/60/33/99/1053603399.db2.gz IVTGPRJMPDDTHK-IPYPFGDCSA-N 1 0 303.446 4.185 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCc1ccc(Cl)nc1 ZINC001323832260 1053604945 /nfs/dbraw/zinc/60/49/45/1053604945.db2.gz UZELXZVCLBBJMW-OCCSQVGLSA-N 1 0 316.832 4.130 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H](C)CCc1ccccc1 ZINC001200378900 1053609634 /nfs/dbraw/zinc/60/96/34/1053609634.db2.gz RJRWAACNNDTSIY-KRWDZBQOSA-N 1 0 310.485 4.420 20 10 DICDRO CC1(C)C[N@H+](Cc2ccc(N3CCCC3)cc2)[C@@H]1c1ccncc1 ZINC001324276597 1053640356 /nfs/dbraw/zinc/64/03/56/1053640356.db2.gz REAWFQNCJYNQLJ-HXUWFJFHSA-N 1 0 321.468 4.265 20 10 DICDRO CCN(CC)[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1ccsc1 ZINC000183415628 1053654883 /nfs/dbraw/zinc/65/48/83/1053654883.db2.gz HZYSFSIMANRCNJ-PBHICJAKSA-N 1 0 318.486 4.187 20 10 DICDRO C[C@H]([NH2+]CCCCOc1ccc(F)cc1)c1ccccc1O ZINC000183411528 1053656033 /nfs/dbraw/zinc/65/60/33/1053656033.db2.gz DUUIDPWPTFATBM-AWEZNQCLSA-N 1 0 303.377 4.041 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1nc(C(C)(C)C)cs1 ZINC001324543384 1053661150 /nfs/dbraw/zinc/66/11/50/1053661150.db2.gz SVGIMROBCSKFHV-DGCLKSJQSA-N 1 0 316.470 4.484 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2O)c(OCC2CC2)c1 ZINC000183550479 1053677050 /nfs/dbraw/zinc/67/70/50/1053677050.db2.gz CBBFUSSFBSKXIJ-OAHLLOKOSA-N 1 0 311.425 4.340 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H](Cc2ccccc2)C2CC2)cc1 ZINC001200473127 1053688032 /nfs/dbraw/zinc/68/80/32/1053688032.db2.gz ZYOPBTVZTQESMA-OUZREKFBSA-N 1 0 320.480 4.377 20 10 DICDRO CCOc1cccc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)c1O ZINC000763625177 1053694732 /nfs/dbraw/zinc/69/47/32/1053694732.db2.gz LBLYMDMLUTTYBG-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001325356428 1053716097 /nfs/dbraw/zinc/71/60/97/1053716097.db2.gz KDRCPGYRANZEEE-ZBFHGGJFSA-N 1 0 311.425 4.356 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001325356426 1053716559 /nfs/dbraw/zinc/71/65/59/1053716559.db2.gz KDRCPGYRANZEEE-GOEBONIOSA-N 1 0 311.425 4.356 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccc(F)cc1 ZINC001325355855 1053716721 /nfs/dbraw/zinc/71/67/21/1053716721.db2.gz GNHVLXHYMIGAAW-GTNSWQLSSA-N 1 0 323.795 4.223 20 10 DICDRO COCC[C@H]([NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C)c1ccco1 ZINC001325357930 1053717036 /nfs/dbraw/zinc/71/70/36/1053717036.db2.gz YAERJLYCBKEKER-KKUMJFAQSA-N 1 0 315.413 4.209 20 10 DICDRO Cc1cccc(C[NH+]2CCC3(CC2)O[C@H](C)c2ccccc23)c1O ZINC001231594603 1053791484 /nfs/dbraw/zinc/79/14/84/1053791484.db2.gz JHDTZEZJSRNSPY-MRXNPFEDSA-N 1 0 323.436 4.283 20 10 DICDRO C[C@@H]1C(=O)CC[N@H+](Cc2c(O)ccc3ccccc32)C12CCCC2 ZINC001231590046 1053793975 /nfs/dbraw/zinc/79/39/75/1053793975.db2.gz ZPZWNDAIGFDBEL-OAHLLOKOSA-N 1 0 323.436 4.269 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1O ZINC001231594696 1053794083 /nfs/dbraw/zinc/79/40/83/1053794083.db2.gz NPYVWKDNXHZUHQ-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCCc1ncccc1C ZINC001326622961 1053795726 /nfs/dbraw/zinc/79/57/26/1053795726.db2.gz NORDZYGPCNQYCA-NVXWUHKLSA-N 1 0 310.441 4.175 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2cccc(Cl)c2F)c1O ZINC001326801648 1053805577 /nfs/dbraw/zinc/80/55/77/1053805577.db2.gz ZOBDVJNZDKOBNT-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COc1cc(C[N@H+](C(C)C)[C@@H](C)c2ccccc2)c(O)cc1O ZINC001231640726 1053813085 /nfs/dbraw/zinc/81/30/85/1053813085.db2.gz UKGMUHJXYSJGMH-AWEZNQCLSA-N 1 0 315.413 4.078 20 10 DICDRO CCCCC[NH+](CCCCC)Cc1cc(OC)c(O)cc1O ZINC001231637400 1053813125 /nfs/dbraw/zinc/81/31/25/1053813125.db2.gz MCDJYDNUCFPJRF-UHFFFAOYSA-N 1 0 309.450 4.289 20 10 DICDRO CCc1ccc(CC[NH2+]Cc2ccc(N(CC)CC)cc2)cc1 ZINC001200648888 1053848617 /nfs/dbraw/zinc/84/86/17/1053848617.db2.gz UGVSEZLISUCACR-UHFFFAOYSA-N 1 0 310.485 4.428 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC2(c3cccc(F)c3)CC2)c(Cl)c1 ZINC001200647799 1053849099 /nfs/dbraw/zinc/84/90/99/1053849099.db2.gz MNDDTYHXDPZUQB-UHFFFAOYSA-N 1 0 319.807 4.315 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c1C ZINC001327614501 1053868452 /nfs/dbraw/zinc/86/84/52/1053868452.db2.gz UWUIDBYIQUSGFF-CZUORRHYSA-N 1 0 311.425 4.356 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1ccc(F)cc1 ZINC001327810308 1053878994 /nfs/dbraw/zinc/87/89/94/1053878994.db2.gz HKFZKTWRWWUYTM-SFHVURJKSA-N 1 0 300.421 4.441 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(C)cc(C)cc2O)cc1 ZINC001231844048 1053888467 /nfs/dbraw/zinc/88/84/67/1053888467.db2.gz FYWWQRGGBGXRPU-IBGZPJMESA-N 1 0 311.425 4.355 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC001231851853 1053890485 /nfs/dbraw/zinc/89/04/85/1053890485.db2.gz IVZVNSZULSIILV-SFHVURJKSA-N 1 0 324.468 4.141 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC001231853692 1053890943 /nfs/dbraw/zinc/89/09/43/1053890943.db2.gz ZXNYFZQJNJFCLY-LJQANCHMSA-N 1 0 310.441 4.098 20 10 DICDRO Cc1cc(O)c(CN2CCc3ccc(F)cc3C2)cc1Cl ZINC001231871117 1053899329 /nfs/dbraw/zinc/89/93/29/1053899329.db2.gz YYNDNGMBTCYTFR-UHFFFAOYSA-N 1 0 305.780 4.051 20 10 DICDRO CCN(Cc1ccccc1O)Cc1c(F)cc(F)cc1Cl ZINC001232103936 1053964583 /nfs/dbraw/zinc/96/45/83/1053964583.db2.gz KQFSRRGCJOIVIC-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO CCC[N@@H+](Cc1ccc(N2CCOCC2)c(Cl)c1)CC(C)C ZINC001232199476 1053986582 /nfs/dbraw/zinc/98/65/82/1053986582.db2.gz ADBNGPRXJFNAOV-UHFFFAOYSA-N 1 0 324.896 4.045 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@H]2C2CCCCC2)cc1Cl ZINC001232262740 1054005462 /nfs/dbraw/zinc/00/54/62/1054005462.db2.gz ODOVAQDLDAJDQQ-HNNXBMFYSA-N 1 0 309.837 4.296 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)c(O)cc2O)cc1C ZINC001232263318 1054005950 /nfs/dbraw/zinc/00/59/50/1054005950.db2.gz MIUOIGQINZNPLD-UHFFFAOYSA-N 1 0 305.805 4.000 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCc3ccccc3[C@@H]2C)cc1Cl ZINC001232267142 1054006631 /nfs/dbraw/zinc/00/66/31/1054006631.db2.gz XPHCGQBDTVVGIY-LBPRGKRZSA-N 1 0 317.816 4.174 20 10 DICDRO COc1cc(C[NH2+]CC(C2CC2)C2CC2)c(O)c(C(C)(C)C)c1 ZINC001200837969 1054024873 /nfs/dbraw/zinc/02/48/73/1054024873.db2.gz JKAVCZRFYKXQNQ-UHFFFAOYSA-N 1 0 317.473 4.224 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c(O)c1 ZINC001330609075 1054042763 /nfs/dbraw/zinc/04/27/63/1054042763.db2.gz XCTIDGRCHVCKBI-GFCCVEGCSA-N 1 0 304.459 4.305 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)[C@H](C)c1ccccc1 ZINC001200854738 1054043586 /nfs/dbraw/zinc/04/35/86/1054043586.db2.gz SNTYWKFUFBFZNN-LSDHHAIUSA-N 1 0 300.421 4.174 20 10 DICDRO C[C@@]1(CC[NH2+]Cc2ccc(N3CCCC3)cc2)C[C@@]1(F)Cl ZINC001332612114 1054123945 /nfs/dbraw/zinc/12/39/45/1054123945.db2.gz 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/nfs/dbraw/zinc/59/91/77/1054599177.db2.gz ZSAMJCJHMBHFDT-JKSUJKDBSA-N 1 0 315.457 4.241 20 10 DICDRO CCS[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000185658302 1054607296 /nfs/dbraw/zinc/60/72/96/1054607296.db2.gz LURPTSDJDHSTAZ-YLQAJVPDSA-N 1 0 309.475 4.116 20 10 DICDRO Cc1ccc(OC(F)F)c(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000185695130 1054619984 /nfs/dbraw/zinc/61/99/84/1054619984.db2.gz LGXDPZHNQQFUFD-CYBMUJFWSA-N 1 0 321.367 4.461 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)CCC1 ZINC000185753096 1054633930 /nfs/dbraw/zinc/63/39/30/1054633930.db2.gz NAGSFUSJKCKOFD-HNNXBMFYSA-N 1 0 313.441 4.403 20 10 DICDRO Oc1c(C[N@@H+]2CCC3(C2)CCOCC3)cccc1-c1ccccc1 ZINC001234996123 1054638013 /nfs/dbraw/zinc/63/80/13/1054638013.db2.gz VHWQXAPCZUVPSI-UHFFFAOYSA-N 1 0 323.436 4.062 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)cccc1-c1ccccc1 ZINC001234993694 1054638461 /nfs/dbraw/zinc/63/84/61/1054638461.db2.gz ALSCVXAROSTNEP-SFHVURJKSA-N 1 0 315.363 4.290 20 10 DICDRO COC[C@@H]1CCCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001235003730 1054640714 /nfs/dbraw/zinc/64/07/14/1054640714.db2.gz XGGAIAXXZWYZQD-SFHVURJKSA-N 1 0 311.425 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@]3(C2)CCCOC3)cccc1-c1ccccc1 ZINC001234997120 1054641103 /nfs/dbraw/zinc/64/11/03/1054641103.db2.gz SWJODDPAMWDVPY-OAQYLSRUSA-N 1 0 323.436 4.062 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccccc1-c1ccncc1 ZINC001235620550 1054756219 /nfs/dbraw/zinc/75/62/19/1054756219.db2.gz LEUNLCURJSXLAT-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO CC(C)(C)c1ccc(C[NH+]2CCC(OC3CCC3)CC2)c(O)c1 ZINC001235674969 1054769856 /nfs/dbraw/zinc/76/98/56/1054769856.db2.gz JXAVGQKAQSHOFF-UHFFFAOYSA-N 1 0 317.473 4.223 20 10 DICDRO CC(C)(C)c1ccc(C[NH+]2CCC(C(F)(F)F)CC2)c(O)c1 ZINC001235676935 1054770246 /nfs/dbraw/zinc/77/02/46/1054770246.db2.gz XSVSVMKRRDPTBK-UHFFFAOYSA-N 1 0 315.379 4.464 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c(O)c1 ZINC001235683543 1054774958 /nfs/dbraw/zinc/77/49/58/1054774958.db2.gz GYCANGQDLCAYFV-ZDUSSCGKSA-N 1 0 301.352 4.074 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](c3cccnc3)C2)c(O)c1 ZINC001235685408 1054777594 /nfs/dbraw/zinc/77/75/94/1054777594.db2.gz PSVIDWACMVFDIG-MRXNPFEDSA-N 1 0 310.441 4.074 20 10 DICDRO Nc1ccc(C[N@@H+]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)cc1 ZINC001235919492 1054849521 /nfs/dbraw/zinc/84/95/21/1054849521.db2.gz WSWLKQYSCRVWKE-OAHLLOKOSA-N 1 0 320.358 4.277 20 10 DICDRO CC1(C)OC2(CC[NH+](Cc3ccc(N)cc3)CC2)c2ccccc21 ZINC001235947774 1054864683 /nfs/dbraw/zinc/86/46/83/1054864683.db2.gz GLLRFSOUKNVGSU-UHFFFAOYSA-N 1 0 322.452 4.025 20 10 DICDRO Nc1ccc(C[NH+]2CCC(c3ccccc3Cl)CC2)cc1 ZINC001236072666 1054926970 /nfs/dbraw/zinc/92/69/70/1054926970.db2.gz VFNLNYCIQACBLW-UHFFFAOYSA-N 1 0 300.833 4.302 20 10 DICDRO Nc1ccc(C[NH+]2CCC(Cc3ccc(F)cc3F)CC2)cc1 ZINC001236084671 1054934409 /nfs/dbraw/zinc/93/44/09/1054934409.db2.gz DLFVEMNDCBMKOA-UHFFFAOYSA-N 1 0 316.395 4.002 20 10 DICDRO COc1cc(C)cc(C[NH+]2CCC(c3ccsc3)CC2)c1O ZINC000186139998 1054987647 /nfs/dbraw/zinc/98/76/47/1054987647.db2.gz WNAVBOJDBAWRDK-UHFFFAOYSA-N 1 0 317.454 4.150 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2c[nH]c3ccccc32)c1 ZINC001236189685 1054987526 /nfs/dbraw/zinc/98/75/26/1054987526.db2.gz BZNBOJQBRKMGDH-LJQANCHMSA-N 1 0 322.408 4.219 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2c[nH]c3ccccc32)c1O ZINC001236190243 1054988132 /nfs/dbraw/zinc/98/81/32/1054988132.db2.gz IIMSEYUWTOMYFF-SFHVURJKSA-N 1 0 322.408 4.225 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC(c3ccc(N)cc3)CC2)c(O)c1 ZINC001236335754 1055063462 /nfs/dbraw/zinc/06/34/62/1055063462.db2.gz BTDWAVXRFDNZPZ-UHFFFAOYSA-N 1 0 324.468 4.477 20 10 DICDRO CCC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000764437683 1055188041 /nfs/dbraw/zinc/18/80/41/1055188041.db2.gz UUQHIVWIXQZVQW-UONOGXRCSA-N 1 0 310.869 4.016 20 10 DICDRO [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(Cl)c2[O-])C2CCCC2)CC1 ZINC001236571643 1055193063 /nfs/dbraw/zinc/19/30/63/1055193063.db2.gz LGVPZNVXOQUTGN-KOMQPUFPSA-N 1 0 322.880 4.060 20 10 DICDRO CC(C)CC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000764502540 1055199382 /nfs/dbraw/zinc/19/93/82/1055199382.db2.gz GQUGLASWPFIEPU-CVEARBPZSA-N 1 0 322.468 4.138 20 10 DICDRO Cc1cc(Br)c([O-])c(C[N@@H+]2CCCC3(CCC3)C2)c1 ZINC001236669562 1055222316 /nfs/dbraw/zinc/22/23/16/1055222316.db2.gz LECGXFJBJYACSY-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO CCC[N@@H+](Cc1cc(C)cc(Br)c1[O-])CC1CC1 ZINC001236673803 1055222887 /nfs/dbraw/zinc/22/28/87/1055222887.db2.gz ORFBRTVVENGSOK-UHFFFAOYSA-N 1 0 312.251 4.085 20 10 DICDRO CC(C)COCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000764692173 1055233526 /nfs/dbraw/zinc/23/35/26/1055233526.db2.gz MNDHPIJPJJUSPV-GOSISDBHSA-N 1 0 318.505 4.390 20 10 DICDRO Cc1c(F)ccc(CN2CCc3cccc(O)c3C2)c1Cl ZINC001236717031 1055240425 /nfs/dbraw/zinc/24/04/25/1055240425.db2.gz BFHIZPRJBRVYGG-UHFFFAOYSA-N 1 0 305.780 4.051 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001236778828 1055255652 /nfs/dbraw/zinc/25/56/52/1055255652.db2.gz MPGBZXOLMPDBAT-HDICACEKSA-N 1 0 323.436 4.203 20 10 DICDRO C[C@@H]1CCCC[N@@H+]1Cc1cc(OCc2ccccc2)ccc1O ZINC001236789318 1055257321 /nfs/dbraw/zinc/25/73/21/1055257321.db2.gz OCPWNIRJRSJZKS-MRXNPFEDSA-N 1 0 311.425 4.346 20 10 DICDRO CCc1ccc(C[N@H+](C)CCCc2cccc(OC)c2)c(O)c1 ZINC001236791520 1055260944 /nfs/dbraw/zinc/26/09/44/1055260944.db2.gz IDXFIFMTMXHVNA-UHFFFAOYSA-N 1 0 313.441 4.028 20 10 DICDRO CC[C@H]1CCCC[C@@H]1[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000764810586 1055266100 /nfs/dbraw/zinc/26/61/00/1055266100.db2.gz NSWFMYBXJGATIO-JXFKEZNVSA-N 1 0 316.489 4.222 20 10 DICDRO CC(C)[N@H+](CCCCCO)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236803064 1055268954 /nfs/dbraw/zinc/26/89/54/1055268954.db2.gz MJBICYWOLQRIKG-UHFFFAOYSA-N 1 0 320.260 4.072 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)c([O-])c1Cl ZINC001236813247 1055271309 /nfs/dbraw/zinc/27/13/09/1055271309.db2.gz KTLXJIZQDHUHTC-LBPRGKRZSA-N 1 0 323.845 4.453 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2)c([O-])c1Cl ZINC001236813892 1055273013 /nfs/dbraw/zinc/27/30/13/1055273013.db2.gz RCWRJNCSANCZBI-HNNXBMFYSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccc(C[N@H+](C)[C@H]2CCc3ccccc32)c([O-])c1Cl ZINC001236818660 1055273482 /nfs/dbraw/zinc/27/34/82/1055273482.db2.gz QFKVBTOJLDEBPC-HNNXBMFYSA-N 1 0 317.816 4.174 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC001236830425 1055280836 /nfs/dbraw/zinc/28/08/36/1055280836.db2.gz AHQJJUNSCMJQST-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO Oc1cc2ccccc2cc1C[N@H+]1C[C@@H]2CC(F)(F)C[C@@H]2C1 ZINC001236826489 1055281132 /nfs/dbraw/zinc/28/11/32/1055281132.db2.gz LFZXIANKHSIKAT-IYBDPMFKSA-N 1 0 303.352 4.023 20 10 DICDRO C[N@H+](Cc1nc2ccccc2o1)Cc1cc2ccccc2cc1O ZINC001236832687 1055285878 /nfs/dbraw/zinc/28/58/78/1055285878.db2.gz KDCBJQIYOJQHBC-UHFFFAOYSA-N 1 0 318.376 4.319 20 10 DICDRO Oc1cc2ccccc2cc1C[NH+]1CCC(c2ccncc2)CC1 ZINC001236842063 1055286491 /nfs/dbraw/zinc/28/64/91/1055286491.db2.gz SVIMXIJQFZLBLG-UHFFFAOYSA-N 1 0 318.420 4.320 20 10 DICDRO C[N@H+](CCCc1ccncc1)Cc1ccc(N2CCCCC2)cc1 ZINC000764954414 1055302782 /nfs/dbraw/zinc/30/27/82/1055302782.db2.gz KOJZWGRAJYFFNH-UHFFFAOYSA-N 1 0 323.484 4.137 20 10 DICDRO C[N@H+](Cc1ccc(-c2ccccc2F)nc1)Cc1ccccc1O ZINC001236993015 1055327883 /nfs/dbraw/zinc/32/78/83/1055327883.db2.gz MORRDQJARHBRCN-UHFFFAOYSA-N 1 0 322.383 4.225 20 10 DICDRO Cc1cc(C[NH+]2CCC(C(F)F)CC2)c(O)c(C(C)(C)C)c1 ZINC000765148116 1055334400 /nfs/dbraw/zinc/33/44/00/1055334400.db2.gz TWGDEAIHCIWUIQ-UHFFFAOYSA-N 1 0 311.416 4.475 20 10 DICDRO COc1ccc(CC[N@H+](C)Cc2ccc(C(C)C)cc2O)cc1 ZINC001237048420 1055349025 /nfs/dbraw/zinc/34/90/25/1055349025.db2.gz FXUBKKDLWNJJKV-UHFFFAOYSA-N 1 0 313.441 4.199 20 10 DICDRO CC(C)c1ccc(C[N@H+](C2CCC2)C2CCOCC2)c(O)c1 ZINC001237052111 1055350522 /nfs/dbraw/zinc/35/05/22/1055350522.db2.gz UDYLLZTXHNUTEB-UHFFFAOYSA-N 1 0 303.446 4.049 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1ccc(C(C)C)cc1O)CC2 ZINC001237045358 1055350796 /nfs/dbraw/zinc/35/07/96/1055350796.db2.gz JMAKJQORYQQOAG-UHFFFAOYSA-N 1 0 311.425 4.083 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCc3ccccc3[C@H]2CC)c(O)c1 ZINC001237047188 1055350869 /nfs/dbraw/zinc/35/08/69/1055350869.db2.gz UKHWZXWIDUEXCP-LJQANCHMSA-N 1 0 311.425 4.300 20 10 DICDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000765312225 1055360919 /nfs/dbraw/zinc/36/09/19/1055360919.db2.gz ALVPSZYFBOFNQK-RRFJBIMHSA-N 1 0 324.896 4.262 20 10 DICDRO COC[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765328333 1055361851 /nfs/dbraw/zinc/36/18/51/1055361851.db2.gz DXVFPRQFDOSLAE-SJORKVTESA-N 1 0 304.478 4.000 20 10 DICDRO COCC[C@H]1CCCC[N@@H+]1Cc1c([O-])ccc(Cl)c1Cl ZINC001237080493 1055363845 /nfs/dbraw/zinc/36/38/45/1055363845.db2.gz DLOMTVJGTOOVET-LLVKDONJSA-N 1 0 318.244 4.090 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1COc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000765333860 1055364538 /nfs/dbraw/zinc/36/45/38/1055364538.db2.gz LYTPGUZGXFLMLJ-OXJNMPFZSA-N 1 0 324.468 4.045 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765343823 1055366424 /nfs/dbraw/zinc/36/64/24/1055366424.db2.gz NGOAYYBXIYZJQW-NVXWUHKLSA-N 1 0 320.452 4.036 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[N@@H+]1CCCC2(CCC2)C1 ZINC001237115498 1055374018 /nfs/dbraw/zinc/37/40/18/1055374018.db2.gz UMHQNJGRKXCCNK-UHFFFAOYSA-N 1 0 315.335 4.057 20 10 DICDRO C[C@]1(F)CCCCN(Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120067 1055374503 /nfs/dbraw/zinc/37/45/03/1055374503.db2.gz LRMOTPLLLMKDFF-AWEZNQCLSA-N 1 0 321.314 4.005 20 10 DICDRO CCCOc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000765379154 1055375083 /nfs/dbraw/zinc/37/50/83/1055375083.db2.gz DLGFETPFKPARMS-INIZCTEOSA-N 1 0 312.457 4.392 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001237129505 1055378788 /nfs/dbraw/zinc/37/87/88/1055378788.db2.gz HVXKWEYYYIEXOG-TXEJJXNPSA-N 1 0 317.791 4.271 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCc2ccsc2C1 ZINC001237139715 1055385310 /nfs/dbraw/zinc/38/53/10/1055385310.db2.gz OGPLRRFMNJNFLL-UHFFFAOYSA-N 1 0 313.344 4.031 20 10 DICDRO CC(C)C[C@@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765474977 1055400684 /nfs/dbraw/zinc/40/06/84/1055400684.db2.gz SQAMUHZHKFQLJK-YLJYHZDGSA-N 1 0 318.505 4.125 20 10 DICDRO CC[N@H+](Cc1ccc(C(F)F)c(OC)c1)Cc1ccccc1O ZINC001237275374 1055413634 /nfs/dbraw/zinc/41/36/34/1055413634.db2.gz AAMPJYKZXGAWBO-UHFFFAOYSA-N 1 0 321.367 4.361 20 10 DICDRO C[C@@H]([NH2+][C@@H](CO)C1CCCCC1)c1ccc2ccccc2c1O ZINC000386213625 1055434679 /nfs/dbraw/zinc/43/46/79/1055434679.db2.gz UIGLGKWTAAOFOZ-KUHUBIRLSA-N 1 0 313.441 4.137 20 10 DICDRO Cc1cccc(O)c1C[N@H+](Cc1ccccc1)Cc1cccnc1 ZINC001237490025 1055458240 /nfs/dbraw/zinc/45/82/40/1055458240.db2.gz PEIDJASXUYQKJN-UHFFFAOYSA-N 1 0 318.420 4.298 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC2(CCc3ccccc32)CC1 ZINC001237484634 1055459803 /nfs/dbraw/zinc/45/98/03/1055459803.db2.gz GMBDZBWWRURYIU-UHFFFAOYSA-N 1 0 307.437 4.181 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001237620111 1055484914 /nfs/dbraw/zinc/48/49/14/1055484914.db2.gz JDXDGSPPVBRCAH-CQSZACIVSA-N 1 0 319.807 4.249 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001237621974 1055485956 /nfs/dbraw/zinc/48/59/56/1055485956.db2.gz KCEXADBBKHGVJH-LBPRGKRZSA-N 1 0 323.770 4.313 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001237621972 1055486620 /nfs/dbraw/zinc/48/66/20/1055486620.db2.gz KCEXADBBKHGVJH-GFCCVEGCSA-N 1 0 323.770 4.313 20 10 DICDRO C[N@H+](Cc1ccncc1)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237640945 1055491797 /nfs/dbraw/zinc/49/17/97/1055491797.db2.gz IJXHMOMWHWAVPG-UHFFFAOYSA-N 1 0 322.383 4.225 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1O ZINC001237686512 1055504631 /nfs/dbraw/zinc/50/46/31/1055504631.db2.gz JDKDLBUDHXYUPK-KRWDZBQOSA-N 1 0 316.832 4.476 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(Cl)ccc1F ZINC001620884504 1055509894 /nfs/dbraw/zinc/50/98/94/1055509894.db2.gz ILDQTAGCJLSOFL-LLVKDONJSA-N 1 0 305.780 4.265 20 10 DICDRO COc1ccc(C)c(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001237713242 1055511637 /nfs/dbraw/zinc/51/16/37/1055511637.db2.gz IZNKELGECCRBAM-UHFFFAOYSA-N 1 0 324.468 4.236 20 10 DICDRO Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765610072 1055512938 /nfs/dbraw/zinc/51/29/38/1055512938.db2.gz UQVABPDWQVVXOQ-LBPRGKRZSA-N 1 0 316.470 4.361 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2nc3ccccc3s2)cc1C ZINC000765623882 1055523351 /nfs/dbraw/zinc/52/33/51/1055523351.db2.gz POEHWWBODZQTRK-CYBMUJFWSA-N 1 0 312.438 4.464 20 10 DICDRO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)CCCO3)CCC2 ZINC001620925996 1055545361 /nfs/dbraw/zinc/54/53/61/1055545361.db2.gz CBXRWUPLXROKNY-IBGZPJMESA-N 1 0 311.400 4.318 20 10 DICDRO C[C@@]1(CC[NH2+]Cc2c(O)cccc2Cl)CC1(Cl)Cl ZINC001620938042 1055551033 /nfs/dbraw/zinc/55/10/33/1055551033.db2.gz KFYUSAMAHAAENL-GFCCVEGCSA-N 1 0 308.636 4.109 20 10 DICDRO CCCOc1cc(F)ccc1C[N@H+](CC)Cc1ccccc1O ZINC001237911403 1055558828 /nfs/dbraw/zinc/55/88/28/1055558828.db2.gz UWQOSBCREYRYPR-UHFFFAOYSA-N 1 0 317.404 4.342 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(F)c(Cl)cc2[O-])cc1 ZINC001237948293 1055563196 /nfs/dbraw/zinc/56/31/96/1055563196.db2.gz CDUZGZHLLBNOGS-LLVKDONJSA-N 1 0 323.795 4.386 20 10 DICDRO C[N@H+](CC/C=C/c1cccnc1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237941231 1055564043 /nfs/dbraw/zinc/56/40/43/1055564043.db2.gz SLPWHPNYFMXFCC-GORDUTHDSA-N 1 0 320.795 4.115 20 10 DICDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001237949263 1055564573 /nfs/dbraw/zinc/56/45/73/1055564573.db2.gz JEESECSSVZBFTR-LBPRGKRZSA-N 1 0 323.770 4.313 20 10 DICDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CCCc2ccccc2C1 ZINC001237938075 1055564734 /nfs/dbraw/zinc/56/47/34/1055564734.db2.gz XLHMFRALEJISKO-UHFFFAOYSA-N 1 0 305.780 4.133 20 10 DICDRO [O-]c1cc(Cl)c(F)cc1C[N@H+](Cc1ccccc1)C1CC1 ZINC001237948783 1055565106 /nfs/dbraw/zinc/56/51/06/1055565106.db2.gz HZFCJWMYLDIYJW-UHFFFAOYSA-N 1 0 305.780 4.349 20 10 DICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237941123 1055565359 /nfs/dbraw/zinc/56/53/59/1055565359.db2.gz PZDCYYYNDOJSCM-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C[C@H](c1ccccc1)C1CC1 ZINC001620951178 1055567000 /nfs/dbraw/zinc/56/70/00/1055567000.db2.gz BHMBIUQSDOLSBR-OAHLLOKOSA-N 1 0 301.817 4.329 20 10 DICDRO CC[C@H]1CCCC[C@@H]1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001620953434 1055573355 /nfs/dbraw/zinc/57/33/55/1055573355.db2.gz LQARUYUGJXXNDN-UONOGXRCSA-N 1 0 310.432 4.337 20 10 DICDRO Cc1cc(F)cc(C[N@H+](C)CCc2ccccc2Cl)c1O ZINC001238063552 1055597911 /nfs/dbraw/zinc/59/79/11/1055597911.db2.gz YMSHJBOBFGGUIH-UHFFFAOYSA-N 1 0 307.796 4.168 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001620964520 1055662712 /nfs/dbraw/zinc/66/27/12/1055662712.db2.gz VBIMVOGGXLAIOC-LXXRFIIISA-N 1 0 324.468 4.434 20 10 DICDRO Cc1ccc(OC(C)C)cc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001238478921 1055668661 /nfs/dbraw/zinc/66/86/61/1055668661.db2.gz CCGZWBNATNHDMV-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(F)c(C3CC3)c2)cc1 ZINC001238518080 1055679042 /nfs/dbraw/zinc/67/90/42/1055679042.db2.gz XMIWQGVGKPKKOO-UHFFFAOYSA-N 1 0 312.432 4.401 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)cc1F ZINC001620974609 1055816342 /nfs/dbraw/zinc/81/63/42/1055816342.db2.gz RPIQIBQPPAQHSH-MRXNPFEDSA-N 1 0 314.448 4.229 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2CCC(C3CCC3)CC2)cc1F ZINC001620756184 1055928174 /nfs/dbraw/zinc/92/81/74/1055928174.db2.gz DORRQDAEZVWCON-UHFFFAOYSA-N 1 0 304.453 4.340 20 10 DICDRO COc1ccc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)cc1C ZINC001649085703 1055947074 /nfs/dbraw/zinc/94/70/74/1055947074.db2.gz XVCQXSPNBFZBCX-NRFANRHFSA-N 1 0 318.420 4.278 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C/C=C\c2ccccc2)cc1F ZINC001620786118 1055958939 /nfs/dbraw/zinc/95/89/39/1055958939.db2.gz YQSNEBIDHYCBPC-FLIBITNWSA-N 1 0 312.432 4.475 20 10 DICDRO C[C@@H]1CCCC[C@@H]1CC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001620796535 1055975463 /nfs/dbraw/zinc/97/54/63/1055975463.db2.gz MZMWXNHXOJKJDX-ZIAGYGMSSA-N 1 0 310.432 4.337 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H](C)Oc1ccc(C)cc1 ZINC001620815196 1056008209 /nfs/dbraw/zinc/00/82/09/1056008209.db2.gz PBDIFQFKLXIGHM-MRXNPFEDSA-N 1 0 322.452 4.352 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cccc(F)c1F ZINC000090963524 1056125450 /nfs/dbraw/zinc/12/54/50/1056125450.db2.gz ICRCKRBBYVNIGW-QWHCGFSZSA-N 1 0 304.384 4.443 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCC[C@H](Oc2ccc(Cl)cc2)C1 ZINC001203558685 1056137072 /nfs/dbraw/zinc/13/70/72/1056137072.db2.gz VJDBTJRYZZFWNN-KRWDZBQOSA-N 1 0 317.816 4.089 20 10 DICDRO CCC(CC)[C@@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765921849 1056484694 /nfs/dbraw/zinc/48/46/94/1056484694.db2.gz MKNVFRLHHDPWRA-JXFKEZNVSA-N 1 0 318.505 4.125 20 10 DICDRO CCC[C@](C)(O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765941262 1056530965 /nfs/dbraw/zinc/53/09/65/1056530965.db2.gz GHOWDWMDOGTXKW-BEFAXECRSA-N 1 0 322.468 4.018 20 10 DICDRO C[C@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1cc(Cl)ccc1O ZINC000756369208 1056572420 /nfs/dbraw/zinc/57/24/20/1056572420.db2.gz BBZRPBURJPVIBV-NHYWBVRUSA-N 1 0 324.877 4.061 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@H](C)C[C@@H]3C)CC2)cc1 ZINC000765959846 1056656379 /nfs/dbraw/zinc/65/63/79/1056656379.db2.gz SIDVQZWANYQQOQ-TWOQFEAHSA-N 1 0 316.489 4.078 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)c1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000186568502 1057051529 /nfs/dbraw/zinc/05/15/29/1057051529.db2.gz AWHHJRZPHAHDGL-SUMWQHHRSA-N 1 0 317.502 4.362 20 10 DICDRO c1cnc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000922885650 1057083341 /nfs/dbraw/zinc/08/33/41/1057083341.db2.gz SCLLWSLNRJMOJF-HXUWFJFHSA-N 1 0 321.468 4.239 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000282420265 1057103106 /nfs/dbraw/zinc/10/31/06/1057103106.db2.gz CQUGJWTYZODIFZ-SNVBAGLBSA-N 1 0 311.212 4.253 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2c1cccc2Cl ZINC000766028832 1057127285 /nfs/dbraw/zinc/12/72/85/1057127285.db2.gz GZCKHZDPPVOATF-IBGZPJMESA-N 1 0 314.860 4.492 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccc2c(c1)CCO2 ZINC000766028763 1057127303 /nfs/dbraw/zinc/12/73/03/1057127303.db2.gz DZHQWPNAMJRTRN-HXUWFJFHSA-N 1 0 324.468 4.237 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1cccc(OC)c1 ZINC000766030774 1057131569 /nfs/dbraw/zinc/13/15/69/1057131569.db2.gz XKVRKTSZNRTIDJ-HXUWFJFHSA-N 1 0 312.457 4.311 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC000766029925 1057132817 /nfs/dbraw/zinc/13/28/17/1057132817.db2.gz QAOPGOFPZYKRGV-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO Cc1cc(Br)cc([C@@H](C)[NH2+]C/C=C\C2CC2)c1O ZINC001117749823 1057160786 /nfs/dbraw/zinc/16/07/86/1057160786.db2.gz CEGVITSKOSAOFU-DLRQAJBASA-N 1 0 310.235 4.080 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccccc2SC)c1O ZINC000282514274 1057190353 /nfs/dbraw/zinc/19/03/53/1057190353.db2.gz XSMIROPBBHHGQE-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO C[C@H]1Cc2ccccc2[C@H]1[NH2+]CCCSc1nccs1 ZINC000766072761 1057285817 /nfs/dbraw/zinc/28/58/17/1057285817.db2.gz MPISEVWQFJDBBV-WFASDCNBSA-N 1 0 304.484 4.148 20 10 DICDRO Fc1cccc2c1CC[C@@H]2[NH2+]CCCSc1nccs1 ZINC000766074251 1057286106 /nfs/dbraw/zinc/28/61/06/1057286106.db2.gz VGJBZXKBNMPGFY-AWEZNQCLSA-N 1 0 308.447 4.042 20 10 DICDRO CSC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766082159 1057299699 /nfs/dbraw/zinc/29/96/99/1057299699.db2.gz BXNQYHLWZONDMR-HOTGVXAUSA-N 1 0 306.519 4.469 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)C3CCCCC3)CC2)cc1 ZINC000766153141 1057513729 /nfs/dbraw/zinc/51/37/29/1057513729.db2.gz DODZBCALJGISHO-MRXNPFEDSA-N 1 0 316.489 4.222 20 10 DICDRO CC(C)(C)CC[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000725848242 1057615086 /nfs/dbraw/zinc/61/50/86/1057615086.db2.gz MOEMAJPZYFMFIE-UHFFFAOYSA-N 1 0 319.449 4.111 20 10 DICDRO c1cc2c(cccc2C[NH2+]Cc2ccc(N3CCCCC3)cc2)[nH]1 ZINC000727469470 1057655713 /nfs/dbraw/zinc/65/57/13/1057655713.db2.gz XALCDVFAWZMCKS-UHFFFAOYSA-N 1 0 319.452 4.448 20 10 DICDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000727645351 1057662221 /nfs/dbraw/zinc/66/22/21/1057662221.db2.gz XLMKTYTVAMSORK-HXUWFJFHSA-N 1 0 306.453 4.155 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(C)c(C)cc1O ZINC000727826702 1057675686 /nfs/dbraw/zinc/67/56/86/1057675686.db2.gz XUZMFXBPQLQCID-SFHVURJKSA-N 1 0 311.425 4.355 20 10 DICDRO CC[C@@](C)(O)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000732229228 1057771188 /nfs/dbraw/zinc/77/11/88/1057771188.db2.gz JIBHEIDMHBZMLN-HXUWFJFHSA-N 1 0 321.505 4.238 20 10 DICDRO Cc1cc(CC[NH2+][C@H](C)c2cccnc2)c(C)n1-c1ccccc1 ZINC000732916567 1057790036 /nfs/dbraw/zinc/79/00/36/1057790036.db2.gz PPRFGKKYYRIIFS-QGZVFWFLSA-N 1 0 319.452 4.382 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1Cl ZINC000732919427 1057790654 /nfs/dbraw/zinc/79/06/54/1057790654.db2.gz GCHZWQLMOVJYJO-LBPRGKRZSA-N 1 0 317.816 4.134 20 10 DICDRO CCc1cc(C[N@@H+]2CCC[C@H](COC)C2)c(O)c(C(C)(C)C)c1 ZINC000733185124 1057806096 /nfs/dbraw/zinc/80/60/96/1057806096.db2.gz QVEYQSICIPMCTE-INIZCTEOSA-N 1 0 319.489 4.111 20 10 DICDRO CC(C)Oc1ccc(CC[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000733323934 1057812261 /nfs/dbraw/zinc/81/22/61/1057812261.db2.gz AKJHNEMCJOUPAA-UHFFFAOYSA-N 1 0 319.832 4.165 20 10 DICDRO CC(C)Oc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000733325023 1057812782 /nfs/dbraw/zinc/81/27/82/1057812782.db2.gz SFZMLCIDENYRHC-UHFFFAOYSA-N 1 0 305.805 4.123 20 10 DICDRO Cc1ccc(OCCCC[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000733324703 1057813191 /nfs/dbraw/zinc/81/31/91/1057813191.db2.gz UZWJYDBXIMMTLO-UHFFFAOYSA-N 1 0 319.832 4.303 20 10 DICDRO Cc1[nH]c2ccc(C[NH2+]Cc3c(O)cccc3Cl)cc2c1C ZINC000733325637 1057813328 /nfs/dbraw/zinc/81/33/28/1057813328.db2.gz OLSBMZQQTQLVBI-UHFFFAOYSA-N 1 0 314.816 4.434 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]CCc1ccc(F)cc1Cl ZINC000733330349 1057813996 /nfs/dbraw/zinc/81/39/96/1057813996.db2.gz USBPORURNRCGMW-UHFFFAOYSA-N 1 0 314.187 4.170 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)ccc1OC ZINC000733327967 1057814025 /nfs/dbraw/zinc/81/40/25/1057814025.db2.gz NSSPBKXGLSHGTJ-HDMKZQKVSA-N 1 0 305.462 4.146 20 10 DICDRO C[C@H](CC(C)(C)SCc1ccco1)[NH2+]Cc1ccc(N)cc1 ZINC001246170952 1058714857 /nfs/dbraw/zinc/71/48/57/1058714857.db2.gz PGYYPVQQMAEBKF-CQSZACIVSA-N 1 0 318.486 4.442 20 10 DICDRO C[C@@H](CC(C)(C)SCc1ccco1)[NH2+]Cc1ccc(N)cc1 ZINC001246170951 1058714880 /nfs/dbraw/zinc/71/48/80/1058714880.db2.gz PGYYPVQQMAEBKF-AWEZNQCLSA-N 1 0 318.486 4.442 20 10 DICDRO CCc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC001559492188 1059270627 /nfs/dbraw/zinc/27/06/27/1059270627.db2.gz HQEOLMQQLKMXDO-UHFFFAOYSA-N 1 0 308.469 4.480 20 10 DICDRO CC/C=C/CC[N@H+](CC)Cc1cc(Br)ccc1O ZINC001559569443 1059401432 /nfs/dbraw/zinc/40/14/32/1059401432.db2.gz YSPOROSJFGEJSM-AATRIKPKSA-N 1 0 312.251 4.333 20 10 DICDRO CCCCC[N@H+](CC)Cc1cc(Br)ccc1O ZINC001559569168 1059397434 /nfs/dbraw/zinc/39/74/34/1059397434.db2.gz QIGPOIZSTUWFMD-UHFFFAOYSA-N 1 0 300.240 4.167 20 10 DICDRO CCOc1ccc(N2CC[NH+](C[C@H]3CCC[C@H](C)C3)CC2)cc1 ZINC001559667086 1059495792 /nfs/dbraw/zinc/49/57/92/1059495792.db2.gz KKRZBPFCLPMMQX-ROUUACIJSA-N 1 0 316.489 4.034 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)cc1 ZINC001559741185 1059574220 /nfs/dbraw/zinc/57/42/20/1059574220.db2.gz JRGDKDMZFGKICK-HIFRSBDPSA-N 1 0 314.395 4.306 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H]2CCC(C)(C)C[C@@H]2C)c1O ZINC001559775339 1059612309 /nfs/dbraw/zinc/61/23/09/1059612309.db2.gz JSLKWZXBGQPQQI-MEDUHNTESA-N 1 0 307.409 4.038 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)CC[C@@H]2CCC[C@@H](C)C2)cc1 ZINC001559966972 1059776913 /nfs/dbraw/zinc/77/69/13/1059776913.db2.gz PWGRNLFVJXYTSB-MSOLQXFVSA-N 1 0 318.505 4.280 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCc3ccsc3[C@H]2C)cc1 ZINC001560112984 1059920450 /nfs/dbraw/zinc/92/04/50/1059920450.db2.gz UNSPAWGTHXDNJR-CQSZACIVSA-N 1 0 300.471 4.324 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCC(C)(C)C)c(C(F)(F)F)c1 ZINC001560262824 1060032167 /nfs/dbraw/zinc/03/21/67/1060032167.db2.gz QHPBMXHPUFEUOY-UHFFFAOYSA-N 1 0 302.384 4.297 20 10 DICDRO C[N@H+](Cc1cncs1)Cc1cc(Cl)c(C(C)(C)C)cc1O ZINC001248884900 1060038086 /nfs/dbraw/zinc/03/80/86/1060038086.db2.gz FOGDBSWZPXEKEU-UHFFFAOYSA-N 1 0 324.877 4.432 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(Cl)c2N)cc1 ZINC001560274598 1060050061 /nfs/dbraw/zinc/05/00/61/1060050061.db2.gz MYTOLLJWNFUGLJ-UHFFFAOYSA-N 1 0 317.864 4.058 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC001560283140 1060059716 /nfs/dbraw/zinc/05/97/16/1060059716.db2.gz ZOMSFRFPUDBUAX-MWWKQMNYSA-N 1 0 310.441 4.125 20 10 DICDRO CC(C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC001560296889 1060080738 /nfs/dbraw/zinc/08/07/38/1060080738.db2.gz NAXCTZJPAYZWFU-MJGOQNOKSA-N 1 0 300.490 4.373 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3cscc3Cl)ccc21 ZINC001560296780 1060081296 /nfs/dbraw/zinc/08/12/96/1060081296.db2.gz HVCVFLHCKONWKL-UHFFFAOYSA-N 1 0 306.862 4.074 20 10 DICDRO CCCc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC001560298641 1060083803 /nfs/dbraw/zinc/08/38/03/1060083803.db2.gz NOEYPMLANXGHAX-UHFFFAOYSA-N 1 0 306.450 4.196 20 10 DICDRO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001560300906 1060085455 /nfs/dbraw/zinc/08/54/55/1060085455.db2.gz ALVMQMGWMDDSQJ-ATZDWAIDSA-N 1 0 301.474 4.420 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccc(F)cc2F)cc1 ZINC001560332735 1060117902 /nfs/dbraw/zinc/11/79/02/1060117902.db2.gz VTYAMKMHANWXOV-UHFFFAOYSA-N 1 0 318.411 4.143 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001560379799 1060165403 /nfs/dbraw/zinc/16/54/03/1060165403.db2.gz APNUABITPURZET-PRPIBZDOSA-N 1 0 322.452 4.052 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CCC1(F)F ZINC001249224250 1060193058 /nfs/dbraw/zinc/19/30/58/1060193058.db2.gz WEUWBBROWDZWLI-LBPRGKRZSA-N 1 0 323.383 4.054 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCC34CCCCC4)ccc2O1 ZINC001249230959 1060197102 /nfs/dbraw/zinc/19/71/02/1060197102.db2.gz YLOIUPVMWSBIBP-UHFFFAOYSA-N 1 0 313.441 4.485 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2sccc2C)cc1F ZINC001560417127 1060201917 /nfs/dbraw/zinc/20/19/17/1060201917.db2.gz SCIPUGDLKIKQNQ-UHFFFAOYSA-N 1 0 320.477 4.374 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[NH+]3CC4CCC(CC4)C3)ccc2O1 ZINC001249259416 1060204214 /nfs/dbraw/zinc/20/42/14/1060204214.db2.gz XRADAGUINDTEJF-UHFFFAOYSA-N 1 0 313.441 4.198 20 10 DICDRO Fc1cccc([C@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)c1 ZINC001560463238 1060254373 /nfs/dbraw/zinc/25/43/73/1060254373.db2.gz KOOAIDFZLHMSDZ-QFBILLFUSA-N 1 0 311.400 4.187 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2coc3ccccc23)cc1 ZINC001560482533 1060272380 /nfs/dbraw/zinc/27/23/80/1060272380.db2.gz UMVMFFSVHSQUJZ-AATRIKPKSA-N 1 0 306.409 4.302 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2C[C@@H](C)O[C@H]2C)cc1 ZINC001560507999 1060303269 /nfs/dbraw/zinc/30/32/69/1060303269.db2.gz IGHOOXJSOOIYMF-AOIWGVFYSA-N 1 0 318.505 4.216 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@H]1CCCCO1 ZINC001560518118 1060317418 /nfs/dbraw/zinc/31/74/18/1060317418.db2.gz JBDFHXHUIFQZAQ-VQTJNVASSA-N 1 0 316.489 4.114 20 10 DICDRO CC[C@@H](C)CC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001560527046 1060326452 /nfs/dbraw/zinc/32/64/52/1060326452.db2.gz QZGOAHZQNLLTTD-GFCCVEGCSA-N 1 0 302.384 4.297 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC1(C(F)(F)F)CCCC1 ZINC001560549738 1060357268 /nfs/dbraw/zinc/35/72/68/1060357268.db2.gz PNSLCYJAZRQACZ-UHFFFAOYSA-N 1 0 307.743 4.258 20 10 DICDRO CC(C)[C@](C)(Cc1ccccc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001560558690 1060368968 /nfs/dbraw/zinc/36/89/68/1060368968.db2.gz GZVULFGSZDUVID-NRFANRHFSA-N 1 0 309.453 4.369 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCCC3(CC3)C2)ccc1OC ZINC001560601835 1060415710 /nfs/dbraw/zinc/41/57/10/1060415710.db2.gz PNQMQYZIDCQHOY-QGZVFWFLSA-N 1 0 303.446 4.044 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C2CC2)[C@@H]2CCCOC2)cc1C ZINC001560607597 1060422268 /nfs/dbraw/zinc/42/22/68/1060422268.db2.gz JRPSMWNXXDVBOV-QUCCMNQESA-N 1 0 317.473 4.079 20 10 DICDRO C[C@H]1c2ccccc2CC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001560627885 1060437240 /nfs/dbraw/zinc/43/72/40/1060437240.db2.gz LUVIJPINIOVWFW-LXXRFIIISA-N 1 0 306.453 4.385 20 10 DICDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2cc(C(C)C)ccc2O)C1(C)C ZINC001560635316 1060446592 /nfs/dbraw/zinc/44/65/92/1060446592.db2.gz AIDHIKXTEVNLTN-ROUUACIJSA-N 1 0 305.462 4.151 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+](CC(C)C)C2CC2)c1O ZINC001560650262 1060474656 /nfs/dbraw/zinc/47/46/56/1060474656.db2.gz HFWMFQJUACFUJO-UHFFFAOYSA-N 1 0 312.251 4.084 20 10 DICDRO COc1cc(C[N@@H+]2CC[C@@H](C(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC001560648785 1060473797 /nfs/dbraw/zinc/47/37/97/1060473797.db2.gz UNRWIVINRTUFRR-CQSZACIVSA-N 1 0 305.462 4.176 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001560665091 1060494206 /nfs/dbraw/zinc/49/42/06/1060494206.db2.gz MACGAEQYQDDNOU-PXDRNWIDSA-N 1 0 306.453 4.255 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2c2cccn2C)cc1Cl ZINC001560676171 1060511920 /nfs/dbraw/zinc/51/19/20/1060511920.db2.gz UIQZALWMJOKISH-QGZVFWFLSA-N 1 0 318.848 4.420 20 10 DICDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2c(O)cc(C)cc2Cl)C1 ZINC001560676648 1060514783 /nfs/dbraw/zinc/51/47/83/1060514783.db2.gz IGSGAMGABYAALR-QWHCGFSZSA-N 1 0 313.894 4.460 20 10 DICDRO C[C@H]1c2ccccc2OCC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001560680504 1060522166 /nfs/dbraw/zinc/52/21/66/1060522166.db2.gz CIXDUNBNMNEVBI-TUYSUELWSA-N 1 0 322.452 4.221 20 10 DICDRO CCC[N@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1ccccc1O ZINC001560685583 1060531629 /nfs/dbraw/zinc/53/16/29/1060531629.db2.gz DSILQJQWBZOZSN-UHFFFAOYSA-N 1 0 321.424 4.195 20 10 DICDRO CCc1cccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1O ZINC001560716664 1060575551 /nfs/dbraw/zinc/57/55/51/1060575551.db2.gz LSFGQNDTBYXYEK-GOSISDBHSA-N 1 0 313.466 4.245 20 10 DICDRO Cc1ccc(OCC[N@@H+](C)Cc2c(O)cc(C)cc2Cl)cc1 ZINC001560721770 1060584402 /nfs/dbraw/zinc/58/44/02/1060584402.db2.gz VJGAZLFBVRQBSY-UHFFFAOYSA-N 1 0 319.832 4.173 20 10 DICDRO Cc1sccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001560729990 1060598320 /nfs/dbraw/zinc/59/83/20/1060598320.db2.gz ZBQSIJIVESJNMT-UHFFFAOYSA-N 1 0 300.471 4.287 20 10 DICDRO C[C@H]1CC[N@H+](Cc2c(O)cccc2Br)CC12CCC2 ZINC001560744614 1060611724 /nfs/dbraw/zinc/61/17/24/1060611724.db2.gz SOXDKMULSSPOKP-LBPRGKRZSA-N 1 0 324.262 4.167 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2ccccc2)c(O)cc1Br ZINC001250117824 1060626002 /nfs/dbraw/zinc/62/60/02/1060626002.db2.gz SJEHLTCPXJKKCC-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1cc(C[N@@H+](CC2CC2)C(C)C)c(O)cc1Br ZINC001250128612 1060633224 /nfs/dbraw/zinc/63/32/24/1060633224.db2.gz HHFDNNYNTWVVGT-UHFFFAOYSA-N 1 0 312.251 4.084 20 10 DICDRO Cc1cc(C[NH+]2CC3(C2)CCCCC3)c(O)cc1Br ZINC001250133986 1060637463 /nfs/dbraw/zinc/63/74/63/1060637463.db2.gz SXWDZLZZBZAIFJ-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO CCOc1cc(C)ccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001250186719 1060664930 /nfs/dbraw/zinc/66/49/30/1060664930.db2.gz IQDDHWAYISVUGU-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@]2(C)CC(C)C)c1O ZINC001560845472 1060702117 /nfs/dbraw/zinc/70/21/17/1060702117.db2.gz VHSGVUNJFVVVPL-QGZVFWFLSA-N 1 0 311.853 4.455 20 10 DICDRO Oc1c(C[NH+]2CC(Cc3ccccc3)C2)ccc2ccccc21 ZINC001560874496 1060736535 /nfs/dbraw/zinc/73/65/35/1060736535.db2.gz BNPMVYOLLNVLPC-UHFFFAOYSA-N 1 0 303.405 4.220 20 10 DICDRO COC[C@H](CC(C)(C)C)[NH2+]Cc1ccc2ccccc2c1O ZINC001560906893 1060767934 /nfs/dbraw/zinc/76/79/34/1060767934.db2.gz WHNSSLBCPHEVQJ-INIZCTEOSA-N 1 0 301.430 4.086 20 10 DICDRO COC[C@@H](CC(C)(C)C)[NH2+]Cc1ccc2ccccc2c1O ZINC001560906894 1060768071 /nfs/dbraw/zinc/76/80/71/1060768071.db2.gz WHNSSLBCPHEVQJ-MRXNPFEDSA-N 1 0 301.430 4.086 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+][C@@H](C)CCC3CCCC3)C2)cc1 ZINC001560928002 1060793502 /nfs/dbraw/zinc/79/35/02/1060793502.db2.gz HLILUPGUOAFOQH-FUHWJXTLSA-N 1 0 316.489 4.222 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccnc(-c3ccccc3)c2)c(O)c1 ZINC001560958486 1060824885 /nfs/dbraw/zinc/82/48/85/1060824885.db2.gz UEYGHJHYPZLMBE-UHFFFAOYSA-N 1 0 304.393 4.052 20 10 DICDRO Cc1cc(C[NH2+]C[C@]2(C)CCCCO2)c(C)n1-c1ccccc1 ZINC001560965152 1060829486 /nfs/dbraw/zinc/82/94/86/1060829486.db2.gz KXFSSZWHXJNCBF-FQEVSTJZSA-N 1 0 312.457 4.143 20 10 DICDRO CC[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)c(C)c2)CCS1 ZINC001473191430 1060949972 /nfs/dbraw/zinc/94/99/72/1060949972.db2.gz ADMIKCDXOJWVBU-GOSISDBHSA-N 1 0 318.530 4.313 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)[C@@H]1COc2ccccc2C1 ZINC001462190895 1061012182 /nfs/dbraw/zinc/01/21/82/1061012182.db2.gz SNWRLUNLDGXJOK-APWZRJJASA-N 1 0 324.468 4.002 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CC(c3ccc(C)cc3)C2)c1 ZINC001462205636 1061026334 /nfs/dbraw/zinc/02/63/34/1061026334.db2.gz GBPBNIOSVAOTMZ-ODIFPOPNSA-N 1 0 311.425 4.306 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nccc3ccccc32)c1 ZINC001462211057 1061029697 /nfs/dbraw/zinc/02/96/97/1061029697.db2.gz SZTKTJRQHWFYFL-KGLIPLIRSA-N 1 0 322.408 4.361 20 10 DICDRO Cc1ccc(C[NH2+]CCn2ccc3cc(Cl)ccc32)c(O)c1 ZINC001462221208 1061037642 /nfs/dbraw/zinc/03/76/42/1061037642.db2.gz RXEBSFHQUMJUED-UHFFFAOYSA-N 1 0 314.816 4.099 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C(C)C)[C@@H]2C(C)C)c1O ZINC001462228822 1061040866 /nfs/dbraw/zinc/04/08/66/1061040866.db2.gz AZYXBDUKCCUGFY-HOCLYGCPSA-N 1 0 311.853 4.167 20 10 DICDRO CC(C)[C@H]1[N@H+](Cc2c(O)cccc2Br)CC1(C)C ZINC001462291912 1061082496 /nfs/dbraw/zinc/08/24/96/1061082496.db2.gz HTRXABCBULOILJ-CQSZACIVSA-N 1 0 312.251 4.021 20 10 DICDRO Oc1c(C[NH+]2CC(c3ccc(F)cc3)C2)ccc2ccccc21 ZINC001462315230 1061101098 /nfs/dbraw/zinc/10/10/98/1061101098.db2.gz KEZPZSQZBRIFAY-UHFFFAOYSA-N 1 0 307.368 4.284 20 10 DICDRO COc1cccc([C@H]2C[C@H]([N@H+](C)Cc3ccc(C)cc3O)C2)c1 ZINC001462330830 1061108247 /nfs/dbraw/zinc/10/82/47/1061108247.db2.gz CRNGCDFSCSBPPB-IYARVYRRSA-N 1 0 311.425 4.087 20 10 DICDRO Cc1ccc2cc(C[NH2+]Cc3cc(Cl)ccc3O)ccc2n1 ZINC001462391776 1061146669 /nfs/dbraw/zinc/14/66/69/1061146669.db2.gz GQHKFNXVSNHJTF-UHFFFAOYSA-N 1 0 312.800 4.192 20 10 DICDRO CCO[C@H]1C[C@@H]([NH2+]Cc2ccc(OC)c(C)c2)C12CCCCC2 ZINC001473446321 1061163330 /nfs/dbraw/zinc/16/33/30/1061163330.db2.gz CGPZHBUIHWINBH-MOPGFXCFSA-N 1 0 317.473 4.221 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CC(Cc3cccs3)C2)c1 ZINC001462486503 1061208529 /nfs/dbraw/zinc/20/85/29/1061208529.db2.gz RNGJDGPAUXOYQU-UHFFFAOYSA-N 1 0 301.455 4.252 20 10 DICDRO Cc1cc(C[NH2+][C@H]2COC(C)(C)C2)c(C)n1-c1cccc(C)c1 ZINC001462502098 1061215080 /nfs/dbraw/zinc/21/50/80/1061215080.db2.gz BVVRPXOMSWKJLD-GOSISDBHSA-N 1 0 312.457 4.060 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](C(C)(C)C)C[C@@H]2C)c1O ZINC001473520613 1061216100 /nfs/dbraw/zinc/21/61/00/1061216100.db2.gz YQNDJTSJLSJJKV-SWLSCSKDSA-N 1 0 321.436 4.381 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2csc3ccccc32)c1 ZINC001462646540 1061314214 /nfs/dbraw/zinc/31/42/14/1061314214.db2.gz BMTLVVFNAYSBRH-GFCCVEGCSA-N 1 0 313.422 4.466 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(-c2ccc(F)cc2)no1)c1ccccc1O ZINC001473722926 1061369899 /nfs/dbraw/zinc/36/98/99/1061369899.db2.gz SKZGQBJWNZVPBR-GFCCVEGCSA-N 1 0 312.344 4.037 20 10 DICDRO CCCc1cccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC001473963925 1061508562 /nfs/dbraw/zinc/50/85/62/1061508562.db2.gz YXGBUIZTWFHOCM-UHFFFAOYSA-N 1 0 308.469 4.311 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCc2csc(C(C)C)n2)c(Cl)c1 ZINC001473973196 1061519016 /nfs/dbraw/zinc/51/90/16/1061519016.db2.gz GADSBAUDRKBUSR-UHFFFAOYSA-N 1 0 324.877 4.266 20 10 DICDRO COc1ccc(C[NH2+]C2(c3ccccc3OC)CCC2)cc1C ZINC001251894965 1061526463 /nfs/dbraw/zinc/52/64/63/1061526463.db2.gz KQQCVERSMWWUPX-UHFFFAOYSA-N 1 0 311.425 4.181 20 10 DICDRO c1ccc2c(c1)SC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001251919391 1061533963 /nfs/dbraw/zinc/53/39/63/1061533963.db2.gz NKGMKNTUMWBZKY-GOSISDBHSA-N 1 0 310.466 4.223 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCc2ccccc21 ZINC001474001851 1061541628 /nfs/dbraw/zinc/54/16/28/1061541628.db2.gz ASTAAIWYKZAFKH-KRWDZBQOSA-N 1 0 304.437 4.306 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CCCCC2CCCC2)cc1F ZINC001474023638 1061565474 /nfs/dbraw/zinc/56/54/74/1061565474.db2.gz DTHSBYAEMOLXSD-UHFFFAOYSA-N 1 0 310.432 4.481 20 10 DICDRO c1csc(CCC[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001474071048 1061618656 /nfs/dbraw/zinc/61/86/56/1061618656.db2.gz TVNXWJBATHXEAQ-UHFFFAOYSA-N 1 0 300.471 4.071 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)cc1F ZINC001474131958 1061680031 /nfs/dbraw/zinc/68/00/31/1061680031.db2.gz ZLSMGZXTJFTIQW-KOMQPUFPSA-N 1 0 316.395 4.067 20 10 DICDRO CCOCc1cc(C[NH2+][C@@]2(C)CCCC[C@@H]2C)ccc1OC ZINC001474169228 1061715280 /nfs/dbraw/zinc/71/52/80/1061715280.db2.gz AJNDJTBMBCMRQH-KXBFYZLASA-N 1 0 305.462 4.290 20 10 DICDRO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)C1(C)C ZINC001474177759 1061724306 /nfs/dbraw/zinc/72/43/06/1061724306.db2.gz VYCGWRUCLNZTKZ-LSDHHAIUSA-N 1 0 311.853 4.117 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)cs1 ZINC001474185403 1061733246 /nfs/dbraw/zinc/73/32/46/1061733246.db2.gz RCMFVWZGIJHZJT-CQSZACIVSA-N 1 0 302.487 4.152 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+]CC(C(C)C)C(C)C)C2)cc1 ZINC001474187182 1061736052 /nfs/dbraw/zinc/73/60/52/1061736052.db2.gz GCRRJHZOBAOUEQ-QGZVFWFLSA-N 1 0 318.505 4.039 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c(Cl)c1 ZINC001474190864 1061738716 /nfs/dbraw/zinc/73/87/16/1061738716.db2.gz DPZRDHDOXDAXQN-HUUCEWRRSA-N 1 0 301.817 4.247 20 10 DICDRO COC[C@H](CC(C)(C)C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001474194567 1061744424 /nfs/dbraw/zinc/74/44/24/1061744424.db2.gz TXXNLXGCIVMCDP-SFHVURJKSA-N 1 0 318.505 4.218 20 10 DICDRO COC[C@@H](CC(C)(C)C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001474194566 1061744736 /nfs/dbraw/zinc/74/47/36/1061744736.db2.gz TXXNLXGCIVMCDP-GOSISDBHSA-N 1 0 318.505 4.218 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCC[C@@H]1CC1(Cl)Cl ZINC001474195599 1061749053 /nfs/dbraw/zinc/74/90/53/1061749053.db2.gz BNVQQZALDKWNGA-SECBINFHSA-N 1 0 308.636 4.109 20 10 DICDRO Cc1ccc(CCC[NH2+]Cc2ccc(N(C)C)c(F)c2)c(C)c1 ZINC001474233842 1061794683 /nfs/dbraw/zinc/79/46/83/1061794683.db2.gz JKDOMPUPNTYIJB-UHFFFAOYSA-N 1 0 314.448 4.231 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c(O)c1 ZINC001474307620 1061872765 /nfs/dbraw/zinc/87/27/65/1061872765.db2.gz PXVOXBKMRUEGPZ-UHFFFAOYSA-N 1 0 324.468 4.323 20 10 DICDRO CCC[N@H+](Cc1cccc(CC)c1O)[C@@H]1C[C@@H](OCC)C1(C)C ZINC001474316373 1061886696 /nfs/dbraw/zinc/88/66/96/1061886696.db2.gz AGZLHRLAJGFCPH-QZTJIDSGSA-N 1 0 319.489 4.370 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@H]2CC(=O)c2ccccc2)c1O ZINC001474313508 1061887293 /nfs/dbraw/zinc/88/72/93/1061887293.db2.gz YUNPNBGYWJTMAI-IBGZPJMESA-N 1 0 323.436 4.192 20 10 DICDRO CC[C@H](Cc1ccccc1)[N@H+](CC)Cc1cc(OC)ccc1O ZINC001474344468 1061946624 /nfs/dbraw/zinc/94/66/24/1061946624.db2.gz LOVMFYGBMZPLRO-GOSISDBHSA-N 1 0 313.441 4.244 20 10 DICDRO CC[C@@H](Cc1ccccc1)[N@H+](CC)Cc1cc(OC)ccc1O ZINC001474344469 1061948899 /nfs/dbraw/zinc/94/88/99/1061948899.db2.gz LOVMFYGBMZPLRO-SFHVURJKSA-N 1 0 313.441 4.244 20 10 DICDRO Cc1cc(O)c(C[N@H+]2Cc3ccccc3C[C@@H]2C)cc1Cl ZINC001474352076 1061964295 /nfs/dbraw/zinc/96/42/95/1061964295.db2.gz SFVLWWFXUBOMPB-ZDUSSCGKSA-N 1 0 301.817 4.301 20 10 DICDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001474360604 1061985607 /nfs/dbraw/zinc/98/56/07/1061985607.db2.gz BQQGEWVSQXHLMF-SUMWQHHRSA-N 1 0 310.432 4.431 20 10 DICDRO CC[C@@H](C)[C@@H](C)[N@H+](Cc1cc(Cl)cc(OC)c1O)C1CC1 ZINC001474366997 1061998193 /nfs/dbraw/zinc/99/81/93/1061998193.db2.gz KLTXSJWSUFMUQZ-VXGBXAGGSA-N 1 0 311.853 4.453 20 10 DICDRO CCC[N@H+](Cc1ccc(CC(C)C)nc1)Cc1ccccc1O ZINC001474368673 1062005283 /nfs/dbraw/zinc/00/52/83/1062005283.db2.gz VEPPMCRULMBIQS-UHFFFAOYSA-N 1 0 312.457 4.398 20 10 DICDRO CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)CCc1cccs1 ZINC001474370577 1062008734 /nfs/dbraw/zinc/00/87/34/1062008734.db2.gz XETXXJYQKQPKON-ALCCZGGFSA-N 1 0 314.498 4.392 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2cc(C(C)C)ccc2O)cc1C ZINC001474383507 1062030138 /nfs/dbraw/zinc/03/01/38/1062030138.db2.gz BPELWDZBFSSPHB-UHFFFAOYSA-N 1 0 313.441 4.465 20 10 DICDRO CCC1(CC)C[N@H+](Cc2ccc(N(C)C)cc2C)CCS1 ZINC001474419342 1062091097 /nfs/dbraw/zinc/09/10/97/1062091097.db2.gz LXBWATFDRYZUOB-UHFFFAOYSA-N 1 0 306.519 4.169 20 10 DICDRO CCN(C)c1ccc(C[N@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)cc1 ZINC001459346891 1062101140 /nfs/dbraw/zinc/10/11/40/1062101140.db2.gz GDRGPGMVMJFYDD-UWJYYQICSA-N 1 0 324.468 4.105 20 10 DICDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1cc(C(C)C)ccc1O ZINC001474465115 1062145677 /nfs/dbraw/zinc/14/56/77/1062145677.db2.gz YEQSMWLXSTVCDY-HKUYNNGSSA-N 1 0 305.462 4.199 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c1 ZINC001474486436 1062163263 /nfs/dbraw/zinc/16/32/63/1062163263.db2.gz MCUWTWGMSYTHIR-RISCZKNCSA-N 1 0 301.352 4.288 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)[C@@H](OC)c1ccccc1 ZINC001474496238 1062175911 /nfs/dbraw/zinc/17/59/11/1062175911.db2.gz RUOFOAHIZFBBRP-OXQOHEQNSA-N 1 0 312.457 4.138 20 10 DICDRO CC[C@H](CCC(F)(F)F)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC001474505173 1062186399 /nfs/dbraw/zinc/18/63/99/1062186399.db2.gz OIYYAEZICBAPIW-WDEREUQCSA-N 1 0 305.340 4.173 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](OC(C)(C)C)C2(C)C)c1 ZINC001474505052 1062187959 /nfs/dbraw/zinc/18/79/59/1062187959.db2.gz NAGQRFJGOOHKNH-VUCTXSBTSA-N 1 0 321.461 4.034 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)ccc1N(C)C ZINC001459540126 1062194969 /nfs/dbraw/zinc/19/49/69/1062194969.db2.gz JCUNDRPUJXXDNY-HNNXBMFYSA-N 1 0 312.432 4.319 20 10 DICDRO COc1cc(C)cc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)c1O ZINC001474539709 1062228740 /nfs/dbraw/zinc/22/87/40/1062228740.db2.gz ULUHTSNJWWXRNK-ZDUSSCGKSA-N 1 0 313.388 4.014 20 10 DICDRO C[C@H](COc1ccccc1F)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC001254721286 1062238640 /nfs/dbraw/zinc/23/86/40/1062238640.db2.gz ONGXLOJOEHNHBG-VXGBXAGGSA-N 1 0 323.795 4.303 20 10 DICDRO COc1ccc(O)c(C[NH2+]C[C@H]2CCC[C@@H]2c2ccccc2)c1 ZINC001474544548 1062240111 /nfs/dbraw/zinc/24/01/11/1062240111.db2.gz RCEWCKLMQHHDHR-VQIMIIECSA-N 1 0 311.425 4.074 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2coc(-c3ccccc3)n2)c(O)c1 ZINC001254721119 1062240180 /nfs/dbraw/zinc/24/01/80/1062240180.db2.gz IZAMJBOOSPVAOZ-HNNXBMFYSA-N 1 0 322.408 4.249 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@@]2(C)CC=CCC2)c1O ZINC001474575080 1062282601 /nfs/dbraw/zinc/28/26/01/1062282601.db2.gz XQAMKCCSJWCKSI-HNNXBMFYSA-N 1 0 310.235 4.052 20 10 DICDRO COc1ccc(C[NH+]2CCC(C)(CC(C)C)CC2)c(O)c1OC ZINC001474563761 1062267080 /nfs/dbraw/zinc/26/70/80/1062267080.db2.gz BXTXPCAZMJHXAI-UHFFFAOYSA-N 1 0 321.461 4.058 20 10 DICDRO CC[C@H]1CCC[C@@H](C[N@H+](C)CCN(C)c2ccc(OC)cc2)C1 ZINC001474612430 1062328541 /nfs/dbraw/zinc/32/85/41/1062328541.db2.gz IAKNIIUAXZTLAM-ZWKOTPCHSA-N 1 0 318.505 4.280 20 10 DICDRO CC[C@H]([NH2+][C@H](C)COc1ccccc1F)c1ccccc1O ZINC001255175410 1062350065 /nfs/dbraw/zinc/35/00/65/1062350065.db2.gz LAONNKRSIATCRE-CJNGLKHVSA-N 1 0 303.377 4.040 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H](C)CCc2c[nH]c3ccccc23)c1 ZINC001474634198 1062358076 /nfs/dbraw/zinc/35/80/76/1062358076.db2.gz CJOKVPKQPNPYNP-HNNXBMFYSA-N 1 0 308.425 4.293 20 10 DICDRO Cc1cc(C[N@@H+]2Cc3cccc(O)c3C2)ccc1C(F)(F)F ZINC001474677258 1062408727 /nfs/dbraw/zinc/40/87/27/1062408727.db2.gz HYCSGWOEOLDESK-UHFFFAOYSA-N 1 0 307.315 4.235 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]C1(C2CC2)CCC1 ZINC001474707235 1062434665 /nfs/dbraw/zinc/43/46/65/1062434665.db2.gz YDMJNNNTYDPQQH-UHFFFAOYSA-N 1 0 323.436 4.394 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2CCC=CCC2)c(C(F)(F)F)c1 ZINC001474712420 1062439903 /nfs/dbraw/zinc/43/99/03/1062439903.db2.gz UOEVGVKEWZCEQJ-UHFFFAOYSA-N 1 0 312.379 4.360 20 10 DICDRO Cc1cc(O)c(C[N@@H+](Cc2ccccn2)CC(C)C)cc1Cl ZINC001474719349 1062445596 /nfs/dbraw/zinc/44/55/96/1062445596.db2.gz VLGQJVCBGFYKLP-UHFFFAOYSA-N 1 0 318.848 4.407 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CCC(F)(F)C2)cc1Cl ZINC001474743558 1062460039 /nfs/dbraw/zinc/46/00/39/1062460039.db2.gz PBDQNJHDCPLAAP-LLVKDONJSA-N 1 0 303.780 4.269 20 10 DICDRO Cc1cc(C)c2c(c1)CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)C2 ZINC001474759928 1062465214 /nfs/dbraw/zinc/46/52/14/1062465214.db2.gz DDCRPWTVDARTFC-AATRIKPKSA-N 1 0 320.480 4.441 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Cl)cc1O)c1cc(F)ccc1N(C)C ZINC001474760125 1062468976 /nfs/dbraw/zinc/46/89/76/1062468976.db2.gz HHZOWZURNHHOCG-NSHDSACASA-N 1 0 322.811 4.102 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C2CCC(C(F)(F)F)CC2)cc1 ZINC001255522608 1062471757 /nfs/dbraw/zinc/47/17/57/1062471757.db2.gz SFWWZMBXZXJLSO-UHFFFAOYSA-N 1 0 314.395 4.306 20 10 DICDRO C[C@@H](CSc1ccc(F)cc1)[NH2+][C@@H](C)c1ccccc1O ZINC001255729407 1062550586 /nfs/dbraw/zinc/55/05/86/1062550586.db2.gz HKXNVDYIINDGOE-STQMWFEESA-N 1 0 305.418 4.363 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)CSc2ccc(F)cc2)cc1C ZINC001255736466 1062559440 /nfs/dbraw/zinc/55/94/40/1062559440.db2.gz ZXSIRLYMYZIMJJ-AWEZNQCLSA-N 1 0 319.445 4.413 20 10 DICDRO C[C@@H](Cc1ccccc1F)[NH2+]Cc1cc2ccccc2cc1O ZINC001255840795 1062628420 /nfs/dbraw/zinc/62/84/20/1062628420.db2.gz JEBCBLROVNVXSM-AWEZNQCLSA-N 1 0 309.384 4.405 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)[C@H]2CCCc3ccccc32)cc1 ZINC001460332505 1062785765 /nfs/dbraw/zinc/78/57/65/1062785765.db2.gz ABWXLETWSOVHMX-NRFANRHFSA-N 1 0 324.468 4.141 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H](C)Cc1ccccn1 ZINC001256410531 1062810627 /nfs/dbraw/zinc/81/06/27/1062810627.db2.gz VDJYVSITNSLWPU-QRWLVFNGSA-N 1 0 324.468 4.248 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2cccc(Cl)c2)cc1 ZINC001460998626 1063174052 /nfs/dbraw/zinc/17/40/52/1063174052.db2.gz AVBMOSQHMIRINU-GQCTYLIASA-N 1 0 300.833 4.209 20 10 DICDRO C[C@@H](CCc1ccccc1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001460998578 1063174979 /nfs/dbraw/zinc/17/49/79/1063174979.db2.gz AHKQELQROUZBFB-HKMNZKMDSA-N 1 0 308.469 4.377 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC2(c3ccccc3)CC2)cc1 ZINC001461034457 1063205447 /nfs/dbraw/zinc/20/54/47/1063205447.db2.gz DFAGGOGDPQKMOE-VOTSOKGWSA-N 1 0 306.453 4.087 20 10 DICDRO COc1cc(C[NH2+][C@H]2CCC[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC001461042250 1063209588 /nfs/dbraw/zinc/20/95/88/1063209588.db2.gz WPGPAHGWIVYCOE-ZFWWWQNUSA-N 1 0 305.462 4.367 20 10 DICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]C[C@@H]2C[C@@H]2C)cc1 ZINC001461051242 1063219085 /nfs/dbraw/zinc/21/90/85/1063219085.db2.gz ITACXFQJBPQERA-PXNSSMCTSA-N 1 0 308.469 4.459 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCO[C@@H]2CCCC[C@@H]2C)c(Cl)c1 ZINC001461053847 1063220333 /nfs/dbraw/zinc/22/03/33/1063220333.db2.gz PITWCFYQFLMSHJ-SUMWQHHRSA-N 1 0 311.853 4.039 20 10 DICDRO CCCCCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001257369167 1063236037 /nfs/dbraw/zinc/23/60/37/1063236037.db2.gz OOBPDIVFTKPDJL-GOSISDBHSA-N 1 0 318.505 4.314 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccc(C4CC4)cc3)ccc21 ZINC001461113482 1063263071 /nfs/dbraw/zinc/26/30/71/1063263071.db2.gz SFMVZGHHNGAHED-UHFFFAOYSA-N 1 0 306.453 4.236 20 10 DICDRO COC[C@H](C)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001461113578 1063263802 /nfs/dbraw/zinc/26/38/02/1063263802.db2.gz VNMGPDNFOQOYBT-CQSZACIVSA-N 1 0 321.505 4.359 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(C)cc1 ZINC001461155335 1063298679 /nfs/dbraw/zinc/29/86/79/1063298679.db2.gz LYHQYKDNHGAVHA-SFHVURJKSA-N 1 0 300.421 4.441 20 10 DICDRO CCC(CC)(C[NH2+]Cc1c(O)cc(C)cc1Cl)SC ZINC001461258471 1063370987 /nfs/dbraw/zinc/37/09/87/1063370987.db2.gz SKSBKHCXLQWEGI-UHFFFAOYSA-N 1 0 301.883 4.365 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1CCCSC1 ZINC001257669010 1063362393 /nfs/dbraw/zinc/36/23/93/1063362393.db2.gz YSWYYSWPMAFSDI-DYVFJYSZSA-N 1 0 305.487 4.118 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2(CCO)CCCCC2)cc1C ZINC001461261752 1063374234 /nfs/dbraw/zinc/37/42/34/1063374234.db2.gz BPASROWYDGVCAH-UHFFFAOYSA-N 1 0 319.489 4.206 20 10 DICDRO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001473109518 1063408764 /nfs/dbraw/zinc/40/87/64/1063408764.db2.gz TVHUPWVFLZYKQH-CYBMUJFWSA-N 1 0 304.384 4.224 20 10 DICDRO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001473109519 1063409769 /nfs/dbraw/zinc/40/97/69/1063409769.db2.gz TVHUPWVFLZYKQH-ZDUSSCGKSA-N 1 0 304.384 4.224 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC2(C)Cc3ccccc3C2)cc1 ZINC001461350752 1063435166 /nfs/dbraw/zinc/43/51/66/1063435166.db2.gz XAIQCMODZKYACH-SREVYHEPSA-N 1 0 320.480 4.161 20 10 DICDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001461435285 1063503395 /nfs/dbraw/zinc/50/33/95/1063503395.db2.gz ADGKODOQLUCLAX-CQSZACIVSA-N 1 0 301.352 4.078 20 10 DICDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC001461439257 1063506548 /nfs/dbraw/zinc/50/65/48/1063506548.db2.gz BHBRJZQINOYQGF-LXXRFIIISA-N 1 0 323.484 4.183 20 10 DICDRO CSCC[C@@H](C)[NH2+][C@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001258213550 1063563699 /nfs/dbraw/zinc/56/36/99/1063563699.db2.gz RPBNDMFHQYVWHL-DYVFJYSZSA-N 1 0 307.503 4.364 20 10 DICDRO Oc1ccccc1CN1CCC([NH2+]C2CCCCCCC2)CC1 ZINC001258235885 1063574327 /nfs/dbraw/zinc/57/43/27/1063574327.db2.gz GLVCWINRKQGLAZ-UHFFFAOYSA-N 1 0 316.489 4.059 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1cccc2c1CCC2 ZINC001461587842 1063595813 /nfs/dbraw/zinc/59/58/13/1063595813.db2.gz VMGTYTXILWTQDV-KRWDZBQOSA-N 1 0 322.496 4.271 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1cccc2c1CCC2 ZINC001461587843 1063598259 /nfs/dbraw/zinc/59/82/59/1063598259.db2.gz VMGTYTXILWTQDV-QGZVFWFLSA-N 1 0 322.496 4.271 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)cc1C ZINC001461628771 1063623115 /nfs/dbraw/zinc/62/31/15/1063623115.db2.gz HBEFENYYTCTXLJ-OWCLPIDISA-N 1 0 309.400 4.307 20 10 DICDRO COc1ccc(C[NH2+]Cc2cc(C3CC3)ccc2OC)cc1C ZINC001461731503 1063683887 /nfs/dbraw/zinc/68/38/87/1063683887.db2.gz ZPLBXJTYGWQLJP-UHFFFAOYSA-N 1 0 311.425 4.179 20 10 DICDRO COc1ccc(C[NH2+]CCc2c[nH]c3ccc(C)cc23)cc1C ZINC001461820358 1063735136 /nfs/dbraw/zinc/73/51/36/1063735136.db2.gz UPTXIOXODRSJMX-UHFFFAOYSA-N 1 0 308.425 4.126 20 10 DICDRO CCSCC[C@H](C)[N@H+](C)Cc1cc(Cl)c(C)cc1O ZINC001461883181 1063771772 /nfs/dbraw/zinc/77/17/72/1063771772.db2.gz PPHXVRJJBKMPRQ-LBPRGKRZSA-N 1 0 301.883 4.318 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC001461926411 1063811856 /nfs/dbraw/zinc/81/18/56/1063811856.db2.gz JLMNVBBFSSYWAR-XLIONFOSSA-N 1 0 308.469 4.439 20 10 DICDRO Cc1ccccc1OCCC[N@@H+](C)Cc1cccc(Cl)c1[O-] ZINC001461936028 1063819325 /nfs/dbraw/zinc/81/93/25/1063819325.db2.gz MYGVQHPADYKHEQ-UHFFFAOYSA-N 1 0 319.832 4.255 20 10 DICDRO COc1ccc(C[N@H+](C)C/C=C\c2ccc(N(C)C)cc2)cc1C ZINC001461980685 1063856426 /nfs/dbraw/zinc/85/64/26/1063856426.db2.gz DVHMIXBMZWLIJN-SREVYHEPSA-N 1 0 324.468 4.215 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1O ZINC001461988002 1063862256 /nfs/dbraw/zinc/86/22/56/1063862256.db2.gz LCVAQAUEOVKUKR-LALPHHSUSA-N 1 0 309.837 4.207 20 10 DICDRO COc1ccccc1C[C@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001258883205 1063871287 /nfs/dbraw/zinc/87/12/87/1063871287.db2.gz IZNKQCOLIZWDOS-HNNXBMFYSA-N 1 0 321.420 4.275 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1C[C@@H]1c1ccccc1 ZINC001462025551 1063885481 /nfs/dbraw/zinc/88/54/81/1063885481.db2.gz IMJLTSHCAJNIAD-PZJWPPBQSA-N 1 0 308.469 4.378 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1C[C@H]1c1ccccc1 ZINC001462025548 1063886671 /nfs/dbraw/zinc/88/66/71/1063886671.db2.gz IMJLTSHCAJNIAD-CTNGQTDRSA-N 1 0 308.469 4.378 20 10 DICDRO CCc1cccc(C[N@H+](CC)Cc2ccc(N(C)C)cc2)c1O ZINC001462028214 1063888800 /nfs/dbraw/zinc/88/88/00/1063888800.db2.gz YHJYBETZXOUNPO-UHFFFAOYSA-N 1 0 312.457 4.043 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)CCOc2ccccc2F)c1 ZINC001462027745 1063889703 /nfs/dbraw/zinc/88/97/03/1063889703.db2.gz TUZGJEKFCVSLCC-UHFFFAOYSA-N 1 0 317.404 4.166 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2ccc(Br)cc2O)CC1(C)C ZINC001462058191 1063908013 /nfs/dbraw/zinc/90/80/13/1063908013.db2.gz HQOYTDHJYAVZSR-LLVKDONJSA-N 1 0 312.251 4.023 20 10 DICDRO c1cc(N2CCCC2)ccc1C[NH2+]CCCOC1CCCCC1 ZINC000378943199 1063981200 /nfs/dbraw/zinc/98/12/00/1063981200.db2.gz JUPIMLMPALAFIF-UHFFFAOYSA-N 1 0 316.489 4.116 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1OC(F)F ZINC000393540032 1064285110 /nfs/dbraw/zinc/28/51/10/1064285110.db2.gz XTVPOTCEEPFJHV-LBPRGKRZSA-N 1 0 319.351 4.074 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000393892075 1064308122 /nfs/dbraw/zinc/30/81/22/1064308122.db2.gz UBPNWOFJQMLIKT-IEBWSBKVSA-N 1 0 324.468 4.016 20 10 DICDRO CCCC[C@H](CC)C[NH+]1CC2(CN(c3ccc(OC)cc3)C2)C1 ZINC001279729120 1064364738 /nfs/dbraw/zinc/36/47/38/1064364738.db2.gz KSFOUUYRWUABKX-KRWDZBQOSA-N 1 0 316.489 4.034 20 10 DICDRO CC(C)CCC[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000725843691 1064412022 /nfs/dbraw/zinc/41/20/22/1064412022.db2.gz CBIHRFSEDDDSJO-UHFFFAOYSA-N 1 0 319.449 4.111 20 10 DICDRO COCC[N@@H+](Cc1ccc(N2CCCCC2)c(C)c1)CC(C)C ZINC001307412347 1065374815 /nfs/dbraw/zinc/37/48/15/1065374815.db2.gz DYTZKXHAEROTSH-UHFFFAOYSA-N 1 0 318.505 4.090 20 10 DICDRO CCCC[C@@H](CC)C[N@@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC001307424893 1065386730 /nfs/dbraw/zinc/38/67/30/1065386730.db2.gz WUVWYXRFBMUUFG-GOSISDBHSA-N 1 0 318.505 4.424 20 10 DICDRO CC1(C)CC[C@H](C[N@H+](Cc2ccccc2O)C2CCCC2)OC1 ZINC001307461053 1065413569 /nfs/dbraw/zinc/41/35/69/1065413569.db2.gz BSZIHPCJKRCUPX-GOSISDBHSA-N 1 0 317.473 4.342 20 10 DICDRO CC(C)C[C@@H](C)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC001307566732 1065485708 /nfs/dbraw/zinc/48/57/08/1065485708.db2.gz LSSSYKRWGLPQCL-AEFFLSMTSA-N 1 0 305.462 4.055 20 10 DICDRO CCOc1ccc(N2CC[NH+](C[C@@H](C)CC(C)(C)C)CC2)cc1 ZINC001307600013 1065506453 /nfs/dbraw/zinc/50/64/53/1065506453.db2.gz RIEMZJCEVOJCDN-KRWDZBQOSA-N 1 0 318.505 4.280 20 10 DICDRO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001307811213 1065633995 /nfs/dbraw/zinc/63/39/95/1065633995.db2.gz NZGFLLCMRIKCTP-IBGZPJMESA-N 1 0 312.457 4.344 20 10 DICDRO COCCCCCN1C[C@@H](C(C)C)Cc2cc(OC)ccc21 ZINC001307862200 1065658216 /nfs/dbraw/zinc/65/82/16/1065658216.db2.gz RVCPYHYVRPBIJJ-KRWDZBQOSA-N 1 0 305.462 4.147 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c(Cl)c1 ZINC001308207960 1065814776 /nfs/dbraw/zinc/81/47/76/1065814776.db2.gz JLMLONHOCOFCPX-DGCLKSJQSA-N 1 0 305.805 4.360 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CCOC(C)(C)C)cc1 ZINC001308231700 1065838720 /nfs/dbraw/zinc/83/87/20/1065838720.db2.gz KBGFHERMJUWKEH-UHFFFAOYSA-N 1 0 306.494 4.218 20 10 DICDRO CN(c1ccc(C[NH2+]Cc2ccns2)cc1)C1CCCCC1 ZINC001308231127 1065838809 /nfs/dbraw/zinc/83/88/09/1065838809.db2.gz FETWXVILWVARAE-UHFFFAOYSA-N 1 0 315.486 4.202 20 10 DICDRO CCS[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001308299393 1065894623 /nfs/dbraw/zinc/89/46/23/1065894623.db2.gz CQUBJBQVEMBOSR-HKUYNNGSSA-N 1 0 318.530 4.441 20 10 DICDRO CCC1(CC)[C@H](OC)C[C@@H]1[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001308341245 1065926756 /nfs/dbraw/zinc/92/67/56/1065926756.db2.gz GIBAXDOMFBMTBC-JKSUJKDBSA-N 1 0 311.853 4.037 20 10 DICDRO CC(C)C[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001308342832 1065928116 /nfs/dbraw/zinc/92/81/16/1065928116.db2.gz MMZAPTGEFGUGDW-GFCCVEGCSA-N 1 0 302.384 4.296 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC001308353461 1065934359 /nfs/dbraw/zinc/93/43/59/1065934359.db2.gz CFXWIXAJJRTHAU-HXUWFJFHSA-N 1 0 305.425 4.123 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)cc1C ZINC001308417323 1065974966 /nfs/dbraw/zinc/97/49/66/1065974966.db2.gz CQYZNJGLALKXKS-SFHVURJKSA-N 1 0 317.379 4.449 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCCc2c(F)cccc21 ZINC001308421868 1065978427 /nfs/dbraw/zinc/97/84/27/1065978427.db2.gz ZMAIMPOIYAVFFS-MRXNPFEDSA-N 1 0 305.780 4.352 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2(COC)CCCCC2)cc1 ZINC001308425248 1065979645 /nfs/dbraw/zinc/97/96/45/1065979645.db2.gz QNNZKUZJFASWMC-UHFFFAOYSA-N 1 0 318.505 4.219 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCC[C@H]2C2CC2)cc1 ZINC001308436860 1065987863 /nfs/dbraw/zinc/98/78/63/1065987863.db2.gz WFEVAAFESQOBLP-QUCCMNQESA-N 1 0 300.490 4.449 20 10 DICDRO COc1ccccc1C1([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC001308443140 1065990934 /nfs/dbraw/zinc/99/09/34/1065990934.db2.gz GNXSSRWRARDREW-SREVYHEPSA-N 1 0 322.452 4.053 20 10 DICDRO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001308444388 1065992705 /nfs/dbraw/zinc/99/27/05/1065992705.db2.gz YXHINEXQACNOJO-RTWAWAEBSA-N 1 0 324.443 4.404 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](CC)[C@@H]2CCCCO2)cc1C ZINC001308451201 1065997157 /nfs/dbraw/zinc/99/71/57/1065997157.db2.gz VOSYFFBPJHRSCM-MJGOQNOKSA-N 1 0 305.462 4.221 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C(C)(C2CC2)C2CC2)cc1F ZINC001308470050 1066009474 /nfs/dbraw/zinc/00/94/74/1066009474.db2.gz APNFNUHQFUXCPA-UHFFFAOYSA-N 1 0 304.453 4.340 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CC[C@H]2CC2(F)F)cc1 ZINC001308471694 1066011414 /nfs/dbraw/zinc/01/14/14/1066011414.db2.gz LRCDEGMKFAWKNZ-INIZCTEOSA-N 1 0 310.432 4.448 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CC2(Cl)Cl)c(Cl)c1 ZINC001308472461 1066012170 /nfs/dbraw/zinc/01/21/70/1066012170.db2.gz UTMNUKYGWAFRTE-SECBINFHSA-N 1 0 308.636 4.028 20 10 DICDRO CCCOc1ccc(C[NH2+]CC(C)(C)[C@H]2CCCCO2)cc1C ZINC001308489784 1066024959 /nfs/dbraw/zinc/02/49/59/1066024959.db2.gz AQAPDIQYFBEXJK-LJQANCHMSA-N 1 0 319.489 4.469 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc(N2CCCCC2)cc1)CC(F)F ZINC001308504909 1066033444 /nfs/dbraw/zinc/03/34/44/1066033444.db2.gz RLFSHLFXVRQKIY-UHFFFAOYSA-N 1 0 310.432 4.448 20 10 DICDRO COc1cc(C[NH2+][C@H](C)c2ccccc2O)cc2ccccc21 ZINC001308507218 1066036212 /nfs/dbraw/zinc/03/62/12/1066036212.db2.gz ZXCOYUNAWPODKL-CQSZACIVSA-N 1 0 307.393 4.405 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2C[C@H]3CC[C@@H](C2)S3)cc1 ZINC001308520901 1066042102 /nfs/dbraw/zinc/04/21/02/1066042102.db2.gz VMGXCOJMUUPTEK-JLYLLQBASA-N 1 0 318.530 4.297 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCCc3cccnc32)cc1C ZINC001308540004 1066056960 /nfs/dbraw/zinc/05/69/60/1066056960.db2.gz WYHUARNXEARNSC-SFHVURJKSA-N 1 0 310.441 4.346 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2C[C@@H]3CCC[C@@H]23)c(C(F)(F)F)c1 ZINC001308548220 1066062643 /nfs/dbraw/zinc/06/26/43/1066062643.db2.gz XSZPQTBKGQUTFE-SGIREYDYSA-N 1 0 312.379 4.050 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2CCC2CCCC2)c1 ZINC001308570825 1066080662 /nfs/dbraw/zinc/08/06/62/1066080662.db2.gz RSAWARPTHQBSLA-QGZVFWFLSA-N 1 0 303.446 4.336 20 10 DICDRO CCCCO[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(C)cc2O)C1(C)C ZINC001308578079 1066094934 /nfs/dbraw/zinc/09/49/34/1066094934.db2.gz MKOFBKPLFNFRNG-QZTJIDSGSA-N 1 0 305.462 4.116 20 10 DICDRO COc1cc(C)cc(C[N@H+](CCc2ccccc2)C(C)C)c1O ZINC001308609498 1066116052 /nfs/dbraw/zinc/11/60/52/1066116052.db2.gz QEEITIDZGLLJGF-UHFFFAOYSA-N 1 0 313.441 4.162 20 10 DICDRO CCC[N@H+](Cc1ccc2scnc2c1)Cc1ccccc1O ZINC001308617157 1066121025 /nfs/dbraw/zinc/12/10/25/1066121025.db2.gz KGCKHUZRFQSJAS-UHFFFAOYSA-N 1 0 312.438 4.414 20 10 DICDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2c(O)cccc2Br)C1 ZINC001308619185 1066122256 /nfs/dbraw/zinc/12/22/56/1066122256.db2.gz JYFVXSCSJRLWAQ-VXGBXAGGSA-N 1 0 312.251 4.165 20 10 DICDRO CN(CC[N@H+](C)Cc1ccc2ccccc2c1O)c1ccccc1 ZINC001308626581 1066124319 /nfs/dbraw/zinc/12/43/19/1066124319.db2.gz CUZCZXMSALPXDA-UHFFFAOYSA-N 1 0 320.436 4.114 20 10 DICDRO C[C@H](Cc1ccc(O)cc1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC001308629836 1066126040 /nfs/dbraw/zinc/12/60/40/1066126040.db2.gz YUPDHCRJRSUPBB-FUTAKVPZSA-N 1 0 324.468 4.034 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cccn1C1CC1)C1CCCC1 ZINC001308633624 1066128814 /nfs/dbraw/zinc/12/88/14/1066128814.db2.gz KOPXTCQTSYPTIY-UHFFFAOYSA-N 1 0 310.441 4.473 20 10 DICDRO CSC1(C[N@H+](Cc2ccccc2O)C2CCCC2)CCC1 ZINC001308633639 1066128860 /nfs/dbraw/zinc/12/88/60/1066128860.db2.gz LAOWBVMCEUVRMB-UHFFFAOYSA-N 1 0 305.487 4.423 20 10 DICDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001308634570 1066130357 /nfs/dbraw/zinc/13/03/57/1066130357.db2.gz MTHPRPBKRKMLMY-XNJGSVPQSA-N 1 0 308.416 4.184 20 10 DICDRO CC(C)[C@@H]1CC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001308638058 1066131757 /nfs/dbraw/zinc/13/17/57/1066131757.db2.gz CNBUCBWFEDSPQY-HNNXBMFYSA-N 1 0 300.368 4.002 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccn2C(F)F)cc1 ZINC001308645510 1066135728 /nfs/dbraw/zinc/13/57/28/1066135728.db2.gz NVJCZUBMDKJJGE-UHFFFAOYSA-N 1 0 321.415 4.361 20 10 DICDRO CCC[N@H+](Cc1ccc(C)cc1)Cc1c(C)cc(OC)cc1O ZINC001308654214 1066139334 /nfs/dbraw/zinc/13/93/34/1066139334.db2.gz JQIWLMKICGKCFI-UHFFFAOYSA-N 1 0 313.441 4.430 20 10 DICDRO COc1cc(C)c(C[N@H+](Cc2ccccc2F)C2CC2)c(O)c1 ZINC001308663472 1066143766 /nfs/dbraw/zinc/14/37/66/1066143766.db2.gz TYDZSDLONMBCNK-UHFFFAOYSA-N 1 0 315.388 4.013 20 10 DICDRO CCC[N@H+](Cc1cc(C(C)C)ccc1O)[C@H](CC)C(=O)OCC ZINC001308685914 1066154939 /nfs/dbraw/zinc/15/49/39/1066154939.db2.gz KRYZNGUCELZARZ-QGZVFWFLSA-N 1 0 321.461 4.069 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cccc(CC)c2O)c(C)c1 ZINC001308689805 1066183024 /nfs/dbraw/zinc/18/30/24/1066183024.db2.gz XYJGMGVFUVGPPF-UHFFFAOYSA-N 1 0 313.441 4.342 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2CCOc3c(F)cccc32)c1 ZINC001308699973 1066187753 /nfs/dbraw/zinc/18/77/53/1066187753.db2.gz GLESJIBMGWGGAW-QGZVFWFLSA-N 1 0 315.388 4.268 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](C)C3(CCCCC3)C2)c1 ZINC001308707595 1066191385 /nfs/dbraw/zinc/19/13/85/1066191385.db2.gz WACOEFOYTAEVOC-OAHLLOKOSA-N 1 0 303.446 4.193 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)cc1Cl ZINC001308715984 1066195111 /nfs/dbraw/zinc/19/51/11/1066195111.db2.gz RPFHHCYBKQBVCI-CHWSQXEVSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC001308717184 1066195194 /nfs/dbraw/zinc/19/51/94/1066195194.db2.gz CNBDBFSXJUDNLH-FQEVSTJZSA-N 1 0 312.432 4.132 20 10 DICDRO Oc1ccc(C[N@@H+](Cc2ccc(Cl)cc2O)CC2CC2)cc1 ZINC001308742253 1066216296 /nfs/dbraw/zinc/21/62/96/1066216296.db2.gz BTDKJEVCOUFASQ-UHFFFAOYSA-N 1 0 317.816 4.163 20 10 DICDRO Cc1ccc2c(c1)C[N@H+](Cc1cc(C(C)C)ccc1O)CCO2 ZINC001308756811 1066231338 /nfs/dbraw/zinc/23/13/38/1066231338.db2.gz QBZPZDUAQQDFBO-UHFFFAOYSA-N 1 0 311.425 4.219 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCCc3ccccc3CC2)cc1 ZINC001308768705 1066241461 /nfs/dbraw/zinc/24/14/61/1066241461.db2.gz SBCZBJLENIRUSV-ALCCZGGFSA-N 1 0 320.480 4.257 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)c1 ZINC001308848424 1066325971 /nfs/dbraw/zinc/32/59/71/1066325971.db2.gz SAPVAYVFCVTOLO-FQEVSTJZSA-N 1 0 321.420 4.294 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC001308901160 1066379732 /nfs/dbraw/zinc/37/97/32/1066379732.db2.gz OYVZUBIFGWRSSZ-NHCUHLMSSA-N 1 0 308.469 4.487 20 10 DICDRO Cc1ccc(C[N@@H+]2CCc3ccc(Cl)c(C)c3C2)c(O)c1 ZINC001308909500 1066387384 /nfs/dbraw/zinc/38/73/84/1066387384.db2.gz HVRVVIYYHATBDM-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CCC(C)(C)CO2)cc1Cl ZINC001308959726 1066419818 /nfs/dbraw/zinc/41/98/18/1066419818.db2.gz TXXYHEFCYOYKDI-CQSZACIVSA-N 1 0 311.853 4.039 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CCC(C)(C)CO2)cc1Cl ZINC001308959723 1066420305 /nfs/dbraw/zinc/42/03/05/1066420305.db2.gz TXXYHEFCYOYKDI-AWEZNQCLSA-N 1 0 311.853 4.039 20 10 DICDRO C[C@@H]1CC=CC[C@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC001308976008 1066429788 /nfs/dbraw/zinc/42/97/88/1066429788.db2.gz NDXHXVVUVQWZLB-OXQOHEQNSA-N 1 0 323.436 4.416 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c1 ZINC000021011900 182260224 /nfs/dbraw/zinc/26/02/24/182260224.db2.gz UJHLLIQRNRAUTN-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c(O)c1C ZINC000273356976 130111314 /nfs/dbraw/zinc/11/13/14/130111314.db2.gz CXMDGFOHKPPUQI-HZPDHXFCSA-N 1 0 303.446 4.151 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000273446661 130121958 /nfs/dbraw/zinc/12/19/58/130121958.db2.gz FFVBWSAJWUWJBW-QWHCGFSZSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000273446665 130122192 /nfs/dbraw/zinc/12/21/92/130122192.db2.gz FFVBWSAJWUWJBW-STQMWFEESA-N 1 0 300.358 4.021 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2cc(F)ccc2O)c1 ZINC000273446428 130122230 /nfs/dbraw/zinc/12/22/30/130122230.db2.gz FBCLLNNNHRVCOF-CYBMUJFWSA-N 1 0 302.393 4.074 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@@H](O)c2cccs2)c(O)c1C ZINC000273455251 130123610 /nfs/dbraw/zinc/12/36/10/130123610.db2.gz HARPWFPRJUDJDN-DUVNUKRYSA-N 1 0 319.470 4.233 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1ccco1 ZINC000273470215 130124891 /nfs/dbraw/zinc/12/48/91/130124891.db2.gz RWOJHZBNWMKERK-HOCLYGCPSA-N 1 0 303.402 4.030 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273492604 130128498 /nfs/dbraw/zinc/12/84/98/130128498.db2.gz XBWXVZPLXJYGJD-RISCZKNCSA-N 1 0 304.459 4.228 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOC3(CCCCC3)C2)c(O)c1 ZINC000273510313 130131001 /nfs/dbraw/zinc/13/10/01/130131001.db2.gz RPKIUDKOPNKLAU-JKSUJKDBSA-N 1 0 303.446 4.233 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccc2ccccc2c1O ZINC000273516567 130131107 /nfs/dbraw/zinc/13/11/07/130131107.db2.gz SNYGZOFNQIZENX-ZBFHGGJFSA-N 1 0 311.425 4.298 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CCO[C@@H](C2CC2)C1 ZINC000274048370 130200388 /nfs/dbraw/zinc/20/03/88/130200388.db2.gz FTTMORHXDJEGLF-PZJWPPBQSA-N 1 0 323.436 4.106 20 10 DICDRO C[C@@H]([NH2+]C1CC(F)(F)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000277003401 130570271 /nfs/dbraw/zinc/57/02/71/130570271.db2.gz ATGBNAOBITUUMA-GFCCVEGCSA-N 1 0 312.379 4.264 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2-n2ccnc2)c(O)c1 ZINC000284140201 131052695 /nfs/dbraw/zinc/05/26/95/131052695.db2.gz OTLSQWSRYGMBPT-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c(O)c1 ZINC000284319511 131069082 /nfs/dbraw/zinc/06/90/82/131069082.db2.gz ZSZSWSPSSBCTDO-QGZVFWFLSA-N 1 0 324.468 4.460 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)c(O)c1 ZINC000285148847 131142797 /nfs/dbraw/zinc/14/27/97/131142797.db2.gz MCKNVQLNZGGAMQ-BBRMVZONSA-N 1 0 315.388 4.323 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000285304295 131156093 /nfs/dbraw/zinc/15/60/93/131156093.db2.gz SFBCWLQEHJUUJJ-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cncc2F)c(O)c1C ZINC000285540119 131178764 /nfs/dbraw/zinc/17/87/64/131178764.db2.gz DEPGWXNBLHGGKU-RYUDHWBXSA-N 1 0 306.356 4.094 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](CCO)c2ccc(Cl)cc2)c1 ZINC000287239776 131270562 /nfs/dbraw/zinc/27/05/62/131270562.db2.gz YRZMJAOWMQLQSC-SUMWQHHRSA-N 1 0 319.832 4.128 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCOc3c(Cl)cccc31)CC2 ZINC000297576296 132023386 /nfs/dbraw/zinc/02/33/86/132023386.db2.gz GXTSIFZFXIHHQO-CABCVRRESA-N 1 0 315.800 4.146 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000297470439 227210542 /nfs/dbraw/zinc/21/05/42/227210542.db2.gz YPCFAVFHXROJTB-QWHCGFSZSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C(C)(C)c2nc3ccccc3s2)c1 ZINC000527745407 331578542 /nfs/dbraw/zinc/57/85/42/331578542.db2.gz PORSXMTWUHIIBV-UHFFFAOYSA-N 1 0 312.438 4.335 20 10 DICDRO COc1cc(Cl)ccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185399833 333208245 /nfs/dbraw/zinc/20/82/45/333208245.db2.gz DLCVXKWBBITTTB-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1O ZINC000191860227 333283102 /nfs/dbraw/zinc/28/31/02/333283102.db2.gz SCLKIGBNVYESGA-QRFRQXIXSA-N 1 0 311.425 4.211 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1O ZINC000295938323 335138725 /nfs/dbraw/zinc/13/87/25/335138725.db2.gz GDUCWWIDLNBSFG-BLLLJJGKSA-N 1 0 300.358 4.102 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273464453 334047492 /nfs/dbraw/zinc/04/74/92/334047492.db2.gz IROPIQJTPQUEHB-WCQYABFASA-N 1 0 302.418 4.068 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C)cc1O ZINC000280231537 334115622 /nfs/dbraw/zinc/11/56/22/334115622.db2.gz VIUSEIODYFKSPR-SUMWQHHRSA-N 1 0 314.385 4.411 20 10 DICDRO CC[C@H]([NH2+]Cc1cccnc1)c1cc(Cl)cc(Cl)c1[O-] ZINC000286989667 334155449 /nfs/dbraw/zinc/15/54/49/334155449.db2.gz PAERAZYJPSUCCK-AWEZNQCLSA-N 1 0 311.212 4.335 20 10 DICDRO C[C@@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccc(N(C)C)cc1 ZINC000296272464 334231247 /nfs/dbraw/zinc/23/12/47/334231247.db2.gz DSEZXMUBVFXZGW-GFCCVEGCSA-N 1 0 323.362 4.017 20 10 DICDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000192790381 336261829 /nfs/dbraw/zinc/26/18/29/336261829.db2.gz KYZGVWMZNNFGJI-UONOGXRCSA-N 1 0 315.413 4.130 20 10 DICDRO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000192790355 336261856 /nfs/dbraw/zinc/26/18/56/336261856.db2.gz KYZGVWMZNNFGJI-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc(NC(C)=O)c1)c1ccccc1O ZINC000192947249 336285672 /nfs/dbraw/zinc/28/56/72/336285672.db2.gz JEITXJTUXYNAIB-ACJLOTCBSA-N 1 0 312.413 4.153 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cc(F)ccc1O ZINC000368234443 336840953 /nfs/dbraw/zinc/84/09/53/336840953.db2.gz KTWXBSZVMWPXIV-UKRRQHHQSA-N 1 0 307.409 4.064 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)c1 ZINC000373257118 336954656 /nfs/dbraw/zinc/95/46/56/336954656.db2.gz TWWUQQJHRLTVFA-VPWXQRGCSA-N 1 0 311.425 4.129 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCc3cnn(C(C)C)c32)c(O)c1 ZINC000375170607 337005057 /nfs/dbraw/zinc/00/50/57/337005057.db2.gz HTOFNPHODIUEKS-WMLDXEAASA-N 1 0 313.445 4.206 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3cnn(C(C)C)c32)c1 ZINC000375171311 337005196 /nfs/dbraw/zinc/00/51/96/337005196.db2.gz OCMLDNRTERCULZ-YOEHRIQHSA-N 1 0 313.445 4.206 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c(O)c1C ZINC000375346524 337008640 /nfs/dbraw/zinc/00/86/40/337008640.db2.gz ZQFVYZPSUHLKIK-CXAGYDPISA-N 1 0 315.388 4.323 20 10 DICDRO Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183549805 337192157 /nfs/dbraw/zinc/19/21/57/337192157.db2.gz NACDJHNZKFNHHG-GJZGRUSLSA-N 1 0 321.424 4.298 20 10 DICDRO C[C@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1ccccc1O ZINC000183634225 337193982 /nfs/dbraw/zinc/19/39/82/337193982.db2.gz LQUGNEGHXWYURB-VBKZILBWSA-N 1 0 322.383 4.367 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000136742540 337455002 /nfs/dbraw/zinc/45/50/02/337455002.db2.gz YNTWKKMGKDTXGR-HNNXBMFYSA-N 1 0 309.837 4.017 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)c(OC)c1 ZINC000320008460 337589385 /nfs/dbraw/zinc/58/93/85/337589385.db2.gz HTNTXOYMTONCKT-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cccc(F)c1F ZINC000527528691 337749356 /nfs/dbraw/zinc/74/93/56/337749356.db2.gz FQENMIHXHSJRRT-UHFFFAOYSA-N 1 0 300.352 4.055 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccnc1C)c1ccc(C(F)(F)F)cc1O ZINC000527988488 337778022 /nfs/dbraw/zinc/77/80/22/337778022.db2.gz SVFWCCBFPZPWPH-OAHLLOKOSA-N 1 0 324.346 4.355 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1O ZINC000236928039 341204656 /nfs/dbraw/zinc/20/46/56/341204656.db2.gz TWYRMHIZPOLMEM-MRXNPFEDSA-N 1 0 317.816 4.221 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000249332375 341396496 /nfs/dbraw/zinc/39/64/96/341396496.db2.gz WZJAVWVQRAJWFF-TUAOUCFPSA-N 1 0 317.351 4.173 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCC(C(F)(F)F)CC2)c1 ZINC000273385021 341635422 /nfs/dbraw/zinc/63/54/22/341635422.db2.gz JHYHNAFMTWYXIK-VOMCLLRMSA-N 1 0 317.351 4.173 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(COC)c1)c1ccc(N(C)C)cc1 ZINC000158535266 522653334 /nfs/dbraw/zinc/65/33/34/522653334.db2.gz BUAHCQNDDIMTJE-FQEVSTJZSA-N 1 0 312.457 4.140 20 10 DICDRO CC[C@H]([NH2+][C@@H](COC)c1ccc(F)c(F)c1)c1ccccc1O ZINC000157027986 522709004 /nfs/dbraw/zinc/70/90/04/522709004.db2.gz YHINSEFUNHQRTA-IRXDYDNUSA-N 1 0 321.367 4.099 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1O ZINC000158133057 522720358 /nfs/dbraw/zinc/72/03/58/522720358.db2.gz PMLGLSNOURAFIC-KPFFTGBYSA-N 1 0 311.425 4.353 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccc(OC)cc1 ZINC000192786267 522737876 /nfs/dbraw/zinc/73/78/76/522737876.db2.gz QFKDMEHUQLOPDM-ACJLOTCBSA-N 1 0 315.413 4.211 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1O ZINC000158133335 522759712 /nfs/dbraw/zinc/75/97/12/522759712.db2.gz PMLGLSNOURAFIC-QRFRQXIXSA-N 1 0 311.425 4.353 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1ccccc1O ZINC000364903628 522884852 /nfs/dbraw/zinc/88/48/52/522884852.db2.gz FFPVJSHXJXEMIC-LJQANCHMSA-N 1 0 321.424 4.034 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1O ZINC000156696970 522910655 /nfs/dbraw/zinc/91/06/55/522910655.db2.gz SVEXUPZZNGJBIW-XJKSGUPXSA-N 1 0 314.385 4.411 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1Cl ZINC000186120785 524074386 /nfs/dbraw/zinc/07/43/86/524074386.db2.gz CUCLVCZKZCWWFK-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3Cl)c1 ZINC000182471930 524765347 /nfs/dbraw/zinc/76/53/47/524765347.db2.gz ITMVCCOUJHTCFH-PIGZYNQJSA-N 1 0 317.816 4.392 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(-c2cccnc2)c1)c1cc(F)ccc1O ZINC000364172328 525454134 /nfs/dbraw/zinc/45/41/34/525454134.db2.gz XTDWALFSTOJLBM-AWEZNQCLSA-N 1 0 322.383 4.444 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)c1cc(F)ccc1O ZINC000158057345 525623698 /nfs/dbraw/zinc/62/36/98/525623698.db2.gz WFDXMSGLOZMHRL-AXHNFQJDSA-N 1 0 315.388 4.102 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOCC1)c1ccc(N2CCCCCC2)cc1 ZINC000183339173 525677619 /nfs/dbraw/zinc/67/76/19/525677619.db2.gz DHDDVMKXABJCLR-MJGOQNOKSA-N 1 0 316.489 4.287 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)CCC2 ZINC000364962688 527108834 /nfs/dbraw/zinc/10/88/34/527108834.db2.gz OPRQYGUWDHECDV-ZANVPECISA-N 1 0 306.406 4.024 20 10 DICDRO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273571656 536514359 /nfs/dbraw/zinc/51/43/59/536514359.db2.gz KVJKCTCRMWWQMJ-CHWSQXEVSA-N 1 0 320.458 4.024 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cnccc2C)cc1F ZINC000271572969 535686950 /nfs/dbraw/zinc/68/69/50/535686950.db2.gz XKQDCAQLNGGNTI-OAHLLOKOSA-N 1 0 315.436 4.226 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](CCOC)c2ccco2)cc1 ZINC000272485722 535765657 /nfs/dbraw/zinc/76/56/57/535765657.db2.gz BPXNCJMGIKXYGV-CRAIPNDOSA-N 1 0 316.445 4.164 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC2CCC(F)(F)CC2)c(Cl)c1 ZINC001620913548 1055536459 /nfs/dbraw/zinc/53/64/59/1055536459.db2.gz LHBNBYQSHYVJJS-UHFFFAOYSA-N 1 0 303.780 4.269 20 10 DICDRO Oc1ccccc1C[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000037073324 1035936134 /nfs/dbraw/zinc/93/61/34/1035936134.db2.gz NTKVASXRAIJOID-CQSZACIVSA-N 1 0 305.830 4.372 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[N@H+](C2CC2)C2CCCC2)c1[O-] ZINC001167363527 1036983070 /nfs/dbraw/zinc/98/30/70/1036983070.db2.gz AZIKVNKDOHGXEN-UHFFFAOYSA-N 1 0 307.821 4.155 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC000160542261 1037198048 /nfs/dbraw/zinc/19/80/48/1037198048.db2.gz ATFXKFAUKYSQLY-FQEVSTJZSA-N 1 0 311.473 4.060 20 10 DICDRO Oc1cccc(Br)c1C[NH2+]CCC1=CCCCC1 ZINC000706821774 1037476554 /nfs/dbraw/zinc/47/65/54/1037476554.db2.gz QOKHBLBCGFIINI-UHFFFAOYSA-N 1 0 310.235 4.135 20 10 DICDRO C[C@@H]([NH2+]Cc1c(O)cccc1Br)c1ccc(F)cc1 ZINC000706833789 1037480712 /nfs/dbraw/zinc/48/07/12/1037480712.db2.gz GTLVUBMOPMVFRT-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)c(O)c1C ZINC000834883760 1037698961 /nfs/dbraw/zinc/69/89/61/1037698961.db2.gz HCEKZPHDFYGAQV-RISCZKNCSA-N 1 0 302.245 4.244 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)c(O)c1C ZINC000834883761 1037699455 /nfs/dbraw/zinc/69/94/55/1037699455.db2.gz HCEKZPHDFYGAQV-SMDDNHRTSA-N 1 0 302.245 4.244 20 10 DICDRO Oc1cccc(Br)c1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC000707165590 1037874494 /nfs/dbraw/zinc/87/44/94/1037874494.db2.gz IUAVZCMWJMYBEV-OLZOCXBDSA-N 1 0 324.262 4.167 20 10 DICDRO CSCCCCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000229519070 1038359027 /nfs/dbraw/zinc/35/90/27/1038359027.db2.gz GEJBJADGECNBBS-UHFFFAOYSA-N 1 0 306.519 4.300 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)C[C@H](C)c2ccccc2)c1O ZINC001204581802 1038505348 /nfs/dbraw/zinc/50/53/48/1038505348.db2.gz WCTXPXUQWGKOOJ-ZDUSSCGKSA-N 1 0 319.832 4.290 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)cc1Cl ZINC001204585620 1038555135 /nfs/dbraw/zinc/55/51/35/1038555135.db2.gz VCTLEMUGGLKWEM-MRXNPFEDSA-N 1 0 315.844 4.419 20 10 DICDRO Cc1cccnc1[C@H]([NH2+]Cc1ccc(N(C)C)cc1)C(C)(C)C ZINC000934287950 1038578219 /nfs/dbraw/zinc/57/82/19/1038578219.db2.gz HBUBWEAJUWICOF-IBGZPJMESA-N 1 0 311.473 4.333 20 10 DICDRO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)C(C)(C)C ZINC000934287952 1038578952 /nfs/dbraw/zinc/57/89/52/1038578952.db2.gz HBUBWEAJUWICOF-LJQANCHMSA-N 1 0 311.473 4.333 20 10 DICDRO Cc1ncsc1C[N@@H+](C)Cc1cc(C(C)C)c(C)cc1O ZINC000172496512 1038613119 /nfs/dbraw/zinc/61/31/19/1038613119.db2.gz WSPXNAQSDNDITP-UHFFFAOYSA-N 1 0 304.459 4.221 20 10 DICDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000230664523 1038621317 /nfs/dbraw/zinc/62/13/17/1038621317.db2.gz YJQCKZGCMRYBBN-AEGPPILISA-N 1 0 301.455 4.480 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CCCCCCSC)c1O ZINC000230935788 1038649247 /nfs/dbraw/zinc/64/92/47/1038649247.db2.gz GLKFMCSZIGWKBO-UHFFFAOYSA-N 1 0 317.882 4.067 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1Br)c1ccccc1O ZINC000048819637 1038669793 /nfs/dbraw/zinc/66/97/93/1038669793.db2.gz WNJIXKQLXUBJPL-HNNXBMFYSA-N 1 0 320.230 4.396 20 10 DICDRO C[C@H]([NH2+]Cc1cc2c(cc1O)OCO2)c1cccc2ccccc21 ZINC000063255923 1038684385 /nfs/dbraw/zinc/68/43/85/1038684385.db2.gz YJQSBULSRKOJGX-ZDUSSCGKSA-N 1 0 321.376 4.125 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3cccc(C)c3)CC2)cc1 ZINC000174040651 1038849202 /nfs/dbraw/zinc/84/92/02/1038849202.db2.gz WWCCTIPAHDMHSJ-QGZVFWFLSA-N 1 0 324.468 4.323 20 10 DICDRO CCSCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000800492210 1038967702 /nfs/dbraw/zinc/96/77/02/1038967702.db2.gz FALXECOOHOADEJ-INIZCTEOSA-N 1 0 306.519 4.471 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H]2c3ccccc3CN2C)cc1C ZINC001203408643 1039119575 /nfs/dbraw/zinc/11/95/75/1039119575.db2.gz NEYJNQQURQWSAP-FQEVSTJZSA-N 1 0 324.468 4.060 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](c1ccccc1)N1CCCC1)c1ccccc1O ZINC000324040102 1039378694 /nfs/dbraw/zinc/37/86/94/1039378694.db2.gz RCDXELNEOAQEGZ-PMACEKPBSA-N 1 0 324.468 4.270 20 10 DICDRO Cc1ncc([C@@H](C)[NH2+]Cc2ccc(N3CCCCC3)cc2)s1 ZINC000761434053 1039501471 /nfs/dbraw/zinc/50/14/71/1039501471.db2.gz AERVTTCCMGSXSS-CQSZACIVSA-N 1 0 315.486 4.293 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)c(O)c1C ZINC000278524922 1039522289 /nfs/dbraw/zinc/52/22/89/1039522289.db2.gz SUHWTVBKLFBFAF-OAHLLOKOSA-N 1 0 310.441 4.134 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cccc(O)c2)cc1F ZINC000152186941 1039987649 /nfs/dbraw/zinc/98/76/49/1039987649.db2.gz KKVLDNPAHXJHID-CQSZACIVSA-N 1 0 316.420 4.228 20 10 DICDRO CCC[C@H](CCO)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152404104 1040067676 /nfs/dbraw/zinc/06/76/76/1040067676.db2.gz PFFQZVMWOBAAIV-ZWKOTPCHSA-N 1 0 318.505 4.126 20 10 DICDRO Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1ccccc1O ZINC000179583455 1040508550 /nfs/dbraw/zinc/50/85/50/1040508550.db2.gz BULFQUDRLYBENX-CYBMUJFWSA-N 1 0 304.459 4.474 20 10 DICDRO Cc1csc(CC[NH2+]Cc2cc(-c3ccccc3)ccc2O)n1 ZINC000725847345 1040718066 /nfs/dbraw/zinc/71/80/66/1040718066.db2.gz JCLYIABNYUAQNH-UHFFFAOYSA-N 1 0 324.449 4.156 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000780518551 1040726846 /nfs/dbraw/zinc/72/68/46/1040726846.db2.gz DNHWNBKEBXZXFI-UHFFFAOYSA-N 1 0 315.722 4.354 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ncccc1Cl ZINC000924572865 1040887214 /nfs/dbraw/zinc/88/72/14/1040887214.db2.gz FYVWOPQNMUPOEG-KRWDZBQOSA-N 1 0 317.864 4.432 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)c1ccc(N(C)C)cc1 ZINC000178120665 1040929894 /nfs/dbraw/zinc/92/98/94/1040929894.db2.gz QSBZTIWDOJPKLW-ORYQWCPZSA-N 1 0 324.468 4.324 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)CCO)c1ccc(N2CCCCCC2)cc1 ZINC000178164717 1040978201 /nfs/dbraw/zinc/97/82/01/1040978201.db2.gz RZNUZDXYZDEZAT-QGZVFWFLSA-N 1 0 318.505 4.126 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)C1CCOCC1 ZINC000808700180 1041007428 /nfs/dbraw/zinc/00/74/28/1041007428.db2.gz IQDGJQHJVYNMMU-MLGOLLRUSA-N 1 0 311.853 4.210 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)C1CCOCC1 ZINC000808700182 1041008417 /nfs/dbraw/zinc/00/84/17/1041008417.db2.gz IQDGJQHJVYNMMU-WBMJQRKESA-N 1 0 311.853 4.210 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1cccc(Cl)c1 ZINC000808732361 1041020506 /nfs/dbraw/zinc/02/05/06/1041020506.db2.gz JYUBMZYOACSUEH-DYVFJYSZSA-N 1 0 319.832 4.392 20 10 DICDRO CC[C@H]([NH2+][C@@H](COC)c1cccc(Cl)c1)c1ccccc1O ZINC000808733328 1041020675 /nfs/dbraw/zinc/02/06/75/1041020675.db2.gz UUQLCPLIVMSQIB-IRXDYDNUSA-N 1 0 319.832 4.474 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccsc1 ZINC000178204874 1041085055 /nfs/dbraw/zinc/08/50/55/1041085055.db2.gz GWGQDXAOMLGUJR-AWEZNQCLSA-N 1 0 318.511 4.152 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c1 ZINC000809693779 1041214035 /nfs/dbraw/zinc/21/40/35/1041214035.db2.gz BTAQOILCOVZZDL-ZCNNSNEGSA-N 1 0 323.436 4.169 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)c1 ZINC000809693776 1041216292 /nfs/dbraw/zinc/21/62/92/1041216292.db2.gz BTAQOILCOVZZDL-AQNXPRMDSA-N 1 0 323.436 4.169 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1O ZINC000809728551 1041222909 /nfs/dbraw/zinc/22/29/09/1041222909.db2.gz BBVMXTFUMHVZJE-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)[C@@H](C)c2ccc(Cl)cc2)c1O ZINC000809739896 1041240071 /nfs/dbraw/zinc/24/00/71/1041240071.db2.gz GEJVBZPPPVJUTI-CHWSQXEVSA-N 1 0 319.832 4.336 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)c1O ZINC000809739713 1041241821 /nfs/dbraw/zinc/24/18/21/1041241821.db2.gz BWGLWGUCMVMCLC-ROUUACIJSA-N 1 0 311.425 4.217 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](Cc2cccnc2)C2CC2)cc1 ZINC000809763741 1041248465 /nfs/dbraw/zinc/24/84/65/1041248465.db2.gz QNHUBWQTCADKKL-UHFFFAOYSA-N 1 0 309.457 4.092 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c1 ZINC000809782682 1041253266 /nfs/dbraw/zinc/25/32/66/1041253266.db2.gz CZCVEBSELZJHFL-UHFFFAOYSA-N 1 0 306.409 4.061 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+](C)C2CCC(F)(F)CC2)c1O ZINC000809782261 1041254222 /nfs/dbraw/zinc/25/42/22/1041254222.db2.gz MNNMNNHJTSOKGI-UHFFFAOYSA-N 1 0 303.780 4.364 20 10 DICDRO CC[C@@H]([NH2+]Cc1nccs1)c1ccc(C(F)(F)F)cc1O ZINC000810211312 1041336868 /nfs/dbraw/zinc/33/68/68/1041336868.db2.gz PNAPCYCBQCKFAE-LLVKDONJSA-N 1 0 316.348 4.108 20 10 DICDRO CC[C@@H]([NH2+]C[C@]1(C)CCCO1)c1ccc(C(F)(F)F)cc1O ZINC000810222161 1041339789 /nfs/dbraw/zinc/33/97/89/1041339789.db2.gz OHWGJTDZXXFZKJ-HIFRSBDPSA-N 1 0 317.351 4.021 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCSC1)c1ccc(C(F)(F)F)cc1O ZINC000810221150 1041339974 /nfs/dbraw/zinc/33/99/74/1041339974.db2.gz LQSHGXXNCPBAND-WCQYABFASA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCCS1)c1ccc(C(F)(F)F)cc1O ZINC000810223676 1041342221 /nfs/dbraw/zinc/34/22/21/1041342221.db2.gz NYVSKRXILWTRDU-DGCLKSJQSA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@H]([NH2+]CC1(SC)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810237829 1041353438 /nfs/dbraw/zinc/35/34/38/1041353438.db2.gz KMKPYFPZIANECV-LBPRGKRZSA-N 1 0 319.392 4.347 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1cc(F)ccc1O ZINC000810250968 1041358085 /nfs/dbraw/zinc/35/80/85/1041358085.db2.gz QZYFMDCWIHSGJV-CRFBAAHOSA-N 1 0 315.388 4.102 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)nc1C ZINC000314341993 1041447220 /nfs/dbraw/zinc/44/72/20/1041447220.db2.gz VCYQAIAQGSEEFX-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)CCC2 ZINC000363868992 1041587065 /nfs/dbraw/zinc/58/70/65/1041587065.db2.gz PPYBZEJSDGMHTB-RISCZKNCSA-N 1 0 302.443 4.194 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](CN2CCCC2)c2ccccc2)c(O)c1 ZINC000184919789 1041601403 /nfs/dbraw/zinc/60/14/03/1041601403.db2.gz ICUXCPGAMMFKMM-FXAWDEMLSA-N 1 0 324.468 4.188 20 10 DICDRO C[C@H]([NH2+]Cc1cncc(C(F)(F)F)c1)c1ccc(N(C)C)cc1 ZINC000812835086 1041654470 /nfs/dbraw/zinc/65/44/70/1041654470.db2.gz LJESCCLBGSKRSR-LBPRGKRZSA-N 1 0 323.362 4.017 20 10 DICDRO Cc1cc(CC[NH2+]Cc2cccnc2C)c(C)n1-c1ccccc1 ZINC000728775144 1041672955 /nfs/dbraw/zinc/67/29/55/1041672955.db2.gz NXFKNIYBHSBBCF-UHFFFAOYSA-N 1 0 319.452 4.130 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCc2ccccc2F)c1 ZINC000813330976 1041697659 /nfs/dbraw/zinc/69/76/59/1041697659.db2.gz KOXMLQXTDBKRSE-KBPBESRZSA-N 1 0 317.404 4.212 20 10 DICDRO CSCc1cccc(C[NH2+]Cc2cc(C)c(C)cc2O)c1 ZINC000189482740 1041703281 /nfs/dbraw/zinc/70/32/81/1041703281.db2.gz OYZRTYYHCYEKIR-UHFFFAOYSA-N 1 0 301.455 4.162 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1C(F)(F)F)CC2 ZINC000319183629 1041714919 /nfs/dbraw/zinc/71/49/19/1041714919.db2.gz AQCZOGAFQDXGLQ-AWEZNQCLSA-N 1 0 307.315 4.188 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2cccc(SCC)c2)c1 ZINC000813791149 1041732158 /nfs/dbraw/zinc/73/21/58/1041732158.db2.gz VVJHKGFSPFDEPY-UHFFFAOYSA-N 1 0 317.454 4.193 20 10 DICDRO CC[C@@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccccc1O ZINC000192874111 1041755688 /nfs/dbraw/zinc/75/56/88/1041755688.db2.gz BSDSSKGKOPDANY-HXUWFJFHSA-N 1 0 324.468 4.098 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1ccccc1O ZINC000364356938 1041761830 /nfs/dbraw/zinc/76/18/30/1041761830.db2.gz CEWDTPIWUCZVGZ-IMFGXOCKSA-N 1 0 311.425 4.211 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C(C)(C)c2ccccc2F)c1O ZINC000814178317 1041780794 /nfs/dbraw/zinc/78/07/94/1041780794.db2.gz LOFMEMKXKASRIA-UHFFFAOYSA-N 1 0 323.795 4.218 20 10 DICDRO C[C@]12CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]1C2(F)F ZINC000814169292 1041783401 /nfs/dbraw/zinc/78/34/01/1041783401.db2.gz GCIWSOXDNAVGFS-MSOLQXFVSA-N 1 0 320.427 4.154 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(Cl)cc1 ZINC000194254939 1041786273 /nfs/dbraw/zinc/78/62/73/1041786273.db2.gz LEMWHOMLVIHOTD-DYVFJYSZSA-N 1 0 319.832 4.392 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c1O ZINC000814225989 1041794404 /nfs/dbraw/zinc/79/44/04/1041794404.db2.gz NKEWOCXGCKGEOC-QGZVFWFLSA-N 1 0 311.425 4.089 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2ccccc2c1O ZINC000194619447 1041828566 /nfs/dbraw/zinc/82/85/66/1041828566.db2.gz RKEOHMGUBROPMH-CYBMUJFWSA-N 1 0 322.364 4.304 20 10 DICDRO Cc1cc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)ccc1N(C)C ZINC000815086514 1041913825 /nfs/dbraw/zinc/91/38/25/1041913825.db2.gz LBDIOWVPBCCXCN-HIFRSBDPSA-N 1 0 314.395 4.224 20 10 DICDRO CCN(C)c1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)cc1 ZINC000815112763 1041913859 /nfs/dbraw/zinc/91/38/59/1041913859.db2.gz AOXGEHVPNQVTIU-UHFFFAOYSA-N 1 0 314.395 4.307 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000815122626 1041915082 /nfs/dbraw/zinc/91/50/82/1041915082.db2.gz PMSZLQIGQNMJGQ-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO Cc1cc(C[NH2+][C@@H](CC(F)(F)F)C(C)C)ccc1N(C)C ZINC000815099596 1041919603 /nfs/dbraw/zinc/91/96/03/1041919603.db2.gz LQUYDTKYFXSJJR-AWEZNQCLSA-N 1 0 302.384 4.128 20 10 DICDRO COc1ccc(N2CCC([NH2+]CCC(C)(C)C3CC3)CC2)cc1 ZINC000815162549 1041922773 /nfs/dbraw/zinc/92/27/73/1041922773.db2.gz HGEHGGZOZKZVJL-UHFFFAOYSA-N 1 0 316.489 4.080 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1O)c1cccc(Cl)c1 ZINC000756734772 1041950087 /nfs/dbraw/zinc/95/00/87/1041950087.db2.gz ZOJSZGADQMZIKK-ACJLOTCBSA-N 1 0 319.832 4.392 20 10 DICDRO CCOCCC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815552985 1041961613 /nfs/dbraw/zinc/96/16/13/1041961613.db2.gz OYNKVJFJUQQZAS-IBGZPJMESA-N 1 0 313.441 4.082 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cc1F ZINC000815577003 1041966432 /nfs/dbraw/zinc/96/64/32/1041966432.db2.gz DPBVGDFZCNREAD-CQSZACIVSA-N 1 0 317.404 4.398 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCSc2nccs2)c(O)c1 ZINC000815581781 1041967455 /nfs/dbraw/zinc/96/74/55/1041967455.db2.gz PHQRENRAZMGPKO-CYBMUJFWSA-N 1 0 322.499 4.299 20 10 DICDRO COC(C)(C)C[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815588969 1041968439 /nfs/dbraw/zinc/96/84/39/1041968439.db2.gz FBLHIINBBFRPLX-GOSISDBHSA-N 1 0 313.441 4.081 20 10 DICDRO CC[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cccc(Cl)c1[O-] ZINC000815647370 1041984302 /nfs/dbraw/zinc/98/43/02/1041984302.db2.gz IHCDPGZRERYUQD-QGZVFWFLSA-N 1 0 324.896 4.352 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)cc(F)cc2F)c(O)c1C ZINC000815650120 1041985320 /nfs/dbraw/zinc/98/53/20/1041985320.db2.gz JAZOULSDJNSFSU-LLVKDONJSA-N 1 0 309.331 4.277 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)c1O ZINC000748051443 1042031481 /nfs/dbraw/zinc/03/14/81/1042031481.db2.gz XJYIMJBHGFNTJV-LLVKDONJSA-N 1 0 319.351 4.066 20 10 DICDRO COCC[N@H+](Cc1ccccc1)Cc1ccc2ccccc2c1O ZINC000816481349 1042056086 /nfs/dbraw/zinc/05/60/86/1042056086.db2.gz RKRHYNXULOTOKR-UHFFFAOYSA-N 1 0 321.420 4.194 20 10 DICDRO CCCO[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000816508826 1042061076 /nfs/dbraw/zinc/06/10/76/1042061076.db2.gz WADYTYOLTHMQEF-SFHVURJKSA-N 1 0 313.441 4.327 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)Oc1ccccc1 ZINC000816551395 1042064796 /nfs/dbraw/zinc/06/47/96/1042064796.db2.gz ABTDRKHZDUPOGT-HNNXBMFYSA-N 1 0 307.393 4.103 20 10 DICDRO Oc1c(C[NH2+]CCc2ccc(F)cc2F)ccc2ccccc21 ZINC000816549363 1042064885 /nfs/dbraw/zinc/06/48/85/1042064885.db2.gz LXWOASFTMCYXQW-UHFFFAOYSA-N 1 0 313.347 4.156 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+]Cc1ccc2ccccc2c1O ZINC000816557863 1042066912 /nfs/dbraw/zinc/06/69/12/1042066912.db2.gz DZKJSGAQPQDTKV-GFCCVEGCSA-N 1 0 310.397 4.044 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC000816558068 1042067176 /nfs/dbraw/zinc/06/71/76/1042067176.db2.gz MANFKESYQLLHMT-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO CCCCn1cc(C[NH2+]Cc2ccc3ccccc3c2O)c(C)n1 ZINC000816560249 1042068994 /nfs/dbraw/zinc/06/89/94/1042068994.db2.gz JIZDKUOYQYRJDF-UHFFFAOYSA-N 1 0 323.440 4.140 20 10 DICDRO COc1cccc2c1CC[N@H+](Cc1ccc3ccccc3c1O)C2 ZINC000816567210 1042069024 /nfs/dbraw/zinc/06/90/24/1042069024.db2.gz UIIJPEBLDQXLKL-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816559628 1042069216 /nfs/dbraw/zinc/06/92/16/1042069216.db2.gz PSHSQNGKIKDQLM-WMZOPIPTSA-N 1 0 313.441 4.229 20 10 DICDRO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816560678 1042069227 /nfs/dbraw/zinc/06/92/27/1042069227.db2.gz XGBZDIWYSFZPIJ-ROUUACIJSA-N 1 0 313.441 4.229 20 10 DICDRO Cc1cnc([C@@H](C)C[NH2+]Cc2ccc3ccccc3c2O)s1 ZINC000816569267 1042069372 /nfs/dbraw/zinc/06/93/72/1042069372.db2.gz FGESJKWSSIVLSG-LBPRGKRZSA-N 1 0 312.438 4.204 20 10 DICDRO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816594974 1042070655 /nfs/dbraw/zinc/07/06/55/1042070655.db2.gz VBIBDROTVYFHEQ-ABAIWWIYSA-N 1 0 309.331 4.318 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1O ZINC000816631528 1042070829 /nfs/dbraw/zinc/07/08/29/1042070829.db2.gz VIGFHNWWBHEUCA-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO Oc1c(C[NH2+]CCc2ccc3[nH]ccc3c2)ccc2ccccc21 ZINC000816599675 1042071781 /nfs/dbraw/zinc/07/17/81/1042071781.db2.gz UWXUJHYVARBQNK-UHFFFAOYSA-N 1 0 316.404 4.359 20 10 DICDRO Oc1c(C[NH2+]CCc2cccc3[nH]ccc32)ccc2ccccc21 ZINC000816600030 1042072310 /nfs/dbraw/zinc/07/23/10/1042072310.db2.gz IAPOLTVGCWSWSW-UHFFFAOYSA-N 1 0 316.404 4.359 20 10 DICDRO C[C@@]12CC[N@H+](Cc3ccc4ccccc4c3O)C[C@@H]1C2(F)F ZINC000816617150 1042073683 /nfs/dbraw/zinc/07/36/83/1042073683.db2.gz POUCRBCKRRVHID-DOTOQJQBSA-N 1 0 303.352 4.023 20 10 DICDRO CC[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CCO1 ZINC000817585679 1042118352 /nfs/dbraw/zinc/11/83/52/1042118352.db2.gz GUYLNJWGZLBTKM-YVWKXTFCSA-N 1 0 316.489 4.285 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC23CCSCC3)c(O)c1C ZINC000817589940 1042119656 /nfs/dbraw/zinc/11/96/56/1042119656.db2.gz RIYCLYRFULWSCV-CABCVRRESA-N 1 0 305.487 4.193 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1cccc(OC(F)(F)F)c1 ZINC000817956052 1042131615 /nfs/dbraw/zinc/13/16/15/1042131615.db2.gz PALOXQPYPWVCMY-GFCCVEGCSA-N 1 0 324.346 4.061 20 10 DICDRO CCSc1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955613 1042131748 /nfs/dbraw/zinc/13/17/48/1042131748.db2.gz CVJHYHDUDTZMBV-AWEZNQCLSA-N 1 0 300.471 4.274 20 10 DICDRO C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]CCc1ccc(N)cc1 ZINC000817957826 1042132545 /nfs/dbraw/zinc/13/25/45/1042132545.db2.gz PJSFHNPFGMGONE-ZDUSSCGKSA-N 1 0 322.374 4.051 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1OC(F)F ZINC000817956358 1042132582 /nfs/dbraw/zinc/13/25/82/1042132582.db2.gz XEYQKDPZDKNFHA-INIZCTEOSA-N 1 0 320.383 4.154 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000817957641 1042132711 /nfs/dbraw/zinc/13/27/11/1042132711.db2.gz NSIGDZZTRSIGSA-BYCMXARLSA-N 1 0 320.889 4.308 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@H](C)c1ccc(Cl)cc1 ZINC000817957848 1042132844 /nfs/dbraw/zinc/13/28/44/1042132844.db2.gz PUGUNLIQCYUYDD-UONOGXRCSA-N 1 0 302.849 4.247 20 10 DICDRO CC(C)[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(F)c(F)c1 ZINC000817957012 1042132859 /nfs/dbraw/zinc/13/28/59/1042132859.db2.gz HIWJBNFAFWXDBO-GOSISDBHSA-N 1 0 304.384 4.076 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000817967546 1042133225 /nfs/dbraw/zinc/13/32/25/1042133225.db2.gz KEKWNNFPFXJFFH-BTYIYWSLSA-N 1 0 323.484 4.453 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000817968609 1042134705 /nfs/dbraw/zinc/13/47/05/1042134705.db2.gz UUEBLDBIHLOTTC-JLTOFOAXSA-N 1 0 309.457 4.063 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000817968616 1042134897 /nfs/dbraw/zinc/13/48/97/1042134897.db2.gz UUEBLDBIHLOTTC-XOBRGWDASA-N 1 0 309.457 4.063 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1[O-] ZINC000817983356 1042135596 /nfs/dbraw/zinc/13/55/96/1042135596.db2.gz MQNWUTMNGMFYDD-ROUUACIJSA-N 1 0 316.420 4.052 20 10 DICDRO Cc1cc(N)cc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000817980229 1042136073 /nfs/dbraw/zinc/13/60/73/1042136073.db2.gz JWJQPCZVKRBSLU-GFCCVEGCSA-N 1 0 304.821 4.095 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3cccc(Cl)c3C2)cc1 ZINC001170907704 1042154006 /nfs/dbraw/zinc/15/40/06/1042154006.db2.gz KDXRCXIWJAUQHY-MRXNPFEDSA-N 1 0 314.860 4.053 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1ccc(N(C)C)cc1 ZINC000165494812 1042157919 /nfs/dbraw/zinc/15/79/19/1042157919.db2.gz NDEJZFSYLUEUCB-MRXNPFEDSA-N 1 0 303.837 4.042 20 10 DICDRO C[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc2ccccc2c1O ZINC000121991784 1042160202 /nfs/dbraw/zinc/16/02/02/1042160202.db2.gz IVVKIAVJRFWVMX-FZKQIMNGSA-N 1 0 301.455 4.482 20 10 DICDRO c1cc(N2CCSCC2)ccc1C[NH2+]C1CCCCCC1 ZINC000236583402 1042369424 /nfs/dbraw/zinc/36/94/24/1042369424.db2.gz FPMNDCUADSMNGR-UHFFFAOYSA-N 1 0 304.503 4.052 20 10 DICDRO CC(C)COc1ccc(C(C)(C)[NH2+]Cc2ccccc2O)cc1 ZINC000236666882 1042370676 /nfs/dbraw/zinc/37/06/76/1042370676.db2.gz UTXGRLVEOMZHOH-UHFFFAOYSA-N 1 0 313.441 4.452 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccc(C)cc1O ZINC000279930473 1042385832 /nfs/dbraw/zinc/38/58/32/1042385832.db2.gz AQMPFBPNAVBSBY-GZBFAFLISA-N 1 0 316.449 4.134 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(Cl)cc2)c1O ZINC000894146796 1042472527 /nfs/dbraw/zinc/47/25/27/1042472527.db2.gz XEPRVKCYAZNHTH-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1O)c1csc(C(F)(F)F)c1 ZINC000924902652 1042540578 /nfs/dbraw/zinc/54/05/78/1042540578.db2.gz PYLGTYMJTLOFPD-VIFPVBQESA-N 1 0 301.333 4.323 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccc(C)cc1O ZINC000280013087 1042560599 /nfs/dbraw/zinc/56/05/99/1042560599.db2.gz GWFGGRXEWFSNFK-SJORKVTESA-N 1 0 315.388 4.404 20 10 DICDRO CC[C@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccc(C)cc1O ZINC000280036728 1042562185 /nfs/dbraw/zinc/56/21/85/1042562185.db2.gz IMYJIWDEJJAPND-JKSUJKDBSA-N 1 0 303.402 4.030 20 10 DICDRO CC[C@H]([NH2+]Cc1csc([C@H](C)OC)n1)c1ccc(C)cc1O ZINC000280097803 1042564398 /nfs/dbraw/zinc/56/43/98/1042564398.db2.gz MXGVRZGPDLORME-WFASDCNBSA-N 1 0 320.458 4.105 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccc(C)cc1O ZINC000280156270 1042566195 /nfs/dbraw/zinc/56/61/95/1042566195.db2.gz QLDYBWQHZROMOQ-IAGOWNOFSA-N 1 0 315.388 4.404 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(-n2cccn2)cc1)c1ccc(C)cc1O ZINC000280245565 1042568049 /nfs/dbraw/zinc/56/80/49/1042568049.db2.gz WGVJYOVPIOLJPU-IBGZPJMESA-N 1 0 321.424 4.127 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000237126376 1042678381 /nfs/dbraw/zinc/67/83/81/1042678381.db2.gz KMQNLKHHUNACKP-UHFFFAOYSA-N 1 0 324.468 4.064 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)cc1F ZINC000237129051 1042686679 /nfs/dbraw/zinc/68/66/79/1042686679.db2.gz SUIZULKWFMKBKP-UHFFFAOYSA-N 1 0 324.399 4.442 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2CCCc3c(F)cccc32)c1O ZINC000894868200 1042994173 /nfs/dbraw/zinc/99/41/73/1042994173.db2.gz POIKZDYQMYRISP-QGZVFWFLSA-N 1 0 315.388 4.016 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(C)cc1O ZINC000794807286 1043050599 /nfs/dbraw/zinc/05/05/99/1043050599.db2.gz XFZFLYPXANSWMW-LJQANCHMSA-N 1 0 324.468 4.324 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2OC)c1ccc(C)cc1O ZINC000794811284 1043056395 /nfs/dbraw/zinc/05/63/95/1043056395.db2.gz PEDQSZPFCCYWNN-ZWKOTPCHSA-N 1 0 311.425 4.437 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccnc(SC)c1)c1ccc(C)cc1O ZINC000794811338 1043056571 /nfs/dbraw/zinc/05/65/71/1043056571.db2.gz POVNGQOZKSXHRZ-OAHLLOKOSA-N 1 0 302.443 4.058 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](CC)c2ccc(C)cc2O)cn1 ZINC000794809045 1043057292 /nfs/dbraw/zinc/05/72/92/1043057292.db2.gz PPUHIVPDSYWIGE-KRWDZBQOSA-N 1 0 314.429 4.125 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2c1cccc2OC)c1ccc(C)cc1O ZINC000794810953 1043058009 /nfs/dbraw/zinc/05/80/09/1043058009.db2.gz PEDQSZPFCCYWNN-MSOLQXFVSA-N 1 0 311.425 4.437 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](CC(C)C)C1)c1ccc(C)cc1O ZINC000794813887 1043059076 /nfs/dbraw/zinc/05/90/76/1043059076.db2.gz QLLCUAOLIMBBBW-BQFCYCMXSA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(C)cc1O ZINC000794815299 1043059237 /nfs/dbraw/zinc/05/92/37/1043059237.db2.gz JTHLQZDGBYNVGB-SFHVURJKSA-N 1 0 313.445 4.253 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(C)cc1O ZINC000794815205 1043059644 /nfs/dbraw/zinc/05/96/44/1043059644.db2.gz JLCXTJNGRPXZBU-QKNQBKEWSA-N 1 0 324.468 4.187 20 10 DICDRO CC[C@H]([NH2+]CCC[C@@H]1CCCC[C@H]1O)c1ccc(C)cc1O ZINC000794815349 1043059875 /nfs/dbraw/zinc/05/98/75/1043059875.db2.gz KCJJRHCCCOQTEZ-RYQLBKOJSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12)c1ccc(C)cc1O ZINC000794817740 1043062022 /nfs/dbraw/zinc/06/20/22/1043062022.db2.gz PUCGUVBWPWZPET-HDEZJCGLSA-N 1 0 323.527 4.121 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C)cc1O ZINC000794818501 1043062184 /nfs/dbraw/zinc/06/21/84/1043062184.db2.gz SYIYJQJSBBDJIX-XJKSGUPXSA-N 1 0 314.385 4.411 20 10 DICDRO CC[C@@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1ccc(C)cc1O ZINC000794818583 1043062573 /nfs/dbraw/zinc/06/25/73/1043062573.db2.gz VKCXLHLDYZPQKO-MRXNPFEDSA-N 1 0 321.461 4.253 20 10 DICDRO CC[C@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1ccc(C)cc1O ZINC000794818449 1043063038 /nfs/dbraw/zinc/06/30/38/1043063038.db2.gz XDHNJWFWHRRRQE-HKUYNNGSSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@H]([NH2+]CCC1CCC(OC)CC1)c1ccc(C)cc1O ZINC000794820044 1043063786 /nfs/dbraw/zinc/06/37/86/1043063786.db2.gz ZZYDTBLZLLVCGU-HTWSVDAQSA-N 1 0 305.462 4.337 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)c1ccc(C)cc1O ZINC000794820176 1043064074 /nfs/dbraw/zinc/06/40/74/1043064074.db2.gz YFCZOJWRXLSGRF-SJLPKXTDSA-N 1 0 305.462 4.337 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)c1ccc(C)cc1O ZINC000794819906 1043065210 /nfs/dbraw/zinc/06/52/10/1043065210.db2.gz YFCZOJWRXLSGRF-FUHWJXTLSA-N 1 0 305.462 4.337 20 10 DICDRO COCCC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1ccccc1O ZINC000794827500 1043065885 /nfs/dbraw/zinc/06/58/85/1043065885.db2.gz ZJYXGSWWWLUKGV-SJLPKXTDSA-N 1 0 313.441 4.081 20 10 DICDRO CCOCCC1(C[NH2+][C@H](CC)c2ccc(C)cc2O)CCC1 ZINC000794819821 1043066350 /nfs/dbraw/zinc/06/63/50/1043066350.db2.gz XXPBEMVTUFIZRZ-QGZVFWFLSA-N 1 0 305.462 4.338 20 10 DICDRO CCC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)[C@H](O)c1ccccc1 ZINC000794832484 1043069000 /nfs/dbraw/zinc/06/90/00/1043069000.db2.gz SRNGIHDMOZWPHW-ZAAXVRCTSA-N 1 0 313.441 4.254 20 10 DICDRO CCC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)[C@@H](O)c1ccccc1 ZINC000794832483 1043069317 /nfs/dbraw/zinc/06/93/17/1043069317.db2.gz SRNGIHDMOZWPHW-QSFXBCCZSA-N 1 0 313.441 4.254 20 10 DICDRO CCN(CC)[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000794834961 1043081850 /nfs/dbraw/zinc/08/18/50/1043081850.db2.gz YHPHADXWOXLXJU-MSOLQXFVSA-N 1 0 317.521 4.058 20 10 DICDRO C[C@@H]([NH2+]Cc1cccnc1F)c1ccc(N2CCCCC2)cc1 ZINC000794837021 1043098691 /nfs/dbraw/zinc/09/86/91/1043098691.db2.gz TXRYGFXNHVKROX-OAHLLOKOSA-N 1 0 313.420 4.062 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)cc1 ZINC000777310035 1043099265 /nfs/dbraw/zinc/09/92/65/1043099265.db2.gz RONCKLKNGXELLT-HQRMLTQVSA-N 1 0 318.505 4.387 20 10 DICDRO C[C@H]([NH2+]Cc1cnc2c(F)cccc2c1)c1ccc(N(C)C)cc1 ZINC000865531748 1043109917 /nfs/dbraw/zinc/10/99/17/1043109917.db2.gz NJTJQTDLBFCKHS-AWEZNQCLSA-N 1 0 323.415 4.291 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(CO)c1)c1ccc(N2CCCCC2)cc1 ZINC000177838238 1043115025 /nfs/dbraw/zinc/11/50/25/1043115025.db2.gz RJLXQFUNJZHIFC-KRWDZBQOSA-N 1 0 324.468 4.020 20 10 DICDRO Cc1nn(-c2ccccc2)c(C)c1C[NH2+][C@H](C)c1ccccc1O ZINC000183386365 1043163407 /nfs/dbraw/zinc/16/34/07/1043163407.db2.gz WCEMYQIYJDDNKS-CQSZACIVSA-N 1 0 321.424 4.046 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOc2c(Cl)cccc21)c1ccccc1O ZINC000183459062 1043164507 /nfs/dbraw/zinc/16/45/07/1043164507.db2.gz NQZQSYHVDZBABZ-NHYWBVRUSA-N 1 0 303.789 4.220 20 10 DICDRO Cc1ccc(-c2nc(CC[NH2+][C@H](C)c3ccccc3O)co2)cc1 ZINC000183481383 1043165235 /nfs/dbraw/zinc/16/52/35/1043165235.db2.gz DSGYIQUJSFSQRD-OAHLLOKOSA-N 1 0 322.408 4.249 20 10 DICDRO Cc1cc(C)n(-c2ccccc2C[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000183561962 1043166610 /nfs/dbraw/zinc/16/66/10/1043166610.db2.gz PCHTYWFGBOUENO-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)cc1[N+](=O)[O-] ZINC000183614548 1043168450 /nfs/dbraw/zinc/16/84/50/1043168450.db2.gz FKGOCHKLXAUFSX-CHWSQXEVSA-N 1 0 300.358 4.021 20 10 DICDRO C[C@@H]([NH2+]CCc1csc(C(C)(C)C)n1)c1ccccc1O ZINC000183633988 1043168534 /nfs/dbraw/zinc/16/85/34/1043168534.db2.gz SOKBMBPCEANHIS-GFCCVEGCSA-N 1 0 304.459 4.040 20 10 DICDRO CCS[C@H]1CCCC[N@H+](Cc2ccc(N(C)CC)cc2)C1 ZINC001307465297 1043178113 /nfs/dbraw/zinc/17/81/13/1043178113.db2.gz RIAJKOVZUOWJNI-SFHVURJKSA-N 1 0 306.519 4.250 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1F ZINC000184927560 1043192232 /nfs/dbraw/zinc/19/22/32/1043192232.db2.gz GEWDGFQPKPPUCO-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO C[C@H]([NH2+]Cc1ccsc1C(F)(F)F)c1cc(F)ccc1O ZINC000866406016 1043197880 /nfs/dbraw/zinc/19/78/80/1043197880.db2.gz PXBWEPWOHWPZIF-QMMMGPOBSA-N 1 0 319.323 4.462 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1F ZINC000185383183 1043200014 /nfs/dbraw/zinc/20/00/14/1043200014.db2.gz ZREFPFJGPZOUSR-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC000185334939 1043200047 /nfs/dbraw/zinc/20/00/47/1043200047.db2.gz WNZJMOYFURMWCK-MDYRTPRTSA-N 1 0 311.425 4.272 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC000185334972 1043200070 /nfs/dbraw/zinc/20/00/70/1043200070.db2.gz WNZJMOYFURMWCK-SYNHAJSKSA-N 1 0 311.425 4.272 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccc(-n3cccn3)c2)c1 ZINC000185616376 1043204056 /nfs/dbraw/zinc/20/40/56/1043204056.db2.gz GMTOWYYEDQKLPO-JKSUJKDBSA-N 1 0 321.424 4.298 20 10 DICDRO CC(C)[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1cccnc1 ZINC000185661274 1043207251 /nfs/dbraw/zinc/20/72/51/1043207251.db2.gz LCTVWFBEDQMJDW-SUMWQHHRSA-N 1 0 302.393 4.017 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21)c1ccc2ccccc2c1O ZINC000185772747 1043207418 /nfs/dbraw/zinc/20/74/18/1043207418.db2.gz IDDHLXYSBYOVMV-BYNBJNPRSA-N 1 0 311.425 4.154 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c(O)c1 ZINC000186010135 1043213239 /nfs/dbraw/zinc/21/32/39/1043213239.db2.gz PIFMLGSSTXIVLK-LRDDRELGSA-N 1 0 301.361 4.014 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c1 ZINC000186009254 1043213344 /nfs/dbraw/zinc/21/33/44/1043213344.db2.gz PNXADIXHINRFIZ-WBMJQRKESA-N 1 0 301.361 4.014 20 10 DICDRO C[C@@H]([NH2+]CCCc1ccccn1)c1ccc2ccccc2c1O ZINC000186140766 1043214331 /nfs/dbraw/zinc/21/43/31/1043214331.db2.gz GMSXOOJUEMYAPA-OAHLLOKOSA-N 1 0 306.409 4.224 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)c1 ZINC000186207915 1043216205 /nfs/dbraw/zinc/21/62/05/1043216205.db2.gz PESKDXUAAIWQGL-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)c1 ZINC000186207947 1043217277 /nfs/dbraw/zinc/21/72/77/1043217277.db2.gz PESKDXUAAIWQGL-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccccc1O ZINC000186268744 1043218504 /nfs/dbraw/zinc/21/85/04/1043218504.db2.gz JMLQXURCIVIYSM-JKSUJKDBSA-N 1 0 301.361 4.096 20 10 DICDRO C[C@@H]([NH2+][C@H]1CC12CCCC2)c1ccc(Br)cc1O ZINC000760039206 1043219989 /nfs/dbraw/zinc/21/99/89/1043219989.db2.gz DERNIJWXSSKUIB-YGRLFVJLSA-N 1 0 310.235 4.138 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CC12CCCC2)c1cc(Br)ccc1O ZINC000760040487 1043228663 /nfs/dbraw/zinc/22/86/63/1043228663.db2.gz KSYKILUBPXXCIL-QMTHXVAHSA-N 1 0 310.235 4.138 20 10 DICDRO Cc1csc([C@@H](C)C[NH2+][C@H](C)c2cc(Cl)ccc2O)n1 ZINC000186561701 1043229159 /nfs/dbraw/zinc/22/91/59/1043229159.db2.gz ZHUHQUQXBURPBK-GXSJLCMTSA-N 1 0 310.850 4.265 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)c1nccs1)c1ccc(N(C)C)cc1 ZINC000186736723 1043232722 /nfs/dbraw/zinc/23/27/22/1043232722.db2.gz VVPHAMWQPRPGRR-XJKSGUPXSA-N 1 0 303.475 4.054 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)c1nccs1)c1ccc(N(C)C)cc1 ZINC000186736704 1043233786 /nfs/dbraw/zinc/23/37/86/1043233786.db2.gz VVPHAMWQPRPGRR-BBRMVZONSA-N 1 0 303.475 4.054 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2cccc3[nH]ccc32)c2c1c(F)ccc2O ZINC000866632251 1043240131 /nfs/dbraw/zinc/24/01/31/1043240131.db2.gz WDFIDOPZOIGGER-MEDUHNTESA-N 1 0 310.372 4.351 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Cl)cc2F)c1 ZINC000187580724 1043246968 /nfs/dbraw/zinc/24/69/68/1043246968.db2.gz LHWLACQKXUDGSO-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2ncccc2c1)c1ccc(N(C)C)cc1 ZINC000187574523 1043247769 /nfs/dbraw/zinc/24/77/69/1043247769.db2.gz FRGKLXFOPJPMKZ-HNNXBMFYSA-N 1 0 305.425 4.152 20 10 DICDRO C[N@H+](Cc1cc(F)c(F)c(F)c1)Cc1cc(Cl)ccc1O ZINC000777444146 1043255120 /nfs/dbraw/zinc/25/51/20/1043255120.db2.gz YBZMQTCFIAQQDH-UHFFFAOYSA-N 1 0 315.722 4.095 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2cc3ccccc3s2)c(O)c1 ZINC000777453594 1043257139 /nfs/dbraw/zinc/25/71/39/1043257139.db2.gz PMSIBBUPFVALCN-UHFFFAOYSA-N 1 0 313.422 4.295 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000121906711 1043265203 /nfs/dbraw/zinc/26/52/03/1043265203.db2.gz JYOAGSLLDAGRAA-AUUYWEPGSA-N 1 0 310.441 4.099 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2nccc3ccccc32)cc1 ZINC000067450939 1043269218 /nfs/dbraw/zinc/26/92/18/1043269218.db2.gz VVQJUCYXMSTNHF-UHFFFAOYSA-N 1 0 319.452 4.371 20 10 DICDRO C[C@H]1C[C@@H]([NH3+])CN1C(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000868090653 1043273194 /nfs/dbraw/zinc/27/31/94/1043273194.db2.gz MUFAQUDNEGDJRT-UONOGXRCSA-N 1 0 323.400 4.055 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)CC(C)(C)c2ccccc2)c1O ZINC000237233638 1043275043 /nfs/dbraw/zinc/27/50/43/1043275043.db2.gz ZYAPDHPDYSLJFZ-OAHLLOKOSA-N 1 0 313.441 4.247 20 10 DICDRO Cc1ccc(CSCC[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000783491518 1043278526 /nfs/dbraw/zinc/27/85/26/1043278526.db2.gz UKRQIDKJOOUUFZ-OAHLLOKOSA-N 1 0 301.455 4.285 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccc(Cl)cc1 ZINC000194255637 1043291365 /nfs/dbraw/zinc/29/13/65/1043291365.db2.gz DNIJYXLIGUKSGL-ZBEGNZNMSA-N 1 0 323.795 4.223 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCCC1 ZINC000122344313 1043296464 /nfs/dbraw/zinc/29/64/64/1043296464.db2.gz VJBJMSMZPMEHTF-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000122687445 1043321774 /nfs/dbraw/zinc/32/17/74/1043321774.db2.gz MYCZLCVCISVMMQ-ZDUSSCGKSA-N 1 0 304.384 4.190 20 10 DICDRO CC(C)C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccn1 ZINC000122918245 1043337179 /nfs/dbraw/zinc/33/71/79/1043337179.db2.gz OGTBDKCNVJCZHP-HXUWFJFHSA-N 1 0 323.484 4.341 20 10 DICDRO COCC(C)(C)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000872104825 1043460086 /nfs/dbraw/zinc/46/00/86/1043460086.db2.gz QVLKBYCEXRGJHN-AWEZNQCLSA-N 1 0 301.430 4.259 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc([C@@H](C)O)cc2)cc1C ZINC000873021377 1043513949 /nfs/dbraw/zinc/51/39/49/1043513949.db2.gz MHEPLCBMHIDSDS-MRXNPFEDSA-N 1 0 313.441 4.127 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](c2cccnc2)C2CC2)cc1C ZINC000873099100 1043516089 /nfs/dbraw/zinc/51/60/89/1043516089.db2.gz YCXJFXHEUWDFIV-FQEVSTJZSA-N 1 0 310.441 4.420 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)nc2)cc1C ZINC000873186515 1043526038 /nfs/dbraw/zinc/52/60/38/1043526038.db2.gz PVGNCDSPWVAENB-LBPRGKRZSA-N 1 0 324.346 4.268 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](OCC(C)C)C2)cc1C(C)C ZINC000759150946 1043547724 /nfs/dbraw/zinc/54/77/24/1043547724.db2.gz MXEHSQAOXJCTAD-QGZVFWFLSA-N 1 0 305.462 4.071 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1F ZINC000124818434 1043571366 /nfs/dbraw/zinc/57/13/66/1043571366.db2.gz VTGXUNSORFCAIP-KBPBESRZSA-N 1 0 316.420 4.312 20 10 DICDRO C[C@@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1ccc2ccccc2c1O ZINC000926916537 1043654633 /nfs/dbraw/zinc/65/46/33/1043654633.db2.gz PZYBGVHNTAAOKE-LXGCGDOSSA-N 1 0 311.425 4.155 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1[C@@H](c2ccccc2)C1(F)F)c1ccccc1O ZINC000926974471 1043666137 /nfs/dbraw/zinc/66/61/37/1043666137.db2.gz SKLRMIQRIUYWJL-JFIYKMOQSA-N 1 0 317.379 4.482 20 10 DICDRO CC[C@H]([NH2+]CCc1cccc2oc(C)nc21)c1ccccc1O ZINC000926976467 1043666154 /nfs/dbraw/zinc/66/61/54/1043666154.db2.gz VOYXBJSIBFAWIP-INIZCTEOSA-N 1 0 310.397 4.125 20 10 DICDRO C[C@H]1C[C@@H]([NH2+][C@H]2CCCc3cccnc32)c2c1c(F)ccc2O ZINC000927064019 1043678214 /nfs/dbraw/zinc/67/82/14/1043678214.db2.gz OAUCJDLOWKJBHR-TUKIKUTGSA-N 1 0 312.388 4.142 20 10 DICDRO CC(C)[C@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1cnn(C)c1 ZINC000927067780 1043681511 /nfs/dbraw/zinc/68/15/11/1043681511.db2.gz GRTXCPJRTJFFIW-KUHUBIRLSA-N 1 0 323.440 4.327 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](c2cnn(C)c2)C(C)C)c1O ZINC000927070551 1043683126 /nfs/dbraw/zinc/68/31/26/1043683126.db2.gz OZOMEAYDAPIYCH-LRDDRELGSA-N 1 0 321.852 4.135 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cc(Cl)cc2c1OCC2 ZINC000927142681 1043699384 /nfs/dbraw/zinc/69/93/84/1043699384.db2.gz VLENRTNOTPAQTG-RYUDHWBXSA-N 1 0 317.816 4.392 20 10 DICDRO C[N@H+](CCc1cccs1)Cc1ccc(N2CCCCC2)cc1 ZINC000729542573 1043707742 /nfs/dbraw/zinc/70/77/42/1043707742.db2.gz HMDWRSYGLQKXRK-UHFFFAOYSA-N 1 0 314.498 4.413 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2cccc(OC(F)F)c2)c(O)c1 ZINC000876933756 1043727081 /nfs/dbraw/zinc/72/70/81/1043727081.db2.gz YKEDQGYLZZEFCN-GFCCVEGCSA-N 1 0 307.340 4.153 20 10 DICDRO Cc1ccc(C[NH2+]Cc2cccc(COC(C)(C)C)c2)c(O)c1 ZINC000876995613 1043731466 /nfs/dbraw/zinc/73/14/66/1043731466.db2.gz GDPBLSSTGOKRRT-UHFFFAOYSA-N 1 0 313.441 4.306 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc(N3CCCC3)c2)c(O)c1 ZINC000877109641 1043745354 /nfs/dbraw/zinc/74/53/54/1043745354.db2.gz OIUIEFVOCXCZAR-INIZCTEOSA-N 1 0 310.441 4.152 20 10 DICDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000825934048 1043745578 /nfs/dbraw/zinc/74/55/78/1043745578.db2.gz FWBWPIMMYCJAFS-MRXNPFEDSA-N 1 0 304.821 4.332 20 10 DICDRO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC000825935332 1043747815 /nfs/dbraw/zinc/74/78/15/1043747815.db2.gz QKBZEPUVMYPVJZ-HNNXBMFYSA-N 1 0 319.836 4.031 20 10 DICDRO Cc1cccc(C[NH2+]Cc2ccsc2C(F)(F)F)c1O ZINC000877663181 1043786791 /nfs/dbraw/zinc/78/67/91/1043786791.db2.gz JRLWBZHNLWIJGH-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO C[C@H]([NH2+]C1CCC(OC2CCCC2)CC1)c1ccccc1O ZINC000877758146 1043795354 /nfs/dbraw/zinc/79/53/54/1043795354.db2.gz KREMFCTVJGPHRP-UQPPLGOBSA-N 1 0 303.446 4.313 20 10 DICDRO Cc1csc([C@@H]2CC[N@H+](Cc3ccc4ccccc4c3O)C2)n1 ZINC000877813692 1043802781 /nfs/dbraw/zinc/80/27/81/1043802781.db2.gz JKEBWVBJOROPPI-MRXNPFEDSA-N 1 0 324.449 4.300 20 10 DICDRO Cc1c(C[NH+]2CCC(C(F)(F)F)CC2)c2ccccc2n1C ZINC001138252850 1043839279 /nfs/dbraw/zinc/83/92/79/1043839279.db2.gz WSTAEELKGAULII-UHFFFAOYSA-N 1 0 310.363 4.261 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+][C@@H](C)c1ccccc1O)CC3 ZINC000783533719 1043848995 /nfs/dbraw/zinc/84/89/95/1043848995.db2.gz WBFMDEOSSIBPRN-GJZGRUSLSA-N 1 0 320.436 4.390 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(N(C)C)cc1 ZINC000127264977 1043911478 /nfs/dbraw/zinc/91/14/78/1043911478.db2.gz RBYRKNBIPMYOBO-HKUYNNGSSA-N 1 0 316.489 4.285 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(N(C)C)cc1 ZINC000127264730 1043911793 /nfs/dbraw/zinc/91/17/93/1043911793.db2.gz RBYRKNBIPMYOBO-IEBWSBKVSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@@H]([NH2+][C@H]1c2ccccc2CC12CCOCC2)c1ccccc1O ZINC000290104818 1043918180 /nfs/dbraw/zinc/91/81/80/1043918180.db2.gz IGMQRLMBOPUVST-QRWLVFNGSA-N 1 0 323.436 4.137 20 10 DICDRO c1c[nH]c([C@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)c1 ZINC000127374535 1043924217 /nfs/dbraw/zinc/92/42/17/1043924217.db2.gz NNNMTFKZCQBWGN-HXUWFJFHSA-N 1 0 309.457 4.342 20 10 DICDRO C[C@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccccc1O ZINC000879651908 1043978586 /nfs/dbraw/zinc/97/85/86/1043978586.db2.gz OTTYKDAPKLOJFQ-LBPRGKRZSA-N 1 0 302.443 4.357 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(C)c1O)c1cc(F)ccc1OC ZINC000896688152 1043980455 /nfs/dbraw/zinc/98/04/55/1043980455.db2.gz HPQYHNSWYJYIFC-MRXNPFEDSA-N 1 0 303.377 4.089 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccccn2)c(C)n1-c1ccccc1 ZINC000320344378 1044025449 /nfs/dbraw/zinc/02/54/49/1044025449.db2.gz OUWVCMCVZSPLML-MRXNPFEDSA-N 1 0 305.425 4.340 20 10 DICDRO C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccccc1O ZINC000798925695 1044073619 /nfs/dbraw/zinc/07/36/19/1044073619.db2.gz CIQPJMHFXNIZEX-LBPRGKRZSA-N 1 0 309.331 4.132 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@@H](C)c2ccccc2F)c1O ZINC000129720769 1044172671 /nfs/dbraw/zinc/17/26/71/1044172671.db2.gz CXZKKMCFTGUFRQ-ZDUSSCGKSA-N 1 0 303.377 4.123 20 10 DICDRO FC(F)(F)[C@H]1CCC[C@H]([NH2+]CCCSc2nccs2)C1 ZINC000129976873 1044188308 /nfs/dbraw/zinc/18/83/08/1044188308.db2.gz RNMVXFFUCDDVDT-QWRGUYRKSA-N 1 0 324.437 4.336 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](Cc2cccs2)C2CC2)c1 ZINC000130259542 1044195531 /nfs/dbraw/zinc/19/55/31/1044195531.db2.gz CGVDNKUWFUWWKD-UHFFFAOYSA-N 1 0 303.427 4.017 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2cccs2)C2CC2)c1O ZINC000130247822 1044195858 /nfs/dbraw/zinc/19/58/58/1044195858.db2.gz KLDBFNGBYWPKEP-UHFFFAOYSA-N 1 0 303.427 4.017 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CCCc3sc(Cl)cc32)c1 ZINC000292691929 1044198174 /nfs/dbraw/zinc/19/81/74/1044198174.db2.gz BOBYHWGJSZXSQX-ZDUSSCGKSA-N 1 0 323.845 4.283 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)c1 ZINC000780791742 1044215504 /nfs/dbraw/zinc/21/55/04/1044215504.db2.gz PFBXQRIMTAGRHB-LPADLIQXSA-N 1 0 309.409 4.079 20 10 DICDRO COc1cccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)c1O ZINC000130852947 1044217928 /nfs/dbraw/zinc/21/79/28/1044217928.db2.gz PETLNCWVBNKJDB-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO C[C@H]([NH2+]CCC1=CCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000130898052 1044218702 /nfs/dbraw/zinc/21/87/02/1044218702.db2.gz ZBJQZXOMLALQBB-KRWDZBQOSA-N 1 0 314.473 4.064 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2ccc(SCC)cc2)c1O ZINC000883237225 1044240497 /nfs/dbraw/zinc/24/04/97/1044240497.db2.gz VNNLDEYNQJADLF-UHFFFAOYSA-N 1 0 317.454 4.193 20 10 DICDRO CCSc1ccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)cc1 ZINC000883245654 1044244585 /nfs/dbraw/zinc/24/45/85/1044244585.db2.gz PFOJSWAFSZVBGM-CYBMUJFWSA-N 1 0 317.454 4.364 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000883265554 1044253192 /nfs/dbraw/zinc/25/31/92/1044253192.db2.gz FGQZNYPOZGSOCX-CQSZACIVSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c(Cl)n1 ZINC000883301697 1044262151 /nfs/dbraw/zinc/26/21/51/1044262151.db2.gz GXCOLFHBTKVMCK-SNVBAGLBSA-N 1 0 311.212 4.253 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c(Cl)n1 ZINC000883302021 1044262669 /nfs/dbraw/zinc/26/26/69/1044262669.db2.gz OKKQATMUWOUQHG-SNVBAGLBSA-N 1 0 311.212 4.253 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c(Cl)n1 ZINC000883302517 1044263720 /nfs/dbraw/zinc/26/37/20/1044263720.db2.gz ZYULDXFLSUAEMV-NOZJJQNGSA-N 1 0 320.795 4.226 20 10 DICDRO C[C@H]([NH2+]C1CCC2(COC2)CC1)c1ccc2ccccc2c1O ZINC000883380843 1044291982 /nfs/dbraw/zinc/29/19/82/1044291982.db2.gz BGBKSZNHZBXOHH-AWEZNQCLSA-N 1 0 311.425 4.155 20 10 DICDRO Oc1c(C[NH2+][C@@H]2CCCc3cccnc32)ccc2ccccc21 ZINC000897071160 1044295711 /nfs/dbraw/zinc/29/57/11/1044295711.db2.gz XJJFNYNZNVVTKW-GOSISDBHSA-N 1 0 304.393 4.108 20 10 DICDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000192744857 1044305053 /nfs/dbraw/zinc/30/50/53/1044305053.db2.gz JEDPQZDWGAQRAN-KBPBESRZSA-N 1 0 312.413 4.071 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H](C)CC1CCOCC1 ZINC000475192789 1044313272 /nfs/dbraw/zinc/31/32/72/1044313272.db2.gz BWBVSXGOUCBUGE-OAHLLOKOSA-N 1 0 314.473 4.029 20 10 DICDRO Fc1ccc2c(c1)[C@@H]([NH2+]CCCSc1nccs1)CC2 ZINC000132237904 1044318764 /nfs/dbraw/zinc/31/87/64/1044318764.db2.gz JJSCXXNKQSGTLS-AWEZNQCLSA-N 1 0 308.447 4.042 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000475201668 1044322862 /nfs/dbraw/zinc/32/28/62/1044322862.db2.gz JJAMHTYYYGDLQV-GUYCJALGSA-N 1 0 308.425 4.493 20 10 DICDRO CC[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccccc1O ZINC000293753884 1044325081 /nfs/dbraw/zinc/32/50/81/1044325081.db2.gz QNTQEYXQFYZKJY-AWEZNQCLSA-N 1 0 324.346 4.089 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2F)cc1 ZINC000133016082 1044350400 /nfs/dbraw/zinc/35/04/00/1044350400.db2.gz APKWPNFDYVKDEQ-ZDUSSCGKSA-N 1 0 304.384 4.272 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccccc1O ZINC000361292550 1044386244 /nfs/dbraw/zinc/38/62/44/1044386244.db2.gz HCOZALBJTNTBJX-YWZLYKJASA-N 1 0 304.393 4.227 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOc2ccccc21)c1ccc(N(C)C)cc1 ZINC000133513479 1044404327 /nfs/dbraw/zinc/40/43/27/1044404327.db2.gz QKHGYINYZPMNQX-DNVCBOLYSA-N 1 0 310.441 4.317 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)CC2 ZINC000696908414 1044411140 /nfs/dbraw/zinc/41/11/40/1044411140.db2.gz YSMSBGVZKPAJGR-AWEZNQCLSA-N 1 0 308.208 4.476 20 10 DICDRO CC(C)Oc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000134021172 1044481339 /nfs/dbraw/zinc/48/13/39/1044481339.db2.gz VWGJHDAHQBZXOQ-INIZCTEOSA-N 1 0 312.457 4.391 20 10 DICDRO C[N@H+](Cc1cccs1)Cc1ccc(N2CCCCC2)cc1 ZINC000216352206 1044553211 /nfs/dbraw/zinc/55/32/11/1044553211.db2.gz HYJXZCGGSKYHEQ-UHFFFAOYSA-N 1 0 300.471 4.370 20 10 DICDRO CC(C)[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1nc2ccccc2[nH]1 ZINC000295787922 1044558415 /nfs/dbraw/zinc/55/84/15/1044558415.db2.gz BJDMDBASNNTURR-APWZRJJASA-N 1 0 321.424 4.243 20 10 DICDRO CCCOCc1ccccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295802434 1044560707 /nfs/dbraw/zinc/56/07/07/1044560707.db2.gz CEJUZURTGSTMTM-SFHVURJKSA-N 1 0 311.425 4.096 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccnc(C(F)(F)F)c2)c(O)c1C ZINC000295855869 1044569069 /nfs/dbraw/zinc/56/90/69/1044569069.db2.gz BFXMWLCOGCQJNH-LBPRGKRZSA-N 1 0 324.346 4.274 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(OC(F)F)cc1 ZINC000295861748 1044569280 /nfs/dbraw/zinc/56/92/80/1044569280.db2.gz GPVCJTSOFVTQIV-IAQYHMDHSA-N 1 0 319.351 4.332 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCSc3c(F)cccc31)CC2 ZINC000296004318 1044582877 /nfs/dbraw/zinc/58/28/77/1044582877.db2.gz OOVWVCKNKZQXBG-HUUCEWRRSA-N 1 0 315.413 4.345 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCCOc3c(F)cccc31)CC2 ZINC000296335792 1044610358 /nfs/dbraw/zinc/61/03/58/1044610358.db2.gz GPVSQYSLKJIGQT-JKSUJKDBSA-N 1 0 313.372 4.022 20 10 DICDRO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C)c(C)cc2O)o1 ZINC000137087814 1044616190 /nfs/dbraw/zinc/61/61/90/1044616190.db2.gz HMMDSNKUMXVQRC-QGZVFWFLSA-N 1 0 315.413 4.086 20 10 DICDRO COC1CCN(c2ccc(C[N@H+](C)C3CCCCC3)cc2)CC1 ZINC000296459903 1044621206 /nfs/dbraw/zinc/62/12/06/1044621206.db2.gz JGJCJMWCWHNYGS-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO COC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(Cl)cc1 ZINC000296575117 1044629992 /nfs/dbraw/zinc/62/99/92/1044629992.db2.gz VLBFKZHRULKLHF-CVEARBPZSA-N 1 0 317.816 4.010 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]C2CC(F)(F)C2)cc1 ZINC000296680776 1044642392 /nfs/dbraw/zinc/64/23/92/1044642392.db2.gz GUSQEAQMIUJCMR-UHFFFAOYSA-N 1 0 322.424 4.272 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCCOc3cc(F)ccc31)CC2 ZINC000296714230 1044644468 /nfs/dbraw/zinc/64/44/68/1044644468.db2.gz IJKLIHFWGZSHBE-JKSUJKDBSA-N 1 0 313.372 4.022 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1O ZINC000155487782 1044700403 /nfs/dbraw/zinc/70/04/03/1044700403.db2.gz ZOEJVGMTCNZDOG-GOSISDBHSA-N 1 0 310.441 4.016 20 10 DICDRO CC(C)n1ncc2c1[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)CCC2 ZINC000368158795 1044767055 /nfs/dbraw/zinc/76/70/55/1044767055.db2.gz IWQAORCWDJBJMX-LRDDRELGSA-N 1 0 317.408 4.037 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCN(Cc3ccccc3)C2)c(O)c1 ZINC000301386429 1044882961 /nfs/dbraw/zinc/88/29/61/1044882961.db2.gz ZAZPEMKRDVTFAT-IEBWSBKVSA-N 1 0 324.468 4.016 20 10 DICDRO CCOCc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000151621263 1045028736 /nfs/dbraw/zinc/02/87/36/1045028736.db2.gz GNYUOHDEJRBZRE-MRXNPFEDSA-N 1 0 312.457 4.140 20 10 DICDRO Cc1occc1C[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC000779013029 1045130551 /nfs/dbraw/zinc/13/05/51/1045130551.db2.gz XRBWTGUZNKZGJD-JTQLQIEISA-N 1 0 324.218 4.215 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(CC)CC)cc1)c1ccc(F)cn1 ZINC000779021817 1045147031 /nfs/dbraw/zinc/14/70/31/1045147031.db2.gz XWKXQMGLXPEFLH-SFHVURJKSA-N 1 0 315.436 4.308 20 10 DICDRO Cc1cc(Br)cc([C@H](C)[NH2+][C@H]2CC=CCC2)c1O ZINC000779032272 1045176411 /nfs/dbraw/zinc/17/64/11/1045176411.db2.gz OHDSVHSLAQZSAG-AAEUAGOBSA-N 1 0 310.235 4.222 20 10 DICDRO CC(C)C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)N(C)C ZINC000320729517 1045185316 /nfs/dbraw/zinc/18/53/16/1045185316.db2.gz XBVUGKANPOEPBL-RDJZCZTQSA-N 1 0 314.473 4.172 20 10 DICDRO CC(C)C[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)N(C)C ZINC000320729519 1045186496 /nfs/dbraw/zinc/18/64/96/1045186496.db2.gz XBVUGKANPOEPBL-WBVHZDCISA-N 1 0 314.473 4.172 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cnn(C2CCC2)c1 ZINC000924647691 1045186908 /nfs/dbraw/zinc/18/69/08/1045186908.db2.gz ILTOGEVNOXLDPC-INIZCTEOSA-N 1 0 324.472 4.059 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cnn(C2CCC2)c1 ZINC000924647694 1045186920 /nfs/dbraw/zinc/18/69/20/1045186920.db2.gz ILTOGEVNOXLDPC-MRXNPFEDSA-N 1 0 324.472 4.059 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@H](c3ccccn3)C3CCC3)ccc21 ZINC000924873739 1045207676 /nfs/dbraw/zinc/20/76/76/1045207676.db2.gz YIOFKQGFGVWNEB-NRFANRHFSA-N 1 0 321.468 4.095 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(-c2ccccc2)no1 ZINC000924901636 1045209252 /nfs/dbraw/zinc/20/92/52/1045209252.db2.gz SKBBZFNIVOQALO-AWEZNQCLSA-N 1 0 320.392 4.127 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000779054027 1045216735 /nfs/dbraw/zinc/21/67/35/1045216735.db2.gz OTZNUQORVUITSW-IINYFYTJSA-N 1 0 319.351 4.017 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1OC)c1cc(Cl)ccc1O ZINC000779056053 1045221297 /nfs/dbraw/zinc/22/12/97/1045221297.db2.gz OSVPGFXQJAVUHL-OAHLLOKOSA-N 1 0 323.795 4.434 20 10 DICDRO c1csc(SCCC[NH2+][C@H](c2ccccn2)C2CCC2)n1 ZINC000925104008 1045227661 /nfs/dbraw/zinc/22/76/61/1045227661.db2.gz UTTZLWRFPCENJL-HNNXBMFYSA-N 1 0 319.499 4.151 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000162359873 1045241539 /nfs/dbraw/zinc/24/15/39/1045241539.db2.gz SMSXEUOTKICTIG-BBRMVZONSA-N 1 0 303.475 4.319 20 10 DICDRO CCOC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000779073549 1045248505 /nfs/dbraw/zinc/24/85/05/1045248505.db2.gz OSPGSBQZABTUBN-DLBZAZTESA-N 1 0 304.478 4.143 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccsc2)c(O)cc1C ZINC000159841143 1045279629 /nfs/dbraw/zinc/27/96/29/1045279629.db2.gz BXKMHGAXDWIEGR-OAHLLOKOSA-N 1 0 303.427 4.108 20 10 DICDRO CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000779149422 1045322881 /nfs/dbraw/zinc/32/28/81/1045322881.db2.gz LRFVNCRLXHDELI-GTNSWQLSSA-N 1 0 323.795 4.051 20 10 DICDRO CSCc1cccc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000188721685 1045338596 /nfs/dbraw/zinc/33/85/96/1045338596.db2.gz SOFHQTWJSVAWCU-CQSZACIVSA-N 1 0 301.455 4.414 20 10 DICDRO CC[NH+](CC)Cc1ccc(NCc2cc(Cl)ccc2O)cc1 ZINC000076272638 1045345831 /nfs/dbraw/zinc/34/58/31/1045345831.db2.gz HCQFBWBZMNJNAV-UHFFFAOYSA-N 1 0 318.848 4.500 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@@H]3CCSc4ccccc43)ccc21 ZINC000320767290 1045395361 /nfs/dbraw/zinc/39/53/61/1045395361.db2.gz PLONTZCXIPQOBV-GOSISDBHSA-N 1 0 324.493 4.396 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)c(OC)c1 ZINC000390348500 1045532203 /nfs/dbraw/zinc/53/22/03/1045532203.db2.gz XKWAYVAUWARGBJ-UONOGXRCSA-N 1 0 315.413 4.130 20 10 DICDRO Nc1ccc(C[NH2+][C@@H](c2ccccc2)C2(CO)CCCCC2)cc1 ZINC001120269630 1045537966 /nfs/dbraw/zinc/53/79/66/1045537966.db2.gz WKMDLPAKWTZCCA-FQEVSTJZSA-N 1 0 324.468 4.043 20 10 DICDRO CSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000800287325 1045605874 /nfs/dbraw/zinc/60/58/74/1045605874.db2.gz YMCXDKAWXHRCGE-CYBMUJFWSA-N 1 0 318.461 4.464 20 10 DICDRO C[C@H]([NH2+]CCc1cccc2[nH]ccc21)c1cc(Cl)ccc1O ZINC000800501446 1045635212 /nfs/dbraw/zinc/63/52/12/1045635212.db2.gz QDAKAFRJPKSQFR-LBPRGKRZSA-N 1 0 314.816 4.420 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCC12CCOCC2)c1ccc(N(C)C)cc1 ZINC000800498250 1045635606 /nfs/dbraw/zinc/63/56/06/1045635606.db2.gz GAZACDSNTOWKKZ-RBUKOAKNSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccc(N(C)C)cc1 ZINC000800500373 1045635786 /nfs/dbraw/zinc/63/57/86/1045635786.db2.gz CDZJIWXIERDXNO-OAHLLOKOSA-N 1 0 307.441 4.127 20 10 DICDRO FCCC[C@@H]1CCC[C@@H]1[NH2+]CCCSc1nccs1 ZINC000800971244 1045671198 /nfs/dbraw/zinc/67/11/98/1045671198.db2.gz HVMDUFDHEJFMKK-STQMWFEESA-N 1 0 302.484 4.133 20 10 DICDRO CC1=C(c2ccco2)C[N@H+](Cc2c(O)ccc3ccncc32)CC1 ZINC000800866337 1045659778 /nfs/dbraw/zinc/65/97/78/1045659778.db2.gz FOAIIMXHOUBHNZ-UHFFFAOYSA-N 1 0 320.392 4.213 20 10 DICDRO CCCCCC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001460999016 1045669737 /nfs/dbraw/zinc/66/97/37/1045669737.db2.gz MJZMGUCUFBSJIX-UHFFFAOYSA-N 1 0 302.384 4.441 20 10 DICDRO Cc1c([C@@H](C)[NH2+]CCCSc2nccs2)cnn1C(C)C ZINC000191296812 1045675549 /nfs/dbraw/zinc/67/55/49/1045675549.db2.gz RCUSAOQYZOMXPP-GFCCVEGCSA-N 1 0 324.519 4.062 20 10 DICDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@H](C)c1cc(F)ccc1O ZINC000800993200 1045679371 /nfs/dbraw/zinc/67/93/71/1045679371.db2.gz LUUOMVTYQQFLEQ-QLJPJBMISA-N 1 0 319.351 4.017 20 10 DICDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)c1cc(F)ccc1O ZINC000800993021 1045679907 /nfs/dbraw/zinc/67/99/07/1045679907.db2.gz LUUOMVTYQQFLEQ-HWPZZCPQSA-N 1 0 319.351 4.017 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc(C)cc1 ZINC000078372124 1045690667 /nfs/dbraw/zinc/69/06/67/1045690667.db2.gz IXOCGLXDDNGTAK-NRFANRHFSA-N 1 0 324.468 4.073 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCC[C@H](c3ccccc3)C2)c1O ZINC000752986689 1045717990 /nfs/dbraw/zinc/71/79/90/1045717990.db2.gz LXNHBEXASHSDCM-WMZOPIPTSA-N 1 0 311.425 4.217 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(N(C)c3ccccc3)CC2)cc1C ZINC000753107474 1045725649 /nfs/dbraw/zinc/72/56/49/1045725649.db2.gz WSMMKBUVZWMVIF-UHFFFAOYSA-N 1 0 324.468 4.110 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2oc3ccccc3c2C)c1O ZINC000191676631 1045746054 /nfs/dbraw/zinc/74/60/54/1045746054.db2.gz XINUALHJRZNSFB-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO CCCC[N@H+](Cc1ccc2c(c1)COC2)Cc1ccccc1O ZINC000801595486 1045749255 /nfs/dbraw/zinc/74/92/55/1045749255.db2.gz MHPHSBNMYKVKSN-UHFFFAOYSA-N 1 0 311.425 4.225 20 10 DICDRO CCCC[N@H+](Cc1ccc(Cl)nc1)Cc1ccccc1O ZINC000801596902 1045752028 /nfs/dbraw/zinc/75/20/28/1045752028.db2.gz SVZYFNMMHGNURB-UHFFFAOYSA-N 1 0 304.821 4.243 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH+]1C2CCC1CC2 ZINC000753536654 1045758754 /nfs/dbraw/zinc/75/87/54/1045758754.db2.gz IGBHKXZTIXDDCZ-UHFFFAOYSA-N 1 0 309.409 4.098 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@H](c3cccc(C)c3)C2)c1O ZINC000753586500 1045770723 /nfs/dbraw/zinc/77/07/23/1045770723.db2.gz AYFWTHOHFRWMTR-KRWDZBQOSA-N 1 0 311.425 4.089 20 10 DICDRO C[C@@H]([NH2+]CCCNc1cccc(F)c1)c1ccc(N(C)C)cc1 ZINC000753767593 1045802134 /nfs/dbraw/zinc/80/21/34/1045802134.db2.gz KVDLLMPJGCGEJK-OAHLLOKOSA-N 1 0 315.436 4.045 20 10 DICDRO Oc1ccccc1C[N@H+](CC[C@H]1CCCCO1)C1CCCC1 ZINC000754042821 1045837601 /nfs/dbraw/zinc/83/76/01/1045837601.db2.gz DSLVQMUCSGCAQY-GOSISDBHSA-N 1 0 303.446 4.096 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000754099851 1045846596 /nfs/dbraw/zinc/84/65/96/1045846596.db2.gz HDKQCDGVWPRBKV-SJLPKXTDSA-N 1 0 311.425 4.217 20 10 DICDRO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000079249388 1045873514 /nfs/dbraw/zinc/87/35/14/1045873514.db2.gz VIMJRBLSASAABT-OAHLLOKOSA-N 1 0 311.425 4.260 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2cccc3cccnc32)ccc1N(C)C ZINC001139670954 1045881169 /nfs/dbraw/zinc/88/11/69/1045881169.db2.gz HXMRTDIMRAPWFQ-UHFFFAOYSA-N 1 0 319.452 4.241 20 10 DICDRO COc1cc(C)cc(C[N@H+]([C@H](C)c2ccccc2)C2CC2)c1O ZINC000754720976 1045918849 /nfs/dbraw/zinc/91/88/49/1045918849.db2.gz WNLBXENEQVPFCB-OAHLLOKOSA-N 1 0 311.425 4.435 20 10 DICDRO COc1cc(C)cc(C[N@H+](Cc2ccc(C)s2)C(C)C)c1O ZINC000754723782 1045920453 /nfs/dbraw/zinc/92/04/53/1045920453.db2.gz VINLMAWDJDILPR-UHFFFAOYSA-N 1 0 319.470 4.490 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1O ZINC000754726917 1045921213 /nfs/dbraw/zinc/92/12/13/1045921213.db2.gz AWIFQYQBZUHLPX-KRWDZBQOSA-N 1 0 315.388 4.185 20 10 DICDRO CCC[N@H+](Cc1cc(C)cc(C)c1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000754742646 1045922699 /nfs/dbraw/zinc/92/26/99/1045922699.db2.gz VXAIAAMSAXITAY-BHIYHBOVSA-N 1 0 317.473 4.035 20 10 DICDRO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1c(O)ccc2ccncc21 ZINC000754857313 1045934461 /nfs/dbraw/zinc/93/44/61/1045934461.db2.gz OYTSTVLEJDTDGR-FOWTUZBSSA-N 1 0 318.420 4.476 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(OC)c(F)c1)c1ccccc1O ZINC000192795863 1045935098 /nfs/dbraw/zinc/93/50/98/1045935098.db2.gz QTGBGSXPFSQDFO-MLGOLLRUSA-N 1 0 303.377 4.342 20 10 DICDRO C[C@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1cc(Cl)ccc1O ZINC000802308905 1045951606 /nfs/dbraw/zinc/95/16/06/1045951606.db2.gz KPOMXRWSKWYYQZ-UPJWGTAASA-N 1 0 311.853 4.290 20 10 DICDRO CCOC1CC[NH+](Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001137857356 1045987421 /nfs/dbraw/zinc/98/74/21/1045987421.db2.gz DXZQTMNBKVJCHF-UHFFFAOYSA-N 1 0 312.457 4.095 20 10 DICDRO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(C)n(-c2ccccc2)c1C ZINC001137859306 1045988021 /nfs/dbraw/zinc/98/80/21/1045988021.db2.gz SGSJGWFHESISBL-FQEVSTJZSA-N 1 0 310.441 4.038 20 10 DICDRO CO[C@H]1CC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)[C@H](C)C1 ZINC001137859168 1045988085 /nfs/dbraw/zinc/98/80/85/1045988085.db2.gz LZICBKNXKIASCA-QRWLVFNGSA-N 1 0 312.457 4.093 20 10 DICDRO Cc1cc(C[N@@H+]2CCC3(C2)CCOCC3)c(C)n1-c1ccccc1 ZINC001137857575 1045988162 /nfs/dbraw/zinc/98/81/62/1045988162.db2.gz JBEKSLQPDODITB-UHFFFAOYSA-N 1 0 324.468 4.097 20 10 DICDRO CSC1CC[NH+](Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001137858080 1045988282 /nfs/dbraw/zinc/98/82/82/1045988282.db2.gz WCGNKDKZNRTOPB-UHFFFAOYSA-N 1 0 314.498 4.422 20 10 DICDRO CO[C@@H]1CC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)[C@H](C)C1 ZINC001137859166 1045988422 /nfs/dbraw/zinc/98/84/22/1045988422.db2.gz LZICBKNXKIASCA-FOIQADDNSA-N 1 0 312.457 4.093 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OCCC(C)C)CC2)cc1C ZINC000193407849 1046004435 /nfs/dbraw/zinc/00/44/35/1046004435.db2.gz YZSRIJGGNPZNGM-UHFFFAOYSA-N 1 0 305.462 4.036 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCO[C@H](CC)C1 ZINC000802657332 1046026206 /nfs/dbraw/zinc/02/62/06/1046026206.db2.gz AZWFZXSEPHCROZ-SJLPKXTDSA-N 1 0 305.462 4.200 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CCCO1 ZINC000756047772 1046044273 /nfs/dbraw/zinc/04/42/73/1046044273.db2.gz VJCMUQKZUUURPZ-QUCCMNQESA-N 1 0 311.425 4.106 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(C(F)(F)F)cn1 ZINC000902728407 1046052601 /nfs/dbraw/zinc/05/26/01/1046052601.db2.gz SHLMHIFYFRGHDW-GFCCVEGCSA-N 1 0 323.362 4.017 20 10 DICDRO C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000756117216 1046053381 /nfs/dbraw/zinc/05/33/81/1046053381.db2.gz BCEMFISKKPHZAG-JKIFEVAISA-N 1 0 324.415 4.035 20 10 DICDRO CCOc1cccc(C[N@H+](C)C/C(C)=C/c2ccccc2)c1O ZINC000756123758 1046053706 /nfs/dbraw/zinc/05/37/06/1046053706.db2.gz YERRJGZLDIJEHN-DTQAZKPQSA-N 1 0 311.425 4.326 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2c[nH]c3ccccc23)c(O)c1C ZINC000756343502 1046066762 /nfs/dbraw/zinc/06/67/62/1046066762.db2.gz MYPOSKMPNOOAHF-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO C[C@@H]([NH2+]CCc1ccccc1)c1ccc(Br)cc1O ZINC000756354939 1046067615 /nfs/dbraw/zinc/06/76/15/1046067615.db2.gz LISHXHXSQVEOJB-GFCCVEGCSA-N 1 0 320.230 4.048 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](c2cccs2)C2CC2)c1 ZINC000756362729 1046068871 /nfs/dbraw/zinc/06/88/71/1046068871.db2.gz CGGLALDXXWVFAV-DIFFPNOSSA-N 1 0 303.427 4.264 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2(c3ccccc3)CCC2)c1 ZINC000756381472 1046073796 /nfs/dbraw/zinc/07/37/96/1046073796.db2.gz LQFQVAYTWVALMN-OAHLLOKOSA-N 1 0 311.425 4.173 20 10 DICDRO COCc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)cc1 ZINC000756384880 1046073832 /nfs/dbraw/zinc/07/38/32/1046073832.db2.gz PTCSQLZNWWLGNM-LRDDRELGSA-N 1 0 315.388 4.016 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC2(c3ccccc3)CCC2)c1 ZINC000756381471 1046074340 /nfs/dbraw/zinc/07/43/40/1046074340.db2.gz LQFQVAYTWVALMN-HNNXBMFYSA-N 1 0 311.425 4.173 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2cccc3ccccc32)c1 ZINC000756402691 1046076243 /nfs/dbraw/zinc/07/62/43/1046076243.db2.gz NVGFCNHDPJYWBT-HNNXBMFYSA-N 1 0 321.420 4.447 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(-n3cccn3)cc2)c(O)c1C ZINC000756431520 1046077874 /nfs/dbraw/zinc/07/78/74/1046077874.db2.gz MWBZBAYKLHKOTN-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO CC(C)Oc1ncccc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756419282 1046079539 /nfs/dbraw/zinc/07/95/39/1046079539.db2.gz DXUFCJIZQPNZMV-GFCCVEGCSA-N 1 0 320.820 4.079 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2c(F)cccc2F)c(O)c1C ZINC000756422972 1046079819 /nfs/dbraw/zinc/07/98/19/1046079819.db2.gz PJBXXNZFDFUWNX-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO C[C@@H]([NH2+]CCc1c(F)cccc1F)c1cc(Cl)ccc1O ZINC000756422978 1046079904 /nfs/dbraw/zinc/07/99/04/1046079904.db2.gz PNVGFVKBTLCENS-SNVBAGLBSA-N 1 0 311.759 4.217 20 10 DICDRO C[C@@H]([NH2+]CCN1CCCC[C@@H]1C)c1ccc2ccccc2c1O ZINC000756419469 1046080052 /nfs/dbraw/zinc/08/00/52/1046080052.db2.gz UQPHAYIFUHABKS-JKSUJKDBSA-N 1 0 312.457 4.070 20 10 DICDRO CO[C@H](C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)c1ccccc1 ZINC000756445203 1046080527 /nfs/dbraw/zinc/08/05/27/1046080527.db2.gz LGUFZPBPSFIJKY-XGWLTEMNSA-N 1 0 315.388 4.057 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(-n3cccn3)cc2)c(O)c1C ZINC000756431526 1046080780 /nfs/dbraw/zinc/08/07/80/1046080780.db2.gz MWBZBAYKLHKOTN-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc3ccccc3n2)c2c1c(F)ccc2O ZINC000756453975 1046081107 /nfs/dbraw/zinc/08/11/07/1046081107.db2.gz BUJWYUOHRDDVDA-PXAZEXFGSA-N 1 0 322.383 4.418 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756435235 1046083186 /nfs/dbraw/zinc/08/31/86/1046083186.db2.gz YDFIDUIJCKSLOI-MQIPJXDCSA-N 1 0 315.388 4.439 20 10 DICDRO C[C@H](Cc1ccsc1)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756457998 1046083927 /nfs/dbraw/zinc/08/39/27/1046083927.db2.gz ITAGEDFZBUYRPY-WDMOLILDSA-N 1 0 305.418 4.362 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2COC(C)C)c(O)c1 ZINC000756463757 1046084107 /nfs/dbraw/zinc/08/41/07/1046084107.db2.gz CXUGSPYXSGEQBB-INIZCTEOSA-N 1 0 313.441 4.476 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCOc2cccc(Cl)c2)c1 ZINC000756477009 1046086110 /nfs/dbraw/zinc/08/61/10/1046086110.db2.gz VLFDYEBTWDGOFQ-ZDUSSCGKSA-N 1 0 305.805 4.084 20 10 DICDRO COc1cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)ccc1C ZINC000756480710 1046087571 /nfs/dbraw/zinc/08/75/71/1046087571.db2.gz UEMFQWHHDLPUEG-IUODEOHRSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc3ccccc3n2)c(O)c1C ZINC000756494007 1046089100 /nfs/dbraw/zinc/08/91/00/1046089100.db2.gz CPCMFDJEQJCYOQ-INIZCTEOSA-N 1 0 320.436 4.451 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2cccc3cccnc32)c2c1c(F)ccc2O ZINC000756493917 1046089352 /nfs/dbraw/zinc/08/93/52/1046089352.db2.gz AZEOCNTUVPKIKW-MLGOLLRUSA-N 1 0 322.383 4.418 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)cc2F)c2c1c(F)ccc2O ZINC000756496074 1046090995 /nfs/dbraw/zinc/09/09/95/1046090995.db2.gz MYOFCKRSHDMKDM-OTYXRUKQSA-N 1 0 307.315 4.148 20 10 DICDRO COc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756503067 1046091649 /nfs/dbraw/zinc/09/16/49/1046091649.db2.gz JJKIJIFVAXNGCK-KBPBESRZSA-N 1 0 317.404 4.212 20 10 DICDRO C[C@H]([NH2+]CCCOC1CCCC1)c1cc2c(cc1O)CCCC2 ZINC000756503522 1046092586 /nfs/dbraw/zinc/09/25/86/1046092586.db2.gz ODNVPCFMCDDNJD-HNNXBMFYSA-N 1 0 317.473 4.271 20 10 DICDRO COc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000756503812 1046092821 /nfs/dbraw/zinc/09/28/21/1046092821.db2.gz NAZNCDVKOZIEPK-CVEARBPZSA-N 1 0 313.441 4.381 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2c[nH]c3cccc(C)c23)c(O)c1 ZINC000756531602 1046096606 /nfs/dbraw/zinc/09/66/06/1046096606.db2.gz AGTPRHMAIQHRSR-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCc2ccc(O)cc2)c(O)c1C ZINC000756532181 1046096707 /nfs/dbraw/zinc/09/67/07/1046096707.db2.gz FBTOXWYINRPHJC-GOEBONIOSA-N 1 0 313.441 4.387 20 10 DICDRO Cc1cccc2[nH]cc(CC[NH2+][C@@H](C)c3cc(F)ccc3O)c21 ZINC000756537262 1046097184 /nfs/dbraw/zinc/09/71/84/1046097184.db2.gz XUZSYSIAEDEPKO-ZDUSSCGKSA-N 1 0 312.388 4.214 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2c[nH]c3cccc(C)c23)c1 ZINC000756537020 1046097207 /nfs/dbraw/zinc/09/72/07/1046097207.db2.gz XCQJIKDQZKMRQU-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO CC(C)[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)Nc1ccccc1 ZINC000756555980 1046100009 /nfs/dbraw/zinc/10/00/09/1046100009.db2.gz NNKGFZSCQDHUNV-RDTXWAMCSA-N 1 0 316.420 4.319 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000756555654 1046100759 /nfs/dbraw/zinc/10/07/59/1046100759.db2.gz UHOMJAYNSZSMJM-HNNXBMFYSA-N 1 0 314.429 4.044 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1F ZINC000756557216 1046101198 /nfs/dbraw/zinc/10/11/98/1046101198.db2.gz RFKPYKKLGXRKPD-AWEZNQCLSA-N 1 0 317.404 4.398 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2)c(O)c1C ZINC000756572358 1046101971 /nfs/dbraw/zinc/10/19/71/1046101971.db2.gz GEKARBHFJXBLFZ-CABCVRRESA-N 1 0 301.434 4.198 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(F)cc1F)c1cc(Cl)ccc1O ZINC000756576149 1046102015 /nfs/dbraw/zinc/10/20/15/1046102015.db2.gz KQXPXROBQCNCAX-JTQLQIEISA-N 1 0 311.759 4.217 20 10 DICDRO Cc1noc(C)c1[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756575469 1046102362 /nfs/dbraw/zinc/10/23/62/1046102362.db2.gz UGXMZSRERZEVLT-ZDMBXUJBSA-N 1 0 304.365 4.035 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c(O)c1C ZINC000756583582 1046104267 /nfs/dbraw/zinc/10/42/67/1046104267.db2.gz BIQNEZBHTUZZIO-INIZCTEOSA-N 1 0 312.457 4.234 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCc2cccc(F)c2)c1 ZINC000756583411 1046104374 /nfs/dbraw/zinc/10/43/74/1046104374.db2.gz NNSYEQIUVCTNCA-KGLIPLIRSA-N 1 0 317.404 4.212 20 10 DICDRO CS[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC000756587518 1046104707 /nfs/dbraw/zinc/10/47/07/1046104707.db2.gz ASSCDKHKOUGVRL-GFQSEFKGSA-N 1 0 309.450 4.343 20 10 DICDRO C[C@H]([NH2+]CCCNc1ccccc1)c1cc(Cl)ccc1O ZINC000756590034 1046104889 /nfs/dbraw/zinc/10/48/89/1046104889.db2.gz NPQXVXYOFXXFFE-ZDUSSCGKSA-N 1 0 304.821 4.198 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1c(C)nn(C)c1C ZINC000756617917 1046110738 /nfs/dbraw/zinc/11/07/38/1046110738.db2.gz QRJHNCLRNTVTCQ-CXAGYDPISA-N 1 0 315.461 4.161 20 10 DICDRO CCC(CC)(CCO)C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756629299 1046112370 /nfs/dbraw/zinc/11/23/70/1046112370.db2.gz OYVGPPLHCWQPMG-HNNXBMFYSA-N 1 0 319.489 4.110 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3cc(Cl)ccc3O)nc2c1 ZINC000756629205 1046112710 /nfs/dbraw/zinc/11/27/10/1046112710.db2.gz OOHNOTHLSDQILM-NSHDSACASA-N 1 0 315.804 4.081 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)C1CCOCC1 ZINC000756628497 1046112747 /nfs/dbraw/zinc/11/27/47/1046112747.db2.gz MRVJCHLUDVKMDY-AUUYWEPGSA-N 1 0 313.441 4.401 20 10 DICDRO CC[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)Oc1ccccc1F ZINC000756639404 1046113920 /nfs/dbraw/zinc/11/39/20/1046113920.db2.gz YIRIVKFGIVUULW-CABCVRRESA-N 1 0 317.404 4.348 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CCCC[C@@H]1O)c1ccc2ccccc2c1O ZINC000756639031 1046114840 /nfs/dbraw/zinc/11/48/40/1046114840.db2.gz VQJRQYMZGRTSCN-ADLFWFRXSA-N 1 0 313.441 4.137 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CC2(CCO)CCCCC2)c2c1c(F)ccc2O ZINC000756647491 1046116617 /nfs/dbraw/zinc/11/66/17/1046116617.db2.gz GZMVNTHQSXPRBM-ZFWWWQNUSA-N 1 0 321.436 4.002 20 10 DICDRO C[C@H]([NH2+][C@H](CCO)C1CCCCC1)c1cc(Cl)ccc1O ZINC000756661744 1046118173 /nfs/dbraw/zinc/11/81/73/1046118173.db2.gz VEZYNWWXTIUZGO-BLLLJJGKSA-N 1 0 311.853 4.028 20 10 DICDRO CC(C)c1csc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000756657746 1046118877 /nfs/dbraw/zinc/11/88/77/1046118877.db2.gz FWFXAZUOEXWLFO-ZYHUDNBSSA-N 1 0 320.433 4.449 20 10 DICDRO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756678366 1046119495 /nfs/dbraw/zinc/11/94/95/1046119495.db2.gz WBIAKZDLOMGHBG-HUUCEWRRSA-N 1 0 310.441 4.386 20 10 DICDRO FC1(F)CC[C@@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138215348 1046119875 /nfs/dbraw/zinc/11/98/75/1046119875.db2.gz ADGONWMSVNNRPQ-AEFFLSMTSA-N 1 0 320.427 4.154 20 10 DICDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000756681442 1046120151 /nfs/dbraw/zinc/12/01/51/1046120151.db2.gz BPVOLNWWUFUZTL-QAPCUYQASA-N 1 0 311.425 4.410 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756683108 1046120646 /nfs/dbraw/zinc/12/06/46/1046120646.db2.gz FQDHUFRVARNVMP-SJKOYZFVSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ccc(F)c(F)c2)c(O)c1C ZINC000756706341 1046121310 /nfs/dbraw/zinc/12/13/10/1046121310.db2.gz MISNICYKBZQEDN-CYBMUJFWSA-N 1 0 321.367 4.017 20 10 DICDRO COC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccccc1 ZINC000756705239 1046121405 /nfs/dbraw/zinc/12/14/05/1046121405.db2.gz SGVQRWQZCRXHFH-WQVCFCJDSA-N 1 0 315.388 4.057 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(F)cc1Cl)c1cc(F)ccc1O ZINC000756706152 1046121731 /nfs/dbraw/zinc/12/17/31/1046121731.db2.gz PABHCMYRXHZADY-JTQLQIEISA-N 1 0 311.759 4.217 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)Oc1ccccc1 ZINC000756704136 1046121914 /nfs/dbraw/zinc/12/19/14/1046121914.db2.gz FQACZZDNLOOFSU-STQMWFEESA-N 1 0 305.805 4.164 20 10 DICDRO C[C@H]([NH2+]C[C@H]1OCCc2ccccc21)c1cc(Cl)ccc1O ZINC000756706102 1046121966 /nfs/dbraw/zinc/12/19/66/1046121966.db2.gz GWOBWLRESDWVNI-KPZWWZAWSA-N 1 0 317.816 4.010 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(F)cc2Cl)c1 ZINC000756706073 1046122203 /nfs/dbraw/zinc/12/22/03/1046122203.db2.gz OPHLZJSTBXNHEY-LLVKDONJSA-N 1 0 323.795 4.087 20 10 DICDRO COc1cccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000756708598 1046122468 /nfs/dbraw/zinc/12/24/68/1046122468.db2.gz RXICTRKZTORKIZ-HOCLYGCPSA-N 1 0 313.441 4.299 20 10 DICDRO C[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)Oc1ccccc1 ZINC000756706505 1046122625 /nfs/dbraw/zinc/12/26/25/1046122625.db2.gz SNRLYDCKGBRNFY-IOASZLSFSA-N 1 0 315.388 4.137 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1Cl)c1cc(F)ccc1O ZINC000756734715 1046123802 /nfs/dbraw/zinc/12/38/02/1046123802.db2.gz YUQGVOGNNAQGGO-NWDGAFQWSA-N 1 0 323.795 4.303 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCNc2ccc3ccccc3n2)c1 ZINC000756738293 1046124460 /nfs/dbraw/zinc/12/44/60/1046124460.db2.gz FBJBXUYEZOZOFV-HNNXBMFYSA-N 1 0 321.424 4.012 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@@H]1Oc2ccccc2[C@H]1C ZINC000756747885 1046125629 /nfs/dbraw/zinc/12/56/29/1046125629.db2.gz SEAJCSCWQQGJQM-RJAOAUJVSA-N 1 0 315.388 4.135 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)c(O)c1 ZINC000756744356 1046126484 /nfs/dbraw/zinc/12/64/84/1046126484.db2.gz AMCLLQXELMOCLT-CJXDPKRBSA-N 1 0 311.425 4.304 20 10 DICDRO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cc(Cl)ccc1O ZINC000756757919 1046127348 /nfs/dbraw/zinc/12/73/48/1046127348.db2.gz OULMZADTJZZVJX-OTYXRUKQSA-N 1 0 324.207 4.483 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cc3c(cc1O)CCCC3)CO2 ZINC000756757791 1046128013 /nfs/dbraw/zinc/12/80/13/1046128013.db2.gz BWVCWNCZUULNLT-KUHUBIRLSA-N 1 0 323.436 4.364 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)c(O)c1C ZINC000756757801 1046128084 /nfs/dbraw/zinc/12/80/84/1046128084.db2.gz CDCWDGCVDVNKGH-MLGOLLRUSA-N 1 0 317.816 4.447 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c(F)c1 ZINC000756759741 1046128165 /nfs/dbraw/zinc/12/81/65/1046128165.db2.gz XXEWNPGFHNTOBI-BONVTDFDSA-N 1 0 319.351 4.017 20 10 DICDRO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cc(Cl)ccc1O ZINC000756757924 1046128253 /nfs/dbraw/zinc/12/82/53/1046128253.db2.gz OULMZADTJZZVJX-YMTOWFKASA-N 1 0 324.207 4.483 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H](c3ccccc3)[C@@H]2C)c1 ZINC000756758633 1046128361 /nfs/dbraw/zinc/12/83/61/1046128361.db2.gz HEHTUSQOCTYBCO-OJFPTFHUSA-N 1 0 311.425 4.244 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)CO2 ZINC000756758465 1046128614 /nfs/dbraw/zinc/12/86/14/1046128614.db2.gz FSYKVWXUGYHKGR-NHYWBVRUSA-N 1 0 303.789 4.138 20 10 DICDRO COc1cccc(C(C)(C)C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000756771013 1046129685 /nfs/dbraw/zinc/12/96/85/1046129685.db2.gz YMSPJDMSDBZZBS-HNNXBMFYSA-N 1 0 313.441 4.338 20 10 DICDRO CC(C)[C@H](O)C(C)(C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756769296 1046130315 /nfs/dbraw/zinc/13/03/15/1046130315.db2.gz DONOWSKAMPCJHT-LIRRHRJNSA-N 1 0 315.457 4.239 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756767976 1046130335 /nfs/dbraw/zinc/13/03/35/1046130335.db2.gz HLJDBMIMBMCKMO-WBMJQRKESA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCOc2ccccc2Cl)c(O)c1 ZINC000756768825 1046130352 /nfs/dbraw/zinc/13/03/52/1046130352.db2.gz NPUITYPCIOLSMJ-ZDUSSCGKSA-N 1 0 305.805 4.084 20 10 DICDRO CC(C)OC1CCC([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756770344 1046130745 /nfs/dbraw/zinc/13/07/45/1046130745.db2.gz TZIGKPNUJSMOCR-USPMSXPRSA-N 1 0 321.436 4.405 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1c(C)noc1C ZINC000756774312 1046132038 /nfs/dbraw/zinc/13/20/38/1046132038.db2.gz BPKLDAQZCXPUBQ-IIMNLJJBSA-N 1 0 318.392 4.425 20 10 DICDRO Cc1c(C[NH+]2CCC(c3cccnc3)CC2)c2ccccc2n1C ZINC001138258397 1046132374 /nfs/dbraw/zinc/13/23/74/1046132374.db2.gz RCQVWMUKMDKIIH-UHFFFAOYSA-N 1 0 319.452 4.261 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)c2c1c(F)ccc2O ZINC000756779221 1046132504 /nfs/dbraw/zinc/13/25/04/1046132504.db2.gz RLGYESLJALBBKU-UNIGVISCSA-N 1 0 321.436 4.263 20 10 DICDRO COc1ccc(C[C@H](C)C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000756786022 1046133506 /nfs/dbraw/zinc/13/35/06/1046133506.db2.gz WQMPWCRRMDZBPS-JKSUJKDBSA-N 1 0 313.441 4.239 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000756783336 1046133748 /nfs/dbraw/zinc/13/37/48/1046133748.db2.gz XTELJTWHIWWWBF-NJSLBKSFSA-N 1 0 317.404 4.267 20 10 DICDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000756790690 1046135468 /nfs/dbraw/zinc/13/54/68/1046135468.db2.gz NYLAOWXMRCMXQM-NJSLBKSFSA-N 1 0 317.404 4.267 20 10 DICDRO CCCCn1cc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c(C)n1 ZINC000756787081 1046135688 /nfs/dbraw/zinc/13/56/88/1046135688.db2.gz OCHSXQDCDHZOAI-MRXNPFEDSA-N 1 0 315.461 4.165 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1O ZINC000193901203 1046136215 /nfs/dbraw/zinc/13/62/15/1046136215.db2.gz RZZJKBHRXHHCAO-MLGOLLRUSA-N 1 0 300.358 4.102 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C2(c3ccccc3F)CC2)c2c1c(F)ccc2O ZINC000756833171 1046142025 /nfs/dbraw/zinc/14/20/25/1046142025.db2.gz JTPGDCWPRDMUML-ABAIWWIYSA-N 1 0 315.363 4.498 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c(O)c1C ZINC000756858254 1046145842 /nfs/dbraw/zinc/14/58/42/1046145842.db2.gz SPMOFBKFRUKOOP-WLWJZTKJSA-N 1 0 315.457 4.007 20 10 DICDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CCO1 ZINC000756874510 1046147115 /nfs/dbraw/zinc/14/71/15/1046147115.db2.gz QCBQKRWBTJVGIT-DSJMHWKBSA-N 1 0 321.436 4.263 20 10 DICDRO CN1CCCc2cc(C[N@@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)ccc21 ZINC001138359745 1046154970 /nfs/dbraw/zinc/15/49/70/1046154970.db2.gz YIUFVKLGCLIKSH-KDURUIRLSA-N 1 0 318.464 4.156 20 10 DICDRO CC[N@H+](Cc1[nH]c2ccc(F)cc2c1C)Cc1ccccc1O ZINC001138414130 1046172255 /nfs/dbraw/zinc/17/22/55/1046172255.db2.gz QLRCFJAQVNZROF-UHFFFAOYSA-N 1 0 312.388 4.343 20 10 DICDRO c1cc(Oc2ccccc2)oc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000779972147 1046183603 /nfs/dbraw/zinc/18/36/03/1046183603.db2.gz FIPCEIKZPQXVFL-UHFFFAOYSA-N 1 0 321.376 4.297 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1cc2c(cc1O)CCCC2 ZINC000757639869 1046195571 /nfs/dbraw/zinc/19/55/71/1046195571.db2.gz PWYDJPOLGPLMDT-QWHCGFSZSA-N 1 0 314.404 4.217 20 10 DICDRO C[C@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1ccc2ccccc2c1O ZINC000757654319 1046196863 /nfs/dbraw/zinc/19/68/63/1046196863.db2.gz ABUAPYAXUNAFNP-OWCLPIDISA-N 1 0 313.441 4.401 20 10 DICDRO C[C@@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1cc2c(cc1O)CCCC2 ZINC000757655786 1046198034 /nfs/dbraw/zinc/19/80/34/1046198034.db2.gz HBJDLSKKPDNHFM-BZUAXINKSA-N 1 0 317.473 4.127 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCNc2ccccc2F)c(O)c1C ZINC000757659076 1046198178 /nfs/dbraw/zinc/19/81/78/1046198178.db2.gz VRJPROTVYSCMJN-HNNXBMFYSA-N 1 0 316.420 4.301 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)s1 ZINC000757703524 1046202614 /nfs/dbraw/zinc/20/26/14/1046202614.db2.gz VOKKENNRTVJXNA-GIPNMCIBSA-N 1 0 320.433 4.238 20 10 DICDRO c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000757707671 1046205506 /nfs/dbraw/zinc/20/55/06/1046205506.db2.gz UPOHBYNBRJDLQZ-SFHVURJKSA-N 1 0 321.420 4.158 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000757706944 1046205564 /nfs/dbraw/zinc/20/55/64/1046205564.db2.gz QEFRLDWLETUCSK-KRWDZBQOSA-N 1 0 309.409 4.237 20 10 DICDRO C[N@H+](Cc1ccncc1)Cc1cc(-c2ccccc2)ccc1O ZINC000757890105 1046222634 /nfs/dbraw/zinc/22/26/34/1046222634.db2.gz RJNFDPGETYYOIR-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1cc2c(cc1O)CCCC2 ZINC000903310468 1046231816 /nfs/dbraw/zinc/23/18/16/1046231816.db2.gz JOBMRUNGUAHSHQ-NEPJUHHUSA-N 1 0 302.443 4.139 20 10 DICDRO COC1CCC(CC[NH2+]Cc2cc(Cl)cc(C)c2O)CC1 ZINC000757984727 1046236342 /nfs/dbraw/zinc/23/63/42/1046236342.db2.gz IAMYFCGVVSDANW-UHFFFAOYSA-N 1 0 311.853 4.039 20 10 DICDRO C[C@H]1CCC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000088698667 1046238269 /nfs/dbraw/zinc/23/82/69/1046238269.db2.gz GCTXGUYFYQMVHL-SUMWQHHRSA-N 1 0 324.415 4.035 20 10 DICDRO CC[C@@H]([NH2+][C@H](c1ncccn1)C1CC1)c1cc(Cl)ccc1O ZINC000903325510 1046240181 /nfs/dbraw/zinc/24/01/81/1046240181.db2.gz IECOXSZCNZXUGR-ZBFHGGJFSA-N 1 0 317.820 4.028 20 10 DICDRO C[C@@]1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CCCS1 ZINC000758489029 1046274617 /nfs/dbraw/zinc/27/46/17/1046274617.db2.gz ZPTFNNHQFXJTNF-IBGZPJMESA-N 1 0 313.466 4.435 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2(c3cccc(OC)c3)CC2)cc1 ZINC000758509474 1046275535 /nfs/dbraw/zinc/27/55/35/1046275535.db2.gz YVHYOJXTFBREMC-UHFFFAOYSA-N 1 0 324.468 4.320 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)c1cc(Cl)ccc1O ZINC000903429106 1046277143 /nfs/dbraw/zinc/27/71/43/1046277143.db2.gz RUKIZOIQFCCESI-GTNSWQLSSA-N 1 0 302.805 4.243 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000903430363 1046279965 /nfs/dbraw/zinc/27/99/65/1046279965.db2.gz ZBWQZTLUUZMSFM-LHSJRXKWSA-N 1 0 322.452 4.468 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001202859009 1046280183 /nfs/dbraw/zinc/28/01/83/1046280183.db2.gz ATLZKFNQNJHJNG-HNNXBMFYSA-N 1 0 316.876 4.435 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1cccc(F)c1F ZINC001202859239 1046280384 /nfs/dbraw/zinc/28/03/84/1046280384.db2.gz DTPZMAPJEPUWGD-CQSZACIVSA-N 1 0 318.411 4.060 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H](C)c2nccs2)cc1 ZINC000753595437 1046363781 /nfs/dbraw/zinc/36/37/81/1046363781.db2.gz PGHMXFUAFLCDNE-OAHLLOKOSA-N 1 0 317.502 4.225 20 10 DICDRO C[C@H]([NH2+]CCSc1ccccc1)c1ccc(N(C)C)cc1 ZINC000037904201 1046370241 /nfs/dbraw/zinc/37/02/41/1046370241.db2.gz FTDVXMZCFIGQQC-HNNXBMFYSA-N 1 0 300.471 4.196 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccccc1F ZINC000759689954 1046372003 /nfs/dbraw/zinc/37/20/03/1046372003.db2.gz QVPOZWHTOJGCCY-UHFFFAOYSA-N 1 0 312.432 4.448 20 10 DICDRO C[N@H+](CCOc1ccccc1)Cc1ccc(N2CCCCC2)cc1 ZINC000759691335 1046372984 /nfs/dbraw/zinc/37/29/84/1046372984.db2.gz KATUECTYFNTINV-UHFFFAOYSA-N 1 0 324.468 4.188 20 10 DICDRO C[N@H+](Cc1c(O)ccc2ccncc21)CC1(c2ccccc2)CC1 ZINC000780472357 1046387656 /nfs/dbraw/zinc/38/76/56/1046387656.db2.gz FAMKLQIKNHHQBH-UHFFFAOYSA-N 1 0 318.420 4.104 20 10 DICDRO Oc1ccccc1C[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000780581422 1046395881 /nfs/dbraw/zinc/39/58/81/1046395881.db2.gz UUSPJMGSWNZZMV-UHFFFAOYSA-N 1 0 321.342 4.232 20 10 DICDRO CC[C@H]1C[C@@H](C[N@H+](Cc2ccccc2O)C2CCCC2)CCO1 ZINC000780758443 1046403054 /nfs/dbraw/zinc/40/30/54/1046403054.db2.gz RVVVWIPNLPGNQJ-LPHOPBHVSA-N 1 0 317.473 4.342 20 10 DICDRO Cc1cc(O)c(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)cc1C ZINC000780793878 1046406458 /nfs/dbraw/zinc/40/64/58/1046406458.db2.gz WHSZOTHAQLQAPY-GXTWGEPZSA-N 1 0 301.352 4.172 20 10 DICDRO C[N@H+](Cc1ccc(Oc2ccccc2)nc1)Cc1ccccc1O ZINC001139247548 1046418699 /nfs/dbraw/zinc/41/86/99/1046418699.db2.gz ILOGFOKVQCCOOE-UHFFFAOYSA-N 1 0 320.392 4.212 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+][C@@H]3CCC[C@@H](C)CC3)C2)cc1 ZINC001202914365 1046420232 /nfs/dbraw/zinc/42/02/32/1046420232.db2.gz ZFHJENRLAFFKOG-KZNAEPCWSA-N 1 0 316.489 4.080 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+][C@H]3CCC[C@H](C)CC3)C2)cc1 ZINC001202914363 1046420706 /nfs/dbraw/zinc/42/07/06/1046420706.db2.gz ZFHJENRLAFFKOG-KSZLIROESA-N 1 0 316.489 4.080 20 10 DICDRO CSc1ccccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000781322589 1046439354 /nfs/dbraw/zinc/43/93/54/1046439354.db2.gz BMVMLNODCWXZDH-UHFFFAOYSA-N 1 0 300.471 4.107 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CC3CCC2CC3)ccc1OC ZINC001202929400 1046441563 /nfs/dbraw/zinc/44/15/63/1046441563.db2.gz HSASYWLWUDWYBZ-VJFUWPCTSA-N 1 0 317.473 4.148 20 10 DICDRO COc1cc(-c2ccccc2)ccc1C[NH2+]Cc1ccccc1O ZINC000781411082 1046442449 /nfs/dbraw/zinc/44/24/49/1046442449.db2.gz BSRKXBIHTWOEEU-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO CCOc1cccc(C[N@H+](CC)[C@H](C)c2cccc(O)c2)c1O ZINC000091975039 1046491022 /nfs/dbraw/zinc/49/10/22/1046491022.db2.gz ZULVJNXHWIJGSJ-CQSZACIVSA-N 1 0 315.413 4.080 20 10 DICDRO COc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)cc1C(C)C ZINC001139624701 1046491098 /nfs/dbraw/zinc/49/10/98/1046491098.db2.gz SMAWTTNINXUSSB-UHFFFAOYSA-N 1 0 311.425 4.083 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001139672404 1046496791 /nfs/dbraw/zinc/49/67/91/1046496791.db2.gz WNONUAPDWIQSDK-HXUWFJFHSA-N 1 0 324.468 4.407 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)ccc1N(C)C ZINC001139671826 1046496846 /nfs/dbraw/zinc/49/68/46/1046496846.db2.gz NPFOCOZZLFAFCK-QGZVFWFLSA-N 1 0 312.432 4.190 20 10 DICDRO COc1cccc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)c1O ZINC000092221672 1046500669 /nfs/dbraw/zinc/50/06/69/1046500669.db2.gz QIUPOQXDDZSRTP-SFHVURJKSA-N 1 0 309.409 4.053 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)[C@@H](O)c1ccc(C)cc1 ZINC001202963577 1046505111 /nfs/dbraw/zinc/50/51/11/1046505111.db2.gz CBBHXOXLUODCCO-HRAATJIYSA-N 1 0 322.452 4.007 20 10 DICDRO C[C@@H](C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)C[C@H](C)O ZINC000248008047 1046525836 /nfs/dbraw/zinc/52/58/36/1046525836.db2.gz KZTMBRZOOYGAJD-FGTMMUONSA-N 1 0 318.505 4.125 20 10 DICDRO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1ccc(N2CCCC2)cc1 ZINC001137319204 1046540446 /nfs/dbraw/zinc/54/04/46/1046540446.db2.gz OMBYIPFURVZCNP-UHFFFAOYSA-N 1 0 319.452 4.400 20 10 DICDRO Cc1ccc(C(F)(F)F)cc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001139886661 1046545988 /nfs/dbraw/zinc/54/59/88/1046545988.db2.gz IATCQAPKZSPWBH-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1cccc(F)c1 ZINC000783243705 1046567940 /nfs/dbraw/zinc/56/79/40/1046567940.db2.gz BBMOKXJBKMCNKS-IBGZPJMESA-N 1 0 300.421 4.441 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CC[C@](C)(c3ccccc3)C2)c1 ZINC000783251287 1046569212 /nfs/dbraw/zinc/56/92/12/1046569212.db2.gz JNPBUSVKRRHPBV-PXNSSMCTSA-N 1 0 311.425 4.001 20 10 DICDRO CCN(Cc1cc(F)ccc1O)Cc1c(F)cccc1Cl ZINC001140058728 1046577069 /nfs/dbraw/zinc/57/70/69/1046577069.db2.gz JQVSHVXSQOWROL-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC=CO1)c1ccc(N2CCCCCC2)cc1 ZINC000783307897 1046576959 /nfs/dbraw/zinc/57/69/59/1046576959.db2.gz BGSICQBLQGDGJN-PXNSSMCTSA-N 1 0 314.473 4.410 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCC=CO1)c1ccc(N2CCCCCC2)cc1 ZINC000783307900 1046578031 /nfs/dbraw/zinc/57/80/31/1046578031.db2.gz BGSICQBLQGDGJN-YLJYHZDGSA-N 1 0 314.473 4.410 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCC=CO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000783309700 1046578827 /nfs/dbraw/zinc/57/88/27/1046578827.db2.gz JOXTTWMKLQDAOM-NVXWUHKLSA-N 1 0 318.436 4.159 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCC=CO1)c1ccc(N2CCCCC2)cc1 ZINC000783311115 1046580716 /nfs/dbraw/zinc/58/07/16/1046580716.db2.gz UHGZBBFVGGXUTQ-APWZRJJASA-N 1 0 300.446 4.020 20 10 DICDRO CCc1cccc(Cl)c1C[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC001203000152 1046584677 /nfs/dbraw/zinc/58/46/77/1046584677.db2.gz IVSWWWOSQOCRDK-LBPRGKRZSA-N 1 0 319.832 4.467 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(O)cc1Cl ZINC001140087926 1046585255 /nfs/dbraw/zinc/58/52/55/1046585255.db2.gz XQUDERDCYPWNBR-UHFFFAOYSA-N 1 0 318.848 4.134 20 10 DICDRO Oc1cccc(Br)c1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001140101248 1046587263 /nfs/dbraw/zinc/58/72/63/1046587263.db2.gz NCOQNOZWIZRSQO-HNNXBMFYSA-N 1 0 318.214 4.102 20 10 DICDRO CC[N@H+](Cc1ccccc1)Cc1c(O)cccc1Br ZINC001140098656 1046588346 /nfs/dbraw/zinc/58/83/46/1046588346.db2.gz JWFCGPZHFUVNJQ-UHFFFAOYSA-N 1 0 320.230 4.177 20 10 DICDRO Oc1cccc(Br)c1C[N@@H+]1CCC12CCCCC2 ZINC001140100498 1046588419 /nfs/dbraw/zinc/58/84/19/1046588419.db2.gz RONOTMIIGBNOFW-UHFFFAOYSA-N 1 0 310.235 4.063 20 10 DICDRO CCC[N@H+](Cc1c(O)cccc1Br)[C@@H](C)CC ZINC001140098820 1046589262 /nfs/dbraw/zinc/58/92/62/1046589262.db2.gz MOKWWIFEOYOQOH-NSHDSACASA-N 1 0 300.240 4.165 20 10 DICDRO C[C@@H]([NH2+][C@H](CN1CCCCC1)c1ccccc1)c1ccccc1O ZINC000783505080 1046602090 /nfs/dbraw/zinc/60/20/90/1046602090.db2.gz DLCXNLCDMFCZIH-YLJYHZDGSA-N 1 0 324.468 4.270 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccccc1O)c1ccccc1Cl ZINC000783520751 1046603428 /nfs/dbraw/zinc/60/34/28/1046603428.db2.gz YNLAGJKKSHLLQG-SJKOYZFVSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1ccccc1O)Oc1cccc(Cl)c1 ZINC000783518636 1046603444 /nfs/dbraw/zinc/60/34/44/1046603444.db2.gz MOWWRTLWLLIQQW-CHWSQXEVSA-N 1 0 305.805 4.164 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1ccccc1O)Oc1ccc(Cl)cc1 ZINC000783515804 1046603985 /nfs/dbraw/zinc/60/39/85/1046603985.db2.gz BRJDBXWYDCNVCN-CHWSQXEVSA-N 1 0 305.805 4.164 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C(C)(C)C ZINC001203007122 1046604069 /nfs/dbraw/zinc/60/40/69/1046604069.db2.gz ZYNMVWZLEXZXPZ-CQSZACIVSA-N 1 0 319.449 4.109 20 10 DICDRO COc1cccc([C@H]2CC[N@H+](Cc3c(C)ccc(C)c3O)C2)c1 ZINC001140185199 1046609372 /nfs/dbraw/zinc/60/93/72/1046609372.db2.gz RKVNDZJOSCOBHJ-KRWDZBQOSA-N 1 0 311.425 4.007 20 10 DICDRO Cc1ccc(C)c(C[N@@H+]2CCc3cccc(Cl)c3C2)c1O ZINC001140183397 1046610081 /nfs/dbraw/zinc/61/00/81/1046610081.db2.gz DUOXEHXECPGJMB-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCO[C@H]2C(C)(C)C)c(O)c1 ZINC000248492749 1046618308 /nfs/dbraw/zinc/61/83/08/1046618308.db2.gz JPSSCTQDXFNDEF-HDMKZQKVSA-N 1 0 305.462 4.193 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C)c1cc(F)ccc1O ZINC000248498504 1046619322 /nfs/dbraw/zinc/61/93/22/1046619322.db2.gz MGBULJUZYGGWOZ-GDZNZVCISA-N 1 0 309.425 4.023 20 10 DICDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(N(C)C)cc2)s1 ZINC000093274653 1046620710 /nfs/dbraw/zinc/62/07/10/1046620710.db2.gz QKOFTRPFPIBAPT-CYBMUJFWSA-N 1 0 303.475 4.019 20 10 DICDRO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(Cl)ccc1O)CCC2 ZINC000093365001 1046626132 /nfs/dbraw/zinc/62/61/32/1046626132.db2.gz NLSRDPFBVXUMSH-AWEZNQCLSA-N 1 0 322.861 4.320 20 10 DICDRO C[C@H](CCCc1cccnc1)[NH2+]CCCSc1nccs1 ZINC000834594021 1046635254 /nfs/dbraw/zinc/63/52/54/1046635254.db2.gz OHMUVQQBEUMWOG-CQSZACIVSA-N 1 0 321.515 4.021 20 10 DICDRO CO[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(Cl)c1 ZINC000834673052 1046648071 /nfs/dbraw/zinc/64/80/71/1046648071.db2.gz MARWVERIRGXHAJ-NVXWUHKLSA-N 1 0 317.816 4.010 20 10 DICDRO Cc1cccc([C@@H]2CC[N@H+](Cc3c(O)ccc4ccncc43)C2)c1 ZINC000784025851 1046652828 /nfs/dbraw/zinc/65/28/28/1046652828.db2.gz QDAIDJKBOLKUPC-GOSISDBHSA-N 1 0 318.420 4.238 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001140341198 1046666456 /nfs/dbraw/zinc/66/64/56/1046666456.db2.gz CDOMDCGORBOLMP-MRXNPFEDSA-N 1 0 319.857 4.336 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001140344214 1046668392 /nfs/dbraw/zinc/66/83/92/1046668392.db2.gz GGJROULGFGMKCQ-HNNXBMFYSA-N 1 0 301.817 4.110 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2c(F)cccc21)c1cc(F)ccc1O ZINC000834814000 1046673784 /nfs/dbraw/zinc/67/37/84/1046673784.db2.gz CCJUHLFILPMTEW-PIGZYNQJSA-N 1 0 303.352 4.399 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2c(F)cccc21)c1cc(F)ccc1O ZINC000834813998 1046673836 /nfs/dbraw/zinc/67/38/36/1046673836.db2.gz CCJUHLFILPMTEW-DIFFPNOSSA-N 1 0 303.352 4.399 20 10 DICDRO C[C@H]([NH2+]CCCC1CCOCC1)c1cc2c(cc1O)CCCC2 ZINC000834819125 1046675877 /nfs/dbraw/zinc/67/58/77/1046675877.db2.gz SKYLHSCXQBZUOW-HNNXBMFYSA-N 1 0 317.473 4.128 20 10 DICDRO CC[C@H]([NH2+]CCCC1CCOCC1)c1cc(Cl)ccc1O ZINC000834818545 1046676270 /nfs/dbraw/zinc/67/62/70/1046676270.db2.gz NEBTYXGSNKHLPP-INIZCTEOSA-N 1 0 311.853 4.293 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2cc(F)cnc2Cl)c2c1c(F)ccc2O ZINC000834836282 1046680149 /nfs/dbraw/zinc/68/01/49/1046680149.db2.gz LWIOJPWAZOIYSM-QPUJVOFHSA-N 1 0 324.758 4.057 20 10 DICDRO CC[N@H+](Cc1ccc(-c2ccccn2)cc1)Cc1ccccc1O ZINC001140381595 1046680461 /nfs/dbraw/zinc/68/04/61/1046680461.db2.gz FPPYKFFTMHQJDJ-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO CC[C@H](COCC(F)(F)F)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000834843798 1046684333 /nfs/dbraw/zinc/68/43/33/1046684333.db2.gz LZTTVGNVSRUWGU-OCCSQVGLSA-N 1 0 319.367 4.099 20 10 DICDRO C[C@H](CC(C)(C)O)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834880217 1046695104 /nfs/dbraw/zinc/69/51/04/1046695104.db2.gz OFCMHPVYBCTVML-SJORKVTESA-N 1 0 318.505 4.267 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1ccc(C)cc1O ZINC000834883593 1046697325 /nfs/dbraw/zinc/69/73/25/1046697325.db2.gz RKEMLTPOCCNJSY-WBVHZDCISA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1ccc(C)cc1O ZINC000834885808 1046698100 /nfs/dbraw/zinc/69/81/00/1046698100.db2.gz YOLARXDPLNLZBL-OCCSQVGLSA-N 1 0 302.245 4.325 20 10 DICDRO CC[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1ccc(C)cc1O ZINC000834885807 1046698212 /nfs/dbraw/zinc/69/82/12/1046698212.db2.gz YOLARXDPLNLZBL-JSGCOSHPSA-N 1 0 302.245 4.325 20 10 DICDRO CC[C@@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1ccc(C)cc1O ZINC000834885809 1046698222 /nfs/dbraw/zinc/69/82/22/1046698222.db2.gz YOLARXDPLNLZBL-TZMCWYRMSA-N 1 0 302.245 4.325 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000834883915 1046698232 /nfs/dbraw/zinc/69/82/32/1046698232.db2.gz UYZVOYXBHGMEOR-QFBILLFUSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1ccc(F)cc1[O-] ZINC000834885268 1046698574 /nfs/dbraw/zinc/69/85/74/1046698574.db2.gz UOZFPDYIHGYAIX-YPMHNXCESA-N 1 0 306.208 4.156 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000834883948 1046698636 /nfs/dbraw/zinc/69/86/36/1046698636.db2.gz VHDGSCYNESNFKI-OLZOCXBDSA-N 1 0 309.837 4.046 20 10 DICDRO Cc1ccncc1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000834889131 1046702692 /nfs/dbraw/zinc/70/26/92/1046702692.db2.gz UWBCGOVWRQBLKH-KRWDZBQOSA-N 1 0 309.457 4.231 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000796039606 1046706719 /nfs/dbraw/zinc/70/67/19/1046706719.db2.gz HWZBJVNTWONVGN-UHFFFAOYSA-N 1 0 323.770 4.302 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c(O)c1 ZINC000834897240 1046706886 /nfs/dbraw/zinc/70/68/86/1046706886.db2.gz RPUIHAOFNRTNMK-QMTHXVAHSA-N 1 0 321.342 4.456 20 10 DICDRO C[C@@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO[C@@H]1C1CC1 ZINC000784688767 1046708246 /nfs/dbraw/zinc/70/82/46/1046708246.db2.gz YHNOGJJOEIRUQA-NHCUHLMSSA-N 1 0 323.436 4.106 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)c1 ZINC000834900994 1046711493 /nfs/dbraw/zinc/71/14/93/1046711493.db2.gz VPMCXLGDHIWNNG-JJRVBVJISA-N 1 0 317.454 4.333 20 10 DICDRO C[C@@H]([NH2+]CCC[C@@H]1CCOC1)c1ccc(N2CCCCC2)cc1 ZINC000834903554 1046713794 /nfs/dbraw/zinc/71/37/94/1046713794.db2.gz KTOJEDFQENJTAO-QZTJIDSGSA-N 1 0 316.489 4.144 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCN(C)c3ccccc32)c(O)c1 ZINC000834902630 1046715074 /nfs/dbraw/zinc/71/50/74/1046715074.db2.gz HRNSVMWZPGTPOB-YJBOKZPZSA-N 1 0 310.441 4.323 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCN(C)c3ccccc32)c1 ZINC000834903835 1046715139 /nfs/dbraw/zinc/71/51/39/1046715139.db2.gz LMAYWYXMLFVKPN-YJBOKZPZSA-N 1 0 310.441 4.323 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C2CCC(OC(F)F)CC2)c(O)c1 ZINC000834906251 1046716444 /nfs/dbraw/zinc/71/64/44/1046716444.db2.gz WSJOGVIHACUEEM-IYXRBSQSSA-N 1 0 313.388 4.210 20 10 DICDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccc3ccccc3c2O)nc1 ZINC000834909589 1046717489 /nfs/dbraw/zinc/71/74/89/1046717489.db2.gz PAPHMXJRTOUAQL-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO Oc1cccc(C2CC[NH+](Cc3ccc(Cl)cc3O)CC2)c1 ZINC001140464297 1046735675 /nfs/dbraw/zinc/73/56/75/1046735675.db2.gz KCGWRTIFYIMKGN-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc(Cl)cc2O)cc1 ZINC001140465615 1046738566 /nfs/dbraw/zinc/73/85/66/1046738566.db2.gz OHMZDZCWEZFEBK-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2cccc3cccnc32)c1 ZINC000321863726 1046739621 /nfs/dbraw/zinc/73/96/21/1046739621.db2.gz YRVFRNVVILVNQP-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO CCC[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccccn1 ZINC000835038226 1046742650 /nfs/dbraw/zinc/74/26/50/1046742650.db2.gz OUMGUASWXVGHLV-XSBJJCPUSA-N 1 0 309.457 4.292 20 10 DICDRO Cc1csc(C(C)(C)[NH2+]C/C=C/c2ccc(N(C)C)cc2)n1 ZINC000835039784 1046746484 /nfs/dbraw/zinc/74/64/84/1046746484.db2.gz LKVWWXYRKSQVGR-VOTSOKGWSA-N 1 0 315.486 4.056 20 10 DICDRO C[C@H](CCCC(F)(F)F)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835048930 1046748169 /nfs/dbraw/zinc/74/81/69/1046748169.db2.gz NBBUOXWCISEMRH-HZRUHFOJSA-N 1 0 314.395 4.477 20 10 DICDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)[C@H]1CCOC(C)(C)C1 ZINC000835052699 1046751118 /nfs/dbraw/zinc/75/11/18/1046751118.db2.gz IXUKXNRWSXVKMA-FQQSSWHASA-N 1 0 316.489 4.045 20 10 DICDRO Cc1cccc(CCC[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000797014640 1046770267 /nfs/dbraw/zinc/77/02/67/1046770267.db2.gz BWXJKIMTWKCPDF-INIZCTEOSA-N 1 0 324.468 4.258 20 10 DICDRO CCc1ccc([C@H](O)C[NH2+][C@H](CC)c2ccc(C)cc2O)cc1 ZINC000797014677 1046770356 /nfs/dbraw/zinc/77/03/56/1046770356.db2.gz CCUSEDGHONXMGD-UYAOXDASSA-N 1 0 313.441 4.037 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(F)cccc1SC)c1ccccc1O ZINC000797008631 1046770399 /nfs/dbraw/zinc/77/03/99/1046770399.db2.gz JASQVTPJFBATHB-OAHLLOKOSA-N 1 0 305.418 4.494 20 10 DICDRO Cc1cccc(CCC[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000797014641 1046770550 /nfs/dbraw/zinc/77/05/50/1046770550.db2.gz BWXJKIMTWKCPDF-MRXNPFEDSA-N 1 0 324.468 4.258 20 10 DICDRO C[C@@H]([NH2+]CCn1ccc2cc(Cl)ccc21)c1ccccc1O ZINC000797010967 1046770895 /nfs/dbraw/zinc/77/08/95/1046770895.db2.gz HDVUSHKVEFBCII-CYBMUJFWSA-N 1 0 314.816 4.351 20 10 DICDRO Cc1cccc(CCC[NH2+][C@H](C)c2cc(Cl)ccc2O)n1 ZINC000797020514 1046772545 /nfs/dbraw/zinc/77/25/45/1046772545.db2.gz ZOESUHDDHFMIAA-CYBMUJFWSA-N 1 0 304.821 4.032 20 10 DICDRO C[C@@H]([NH2+]CC1(c2ccccn2)CCC1)c1cc(Cl)ccc1O ZINC000797100237 1046790299 /nfs/dbraw/zinc/79/02/99/1046790299.db2.gz OVFUGGKLDGWETB-CYBMUJFWSA-N 1 0 316.832 4.213 20 10 DICDRO CC[C@@H]([NH2+]CC1(c2ccccn2)CCC1)c1ccc(C)cc1O ZINC000797099616 1046790333 /nfs/dbraw/zinc/79/03/33/1046790333.db2.gz MJCWKGOWZHMVNY-QGZVFWFLSA-N 1 0 310.441 4.258 20 10 DICDRO [O-]c1cc(F)cc(F)c1C[N@@H+]1CCC[C@H]1c1ccccc1F ZINC001140583903 1046792532 /nfs/dbraw/zinc/79/25/32/1046792532.db2.gz XZOCLMSRQJEYRN-INIZCTEOSA-N 1 0 307.315 4.147 20 10 DICDRO Cc1ccc(O[C@H]2CCC[N@H+](Cc3cc(C)ccc3O)C2)cc1 ZINC001140620852 1046814306 /nfs/dbraw/zinc/81/43/06/1046814306.db2.gz AJPFSSZHWVJJKY-IBGZPJMESA-N 1 0 311.425 4.052 20 10 DICDRO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(C)ccc1O ZINC001140623691 1046816816 /nfs/dbraw/zinc/81/68/16/1046816816.db2.gz PXYWMWLLYQPXNO-GOSISDBHSA-N 1 0 311.425 4.184 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC(Sc3ccccc3)CC2)c1 ZINC001140623789 1046818644 /nfs/dbraw/zinc/81/86/44/1046818644.db2.gz RSAAGSOMJGYOEY-UHFFFAOYSA-N 1 0 313.466 4.457 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)c1O ZINC001140746424 1046882591 /nfs/dbraw/zinc/88/25/91/1046882591.db2.gz YPTPOTXMQFSDGV-QGZVFWFLSA-N 1 0 315.388 4.273 20 10 DICDRO COC1CCN(c2ccc(C[NH+]3CCCCCCC3)cc2)CC1 ZINC000827294680 1046883781 /nfs/dbraw/zinc/88/37/81/1046883781.db2.gz LPVRPJGQHHASHT-UHFFFAOYSA-N 1 0 316.489 4.068 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)c1O ZINC001140747445 1046884517 /nfs/dbraw/zinc/88/45/17/1046884517.db2.gz DLOTYGSKQCMBLM-GFCCVEGCSA-N 1 0 323.845 4.458 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCCC3)c1O ZINC000237419821 1046898643 /nfs/dbraw/zinc/89/86/43/1046898643.db2.gz AILGBCXURVDKDG-CQSZACIVSA-N 1 0 311.425 4.130 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1C[C@H](c2ccccc2F)C1 ZINC000797876883 1046899450 /nfs/dbraw/zinc/89/94/50/1046899450.db2.gz RKPFSVQOJVYOSN-YEORSEQZSA-N 1 0 305.780 4.221 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc3occc3c2)c(Cl)c1 ZINC001203067246 1046900658 /nfs/dbraw/zinc/90/06/58/1046900658.db2.gz BBHMLBXFBPLPRL-UHFFFAOYSA-N 1 0 301.773 4.390 20 10 DICDRO CSc1ccc(CC[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000797878538 1046900740 /nfs/dbraw/zinc/90/07/40/1046900740.db2.gz ZANSWPQOUAIAHH-UHFFFAOYSA-N 1 0 307.846 4.100 20 10 DICDRO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)CC1CC(F)(F)C1 ZINC000827337940 1046911933 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CN(C)c1ccc(CN2CCc3ccsc3C2)c(Cl)c1 ZINC001140924178 1046950234 /nfs/dbraw/zinc/95/02/34/1046950234.db2.gz NUWVBFRIIIBMOG-UHFFFAOYSA-N 1 0 306.862 4.026 20 10 DICDRO COc1cc(C)cc(C[N@H+](Cc2ccccc2F)C2CC2)c1O ZINC000836364373 1046954139 /nfs/dbraw/zinc/95/41/39/1046954139.db2.gz YCTROBYVNRAUBK-UHFFFAOYSA-N 1 0 315.388 4.013 20 10 DICDRO Cc1ccc(C[NH+]2CCC3(C=Cc4ccccc43)CC2)c(O)c1 ZINC001140948195 1046957625 /nfs/dbraw/zinc/95/76/25/1046957625.db2.gz XUFAGJNHUNNKHE-UHFFFAOYSA-N 1 0 305.421 4.261 20 10 DICDRO Cc1ccc(C[NH+]2CCC(Oc3ccccc3C)CC2)c(O)c1 ZINC001140948675 1046958789 /nfs/dbraw/zinc/95/87/89/1046958789.db2.gz VGGBZJYIQYOFPL-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cccc(OC2CC[NH+](Cc3ccc(C)cc3O)CC2)c1 ZINC001140957625 1046962125 /nfs/dbraw/zinc/96/21/25/1046962125.db2.gz GAASYYAWNXTBRU-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO C[C@H](CCO)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000237471710 1046968479 /nfs/dbraw/zinc/96/84/79/1046968479.db2.gz DOWDEDSDKXNIIR-CQSZACIVSA-N 1 0 321.505 4.095 20 10 DICDRO C[C@H]([NH2+]CCCCC1CCOCC1)c1ccc(N(C)C)cc1 ZINC000799167343 1047005593 /nfs/dbraw/zinc/00/55/93/1047005593.db2.gz XGQKSDDWBMVMRG-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)cc1 ZINC000096970823 1047006962 /nfs/dbraw/zinc/00/69/62/1047006962.db2.gz COIJUURUHYXLBJ-UHFFFAOYSA-N 1 0 307.393 4.496 20 10 DICDRO Oc1ccc(O)c(C[NH+]2CCC(c3ccccc3Cl)CC2)c1 ZINC001141161829 1047029269 /nfs/dbraw/zinc/02/92/69/1047029269.db2.gz ZKUWPBZKJQVDBR-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO CSc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(O)ccc1O ZINC001141162587 1047031602 /nfs/dbraw/zinc/03/16/02/1047031602.db2.gz WPKQXACKAZHXLU-INIZCTEOSA-N 1 0 315.438 4.157 20 10 DICDRO CC(C)c1ncc(C[N@H+](C)Cc2c(O)ccc3ccccc32)cn1 ZINC000799579049 1047044230 /nfs/dbraw/zinc/04/42/30/1047044230.db2.gz DKCLSOIYBXBGCQ-UHFFFAOYSA-N 1 0 321.424 4.091 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1CO)c1ccc(N2CCCCC2)cc1 ZINC000305134901 1047099448 /nfs/dbraw/zinc/09/94/48/1047099448.db2.gz ODDCISSNSKGDDB-KRWDZBQOSA-N 1 0 324.468 4.020 20 10 DICDRO C[C@H](Cc1ccc(O)cc1)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116444262 1047142499 /nfs/dbraw/zinc/14/24/99/1047142499.db2.gz VACCDANFOVGZRM-QGZVFWFLSA-N 1 0 324.468 4.055 20 10 DICDRO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116444261 1047142707 /nfs/dbraw/zinc/14/27/07/1047142707.db2.gz VACCDANFOVGZRM-KRWDZBQOSA-N 1 0 324.468 4.055 20 10 DICDRO CC[N@H+](Cc1ccc2nc(C)ccc2c1)Cc1ccccc1O ZINC001141482831 1047147929 /nfs/dbraw/zinc/14/79/29/1047147929.db2.gz QRIXDFGDEZRGHJ-UHFFFAOYSA-N 1 0 306.409 4.271 20 10 DICDRO Cc1cc(C[NH2+]Cc2cccc(C)c2O)ccc1Br ZINC000839149877 1047199017 /nfs/dbraw/zinc/19/90/17/1047199017.db2.gz SXFWYSCMARKDFB-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000839180800 1047202406 /nfs/dbraw/zinc/20/24/06/1047202406.db2.gz XZUFZVHQPIKIOZ-ARJAWSKDSA-N 1 0 308.416 4.179 20 10 DICDRO Cn1cccc1C[N@H+](C)Cc1cc2oc3ccccc3c2cc1O ZINC000760406901 1047229064 /nfs/dbraw/zinc/22/90/64/1047229064.db2.gz JJMMAHQNVPMACT-UHFFFAOYSA-N 1 0 320.392 4.262 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cc3cccnc3cc2F)cc1 ZINC001141634598 1047240663 /nfs/dbraw/zinc/24/06/63/1047240663.db2.gz KHECOWGGCIPEOB-UHFFFAOYSA-N 1 0 323.415 4.072 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CCO[C@@H](C(C)C)C1 ZINC001117779645 1047244335 /nfs/dbraw/zinc/24/43/35/1047244335.db2.gz UIPFILNWVZLWKW-XLMAVXFVSA-N 1 0 317.473 4.290 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCCC1CCOCC1 ZINC001117831495 1047247385 /nfs/dbraw/zinc/24/73/85/1047247385.db2.gz PASGSWDXZRHMOH-ZBFHGGJFSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1ccc2ncc(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)cc2c1 ZINC000839564211 1047248583 /nfs/dbraw/zinc/24/85/83/1047248583.db2.gz SHPZPIOHQWQJDU-MRXNPFEDSA-N 1 0 319.452 4.460 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C)c1cncc(F)c1 ZINC001117945118 1047250924 /nfs/dbraw/zinc/25/09/24/1047250924.db2.gz OUNFYJDSVKCDPH-XUJVJEKNSA-N 1 0 300.377 4.134 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H]2C)c(O)c1 ZINC000383865768 1047272128 /nfs/dbraw/zinc/27/21/28/1047272128.db2.gz ZUYJVKSQENUQPV-QKLQHJQFSA-N 1 0 324.468 4.014 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c(O)c1 ZINC000383865770 1047273396 /nfs/dbraw/zinc/27/33/96/1047273396.db2.gz ZUYJVKSQENUQPV-SQGPQFPESA-N 1 0 324.468 4.014 20 10 DICDRO COc1ccc(C[NH2+]Cc2c(F)cccc2SC)cc1C ZINC000796441561 1047284244 /nfs/dbraw/zinc/28/42/44/1047284244.db2.gz JKBPZQKNSPONLY-UHFFFAOYSA-N 1 0 305.418 4.154 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)CCOCc2ccccc2)c(O)c1 ZINC000389935972 1047292825 /nfs/dbraw/zinc/29/28/25/1047292825.db2.gz MNSONIBVABEXAF-IAGOWNOFSA-N 1 0 313.441 4.347 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)COCc1ccccc1)c1cc(F)ccc1O ZINC000389907200 1047293114 /nfs/dbraw/zinc/29/31/14/1047293114.db2.gz HOQSWCOVPRXJCZ-LSDHHAIUSA-N 1 0 317.404 4.035 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccc2ccccc2c1O ZINC001118428513 1047294928 /nfs/dbraw/zinc/29/49/28/1047294928.db2.gz UQCZTXRFGMAUHH-CAAGUOMGSA-N 1 0 303.352 4.240 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCn2ccc3ccccc32)c1 ZINC000390218386 1047295239 /nfs/dbraw/zinc/29/52/39/1047295239.db2.gz GXWIZGBNCCRAMA-INIZCTEOSA-N 1 0 308.425 4.396 20 10 DICDRO C[C@H](CN1CCCCC1)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000390350939 1047296926 /nfs/dbraw/zinc/29/69/26/1047296926.db2.gz YSTKAEWRXMYJMO-HZPDHXFCSA-N 1 0 312.457 4.070 20 10 DICDRO FC1(F)CCC[C@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000390551402 1047297492 /nfs/dbraw/zinc/29/74/92/1047297492.db2.gz KEXSGHZJLHBYQN-INIZCTEOSA-N 1 0 308.416 4.202 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCN2Cc2ccccc2)c1 ZINC000390557200 1047297989 /nfs/dbraw/zinc/29/79/89/1047297989.db2.gz IIYROFJUNANWAX-PKOBYXMFSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000390557199 1047298121 /nfs/dbraw/zinc/29/81/21/1047298121.db2.gz IIYROFJUNANWAX-MJGOQNOKSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccncc2C)c(C)n1-c1ccccc1 ZINC000391462396 1047304557 /nfs/dbraw/zinc/30/45/57/1047304557.db2.gz GPIWGMQPXPDTTQ-UHFFFAOYSA-N 1 0 305.425 4.087 20 10 DICDRO c1ccc(OCCC[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000391960542 1047306037 /nfs/dbraw/zinc/30/60/37/1047306037.db2.gz JHBMDAOPYYFZQW-UHFFFAOYSA-N 1 0 324.468 4.236 20 10 DICDRO CC[C@H](C)[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)OC ZINC000394444146 1047311316 /nfs/dbraw/zinc/31/13/16/1047311316.db2.gz LYGOOYVXRPBWEU-IYOUNJFTSA-N 1 0 301.430 4.257 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001118813064 1047312091 /nfs/dbraw/zinc/31/20/91/1047312091.db2.gz SJTVSQZLOWJRDU-MLGOLLRUSA-N 1 0 315.388 4.186 20 10 DICDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3cc(Br)ccc32)C1 ZINC000725778969 1047313242 /nfs/dbraw/zinc/31/32/42/1047313242.db2.gz JVTTYDZYBBYNMH-NSHDSACASA-N 1 0 320.230 4.150 20 10 DICDRO COc1c(C)cc(C[N@H+](C)Cc2cc(C)c(C)cc2O)cc1C ZINC000725786852 1047314504 /nfs/dbraw/zinc/31/45/04/1047314504.db2.gz MKNRYYZUWILYMZ-UHFFFAOYSA-N 1 0 313.441 4.266 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]C[C@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000725841442 1047318208 /nfs/dbraw/zinc/31/82/08/1047318208.db2.gz IHRUMOIHDQGHIV-MRXNPFEDSA-N 1 0 319.489 4.256 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCc1cccs1 ZINC000725841657 1047318493 /nfs/dbraw/zinc/31/84/93/1047318493.db2.gz RIPGKROQDBIHOR-UHFFFAOYSA-N 1 0 309.434 4.453 20 10 DICDRO C[C@@H](Cc1ccco1)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725845270 1047318790 /nfs/dbraw/zinc/31/87/90/1047318790.db2.gz SBNXHAIRJTULJP-HNNXBMFYSA-N 1 0 307.393 4.373 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCc1ccsc1 ZINC000725844269 1047319092 /nfs/dbraw/zinc/31/90/92/1047319092.db2.gz QCEZGMCUWAXDDZ-UHFFFAOYSA-N 1 0 309.434 4.453 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c(C)c1 ZINC000840714842 1047319440 /nfs/dbraw/zinc/31/94/40/1047319440.db2.gz ZKVLLVXGEIBPKI-KRWDZBQOSA-N 1 0 324.468 4.455 20 10 DICDRO Cc1csc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)n1 ZINC000725845062 1047319657 /nfs/dbraw/zinc/31/96/57/1047319657.db2.gz HWVWFWDEPARJDU-UHFFFAOYSA-N 1 0 310.422 4.114 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)c(O)c1 ZINC000725846389 1047319688 /nfs/dbraw/zinc/31/96/88/1047319688.db2.gz CKRSSSKKFPMQQR-UHFFFAOYSA-N 1 0 323.392 4.341 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCOC1CCCC1 ZINC000725849606 1047320649 /nfs/dbraw/zinc/32/06/49/1047320649.db2.gz RRQJSOBNQAZNBX-UHFFFAOYSA-N 1 0 311.425 4.108 20 10 DICDRO Cc1csc(C2([NH2+]Cc3c(O)ccc4ccccc43)CCC2)n1 ZINC000725851801 1047320760 /nfs/dbraw/zinc/32/07/60/1047320760.db2.gz YCWPAFXURRDUCW-UHFFFAOYSA-N 1 0 324.449 4.479 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000725848996 1047321846 /nfs/dbraw/zinc/32/18/46/1047321846.db2.gz OZWRKIIMAKUIJK-OAHLLOKOSA-N 1 0 321.779 4.188 20 10 DICDRO C[C@H]([NH2+]Cc1csc(Br)c1)c1ccccc1O ZINC000397333124 1047324945 /nfs/dbraw/zinc/32/49/45/1047324945.db2.gz RUPFJUUUCCBIBE-VIFPVBQESA-N 1 0 312.232 4.067 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CS[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000840854993 1047346325 /nfs/dbraw/zinc/34/63/25/1047346325.db2.gz ILJHSYWZKWFJDA-INMHGKMJSA-N 1 0 304.503 4.222 20 10 DICDRO C[C@@H]([NH2+][C@H]1CS[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000840854986 1047346816 /nfs/dbraw/zinc/34/68/16/1047346816.db2.gz ILJHSYWZKWFJDA-BFYDXBDKSA-N 1 0 304.503 4.222 20 10 DICDRO COCC1CCC([NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000840876979 1047351874 /nfs/dbraw/zinc/35/18/74/1047351874.db2.gz VOFMUJOBWUIIOT-DNOWBOINSA-N 1 0 311.853 4.210 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOC3(CCCCC3)C2)c(Cl)c1 ZINC000840910379 1047358092 /nfs/dbraw/zinc/35/80/92/1047358092.db2.gz ZTHWLAKKFCWJFA-CQSZACIVSA-N 1 0 323.864 4.326 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OC3CCCC3)CC2)c(Cl)c1 ZINC000840912444 1047358517 /nfs/dbraw/zinc/35/85/17/1047358517.db2.gz IHVCGKSOKWTCHY-UHFFFAOYSA-N 1 0 323.864 4.278 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](c1ccccc1)[C@H]1CCCO1 ZINC000840929976 1047360339 /nfs/dbraw/zinc/36/03/39/1047360339.db2.gz DZWPJGMAXSOKKZ-RTWAWAEBSA-N 1 0 324.468 4.071 20 10 DICDRO Cc1cc2cc(C[NH2+]Cc3ccc(N(C)C)cc3C)ccc2[nH]1 ZINC000840947000 1047362983 /nfs/dbraw/zinc/36/29/83/1047362983.db2.gz YYDXRSFDXKIPMQ-UHFFFAOYSA-N 1 0 307.441 4.141 20 10 DICDRO Oc1ccc2ccncc2c1C[NH+]1CCC2(CCCCC2)CC1 ZINC000726590948 1047366899 /nfs/dbraw/zinc/36/68/99/1047366899.db2.gz AFYYXOMWKYQRGG-UHFFFAOYSA-N 1 0 310.441 4.487 20 10 DICDRO C[C@@H](C[NH2+]CCc1ccc(N)cc1)c1ccc(C(F)(F)F)cc1 ZINC000841038799 1047373626 /nfs/dbraw/zinc/37/36/26/1047373626.db2.gz QPSZLPWXZYRTEL-ZDUSSCGKSA-N 1 0 322.374 4.223 20 10 DICDRO CC[NH2+]Cc1cccc(NCc2c(O)cc(C)cc2Cl)c1 ZINC000841041794 1047374457 /nfs/dbraw/zinc/37/44/57/1047374457.db2.gz AKHCMFDIVBASHC-UHFFFAOYSA-N 1 0 304.821 4.076 20 10 DICDRO CCN(CC)c1ccc(CNc2ccc(C[NH2+]C)cc2)cc1F ZINC000841071306 1047378791 /nfs/dbraw/zinc/37/87/91/1047378791.db2.gz NLTTXKCGTFPCKF-UHFFFAOYSA-N 1 0 315.436 4.003 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(Cl)cc2[O-])CCC1 ZINC000841747421 1047448316 /nfs/dbraw/zinc/44/83/16/1047448316.db2.gz AULJMXJQKZRZKQ-ZDUSSCGKSA-N 1 0 311.853 4.293 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000841745649 1047448390 /nfs/dbraw/zinc/44/83/90/1047448390.db2.gz RTNCSZVWWYSTLC-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO COCc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841745505 1047449055 /nfs/dbraw/zinc/44/90/55/1047449055.db2.gz YZDUZFJZRPBWRQ-LBPRGKRZSA-N 1 0 305.805 4.043 20 10 DICDRO COc1cccc(C2([NH2+][C@H](C)c3ccc(Cl)cc3O)CC2)c1 ZINC000841750521 1047450201 /nfs/dbraw/zinc/45/02/01/1047450201.db2.gz RLAURUWAVQDUKN-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc(Cl)cc2O)o1 ZINC000841748908 1047450425 /nfs/dbraw/zinc/45/04/25/1047450425.db2.gz BVWLECJJSFZAKP-ABAIWWIYSA-N 1 0 323.820 4.239 20 10 DICDRO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc(Cl)cc2O)o1 ZINC000841748912 1047450757 /nfs/dbraw/zinc/45/07/57/1047450757.db2.gz BVWLECJJSFZAKP-XHDPSFHLSA-N 1 0 323.820 4.239 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1c(C)noc1C ZINC000841751964 1047451393 /nfs/dbraw/zinc/45/13/93/1047451393.db2.gz POESKRASBCOJAC-LKFCYVNXSA-N 1 0 308.809 4.452 20 10 DICDRO CCSc1cc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)ccn1 ZINC000841751782 1047451750 /nfs/dbraw/zinc/45/17/50/1047451750.db2.gz JNZJEIFJTCFAGH-LLVKDONJSA-N 1 0 322.861 4.403 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1c(C)noc1C ZINC000841751966 1047451933 /nfs/dbraw/zinc/45/19/33/1047451933.db2.gz POESKRASBCOJAC-XPTSAGLGSA-N 1 0 308.809 4.452 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000841753510 1047452466 /nfs/dbraw/zinc/45/24/66/1047452466.db2.gz UXTPLTHGSQTWKU-SNVBAGLBSA-N 1 0 311.212 4.253 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1ccc(Cl)cc1O ZINC000841751787 1047452474 /nfs/dbraw/zinc/45/24/74/1047452474.db2.gz JSAOFJIHULFJBU-LBPRGKRZSA-N 1 0 319.832 4.124 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2COCc3ccccc32)cc1 ZINC000841759401 1047453642 /nfs/dbraw/zinc/45/36/42/1047453642.db2.gz FPYCLEBBSBLGRR-MGPUTAFESA-N 1 0 310.441 4.065 20 10 DICDRO C[C@@H]([NH2+][C@@H]1COCc2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000841760375 1047453803 /nfs/dbraw/zinc/45/38/03/1047453803.db2.gz KDJXSRRWSYLPDX-JLTOFOAXSA-N 1 0 323.436 4.193 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841765249 1047455754 /nfs/dbraw/zinc/45/57/54/1047455754.db2.gz WCTLWJKKIORDKI-ZDUSSCGKSA-N 1 0 318.848 4.271 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC3(C[C@@H]2C)CCOCC3)cc1C(C)C ZINC000842637773 1047494138 /nfs/dbraw/zinc/49/41/38/1047494138.db2.gz QZMAFTUWYSCADI-INIZCTEOSA-N 1 0 317.473 4.215 20 10 DICDRO COc1cccc(C[NH2+]C2(c3cccc(Cl)c3)CCC2)c1O ZINC000842771518 1047502796 /nfs/dbraw/zinc/50/27/96/1047502796.db2.gz LZUUDDJKEBJSPY-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](CC)c2csc(C)c2)c(O)c1 ZINC000842774796 1047504148 /nfs/dbraw/zinc/50/41/48/1047504148.db2.gz KEPGPMFXSYDNSZ-INIZCTEOSA-N 1 0 305.443 4.402 20 10 DICDRO CC(C)C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccncc1 ZINC000842835566 1047507200 /nfs/dbraw/zinc/50/72/00/1047507200.db2.gz IGQVNJDUAHGPOA-SFHVURJKSA-N 1 0 315.436 4.164 20 10 DICDRO COCC1(CC[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000842894244 1047512798 /nfs/dbraw/zinc/51/27/98/1047512798.db2.gz NREOXDGURSBVSG-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(Br)cc1O)CC(F)F ZINC000842889812 1047512832 /nfs/dbraw/zinc/51/28/32/1047512832.db2.gz HISIZQMCVDWDIN-BDAKNGLRSA-N 1 0 322.193 4.097 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(c3ccc(C)cc3)CCC2)c1 ZINC000842927782 1047513544 /nfs/dbraw/zinc/51/35/44/1047513544.db2.gz LPZBNYCLNCTVFH-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO C[N@H+](Cc1cccc(F)c1)Cc1cccc(C(C)(C)C)c1O ZINC001143103625 1047531160 /nfs/dbraw/zinc/53/11/60/1047531160.db2.gz HSYGIWWAZGGFLD-UHFFFAOYSA-N 1 0 301.405 4.461 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H](c3cccnc3)C2)c1O ZINC001143111082 1047532307 /nfs/dbraw/zinc/53/23/07/1047532307.db2.gz WVHPZSRLWFXJTD-MRXNPFEDSA-N 1 0 310.441 4.074 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)c1O ZINC001143111042 1047532501 /nfs/dbraw/zinc/53/25/01/1047532501.db2.gz VEXHGSGSEGBKNA-GOSISDBHSA-N 1 0 324.468 4.292 20 10 DICDRO Cc1nc2c(s1)C[N@H+](Cc1cccc(C(C)(C)C)c1O)CC2 ZINC001143110644 1047532650 /nfs/dbraw/zinc/53/26/50/1047532650.db2.gz MXCSICPNSUTDCF-UHFFFAOYSA-N 1 0 316.470 4.013 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccnn1C1CCC1 ZINC000924648086 1047643613 /nfs/dbraw/zinc/64/36/13/1047643613.db2.gz KSRMRAXKNZALNY-INIZCTEOSA-N 1 0 324.472 4.059 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1[C@@H](c2ccccc2)C1(F)F)c1ccccc1O ZINC000926974111 1047663873 /nfs/dbraw/zinc/66/38/73/1047663873.db2.gz PKRANCNMKMSJSK-XGWLTEMNSA-N 1 0 303.352 4.092 20 10 DICDRO CCN(C)c1ccc(C[N@H+](C)[C@H](C)c2ccccc2F)cc1 ZINC001307418674 1047825591 /nfs/dbraw/zinc/82/55/91/1047825591.db2.gz NYTAUKVPCBBYFB-OAHLLOKOSA-N 1 0 300.421 4.475 20 10 DICDRO COc1ccc(N(c2ccc(N)cc2)c2cc[nH+]cc2C)cc1 ZINC001174539366 1047864693 /nfs/dbraw/zinc/86/46/93/1047864693.db2.gz DCDDREPYLSVAAF-UHFFFAOYSA-N 1 0 305.381 4.451 20 10 DICDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1c(C)c3ccccc3n1C)CC2 ZINC000479440232 1047890646 /nfs/dbraw/zinc/89/06/46/1047890646.db2.gz SINIBKDBVLHNQK-LJQANCHMSA-N 1 0 320.436 4.272 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccccc1N(C)C ZINC000479457988 1047898502 /nfs/dbraw/zinc/89/85/02/1047898502.db2.gz UUPHIVQQEFGHQO-MRXNPFEDSA-N 1 0 321.468 4.404 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC001183363236 1047919623 /nfs/dbraw/zinc/91/96/23/1047919623.db2.gz IAFZNARWGNDRNL-QTLSWZBMSA-N 1 0 312.379 4.040 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2c3ccccc3CC[C@H]2F)cc1Cl ZINC001183492679 1047937173 /nfs/dbraw/zinc/93/71/73/1047937173.db2.gz XXRPENYKGLSSOG-AEFFLSMTSA-N 1 0 319.807 4.469 20 10 DICDRO Cc1nc2c(cccc2CC[NH2+]Cc2cc(C(C)C)ccc2O)o1 ZINC001183708631 1047957404 /nfs/dbraw/zinc/95/74/04/1047957404.db2.gz KLRREHRNYJTPKG-UHFFFAOYSA-N 1 0 324.424 4.298 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@]3(C2)OCc2ccccc23)cc1C ZINC000774701418 1047986186 /nfs/dbraw/zinc/98/61/86/1047986186.db2.gz IVORZIDIUIHJPG-OAQYLSRUSA-N 1 0 323.436 4.031 20 10 DICDRO Oc1c(C[NH2+]CC[C@H]2CCC(F)(F)C2)ccc2ccccc21 ZINC001184239275 1048015160 /nfs/dbraw/zinc/01/51/60/1048015160.db2.gz LDTHZGWCOCVJLS-CYBMUJFWSA-N 1 0 305.368 4.461 20 10 DICDRO COC[C@H]([NH2+]Cc1cc(C(C)C)ccc1O)c1ccc(F)cc1 ZINC001184278592 1048024914 /nfs/dbraw/zinc/02/49/14/1048024914.db2.gz UEQWINAGGLCDKH-SFHVURJKSA-N 1 0 317.404 4.132 20 10 DICDRO CCc1onc(C)c1C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000927133810 1048054985 /nfs/dbraw/zinc/05/49/85/1048054985.db2.gz DYKHGLRMFZVDDU-SNVBAGLBSA-N 1 0 308.809 4.064 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2ccc(N(CC)CC)cc2)cc1 ZINC001199403122 1048063914 /nfs/dbraw/zinc/06/39/14/1048063914.db2.gz GWXQXLCQYUQNQH-UHFFFAOYSA-N 1 0 312.457 4.221 20 10 DICDRO Fc1cccc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)c1 ZINC000105023967 1048067172 /nfs/dbraw/zinc/06/71/72/1048067172.db2.gz NASJHOXRXLWDPI-UHFFFAOYSA-N 1 0 312.432 4.148 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC2(c3ccccc3C)CC2)c(Cl)c1 ZINC001199972447 1048128506 /nfs/dbraw/zinc/12/85/06/1048128506.db2.gz RPUHGGYODPEKGX-UHFFFAOYSA-N 1 0 315.844 4.484 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@@H]1CCC=CO1)C1CCCCC1 ZINC000774821704 1048131249 /nfs/dbraw/zinc/13/12/49/1048131249.db2.gz QEADURXXJVHIMG-SFHVURJKSA-N 1 0 301.430 4.220 20 10 DICDRO CCS[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001200921056 1048156457 /nfs/dbraw/zinc/15/64/57/1048156457.db2.gz CJLMOBNHIDJAPI-IAGOWNOFSA-N 1 0 305.487 4.166 20 10 DICDRO CCO[C@H](CC[NH2+]Cc1ccc2c(c1)CCCO2)C1CCCC1 ZINC001200960717 1048163810 /nfs/dbraw/zinc/16/38/10/1048163810.db2.gz MTZBNNBETJGSQG-HXUWFJFHSA-N 1 0 317.473 4.087 20 10 DICDRO CC[C@H](O)CC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001201017251 1048172293 /nfs/dbraw/zinc/17/22/93/1048172293.db2.gz AEGTUMBXJSDTNM-INIZCTEOSA-N 1 0 321.505 4.238 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCc1c(C)cccc1C ZINC001201025769 1048173372 /nfs/dbraw/zinc/17/33/72/1048173372.db2.gz HBQQGEBGKOYSKQ-UHFFFAOYSA-N 1 0 306.453 4.436 20 10 DICDRO CCOCc1cc(C[NH2+]CC2(CC(C)C)CC2)ccc1OC ZINC001201398058 1048250364 /nfs/dbraw/zinc/25/03/64/1048250364.db2.gz ANAGEQUGOVHPON-UHFFFAOYSA-N 1 0 305.462 4.148 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c(Cl)c1 ZINC001201380569 1048255066 /nfs/dbraw/zinc/25/50/66/1048255066.db2.gz RPAAZOQGBKDZRP-KHYOSLBOSA-N 1 0 313.828 4.030 20 10 DICDRO CC(C)c1ccc(C[C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001201466027 1048270625 /nfs/dbraw/zinc/27/06/25/1048270625.db2.gz ZBKVYTAJBFHIFQ-INIZCTEOSA-N 1 0 309.453 4.466 20 10 DICDRO CC(C)c1ccc(C[C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001201466029 1048271875 /nfs/dbraw/zinc/27/18/75/1048271875.db2.gz ZBKVYTAJBFHIFQ-MRXNPFEDSA-N 1 0 309.453 4.466 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCCc2cccs2)cc1 ZINC001201450572 1048278902 /nfs/dbraw/zinc/27/89/02/1048278902.db2.gz WXCREOQITUQGPD-UHFFFAOYSA-N 1 0 302.487 4.317 20 10 DICDRO C[C@H]([NH2+]C[C@H]1[C@H](c2ccccc2)C1(F)F)c1ccccc1O ZINC001175427383 1048304580 /nfs/dbraw/zinc/30/45/80/1048304580.db2.gz PKRANCNMKMSJSK-NUTKFTJISA-N 1 0 303.352 4.092 20 10 DICDRO C[C@H]1CC[C@H]([N@H+](C)Cc2cc(Br)ccc2O)CC1 ZINC001203648823 1048357637 /nfs/dbraw/zinc/35/76/37/1048357637.db2.gz VVNVEBKTUCSOAO-YEORSEQZSA-N 1 0 312.251 4.165 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](C)c2nc(C)cs2)cc1C ZINC001201919319 1048401300 /nfs/dbraw/zinc/40/13/00/1048401300.db2.gz CXMFHWHWUPNMEJ-CQSZACIVSA-N 1 0 318.486 4.442 20 10 DICDRO C[C@H]([NH2+]CCOc1ccc2ccccc2c1)c1ccccc1O ZINC000775131867 1048407105 /nfs/dbraw/zinc/40/71/05/1048407105.db2.gz XWLLZEWONBADAG-HNNXBMFYSA-N 1 0 307.393 4.275 20 10 DICDRO CSc1ccc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001202059280 1048434023 /nfs/dbraw/zinc/43/40/23/1048434023.db2.gz VIQXSWIZIUXLFY-PLNGDYQASA-N 1 0 312.482 4.278 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC001202066164 1048436912 /nfs/dbraw/zinc/43/69/12/1048436912.db2.gz NSCHVKWDAJLRAO-OXQOHEQNSA-N 1 0 308.469 4.351 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)cc1 ZINC001202168643 1048470758 /nfs/dbraw/zinc/47/07/58/1048470758.db2.gz PPJVDKCWLGNGBH-TWEDNUIGSA-N 1 0 324.443 4.441 20 10 DICDRO Nc1ccc(N(Cc2ccccc2)c2ccc(C[NH3+])cc2)cc1 ZINC001175970655 1048509532 /nfs/dbraw/zinc/50/95/32/1048509532.db2.gz FZNOPVDWUVOKMG-UHFFFAOYSA-N 1 0 303.409 4.066 20 10 DICDRO [NH3+]Cc1ccc(Nc2ccccc2C(=O)c2ccc(F)cc2)cc1 ZINC001175969710 1048509943 /nfs/dbraw/zinc/50/99/43/1048509943.db2.gz XPOXCPSRHPAMSZ-UHFFFAOYSA-N 1 0 320.367 4.259 20 10 DICDRO CC[C@@H]([NH2+]Cc1occc1C)c1cc(Br)ccc1O ZINC000388728103 1048584555 /nfs/dbraw/zinc/58/45/55/1048584555.db2.gz IFCGRTKLBCIUOT-CYBMUJFWSA-N 1 0 324.218 4.297 20 10 DICDRO Cc1ccc2cc(C[NH2+]Cc3ccc(N(C)C)cc3C)[nH]c2c1 ZINC000850139179 1048620102 /nfs/dbraw/zinc/62/01/02/1048620102.db2.gz NODLSSPCMZINIW-UHFFFAOYSA-N 1 0 307.441 4.141 20 10 DICDRO Cc1cccc2[nH]c(C[NH2+]Cc3ccc(N(C)C)cc3C)cc21 ZINC000850139450 1048620561 /nfs/dbraw/zinc/62/05/61/1048620561.db2.gz PEFRSXLMHZKPPX-UHFFFAOYSA-N 1 0 307.441 4.141 20 10 DICDRO CNc1ccccc1N[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC001164499606 1048636068 /nfs/dbraw/zinc/63/60/68/1048636068.db2.gz SQUHFZJWYUYXOO-IPMKNSEASA-N 1 0 321.468 4.051 20 10 DICDRO CNc1ccccc1N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC001164499600 1048636495 /nfs/dbraw/zinc/63/64/95/1048636495.db2.gz SQUHFZJWYUYXOO-CEXWTWQISA-N 1 0 321.468 4.051 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)cc1C ZINC000850429724 1048654129 /nfs/dbraw/zinc/65/41/29/1048654129.db2.gz HQUFRXCOHHQIAZ-HNNXBMFYSA-N 1 0 311.425 4.179 20 10 DICDRO CC[C@@H]([NH2+]CCc1noc2ccccc12)c1ccc(N(C)C)cc1 ZINC000850483004 1048670612 /nfs/dbraw/zinc/67/06/12/1048670612.db2.gz MXVMOQYWDSYWOT-GOSISDBHSA-N 1 0 323.440 4.177 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)c1ccsc1 ZINC000850485721 1048671384 /nfs/dbraw/zinc/67/13/84/1048671384.db2.gz BABWDHQOXGOMSP-MAUKXSAKSA-N 1 0 316.470 4.076 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccnc3ccccc23)c1 ZINC000850505908 1048672447 /nfs/dbraw/zinc/67/24/47/1048672447.db2.gz CVJKWFGYJFTRAW-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccnc3ccccc23)c(O)c1C ZINC000850507596 1048672566 /nfs/dbraw/zinc/67/25/66/1048672566.db2.gz OXCJBPYFQPYCHE-INIZCTEOSA-N 1 0 320.436 4.451 20 10 DICDRO C[C@H]([NH2+]CCc1ccnc2ccccc12)c1ccc(N(C)C)cc1 ZINC000850507789 1048672834 /nfs/dbraw/zinc/67/28/34/1048672834.db2.gz QFVQJJINIKDDNK-INIZCTEOSA-N 1 0 319.452 4.194 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)COc2c(F)cccc2F)c(O)c1 ZINC000850522383 1048676438 /nfs/dbraw/zinc/67/64/38/1048676438.db2.gz ARUJZUUATVECKG-QWHCGFSZSA-N 1 0 321.367 4.097 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(COC)cs1)c1ccc(C)cc1O ZINC000850531433 1048682307 /nfs/dbraw/zinc/68/23/07/1048682307.db2.gz DQJKOHFCOQFFEO-MRXNPFEDSA-N 1 0 305.443 4.149 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@H](O)c2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000850530519 1048682376 /nfs/dbraw/zinc/68/23/76/1048682376.db2.gz ZGYWPIBFRJKFCF-NQZBTDCJSA-N 1 0 323.436 4.100 20 10 DICDRO COCc1csc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000850531178 1048683509 /nfs/dbraw/zinc/68/35/09/1048683509.db2.gz CNOPJLDYEISFAV-CYBMUJFWSA-N 1 0 305.443 4.068 20 10 DICDRO C[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(N2CCCCC2)cc1 ZINC000850534451 1048684473 /nfs/dbraw/zinc/68/44/73/1048684473.db2.gz JVXMYQPURYKHNL-RHSMWYFYSA-N 1 0 308.416 4.373 20 10 DICDRO CC[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(C(F)(F)F)cc1O ZINC000850536621 1048684770 /nfs/dbraw/zinc/68/47/70/1048684770.db2.gz MBIROYQUQDXMNC-DGCLKSJQSA-N 1 0 323.305 4.497 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)c1O ZINC000850535906 1048684992 /nfs/dbraw/zinc/68/49/92/1048684992.db2.gz DOLUGNASSMOIKU-YGRLFVJLSA-N 1 0 303.780 4.440 20 10 DICDRO COCc1csc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000850531815 1048685417 /nfs/dbraw/zinc/68/54/17/1048685417.db2.gz HTEIPEHKVNAZEP-SNVBAGLBSA-N 1 0 311.834 4.104 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)c1O ZINC000850542106 1048686845 /nfs/dbraw/zinc/68/68/45/1048686845.db2.gz HTTHMIMWCXXDEL-DIFFPNOSSA-N 1 0 317.816 4.398 20 10 DICDRO CC[C@H]([NH2+]CCC1SCCS1)c1cc(Cl)ccc1O ZINC000850569138 1048696912 /nfs/dbraw/zinc/69/69/12/1048696912.db2.gz VEIKZNKDNDVKLZ-LBPRGKRZSA-N 1 0 317.907 4.283 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1F)c1ccc(N(C)C)cc1 ZINC000775360154 1048702523 /nfs/dbraw/zinc/70/25/23/1048702523.db2.gz AFXLQMBWPZBCJO-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO C[C@@H]([NH2+]Cc1cnc(C2CCC2)s1)c1ccc(N(C)C)cc1 ZINC000775365070 1048704579 /nfs/dbraw/zinc/70/45/79/1048704579.db2.gz RZWRWLZADNVEIF-CYBMUJFWSA-N 1 0 315.486 4.327 20 10 DICDRO COc1c(C)cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1C ZINC000775363283 1048705006 /nfs/dbraw/zinc/70/50/06/1048705006.db2.gz MEFCMFWCORQXIK-MRXNPFEDSA-N 1 0 312.457 4.229 20 10 DICDRO CC(C)c1ncc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000775361882 1048705059 /nfs/dbraw/zinc/70/50/59/1048705059.db2.gz GSKXWNASCGGVOX-ZDUSSCGKSA-N 1 0 303.475 4.183 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)c(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000775365744 1048707797 /nfs/dbraw/zinc/70/77/97/1048707797.db2.gz WSIWNBKHUXXRAY-LLVKDONJSA-N 1 0 308.347 4.021 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC001206707385 1048709326 /nfs/dbraw/zinc/70/93/26/1048709326.db2.gz HLPPUJHXBITCQU-QGZVFWFLSA-N 1 0 302.805 4.072 20 10 DICDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000776497756 1048719519 /nfs/dbraw/zinc/71/95/19/1048719519.db2.gz FBWAQQBOGUIWCB-KUHUBIRLSA-N 1 0 317.404 4.014 20 10 DICDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000776498588 1048722649 /nfs/dbraw/zinc/72/26/49/1048722649.db2.gz OQCSGXDNVFCKGJ-GTNSWQLSSA-N 1 0 323.795 4.051 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(Cl)cn2)cc1F ZINC000776497247 1048723200 /nfs/dbraw/zinc/72/32/00/1048723200.db2.gz SLKCJADKDKTDOX-UHFFFAOYSA-N 1 0 321.827 4.010 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1O ZINC000775412783 1048785339 /nfs/dbraw/zinc/78/53/39/1048785339.db2.gz QLGBLNRVZNZABH-DOMZBBRYSA-N 1 0 300.358 4.102 20 10 DICDRO CC[C@@H]([NH2+]CCOc1ccc(Cl)cc1)c1ccccc1O ZINC000775413871 1048788882 /nfs/dbraw/zinc/78/88/82/1048788882.db2.gz DEJYRNXKKPEQLR-MRXNPFEDSA-N 1 0 305.805 4.165 20 10 DICDRO COc1ccc2c(c1)CCC[N@@H+](Cc1ccc(N(C)C)c(C)c1)C2 ZINC001190838073 1048790134 /nfs/dbraw/zinc/79/01/34/1048790134.db2.gz MLQJFLQZWHAQDQ-UHFFFAOYSA-N 1 0 324.468 4.018 20 10 DICDRO Oc1ccccc1C[N@H+](CCCOC(F)(F)F)C1CCCC1 ZINC001190894395 1048798166 /nfs/dbraw/zinc/79/81/66/1048798166.db2.gz CTJPZNTWVXHHMR-UHFFFAOYSA-N 1 0 317.351 4.063 20 10 DICDRO C[C@H]([NH2+]Cc1nsc2ccccc12)c1ccc(N(C)C)cc1 ZINC000851951162 1048815459 /nfs/dbraw/zinc/81/54/59/1048815459.db2.gz VKPQPONJJSZRAJ-ZDUSSCGKSA-N 1 0 311.454 4.213 20 10 DICDRO c1c2ccccc2oc1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001177294422 1048858877 /nfs/dbraw/zinc/85/88/77/1048858877.db2.gz JIRWZEANSULDAR-UHFFFAOYSA-N 1 0 306.409 4.323 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)CCCO3)c(O)c1 ZINC000853241617 1048891074 /nfs/dbraw/zinc/89/10/74/1048891074.db2.gz LZLDQHRXBUIYKL-HUUCEWRRSA-N 1 0 311.425 4.437 20 10 DICDRO CC(C)c1ccccc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001177553952 1048907250 /nfs/dbraw/zinc/90/72/50/1048907250.db2.gz HLLHQHMNDQJJGU-UHFFFAOYSA-N 1 0 300.421 4.305 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2(OC(C)C)CCC2)cc1C ZINC001203566183 1048930091 /nfs/dbraw/zinc/93/00/91/1048930091.db2.gz QBKWUQRWZUHHDY-UHFFFAOYSA-N 1 0 305.462 4.221 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCCc1cccc(F)c1 ZINC001177688485 1048932369 /nfs/dbraw/zinc/93/23/69/1048932369.db2.gz XDPLHHGSCVCHEL-UHFFFAOYSA-N 1 0 310.416 4.348 20 10 DICDRO Cc1cccc2c1CC[C@@H]2[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001177774185 1048936560 /nfs/dbraw/zinc/93/65/60/1048936560.db2.gz BIZNWPACYBWVNQ-JKTFDMFLSA-N 1 0 306.453 4.351 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c1O ZINC001203609464 1048939058 /nfs/dbraw/zinc/93/90/58/1048939058.db2.gz UPOUEPFNTSOWFM-QGZVFWFLSA-N 1 0 315.388 4.267 20 10 DICDRO COc1ccc(C[NH2+]CC2(c3cccc(F)c3)CCC2)cc1C ZINC001203597462 1048939471 /nfs/dbraw/zinc/93/94/71/1048939471.db2.gz GADHWELWXYVSCD-UHFFFAOYSA-N 1 0 313.416 4.354 20 10 DICDRO Cc1cc(C)c(O)c(C[N@H+](C)Cc2nc3ccccc3s2)c1 ZINC000111898409 1048939700 /nfs/dbraw/zinc/93/97/00/1048939700.db2.gz SULXVSGLKUOZAL-UHFFFAOYSA-N 1 0 312.438 4.251 20 10 DICDRO CCOc1cccc(C[N@H+](CC)Cc2cccc(Cl)c2)c1O ZINC001203615709 1048941476 /nfs/dbraw/zinc/94/14/76/1048941476.db2.gz YHLCJLFDXWLONB-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c(O)c1 ZINC001203634465 1048944257 /nfs/dbraw/zinc/94/42/57/1048944257.db2.gz HIIDYCGVJCCPKU-QGZVFWFLSA-N 1 0 319.351 4.016 20 10 DICDRO C[C@H]1[C@H](Cc2ccccc2)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001191474193 1048949428 /nfs/dbraw/zinc/94/94/28/1048949428.db2.gz HMJSSZYYTUUNQT-PXNSSMCTSA-N 1 0 308.469 4.206 20 10 DICDRO C[N@H+](Cc1cc(Cl)ccc1O)Cc1cccc2cccnc21 ZINC001203657349 1048950867 /nfs/dbraw/zinc/95/08/67/1048950867.db2.gz JMMABLZCYFGPRZ-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(Cl)ccc1O ZINC001203664267 1048952872 /nfs/dbraw/zinc/95/28/72/1048952872.db2.gz UUNHGBUYDPRUCC-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1cc(Cl)ccc1O)CCC2 ZINC001203664597 1048953675 /nfs/dbraw/zinc/95/36/75/1048953675.db2.gz MMNIPICFWITMCZ-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO CCCC[C@H](CCC)C[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001178010111 1048974744 /nfs/dbraw/zinc/97/47/44/1048974744.db2.gz PQWJWVGVGUAJFH-SFHVURJKSA-N 1 0 318.505 4.219 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(F)cc2CSC)cc1C ZINC001177990734 1048979023 /nfs/dbraw/zinc/97/90/23/1048979023.db2.gz BNJKGOMMHFVJKJ-UHFFFAOYSA-N 1 0 319.445 4.296 20 10 DICDRO COc1cc(C)c(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1C ZINC001203758271 1048991586 /nfs/dbraw/zinc/99/15/86/1048991586.db2.gz MIJJGBNPSQSXGM-UHFFFAOYSA-N 1 0 312.457 4.010 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(OC)c1)c1cc(Cl)ccc1O ZINC000775484606 1049002794 /nfs/dbraw/zinc/00/27/94/1049002794.db2.gz GKXWGAJMXJCLPE-INIZCTEOSA-N 1 0 305.805 4.295 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2C2CCOCC2)cc1C(C)C ZINC000776770220 1049004425 /nfs/dbraw/zinc/00/44/25/1049004425.db2.gz PPGFROKAJNYBDQ-IBGZPJMESA-N 1 0 317.473 4.215 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H](CO)CC(C)(C)C)cc1 ZINC001178237649 1049007597 /nfs/dbraw/zinc/00/75/97/1049007597.db2.gz GYXOKGHSNTYGBX-SFHVURJKSA-N 1 0 320.521 4.200 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1ccc(N(C)C)cc1 ZINC000776799000 1049017572 /nfs/dbraw/zinc/01/75/72/1049017572.db2.gz DKNRCSSLJSOSAH-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO CC[C@H]([NH2+]CCCOc1ccccc1F)c1ccccc1O ZINC000775491594 1049020528 /nfs/dbraw/zinc/02/05/28/1049020528.db2.gz FJSZXDBOLWDTMX-INIZCTEOSA-N 1 0 303.377 4.041 20 10 DICDRO CC[C@H]([NH2+]C[C@H](OC)c1ccccc1)c1cc(Cl)ccc1O ZINC000775493880 1049026132 /nfs/dbraw/zinc/02/61/32/1049026132.db2.gz VYLIAEZCUZAJLJ-WMZOPIPTSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@H]([NH2+]CCOc1cccc(Cl)c1)c1ccccc1O ZINC000775497759 1049033811 /nfs/dbraw/zinc/03/38/11/1049033811.db2.gz UWENKKDKSBWDHR-INIZCTEOSA-N 1 0 305.805 4.165 20 10 DICDRO COc1cccc([C@H]2CCC[N@H+](Cc3ccc(N(C)C)cc3)C2)c1 ZINC001203937153 1049034264 /nfs/dbraw/zinc/03/42/64/1049034264.db2.gz NOQNKHBMDRAHPA-IBGZPJMESA-N 1 0 324.468 4.141 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)cc1 ZINC001203935305 1049034847 /nfs/dbraw/zinc/03/48/47/1049034847.db2.gz CFDWXCHCIZMSMP-INIZCTEOSA-N 1 0 314.395 4.102 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(N(C)C)c1)c1cc(Cl)ccc1O ZINC000775499361 1049035860 /nfs/dbraw/zinc/03/58/60/1049035860.db2.gz RGEGLBPMPYZBJG-QGZVFWFLSA-N 1 0 318.848 4.353 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1cc(Cl)ccc1O ZINC000775499360 1049036068 /nfs/dbraw/zinc/03/60/68/1049036068.db2.gz RGEGLBPMPYZBJG-KRWDZBQOSA-N 1 0 318.848 4.353 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](CC)Cc2ccccc2O)cc1 ZINC001203941926 1049038064 /nfs/dbraw/zinc/03/80/64/1049038064.db2.gz HDOOAXOXJAQATM-UHFFFAOYSA-N 1 0 312.457 4.261 20 10 DICDRO CC[C@@H]([NH2+]CCc1c[nH]c2cccc(C)c12)c1ccccc1O ZINC000775498889 1049038279 /nfs/dbraw/zinc/03/82/79/1049038279.db2.gz OVZRWMSOQSXSHU-QGZVFWFLSA-N 1 0 308.425 4.465 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC001203939839 1049039058 /nfs/dbraw/zinc/03/90/58/1049039058.db2.gz WRVNCWHOEFVLDO-OAHLLOKOSA-N 1 0 314.395 4.307 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2CCC=CO2)cc1 ZINC001178497031 1049039171 /nfs/dbraw/zinc/03/91/71/1049039171.db2.gz UQAPIKGYGIFVLL-IBGZPJMESA-N 1 0 302.462 4.095 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H](c2ccccc2)C(F)(F)F)cc1C ZINC000776816754 1049044456 /nfs/dbraw/zinc/04/44/56/1049044456.db2.gz RAZWCDVSSRXJCM-INIZCTEOSA-N 1 0 323.358 4.439 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)cc1 ZINC001203967920 1049045796 /nfs/dbraw/zinc/04/57/96/1049045796.db2.gz UXEBMIYTCBBLJF-UHFFFAOYSA-N 1 0 324.468 4.318 20 10 DICDRO CCc1cnc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)s1 ZINC000775508002 1049048090 /nfs/dbraw/zinc/04/80/90/1049048090.db2.gz GRCVHWKZKHAJTH-ZDUSSCGKSA-N 1 0 310.850 4.305 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)Cc1ccncc1)c1cc(Cl)ccc1O ZINC000775513339 1049049748 /nfs/dbraw/zinc/04/97/48/1049049748.db2.gz XKRCSLWXSVIHMD-LRDDRELGSA-N 1 0 304.821 4.113 20 10 DICDRO CC[C@H]([NH2+][C@H](COC)c1ccc(C)o1)c1cc(Cl)ccc1O ZINC000775511104 1049054036 /nfs/dbraw/zinc/05/40/36/1049054036.db2.gz BEJOUNSZZWLXKD-LSDHHAIUSA-N 1 0 323.820 4.375 20 10 DICDRO CC[C@H]([NH2+][C@H](CO)c1ccccc1C)c1cc(Cl)ccc1O ZINC000775511619 1049056375 /nfs/dbraw/zinc/05/63/75/1049056375.db2.gz FRZFPLOEPBVLDI-DLBZAZTESA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+]CCNc1ccccc1)c1cc(Cl)ccc1O ZINC000775512911 1049056651 /nfs/dbraw/zinc/05/66/51/1049056651.db2.gz SCURDCWPKOHTGI-INIZCTEOSA-N 1 0 304.821 4.198 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](CC)c2ccccc2O)C12CCCC2 ZINC000775512514 1049057368 /nfs/dbraw/zinc/05/73/68/1049057368.db2.gz LPCAIRWCDBOMJP-CGTJXYLNSA-N 1 0 303.446 4.171 20 10 DICDRO CC[C@@H]([NH2+]CCNc1ccccc1)c1cc(Cl)ccc1O ZINC000775512912 1049057808 /nfs/dbraw/zinc/05/78/08/1049057808.db2.gz SCURDCWPKOHTGI-MRXNPFEDSA-N 1 0 304.821 4.198 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@H](C)[C@H]2C)ccc1OC ZINC001178595866 1049058967 /nfs/dbraw/zinc/05/89/67/1049058967.db2.gz VQVVFCATCLFVBY-JZXOWHBKSA-N 1 0 319.489 4.394 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)cc1 ZINC000773758849 1049065058 /nfs/dbraw/zinc/06/50/58/1049065058.db2.gz WEVPWIFYEVOBEO-NRFANRHFSA-N 1 0 324.468 4.106 20 10 DICDRO Fc1ccc([C@@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001178623903 1049067124 /nfs/dbraw/zinc/06/71/24/1049067124.db2.gz BSSCWTDXTYPTKF-VQIMIIECSA-N 1 0 311.400 4.187 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](C(C)C)C1)c1cc(Cl)ccc1O ZINC000775518104 1049074174 /nfs/dbraw/zinc/07/41/74/1049074174.db2.gz CVEDSCZKSVZYOR-KMFMINBZSA-N 1 0 311.853 4.290 20 10 DICDRO Fc1ccc(CC2([NH2+]Cc3ccc(N4CCCC4)cc3)CC2)cc1 ZINC001178724061 1049074940 /nfs/dbraw/zinc/07/49/40/1049074940.db2.gz UEAZTBKGCPSOAI-UHFFFAOYSA-N 1 0 324.443 4.291 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)[C@H](C)O ZINC001178710056 1049078561 /nfs/dbraw/zinc/07/85/61/1049078561.db2.gz QBYVPHRNZAWQIM-SUMWQHHRSA-N 1 0 321.505 4.236 20 10 DICDRO CC[C@H]([NH2+]C[C@H](O)c1cccc(C)c1)c1cc(Cl)ccc1O ZINC000775522771 1049081540 /nfs/dbraw/zinc/08/15/40/1049081540.db2.gz ZWJSHNZVISMISO-WMZOPIPTSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1N(C)C)c1cc(Cl)ccc1O ZINC000775522833 1049081674 /nfs/dbraw/zinc/08/16/74/1049081674.db2.gz BTUCPLZFYQBYCM-INIZCTEOSA-N 1 0 318.848 4.353 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1N(C)C)c1cc(Cl)ccc1O ZINC000775522834 1049081703 /nfs/dbraw/zinc/08/17/03/1049081703.db2.gz BTUCPLZFYQBYCM-MRXNPFEDSA-N 1 0 318.848 4.353 20 10 DICDRO CC[C@H]([NH2+]C[C@H](OC)c1ccccc1Cl)c1ccccc1O ZINC000775522547 1049082902 /nfs/dbraw/zinc/08/29/02/1049082902.db2.gz SZDHPZHKAAUJTG-WMZOPIPTSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)COC2)c1cc(Cl)ccc1O ZINC000775522647 1049083186 /nfs/dbraw/zinc/08/31/86/1049083186.db2.gz WMAOZRGUEIFRTO-KRWDZBQOSA-N 1 0 317.816 4.317 20 10 DICDRO CCOCCC1(C[NH2+][C@H](CC)c2cc(Cl)ccc2O)CC1 ZINC000775523822 1049086237 /nfs/dbraw/zinc/08/62/37/1049086237.db2.gz NVTMGNSUWQSWHJ-OAHLLOKOSA-N 1 0 311.853 4.293 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775523520 1049087442 /nfs/dbraw/zinc/08/74/42/1049087442.db2.gz JQCSCTQNOCKFTG-BMIGLBTASA-N 1 0 322.836 4.495 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@H](OC)c1ccc(F)cc1)c1ccccc1O ZINC000775526699 1049093470 /nfs/dbraw/zinc/09/34/70/1049093470.db2.gz TXWIJGUYXOWQRZ-SOVGHPHASA-N 1 0 317.404 4.348 20 10 DICDRO Oc1cccc(Br)c1C[NH2+]CC1(C2CCC2)CCC1 ZINC001178872561 1049103317 /nfs/dbraw/zinc/10/33/17/1049103317.db2.gz KKQRYFNZJXEYEZ-UHFFFAOYSA-N 1 0 324.262 4.215 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000773777840 1049103336 /nfs/dbraw/zinc/10/33/36/1049103336.db2.gz VQAPYPLUGWTPEM-HXUWFJFHSA-N 1 0 310.441 4.185 20 10 DICDRO CN(C)c1ccc(C[NH+]2Cc3ccccc3C2)c2ccccc21 ZINC001204232926 1049107458 /nfs/dbraw/zinc/10/74/58/1049107458.db2.gz LVJYNPLLRMTWDB-UHFFFAOYSA-N 1 0 302.421 4.422 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](OC)c1cccc(Cl)c1)c1ccccc1O ZINC000775528556 1049107629 /nfs/dbraw/zinc/10/76/29/1049107629.db2.gz ZIKDLQCJFCHZMK-FUHWJXTLSA-N 1 0 319.832 4.474 20 10 DICDRO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1(C)C ZINC001178934042 1049107720 /nfs/dbraw/zinc/10/77/20/1049107720.db2.gz GJGBQAJZFPNDGD-ZWKOTPCHSA-N 1 0 317.473 4.083 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)ccc1F ZINC001178972414 1049115952 /nfs/dbraw/zinc/11/59/52/1049115952.db2.gz TVCUCNBAMQQEKV-MRXNPFEDSA-N 1 0 314.448 4.229 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1cccc2cc[nH]c21 ZINC001178972430 1049116073 /nfs/dbraw/zinc/11/60/73/1049116073.db2.gz UECCUPJRUTYXNF-INIZCTEOSA-N 1 0 321.468 4.263 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)c3ccccc23)CCC1(F)F ZINC001204234021 1049116780 /nfs/dbraw/zinc/11/67/80/1049116780.db2.gz WCRCNZMPYUDQPU-AWEZNQCLSA-N 1 0 318.411 4.383 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)C1CCCCC1 ZINC001192585624 1049119482 /nfs/dbraw/zinc/11/94/82/1049119482.db2.gz XZCPCOULRLBYEK-QGZVFWFLSA-N 1 0 307.409 4.182 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@H+](Cc2ccccc2)C2CC2)cc1 ZINC001204251411 1049121098 /nfs/dbraw/zinc/12/10/98/1049121098.db2.gz YPTLASUEQCAYPB-RMKNXTFCSA-N 1 0 306.453 4.430 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+]C3CCC(C)(C)CC3)C2)cc1 ZINC001179003268 1049121239 /nfs/dbraw/zinc/12/12/39/1049121239.db2.gz WFOLYANGAQVPIQ-MRXNPFEDSA-N 1 0 316.489 4.080 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2C[C@H]2C2CCC2)c(C(F)(F)F)c1 ZINC001178998304 1049121461 /nfs/dbraw/zinc/12/14/61/1049121461.db2.gz IZOSBEFLVPXHQP-GOEBONIOSA-N 1 0 312.379 4.050 20 10 DICDRO Oc1ccc(C[NH+](Cc2ccccc2)Cc2ccccc2)c(O)c1 ZINC001204279030 1049125854 /nfs/dbraw/zinc/12/58/54/1049125854.db2.gz OFSUIOIENCJDHY-UHFFFAOYSA-N 1 0 319.404 4.300 20 10 DICDRO C[C@@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(N2CCCCC2)cc1 ZINC000857081509 1049126100 /nfs/dbraw/zinc/12/61/00/1049126100.db2.gz POIRJHMYNQUKTR-ZBFHGGJFSA-N 1 0 308.416 4.373 20 10 DICDRO Cc1cc[nH+]c(NC/C=C\c2ccc(N(C)C)cc2)c1C1CC1 ZINC001179094717 1049129695 /nfs/dbraw/zinc/12/96/95/1049129695.db2.gz AACDOQZQTQPMAQ-PLNGDYQASA-N 1 0 307.441 4.459 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCOC)c1ccco1)c1cc(Cl)ccc1O ZINC000775546766 1049136305 /nfs/dbraw/zinc/13/63/05/1049136305.db2.gz KZOUZXZWDBSWCI-CABCVRRESA-N 1 0 323.820 4.457 20 10 DICDRO c1cncc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCCC3)cc2)c1 ZINC001204319964 1049140233 /nfs/dbraw/zinc/14/02/33/1049140233.db2.gz JJSLQZRRUTVRQR-FQEVSTJZSA-N 1 0 307.441 4.019 20 10 DICDRO c1ccc([C@@H]2CC[N@@H+](Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001204323329 1049141798 /nfs/dbraw/zinc/14/17/98/1049141798.db2.gz HBVAGTIEYSEYIA-HXUWFJFHSA-N 1 0 306.453 4.276 20 10 DICDRO c1ccc([C@H]2CC[N@@H+](Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001204321138 1049141817 /nfs/dbraw/zinc/14/18/17/1049141817.db2.gz HBVAGTIEYSEYIA-FQEVSTJZSA-N 1 0 306.453 4.276 20 10 DICDRO CC1(C)C[N@H+](Cc2ccc(N3CCCC3)cc2)CCC1(F)F ZINC001204323994 1049142281 /nfs/dbraw/zinc/14/22/81/1049142281.db2.gz KJRZLMHCGXCUFM-UHFFFAOYSA-N 1 0 308.416 4.154 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)c1nccs1)c1cc(Cl)ccc1O ZINC000775551023 1049142359 /nfs/dbraw/zinc/14/23/59/1049142359.db2.gz GIRYJMNPCIJCGU-GXFFZTMASA-N 1 0 310.850 4.347 20 10 DICDRO c1cc(C2CC[NH+](Cc3ccc(N4CCCC4)cc3)CC2)ccn1 ZINC001204325842 1049142573 /nfs/dbraw/zinc/14/25/73/1049142573.db2.gz BCXVJTFKLNSGRS-UHFFFAOYSA-N 1 0 321.468 4.061 20 10 DICDRO c1ccc([C@H]2CCC[N@@H+](Cc3ccc(N4CCCC4)cc3)C2)nc1 ZINC001204327478 1049142690 /nfs/dbraw/zinc/14/26/90/1049142690.db2.gz VHONXSWDPCRSSR-IBGZPJMESA-N 1 0 321.468 4.061 20 10 DICDRO C[N@H+](CCc1ccccc1F)Cc1ccc(N2CCCC2)cc1 ZINC001204328004 1049142728 /nfs/dbraw/zinc/14/27/28/1049142728.db2.gz ASAMTPDUEPCLIM-UHFFFAOYSA-N 1 0 312.432 4.100 20 10 DICDRO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204325632 1049142919 /nfs/dbraw/zinc/14/29/19/1049142919.db2.gz RRAWKHRLYQTETK-QGZVFWFLSA-N 1 0 306.453 4.406 20 10 DICDRO CC[C@H]([NH2+]CC[C@H]1CCO[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000775550825 1049143275 /nfs/dbraw/zinc/14/32/75/1049143275.db2.gz CGJKTJWGKSVHKH-XEZPLFJOSA-N 1 0 311.853 4.292 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cccc(F)c1 ZINC001204329148 1049143929 /nfs/dbraw/zinc/14/39/29/1049143929.db2.gz YUGZMUUBMFISBQ-UHFFFAOYSA-N 1 0 312.432 4.448 20 10 DICDRO CCCCC[NH+](CCCCC)Cc1cc(O)c(O)c(OC)c1 ZINC001204346766 1049147092 /nfs/dbraw/zinc/14/70/92/1049147092.db2.gz YXYBHKXSSCAXDC-UHFFFAOYSA-N 1 0 309.450 4.289 20 10 DICDRO CC[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000775554587 1049147266 /nfs/dbraw/zinc/14/72/66/1049147266.db2.gz BVDUYCNEGSGPAV-GDBMZVCRSA-N 1 0 311.853 4.436 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C1CCC(F)CC1 ZINC001179259138 1049148707 /nfs/dbraw/zinc/14/87/07/1049148707.db2.gz ROORXEDPUBGHHU-DCBWTQNWSA-N 1 0 314.395 4.037 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)cc1 ZINC000773815125 1049171336 /nfs/dbraw/zinc/17/13/36/1049171336.db2.gz ZCOSJHUHSBEQSP-FPOVZHCZSA-N 1 0 324.468 4.010 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2F)cc1 ZINC000773813848 1049171398 /nfs/dbraw/zinc/17/13/98/1049171398.db2.gz WLDOCHRQGKBVLD-ZDUSSCGKSA-N 1 0 304.384 4.272 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2cccc3ncccc23)cc1 ZINC001179524898 1049173188 /nfs/dbraw/zinc/17/31/88/1049173188.db2.gz CWJNIQLZAKYOSZ-GQCTYLIASA-N 1 0 317.436 4.104 20 10 DICDRO C[C@H]([NH2+][C@H]1CN(Cc2ccccc2)C(C)(C)C1)c1ccccc1O ZINC001179493744 1049173818 /nfs/dbraw/zinc/17/38/18/1049173818.db2.gz FOMVPTVQGWYBLK-FUHWJXTLSA-N 1 0 324.468 4.096 20 10 DICDRO CC(C)c1ccc(O)c(CN2CCOC[C@@H]2c2ccccc2)c1 ZINC001204549965 1049187621 /nfs/dbraw/zinc/18/76/21/1049187621.db2.gz DIGDXKMGODFHPZ-LJQANCHMSA-N 1 0 311.425 4.089 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)C2CCCCCC2)c1O ZINC001193261990 1049192610 /nfs/dbraw/zinc/19/26/10/1049192610.db2.gz XUFJLRUIBPUVAT-GFCCVEGCSA-N 1 0 307.409 4.182 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@H]2Cc2ccccc2)cc1 ZINC001204580112 1049192872 /nfs/dbraw/zinc/19/28/72/1049192872.db2.gz LBAVSBDWWXQKGT-VHTFYLNKSA-N 1 0 306.453 4.083 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@H](c3ccc(F)cc3F)C2)cc1C ZINC001179670383 1049195817 /nfs/dbraw/zinc/19/58/17/1049195817.db2.gz OGFPOYCVDJCDCX-KOMQPUFPSA-N 1 0 317.379 4.318 20 10 DICDRO CCOCc1cc(C[NH2+]C2(C)C(C)(C)C2(C)C)ccc1OC ZINC001179740315 1049199846 /nfs/dbraw/zinc/19/98/46/1049199846.db2.gz LNBDAIWASZVTJO-UHFFFAOYSA-N 1 0 305.462 4.146 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)CC)cc2)cc1 ZINC000773826127 1049205929 /nfs/dbraw/zinc/20/59/29/1049205929.db2.gz ZKPBERMXORTZSR-INIZCTEOSA-N 1 0 312.457 4.392 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](c2ccc(OC)cc2)C2CC2)cc1 ZINC000773831273 1049211376 /nfs/dbraw/zinc/21/13/76/1049211376.db2.gz INEUBCPSAZOGEY-NRFANRHFSA-N 1 0 324.468 4.392 20 10 DICDRO C[C@@H]1C[C@@H]1c1ccc(CNCc2cc(F)c(N(C)C)cc2F)o1 ZINC000858100622 1049218648 /nfs/dbraw/zinc/21/86/48/1049218648.db2.gz LJWVLNRMDPPPAQ-RISCZKNCSA-N 1 0 320.383 4.037 20 10 DICDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858160824 1049224599 /nfs/dbraw/zinc/22/45/99/1049224599.db2.gz RTOPIGWRYXNXFO-JTQLQIEISA-N 1 0 324.337 4.242 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccccc2O)C2CCCC2)c(C)n1 ZINC000775601341 1049251331 /nfs/dbraw/zinc/25/13/31/1049251331.db2.gz SQYLPZSNBVKHAX-UHFFFAOYSA-N 1 0 310.441 4.349 20 10 DICDRO C[C@@H]([NH2+]CC[C@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000858445096 1049260073 /nfs/dbraw/zinc/26/00/73/1049260073.db2.gz AEROBPQBFPJCMP-QZTJIDSGSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccc(N(C)C)cc1 ZINC000858484273 1049264859 /nfs/dbraw/zinc/26/48/59/1049264859.db2.gz NBMLVOLIVVPABQ-QRWLVFNGSA-N 1 0 309.457 4.340 20 10 DICDRO CC(C)CCO[C@H]1CC[C@H]([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000858509317 1049268563 /nfs/dbraw/zinc/26/85/63/1049268563.db2.gz VPNCTFFBLBRNPK-ULQDDVLXSA-N 1 0 305.462 4.417 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)c1O ZINC001180057745 1049268542 /nfs/dbraw/zinc/26/85/42/1049268542.db2.gz ICIHIOXUOUNIOM-LJQANCHMSA-N 1 0 310.441 4.031 20 10 DICDRO CC[C@H](C)[C@H](C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C)OC ZINC001180077741 1049273976 /nfs/dbraw/zinc/27/39/76/1049273976.db2.gz UDBHHEUYRHGIAP-LPHOPBHVSA-N 1 0 306.494 4.024 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c1O ZINC000858569045 1049276226 /nfs/dbraw/zinc/27/62/26/1049276226.db2.gz WSXITOLBSRMEEZ-LLVKDONJSA-N 1 0 317.351 4.174 20 10 DICDRO CC[N@H+](Cc1cccc(OC(F)F)c1)Cc1ccccc1O ZINC001204843203 1049284398 /nfs/dbraw/zinc/28/43/98/1049284398.db2.gz PJQIZWCPEFPHSU-UHFFFAOYSA-N 1 0 307.340 4.016 20 10 DICDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2cccc(F)c2[O-])C12CCCCC2 ZINC001180098283 1049285023 /nfs/dbraw/zinc/28/50/23/1049285023.db2.gz KTSOAAWYYLPWDU-DLBZAZTESA-N 1 0 321.436 4.091 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C2(c3nc(C)cs3)CCC2)cc1 ZINC000773840496 1049288012 /nfs/dbraw/zinc/28/80/12/1049288012.db2.gz ROFZKCXWTILCCS-UHFFFAOYSA-N 1 0 315.486 4.077 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@@H]2CCCC[C@@H]12 ZINC001204887805 1049299718 /nfs/dbraw/zinc/29/97/18/1049299718.db2.gz ASBHJTCTSFXSLQ-QIIPPGSGSA-N 1 0 322.443 4.431 20 10 DICDRO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccc(Cl)cc1O)CCC2 ZINC001204924568 1049312683 /nfs/dbraw/zinc/31/26/83/1049312683.db2.gz XEMUNOBKLILIGH-AWEZNQCLSA-N 1 0 322.861 4.320 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)CC1CC1 ZINC001204924453 1049313888 /nfs/dbraw/zinc/31/38/88/1049313888.db2.gz UTDHUXGHNCCRED-UHFFFAOYSA-N 1 0 300.368 4.003 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2c3ccccc3CC[C@H]2C)c1O ZINC001204974981 1049327949 /nfs/dbraw/zinc/32/79/49/1049327949.db2.gz FCRXKQIRLXQPJQ-KUHUBIRLSA-N 1 0 311.425 4.122 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1c2ccccc2CC[C@H]1C ZINC001180326740 1049345024 /nfs/dbraw/zinc/34/50/24/1049345024.db2.gz PWZHKGDQKQZMDZ-QVKFZJNVSA-N 1 0 308.469 4.474 20 10 DICDRO CCC[N@H+](Cc1ccccc1)Cc1cc(F)c(N(C)C)cc1F ZINC001180497888 1049376185 /nfs/dbraw/zinc/37/61/85/1049376185.db2.gz XZBVPFIXRQTKQX-UHFFFAOYSA-N 1 0 318.411 4.443 20 10 DICDRO CC(C)CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC001205101321 1049378491 /nfs/dbraw/zinc/37/84/91/1049378491.db2.gz PYKSNMNIHCGNJU-SFHVURJKSA-N 1 0 305.462 4.200 20 10 DICDRO C[C@@H]([NH2+]C1(C2CC2)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000777149906 1049406114 /nfs/dbraw/zinc/40/61/14/1049406114.db2.gz QGSYXOFJWWTHFK-CQSZACIVSA-N 1 0 302.437 4.409 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1O ZINC001205229326 1049412834 /nfs/dbraw/zinc/41/28/34/1049412834.db2.gz FHJKTVVWHHCQJA-GOSISDBHSA-N 1 0 311.425 4.436 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2CCC[C@@H](C(C)C)CC2)c1O ZINC001181072394 1049441797 /nfs/dbraw/zinc/44/17/97/1049441797.db2.gz HGEGMPGQMJXHSQ-NVXWUHKLSA-N 1 0 305.462 4.404 20 10 DICDRO Cc1cnc(C2CC[NH+](Cc3ccc(Cl)cc3O)CC2)s1 ZINC001205409598 1049464005 /nfs/dbraw/zinc/46/40/05/1049464005.db2.gz XBJWZBAGTUWQIZ-UHFFFAOYSA-N 1 0 322.861 4.190 20 10 DICDRO Cc1c(C[N@H+](Cc2ccccc2O)C2CCCC2)ccnc1F ZINC000862242781 1049480588 /nfs/dbraw/zinc/48/05/88/1049480588.db2.gz QQKMGSXIRPAYBG-UHFFFAOYSA-N 1 0 314.404 4.180 20 10 DICDRO COc1cccc(C[NH2+]C/C=C\c2c(C)cc(C)cc2C)c1O ZINC001181488126 1049483633 /nfs/dbraw/zinc/48/36/33/1049483633.db2.gz RVFFIIVQFUKUES-VURMDHGXSA-N 1 0 311.425 4.129 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+]Cc2ccc3ccccc3c2O)nc1 ZINC000862480830 1049495360 /nfs/dbraw/zinc/49/53/60/1049495360.db2.gz MGFIVFVOXNQBBL-UHFFFAOYSA-N 1 0 320.436 4.316 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](c3ccc(C)cc3)C[C@H]2C)c1 ZINC001205568462 1049499065 /nfs/dbraw/zinc/49/90/65/1049499065.db2.gz IOAMXENELUFWMH-WBVHZDCISA-N 1 0 311.425 4.087 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)Cc2cccc3ccccc32)c1 ZINC000775647908 1049499803 /nfs/dbraw/zinc/49/98/03/1049499803.db2.gz HLDKNXRVQGYNDS-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCOCC23CCCCC3)c1 ZINC001181787314 1049518899 /nfs/dbraw/zinc/51/88/99/1049518899.db2.gz RGEBPIZRBUZXNS-UHFFFAOYSA-N 1 0 303.446 4.051 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CS[C@H](C(C)(C)C)C1 ZINC001205655777 1049523044 /nfs/dbraw/zinc/52/30/44/1049523044.db2.gz BETWCEGKGHIMEE-SJORKVTESA-N 1 0 306.519 4.282 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)cc1 ZINC001205709150 1049540301 /nfs/dbraw/zinc/54/03/01/1049540301.db2.gz VHKVQLFQRLVAQA-UHFFFAOYSA-N 1 0 308.469 4.481 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC(c3ccccn3)CC2)c1O ZINC000775661811 1049541184 /nfs/dbraw/zinc/54/11/84/1049541184.db2.gz PTZSAKAAYVCEOE-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2cccc(C3CC3)c2)c1O ZINC001182044472 1049562088 /nfs/dbraw/zinc/56/20/88/1049562088.db2.gz ZOYGOJOSWFJBAU-CQSZACIVSA-N 1 0 311.425 4.437 20 10 DICDRO c1ccc2c(c1)CCC[N@@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001204320813 1049570373 /nfs/dbraw/zinc/57/03/73/1049570373.db2.gz BALNIIMGZHZGAY-UHFFFAOYSA-N 1 0 306.453 4.235 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@@H]2CSc3ccccc32)c1 ZINC001205950783 1049609415 /nfs/dbraw/zinc/60/94/15/1049609415.db2.gz FFHZBHDADSTCRV-MRXNPFEDSA-N 1 0 313.466 4.495 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000775695620 1049629960 /nfs/dbraw/zinc/62/99/60/1049629960.db2.gz PGWZCAHETMAPSK-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2C)c1 ZINC001182346350 1049630583 /nfs/dbraw/zinc/63/05/83/1049630583.db2.gz YEQHINJKRWSLJQ-SFHVURJKSA-N 1 0 315.388 4.185 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)[C@@H]1C ZINC001206016897 1049630908 /nfs/dbraw/zinc/63/09/08/1049630908.db2.gz SKNPLKBACQVPPE-IAGOWNOFSA-N 1 0 306.453 4.090 20 10 DICDRO COc1ccc(C2CC[NH+](Cc3cccc(C)c3O)CC2)cc1 ZINC000775691126 1049632159 /nfs/dbraw/zinc/63/21/59/1049632159.db2.gz VCBMKFVKEPYQDZ-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc(N(C)C)c2)cc1 ZINC000119852781 1049642457 /nfs/dbraw/zinc/64/24/57/1049642457.db2.gz CPRCKGAGXZGJMG-INIZCTEOSA-N 1 0 311.473 4.060 20 10 DICDRO COc1cc(O)c(C[N@H+](C)[C@@H]2CCC[C@@H]2C(C)(C)C)cc1OC ZINC001182444039 1049653546 /nfs/dbraw/zinc/65/35/46/1049653546.db2.gz MZBFVCCYKDEFOV-LSDHHAIUSA-N 1 0 321.461 4.056 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](c1ccc(F)cc1)C1CC1 ZINC000774415945 1049660323 /nfs/dbraw/zinc/66/03/23/1049660323.db2.gz QJAFAJHDPWIFSX-FQEVSTJZSA-N 1 0 312.432 4.441 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)c1 ZINC000775721247 1049662701 /nfs/dbraw/zinc/66/27/01/1049662701.db2.gz UTCKFACMAQGNHP-HNAYVOBHSA-N 1 0 311.425 4.026 20 10 DICDRO Cc1cc(C[NH2+][C@H](c2cccs2)C2CC2)ccc1N(C)C ZINC000774446569 1049664461 /nfs/dbraw/zinc/66/44/61/1049664461.db2.gz CGZWHSSZLAGVFS-SFHVURJKSA-N 1 0 300.471 4.363 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)c1 ZINC000775724913 1049668512 /nfs/dbraw/zinc/66/85/12/1049668512.db2.gz LHTFBSSHQMCRRD-DJJJIMSYSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC001182470343 1049674544 /nfs/dbraw/zinc/67/45/44/1049674544.db2.gz MJYVMWCIMRKAGA-UHFFFAOYSA-N 1 0 314.860 4.493 20 10 DICDRO CCO[C@@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccccc1 ZINC000774494895 1049678307 /nfs/dbraw/zinc/67/83/07/1049678307.db2.gz GSBJWOALCUHOJF-ACJLOTCBSA-N 1 0 319.832 4.474 20 10 DICDRO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1O ZINC001206276368 1049697266 /nfs/dbraw/zinc/69/72/66/1049697266.db2.gz GQAHKGADBPWYEC-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO CC[C@@H]([NH2+]CCOc1ccc(F)cc1F)c1ccc(C)cc1O ZINC000794800702 1049697375 /nfs/dbraw/zinc/69/73/75/1049697375.db2.gz FVRPFJALQOTNJZ-MRXNPFEDSA-N 1 0 321.367 4.099 20 10 DICDRO CC[C@@H]([NH2+]CCc1nc2c(cccc2C)o1)c1ccc(C)cc1O ZINC000794800040 1049697516 /nfs/dbraw/zinc/69/75/16/1049697516.db2.gz BJSDFCIRSCGYBX-MRXNPFEDSA-N 1 0 324.424 4.434 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)c1ccc(C)cc1O ZINC000794802147 1049698966 /nfs/dbraw/zinc/69/89/66/1049698966.db2.gz MTGDIJXYNLXIPZ-IBGZPJMESA-N 1 0 321.424 4.127 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](c1ccccc1)N(C)C)c1ccc(C)cc1O ZINC000794793930 1049699237 /nfs/dbraw/zinc/69/92/37/1049699237.db2.gz LILGMNLCBVKKFH-MOPGFXCFSA-N 1 0 312.457 4.044 20 10 DICDRO CCOc1ccc(N(CCC[NH+]2CCCCC2)CC2CC2)cc1 ZINC001196952115 1049710115 /nfs/dbraw/zinc/71/01/15/1049710115.db2.gz CKCBUYNTHBSKBL-UHFFFAOYSA-N 1 0 316.489 4.178 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(c3cccc(F)c3)CC2)cc1 ZINC001197506954 1049757923 /nfs/dbraw/zinc/75/79/23/1049757923.db2.gz QWHZYGSIPRMTHC-UHFFFAOYSA-N 1 0 312.432 4.271 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc3occc3c2)c1O ZINC001206604535 1049766879 /nfs/dbraw/zinc/76/68/79/1049766879.db2.gz FEWWRJKCODKPKS-UHFFFAOYSA-N 1 0 317.772 4.090 20 10 DICDRO CCCCCC[C@H](C)[NH2+][C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206645085 1049774651 /nfs/dbraw/zinc/77/46/51/1049774651.db2.gz LPHIFSKRALUZPT-IRXDYDNUSA-N 1 0 304.478 4.222 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CCC([C@H]3CCCCO3)CC2)c1 ZINC001206691546 1049779621 /nfs/dbraw/zinc/77/96/21/1049779621.db2.gz JPUZEWJJYHBDTK-HXUWFJFHSA-N 1 0 317.473 4.297 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC([C@@H]3CCCCO3)CC2)cc1Cl ZINC001206691711 1049779984 /nfs/dbraw/zinc/77/99/84/1049779984.db2.gz NNZRHFNFZFVLBR-SFHVURJKSA-N 1 0 323.864 4.135 20 10 DICDRO COc1cc(C)cc(C[NH2+]CC(C2CCC2)C2CCC2)c1O ZINC001206776861 1049798007 /nfs/dbraw/zinc/79/80/07/1049798007.db2.gz HNRLBPRLBVFIAU-UHFFFAOYSA-N 1 0 303.446 4.015 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@H](c3ccc(O)cc3)C2)c1 ZINC001206999200 1049819645 /nfs/dbraw/zinc/81/96/45/1049819645.db2.gz DYTQMFVFXUZBMS-KRWDZBQOSA-N 1 0 311.425 4.211 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@H]1CCc2cc(Cl)ccc21 ZINC001207103112 1049834047 /nfs/dbraw/zinc/83/40/47/1049834047.db2.gz VGVIMNOFQWXQTQ-HNNXBMFYSA-N 1 0 308.208 4.476 20 10 DICDRO C[C@@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)c1ccccc1O ZINC001207160259 1049848041 /nfs/dbraw/zinc/84/80/41/1049848041.db2.gz PDXSUECEVFSMDX-SNVBAGLBSA-N 1 0 302.761 4.038 20 10 DICDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000760647746 1049905450 /nfs/dbraw/zinc/90/54/50/1049905450.db2.gz CDSQTXVUZUEROW-OAHLLOKOSA-N 1 0 314.395 4.498 20 10 DICDRO c1cc(N2CCCCC2)ccc1C[NH2+]C[C@H]1CCCCS1 ZINC000156386202 1049920663 /nfs/dbraw/zinc/92/06/63/1049920663.db2.gz CMCLGOOFHRUPPE-GOSISDBHSA-N 1 0 304.503 4.052 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)Cc2c(C)cccc2C)c1O ZINC001207678840 1049926259 /nfs/dbraw/zinc/92/62/59/1049926259.db2.gz DMZMTIODJZHWMM-UHFFFAOYSA-N 1 0 319.832 4.303 20 10 DICDRO Oc1c(C[NH2+][C@@H]2CCSC3(CCC3)C2)ccc2ccccc21 ZINC001207719425 1049931037 /nfs/dbraw/zinc/93/10/37/1049931037.db2.gz ILMKWPGSNBURMD-MRXNPFEDSA-N 1 0 313.466 4.453 20 10 DICDRO COC1(C[NH2+]Cc2cc(Cl)c(C)cc2O)CCCCCC1 ZINC001207746011 1049933090 /nfs/dbraw/zinc/93/30/90/1049933090.db2.gz UXBVAWHVDDFTHG-UHFFFAOYSA-N 1 0 311.853 4.183 20 10 DICDRO COC(C)(C)CCC[C@@H](C)CC[N@H+](C)Cc1ccccc1O ZINC001208220943 1049987949 /nfs/dbraw/zinc/98/79/49/1049987949.db2.gz WALIDZJWRRTIQQ-MRXNPFEDSA-N 1 0 307.478 4.446 20 10 DICDRO CC[N@H+](Cc1cnc(C2CC2)s1)Cc1ccc(N(C)C)cc1 ZINC000156849726 1049993939 /nfs/dbraw/zinc/99/39/39/1049993939.db2.gz UNBUOZWHWUUWKM-UHFFFAOYSA-N 1 0 315.486 4.109 20 10 DICDRO Cc1ccc(C)n1-c1ccc(CN2Cc3cccnc3C2)cc1 ZINC001209519093 1050065993 /nfs/dbraw/zinc/06/59/93/1050065993.db2.gz RJGCMSIBLLWUMT-UHFFFAOYSA-N 1 0 303.409 4.005 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)cc1 ZINC001209519024 1050066523 /nfs/dbraw/zinc/06/65/23/1050066523.db2.gz QHATWGMVMUHRRQ-CTNGQTDRSA-N 1 0 324.468 4.095 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2c(Cl)cccc2C1)c1ccccc1O ZINC001171023182 1050145931 /nfs/dbraw/zinc/14/59/31/1050145931.db2.gz UIQARGYKJSOHNC-TZMCWYRMSA-N 1 0 301.817 4.254 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1cccc(Cl)c1[O-] ZINC000806150686 1050156438 /nfs/dbraw/zinc/15/64/38/1050156438.db2.gz XZPICDOMPDSZHN-GUDXXQAFSA-N 1 0 321.848 4.044 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000770510022 1050162659 /nfs/dbraw/zinc/16/26/59/1050162659.db2.gz VQBHGAHCWWIQHD-FXAWDEMLSA-N 1 0 324.468 4.050 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCC12CCOCC2)c1cc(Cl)ccc1O ZINC000282652423 1050172112 /nfs/dbraw/zinc/17/21/12/1050172112.db2.gz ICQLYUUNTWNFCB-BLLLJJGKSA-N 1 0 309.837 4.046 20 10 DICDRO Cc1ccc(SC[C@H](C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC000770666560 1050182324 /nfs/dbraw/zinc/18/23/24/1050182324.db2.gz PSUPIIVWBOJRAK-HNNXBMFYSA-N 1 0 301.455 4.279 20 10 DICDRO CC[C@H](CCO)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000166803599 1050182216 /nfs/dbraw/zinc/18/22/16/1050182216.db2.gz KNAHYTPXCFHNGV-QZTJIDSGSA-N 1 0 318.505 4.126 20 10 DICDRO Nc1ccc(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)cc1 ZINC001210267058 1050186275 /nfs/dbraw/zinc/18/62/75/1050186275.db2.gz LQSPQSRDOTTYAX-UHFFFAOYSA-N 1 0 300.833 4.302 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1nc2ccccc2s1 ZINC000378871044 1050190317 /nfs/dbraw/zinc/19/03/17/1050190317.db2.gz NRNVTRCVRZARKJ-ZDUSSCGKSA-N 1 0 311.454 4.213 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000770750115 1050191631 /nfs/dbraw/zinc/19/16/31/1050191631.db2.gz ZNHIBSRRMQGMRJ-KRWDZBQOSA-N 1 0 309.457 4.231 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)c1O ZINC000378913015 1050194590 /nfs/dbraw/zinc/19/45/90/1050194590.db2.gz UNTXZUCPTNSHTG-SFHVURJKSA-N 1 0 317.404 4.417 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC(C)(C)c2cccs2)cc1F ZINC000734004095 1050213598 /nfs/dbraw/zinc/21/35/98/1050213598.db2.gz MSTURAVELUXDRT-UHFFFAOYSA-N 1 0 306.450 4.021 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H]1CSc2ccccc21 ZINC000824483085 1050214218 /nfs/dbraw/zinc/21/42/18/1050214218.db2.gz HLCVZZUPYZBEOL-LLVKDONJSA-N 1 0 305.830 4.025 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccn1 ZINC000824583118 1050228093 /nfs/dbraw/zinc/22/80/93/1050228093.db2.gz IBEZGVAAVNMOPT-UHFFFAOYSA-N 1 0 323.484 4.139 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OC3CCCC3)CC2)cc1Cl ZINC000824657105 1050229618 /nfs/dbraw/zinc/22/96/18/1050229618.db2.gz NKHODNVRVSTEEH-UHFFFAOYSA-N 1 0 323.864 4.278 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CCCCO)c1ccc(C(F)(F)F)cc1O ZINC000824653982 1050230636 /nfs/dbraw/zinc/23/06/36/1050230636.db2.gz KBFHDCZKEFLIRS-FZMZJTMJSA-N 1 0 319.367 4.003 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CC(C)(C)O)c1ccc(C(F)(F)F)cc1O ZINC000824702534 1050235400 /nfs/dbraw/zinc/23/54/00/1050235400.db2.gz NEIQYFXXQFRFEI-GWCFXTLKSA-N 1 0 319.367 4.001 20 10 DICDRO C[C@]1(C[NH2+]Cc2ccc3ccccc3c2O)CC1(Cl)Cl ZINC000824780333 1050244104 /nfs/dbraw/zinc/24/41/04/1050244104.db2.gz KOHKQQJQZYAAJX-OAHLLOKOSA-N 1 0 310.224 4.219 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2cnccc2C)cc1 ZINC000824910624 1050253002 /nfs/dbraw/zinc/25/30/02/1050253002.db2.gz ZAKBLRHDDPHVRZ-UHFFFAOYSA-N 1 0 311.473 4.306 20 10 DICDRO CC[C@@H]([NH2+]Cc1cnccc1C)c1ccc(C(F)(F)F)cc1O ZINC000824908626 1050253103 /nfs/dbraw/zinc/25/31/03/1050253103.db2.gz AKGFJITUMCOPDB-OAHLLOKOSA-N 1 0 324.346 4.355 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c1 ZINC000824977751 1050265332 /nfs/dbraw/zinc/26/53/32/1050265332.db2.gz PVQTVDLXLGXANY-HZMBPMFUSA-N 1 0 318.244 4.025 20 10 DICDRO CCOc1cccc(C[NH+]2CC(c3ccc(Cl)cc3)C2)c1O ZINC000824988957 1050265541 /nfs/dbraw/zinc/26/55/41/1050265541.db2.gz VOYIFLYMFBCMCW-UHFFFAOYSA-N 1 0 317.816 4.044 20 10 DICDRO CCOc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c(O)c1 ZINC000825104347 1050270213 /nfs/dbraw/zinc/27/02/13/1050270213.db2.gz USAGDRNPSYJYTC-GOSISDBHSA-N 1 0 313.397 4.111 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1ccccc1O ZINC000825117686 1050275439 /nfs/dbraw/zinc/27/54/39/1050275439.db2.gz JRKHGCMLQTXKNA-MSOLQXFVSA-N 1 0 310.441 4.404 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC000734511769 1050281361 /nfs/dbraw/zinc/28/13/61/1050281361.db2.gz GKMWNTIJTBUUDD-UHFFFAOYSA-N 1 0 312.457 4.140 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)cc1 ZINC000825168467 1050282021 /nfs/dbraw/zinc/28/20/21/1050282021.db2.gz YGWWSUIHRCOJCQ-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOc3ccc(F)cc32)cc1Cl ZINC000825222282 1050284059 /nfs/dbraw/zinc/28/40/59/1050284059.db2.gz CDIBIGROOMAAEZ-OAHLLOKOSA-N 1 0 321.779 4.107 20 10 DICDRO CCc1nc([C@@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)cs1 ZINC000825291537 1050291530 /nfs/dbraw/zinc/29/15/30/1050291530.db2.gz NCQMFDZVDCPVEP-SNVBAGLBSA-N 1 0 310.850 4.224 20 10 DICDRO Cc1ccc(O)c(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000771928030 1050295190 /nfs/dbraw/zinc/29/51/90/1050295190.db2.gz PFIRNJSZRGMIFL-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1c(C)noc1C ZINC000825385078 1050302339 /nfs/dbraw/zinc/30/23/39/1050302339.db2.gz PQWMAGLNICQMDC-CQSZACIVSA-N 1 0 308.809 4.200 20 10 DICDRO CCO[C@H]1CCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000771941142 1050302580 /nfs/dbraw/zinc/30/25/80/1050302580.db2.gz YPCVPDNMUQAWBR-IBGZPJMESA-N 1 0 311.425 4.060 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)CCC2 ZINC000825469442 1050309834 /nfs/dbraw/zinc/30/98/34/1050309834.db2.gz XZRGHYKDVYHOOU-ZDUSSCGKSA-N 1 0 322.861 4.286 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(F)c(Cl)c1F ZINC001143627546 1050321625 /nfs/dbraw/zinc/32/16/25/1050321625.db2.gz RVGYIIYUGFOOOP-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO CCOc1cccc(C[NH2+][C@@]2(C)CCCc3ccccc32)c1O ZINC000734843500 1050324585 /nfs/dbraw/zinc/32/45/85/1050324585.db2.gz MENDPHIYSFAYHX-FQEVSTJZSA-N 1 0 311.425 4.132 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cc(Cl)ccc2C1)c1ccccc1O ZINC001171099497 1050349742 /nfs/dbraw/zinc/34/97/42/1050349742.db2.gz JGNGOIBKRDJKGA-LRDDRELGSA-N 1 0 301.817 4.254 20 10 DICDRO CC[N@@H+](Cc1ccccc1O)Cc1ccc(C(F)(F)F)nc1C ZINC001141434604 1050351265 /nfs/dbraw/zinc/35/12/65/1050351265.db2.gz IYCGDYDOYUQKEZ-UHFFFAOYSA-N 1 0 324.346 4.137 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H]2CCc3cc(Cl)ccc3C2)c(O)c1 ZINC001171108925 1050358391 /nfs/dbraw/zinc/35/83/91/1050358391.db2.gz JFJUGLPBAGPBRH-KRWDZBQOSA-N 1 0 315.844 4.310 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H]3CC(C)(C)C[C@@H]3C)CC2)cc1 ZINC000766213658 1050370828 /nfs/dbraw/zinc/37/08/28/1050370828.db2.gz HVYKQQJASIARGN-KXBFYZLASA-N 1 0 316.489 4.078 20 10 DICDRO CCOc1c(Cl)ccc(C[N@H+](C)Cc2ccccc2O)c1F ZINC001143832749 1050375578 /nfs/dbraw/zinc/37/55/78/1050375578.db2.gz IPYUNIYVLVKNGK-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO CC[C@@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1 ZINC000157754630 1050378412 /nfs/dbraw/zinc/37/84/12/1050378412.db2.gz OJMAPIGMBAMDNE-QGZVFWFLSA-N 1 0 324.415 4.035 20 10 DICDRO COC[C@H]([NH2+]Cc1ccc(OC)c(C)c1)c1ccc(Cl)cc1 ZINC000785543404 1050387713 /nfs/dbraw/zinc/38/77/13/1050387713.db2.gz DPPSQSXDGOKQQK-KRWDZBQOSA-N 1 0 319.832 4.134 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCC[C@H]2c2cccc(N(C)C)c2)cc1C ZINC000735484239 1050396741 /nfs/dbraw/zinc/39/67/41/1050396741.db2.gz BKSHCPMXRSDISM-FQEVSTJZSA-N 1 0 324.468 4.412 20 10 DICDRO Cc1ccccc1[C@H]([C@@H](C)[NH2+][C@H](C)c1ccccc1O)N(C)C ZINC000785572729 1050397561 /nfs/dbraw/zinc/39/75/61/1050397561.db2.gz KUZNRBRSCFPPDR-QINHECLXSA-N 1 0 312.457 4.043 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)cc1C ZINC000735484242 1050398022 /nfs/dbraw/zinc/39/80/22/1050398022.db2.gz BKSHCPMXRSDISM-HXUWFJFHSA-N 1 0 324.468 4.412 20 10 DICDRO CCc1ccccc1C[NH2+]Cc1cc(Br)ccc1O ZINC000226163224 1050401567 /nfs/dbraw/zinc/40/15/67/1050401567.db2.gz BFHJKDRFBACBJZ-UHFFFAOYSA-N 1 0 320.230 4.007 20 10 DICDRO Cc1cccc(C(C)(C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000736360030 1050469300 /nfs/dbraw/zinc/46/93/00/1050469300.db2.gz RFRSJZXOEFVHDA-UHFFFAOYSA-N 1 0 300.421 4.225 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](CC)c2ccccc2O)CCO1 ZINC000157891665 1050478700 /nfs/dbraw/zinc/47/87/00/1050478700.db2.gz NXVUERJNASUOCC-AYBZRNKSSA-N 1 0 305.462 4.417 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccccc1O ZINC000786431512 1050480873 /nfs/dbraw/zinc/48/08/73/1050480873.db2.gz QZBQVCHWYUEYJW-WBVHZDCISA-N 1 0 303.446 4.315 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccccc1O ZINC000786431504 1050481035 /nfs/dbraw/zinc/48/10/35/1050481035.db2.gz QZBQVCHWYUEYJW-DOTOQJQBSA-N 1 0 303.446 4.315 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](c2ccccn2)C(C)C)cc1 ZINC000736648125 1050485203 /nfs/dbraw/zinc/48/52/03/1050485203.db2.gz PGFJOCVTAGKJBK-FQEVSTJZSA-N 1 0 311.473 4.415 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c(O)c(C(C)(C)C)c1 ZINC000844758006 1050492941 /nfs/dbraw/zinc/49/29/41/1050492941.db2.gz HRJXQAMCAAVVET-KRWDZBQOSA-N 1 0 309.400 4.229 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c(O)c(C(C)(C)C)c1 ZINC000844758008 1050493914 /nfs/dbraw/zinc/49/39/14/1050493914.db2.gz HRJXQAMCAAVVET-QGZVFWFLSA-N 1 0 309.400 4.229 20 10 DICDRO CC(C)CCC[C@H](C)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001170063881 1050516085 /nfs/dbraw/zinc/51/60/85/1050516085.db2.gz IRYBHXYVDXXJCC-KRWDZBQOSA-N 1 0 318.505 4.161 20 10 DICDRO CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000786792051 1050518095 /nfs/dbraw/zinc/51/80/95/1050518095.db2.gz HBQYKDRPJULOCT-UWJYYQICSA-N 1 0 324.468 4.153 20 10 DICDRO CCc1cc(C[N@H+](CC)C[C@@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000738079936 1050521502 /nfs/dbraw/zinc/52/15/02/1050521502.db2.gz DZZUGKBHVHXWOQ-INIZCTEOSA-N 1 0 319.489 4.111 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(F)c(F)c2)c(O)c1C ZINC000786939543 1050534621 /nfs/dbraw/zinc/53/46/21/1050534621.db2.gz HNTSQQKHQGLTNU-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO CC[N@H+](Cc1scnc1C1CC1)Cc1ccc(N(C)C)cc1 ZINC000787049060 1050546047 /nfs/dbraw/zinc/54/60/47/1050546047.db2.gz LFYMIRMFYWGUDJ-UHFFFAOYSA-N 1 0 315.486 4.109 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCC1 ZINC000766237150 1050554318 /nfs/dbraw/zinc/55/43/18/1050554318.db2.gz JETPTTPKOZOVMU-ZFWWWQNUSA-N 1 0 324.415 4.035 20 10 DICDRO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cc(C)ccc1O ZINC000787330849 1050585088 /nfs/dbraw/zinc/58/50/88/1050585088.db2.gz FGSQIFFOFOOSMW-QGZVFWFLSA-N 1 0 319.832 4.174 20 10 DICDRO COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cc(C)ccc1O ZINC000787330847 1050585234 /nfs/dbraw/zinc/58/52/34/1050585234.db2.gz FGSQIFFOFOOSMW-KRWDZBQOSA-N 1 0 319.832 4.174 20 10 DICDRO Cc1ccc2oc(C[NH2+]Cc3ccc(N(C)C)cc3C)cc2c1 ZINC000740007987 1050596223 /nfs/dbraw/zinc/59/62/23/1050596223.db2.gz VZPQQPMHUTZENO-UHFFFAOYSA-N 1 0 308.425 4.405 20 10 DICDRO Cc1ccccc1C[N@H+](Cc1c(O)ccc2ccncc21)C1CC1 ZINC000746709365 1050625021 /nfs/dbraw/zinc/62/50/21/1050625021.db2.gz OCJMMQFMJXSDJQ-UHFFFAOYSA-N 1 0 318.420 4.413 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)cc(Cl)c2)c1 ZINC000845971126 1050639169 /nfs/dbraw/zinc/63/91/69/1050639169.db2.gz HHGBVNONAWJVFY-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)c3ncccc3c2)c1 ZINC000845973344 1050640170 /nfs/dbraw/zinc/64/01/70/1050640170.db2.gz ZEPUEGKUXLMLAR-CQSZACIVSA-N 1 0 322.408 4.108 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)s1)c1ccccc1O ZINC000845988929 1050641693 /nfs/dbraw/zinc/64/16/93/1050641693.db2.gz CJSUHEWXOLRRHP-SECBINFHSA-N 1 0 301.333 4.323 20 10 DICDRO C[C@]1(CC[NH2+]Cc2ccc3ccccc3c2O)C[C@@]1(F)Cl ZINC000846031584 1050650832 /nfs/dbraw/zinc/65/08/32/1050650832.db2.gz ASJFTTWVPNNFSG-IRXDYDNUSA-N 1 0 307.796 4.340 20 10 DICDRO CC(C)(C)c1cnc(C[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000846055804 1050660059 /nfs/dbraw/zinc/66/00/59/1050660059.db2.gz OAEOYFAQSLMNNW-UHFFFAOYSA-N 1 0 310.850 4.089 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)c1 ZINC000846051544 1050660216 /nfs/dbraw/zinc/66/02/16/1050660216.db2.gz FLOOTZIJRZVEKL-MRXNPFEDSA-N 1 0 315.388 4.232 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCc3ccc(C)cc32)c1O ZINC000846055209 1050662651 /nfs/dbraw/zinc/66/26/51/1050662651.db2.gz JZVSNUJTBFXNHC-INIZCTEOSA-N 1 0 317.816 4.140 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CC[C@@H](c2ccccc2)O1)c1ccccc1O ZINC000846102015 1050670029 /nfs/dbraw/zinc/67/00/29/1050670029.db2.gz JTMFXMJESIBILU-QRFRQXIXSA-N 1 0 311.425 4.353 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)Cc2ccc(C)s2)c1O ZINC000846148468 1050672268 /nfs/dbraw/zinc/67/22/68/1050672268.db2.gz ZVODTDCYQZLJPU-DGCLKSJQSA-N 1 0 305.443 4.053 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC(C)(C)c2ccc(F)cc2)c1O ZINC000846147271 1050672322 /nfs/dbraw/zinc/67/23/22/1050672322.db2.gz VABBKLNEJMSFJF-ZDUSSCGKSA-N 1 0 317.404 4.168 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(F)c(C)c2)c1O ZINC000846154811 1050674032 /nfs/dbraw/zinc/67/40/32/1050674032.db2.gz PVGXSVXGTZOPGN-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CC(C)(C)c3ccccc32)c1O ZINC000846157745 1050675153 /nfs/dbraw/zinc/67/51/53/1050675153.db2.gz WNSZGURFUIAILI-SUMWQHHRSA-N 1 0 311.425 4.474 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2F)c1O ZINC000846157903 1050675255 /nfs/dbraw/zinc/67/52/55/1050675255.db2.gz PGIHBNCFQZSISJ-GHMZBOCLSA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](Cc2ccccc2)C2CC2)c1O ZINC000846156944 1050675278 /nfs/dbraw/zinc/67/52/78/1050675278.db2.gz ZQJWRUQUFVTGGK-KSSFIOAISA-N 1 0 311.425 4.073 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](CC(F)(F)F)C(C)C)c1O ZINC000846162500 1050675840 /nfs/dbraw/zinc/67/58/40/1050675840.db2.gz CCEWYOYXBBNRRI-ZYHUDNBSSA-N 1 0 305.340 4.028 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(Cc3ccccc3)CCC2)c1O ZINC000846159934 1050677208 /nfs/dbraw/zinc/67/72/08/1050677208.db2.gz KUWOGEIGLFHAMW-OAHLLOKOSA-N 1 0 311.425 4.217 20 10 DICDRO CCCNc1ccc(C[NH2+][C@@H](C)c2cccc(OC)c2O)cc1 ZINC000846166997 1050678702 /nfs/dbraw/zinc/67/87/02/1050678702.db2.gz QOYOUTFRICCTTK-AWEZNQCLSA-N 1 0 314.429 4.074 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(c3ccccc3F)CCC2)c1O ZINC000846171405 1050679959 /nfs/dbraw/zinc/67/99/59/1050679959.db2.gz GKZUYUQBEZZQRR-CYBMUJFWSA-N 1 0 315.388 4.270 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(c3cccc(C)c3)CCC2)c1O ZINC000846171446 1050680355 /nfs/dbraw/zinc/68/03/55/1050680355.db2.gz GVOGVGGRDFRAEN-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(c3ccccc3Cl)CC2)c1O ZINC000846171380 1050680408 /nfs/dbraw/zinc/68/04/08/1050680408.db2.gz GARHQVSCAJWEFX-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCc3c(F)cccc32)c1O ZINC000846171771 1050680427 /nfs/dbraw/zinc/68/04/27/1050680427.db2.gz WDCRJWBHIIPAEN-SJKOYZFVSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(c3ccccc3C)CCC2)c1O ZINC000846171837 1050680579 /nfs/dbraw/zinc/68/05/79/1050680579.db2.gz IDMJTJYLZYBGBQ-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(c3cccc(F)c3)CCC2)c1O ZINC000846171817 1050680893 /nfs/dbraw/zinc/68/08/93/1050680893.db2.gz HVHAKISBVOLZES-ZDUSSCGKSA-N 1 0 315.388 4.270 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2cc(C3CC3)ccc2F)c1O ZINC000846168589 1050681066 /nfs/dbraw/zinc/68/10/66/1050681066.db2.gz AYNLNUYBIZUQDQ-LBPRGKRZSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](c2cccs2)C2CC2)c1O ZINC000846136972 1050681880 /nfs/dbraw/zinc/68/18/80/1050681880.db2.gz PBSCHSLQFXMDOQ-BDJLRTHQSA-N 1 0 303.427 4.264 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c1O ZINC000846135699 1050682190 /nfs/dbraw/zinc/68/21/90/1050682190.db2.gz FTDJIPHJPMXKEY-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(OC)c2O)cc1 ZINC000846136738 1050682306 /nfs/dbraw/zinc/68/23/06/1050682306.db2.gz OBCJRMANTAPGPW-ZIAGYGMSSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c1O ZINC000846136622 1050682411 /nfs/dbraw/zinc/68/24/11/1050682411.db2.gz IHWVJCBEUAHKIF-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCCc2c[nH]c3ccccc23)c1O ZINC000846143377 1050683618 /nfs/dbraw/zinc/68/36/18/1050683618.db2.gz FEPDBMKSNBMDOQ-AWEZNQCLSA-N 1 0 324.424 4.166 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1O ZINC000846145743 1050684235 /nfs/dbraw/zinc/68/42/35/1050684235.db2.gz QBHCMLAOTQFMAM-MNOVXSKESA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)Sc2ccccc2)c1O ZINC000846143041 1050684351 /nfs/dbraw/zinc/68/43/51/1050684351.db2.gz AEJIJTDGCWSTGL-ZIAGYGMSSA-N 1 0 317.454 4.232 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CSCc3ccccc32)c1O ZINC000846141499 1050684521 /nfs/dbraw/zinc/68/45/21/1050684521.db2.gz KKVBWCMPQAEEIT-BLLLJJGKSA-N 1 0 315.438 4.040 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCc2ccc(Cl)s2)c1O ZINC000846143337 1050684688 /nfs/dbraw/zinc/68/46/88/1050684688.db2.gz ZOLXRDGYSOQGQW-SNVBAGLBSA-N 1 0 311.834 4.009 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C1CC1)C1CCOCC1)c1cc(Cl)ccc1O ZINC000846189883 1050690357 /nfs/dbraw/zinc/69/03/57/1050690357.db2.gz VQFFPDFIXGUSNB-AEFFLSMTSA-N 1 0 323.864 4.292 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C2CC2)C2CCOCC2)c1O ZINC000846187614 1050691118 /nfs/dbraw/zinc/69/11/18/1050691118.db2.gz LKZWRCQFVPNSIT-PXAZEXFGSA-N 1 0 323.864 4.210 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1 ZINC000846214654 1050693919 /nfs/dbraw/zinc/69/39/19/1050693919.db2.gz LCAQDYOTYJYNKA-NWDGAFQWSA-N 1 0 302.245 4.325 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2c(C)cc(C)cc2O)C12CCC2 ZINC000788615099 1050715496 /nfs/dbraw/zinc/71/54/96/1050715496.db2.gz UZRLHXILQICNQR-DJIMGWMZSA-N 1 0 303.446 4.007 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000788614011 1050715694 /nfs/dbraw/zinc/71/56/94/1050715694.db2.gz PPMKBYTZVCDMHB-XLIONFOSSA-N 1 0 324.468 4.350 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3c(C)cc(C)cc3O)nc2c1 ZINC000788611647 1050716576 /nfs/dbraw/zinc/71/65/76/1050716576.db2.gz NWTPRVVJKGJTBQ-AWEZNQCLSA-N 1 0 309.413 4.045 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C(C)C)[C@H](O)c2ccccc2)c(O)c1 ZINC000788618549 1050717853 /nfs/dbraw/zinc/71/78/53/1050717853.db2.gz AUBFYOGDWXXJNX-RYGJVYDSSA-N 1 0 313.441 4.109 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000788620978 1050718340 /nfs/dbraw/zinc/71/83/40/1050718340.db2.gz SSQVCOMHAILGTE-MSOLQXFVSA-N 1 0 324.468 4.268 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)c(Cl)cc2F)c(O)c1 ZINC000788620333 1050718443 /nfs/dbraw/zinc/71/84/43/1050718443.db2.gz OXRXOJMKFRBYPE-SNVBAGLBSA-N 1 0 311.759 4.483 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](c2cccnc2)C(C)C)c(O)c1 ZINC000788629376 1050720547 /nfs/dbraw/zinc/72/05/47/1050720547.db2.gz UHFKHRGENUXOCI-SJLPKXTDSA-N 1 0 312.457 4.494 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CCCC1 ZINC000788630732 1050722696 /nfs/dbraw/zinc/72/26/96/1050722696.db2.gz INEHOQJEESDPEL-MRXNPFEDSA-N 1 0 305.462 4.257 20 10 DICDRO CC[N@H+](Cc1ccccc1)Cc1cc(Cl)cc(OC)c1O ZINC000761183874 1050744421 /nfs/dbraw/zinc/74/44/21/1050744421.db2.gz FVVAEKLFDPNMDC-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)[C@H](C)c2ccc(F)cc2)c1O ZINC000761184134 1050746565 /nfs/dbraw/zinc/74/65/65/1050746565.db2.gz RHGAIKDYESHMNL-LLVKDONJSA-N 1 0 323.795 4.386 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(O)c1 ZINC000788774398 1050752558 /nfs/dbraw/zinc/75/25/58/1050752558.db2.gz DDVXZBGGXHKDTI-AWEZNQCLSA-N 1 0 314.385 4.076 20 10 DICDRO CSC1(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000788841166 1050759688 /nfs/dbraw/zinc/75/96/88/1050759688.db2.gz RYCMTGSGRHZTLX-UHFFFAOYSA-N 1 0 304.503 4.004 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC000788970978 1050767920 /nfs/dbraw/zinc/76/79/20/1050767920.db2.gz YPEVFZQXSXXREK-UHFFFAOYSA-N 1 0 311.425 4.009 20 10 DICDRO CSC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCC1 ZINC000227946211 1050770674 /nfs/dbraw/zinc/77/06/74/1050770674.db2.gz KFDKNXBVQLJNRP-UHFFFAOYSA-N 1 0 304.503 4.052 20 10 DICDRO COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000788983637 1050770808 /nfs/dbraw/zinc/77/08/08/1050770808.db2.gz CVHMTMBXORTKRJ-IBGZPJMESA-N 1 0 323.436 4.142 20 10 DICDRO CC[C@@H]([NH2+]Cc1oc2ccccc2c1OC)c1ccccc1O ZINC000788980957 1050780448 /nfs/dbraw/zinc/78/04/48/1050780448.db2.gz PXXKBKHJXTUKET-OAHLLOKOSA-N 1 0 311.381 4.388 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@H]1C)c1ccc(N2CCOCC2)cc1Cl ZINC000772959498 1050805430 /nfs/dbraw/zinc/80/54/30/1050805430.db2.gz PXTHKWABGMWEBQ-QWQRMKEZSA-N 1 0 322.880 4.016 20 10 DICDRO C[N@H+](Cc1c(O)ccc2cc(Br)ccc21)C1CCC1 ZINC000742172923 1050808139 /nfs/dbraw/zinc/80/81/39/1050808139.db2.gz KCEWPQXCWDSDFK-UHFFFAOYSA-N 1 0 320.230 4.292 20 10 DICDRO C[C@H](C[NH2+]Cc1c(O)cccc1Cl)Sc1ccccc1 ZINC000742383301 1050826837 /nfs/dbraw/zinc/82/68/37/1050826837.db2.gz YLVCCEXMYZWSQE-GFCCVEGCSA-N 1 0 307.846 4.316 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cccc(Cl)c1F ZINC000742388412 1050827754 /nfs/dbraw/zinc/82/77/54/1050827754.db2.gz UBILCYJIUVTWJM-UHFFFAOYSA-N 1 0 300.160 4.128 20 10 DICDRO C[C@H](C[NH2+]Cc1c(O)cccc1Cl)c1ccc(F)cc1F ZINC000742390722 1050829014 /nfs/dbraw/zinc/82/90/14/1050829014.db2.gz MGCINOPHARFNBR-SNVBAGLBSA-N 1 0 311.759 4.217 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc2C1)c1ccc(N(C)C)cc1 ZINC001168411090 1050831455 /nfs/dbraw/zinc/83/14/55/1050831455.db2.gz GCJUBZOYDUEYMS-IFXJQAMLSA-N 1 0 312.432 4.100 20 10 DICDRO CO[C@H](C[NH2+]Cc1cc(C)c(C)cc1O)c1ccc(Cl)cc1 ZINC000742377465 1050836841 /nfs/dbraw/zinc/83/68/41/1050836841.db2.gz MKEXYZQVIUVEGX-GOSISDBHSA-N 1 0 319.832 4.140 20 10 DICDRO COc1ccc(C[NH2+]C[C@H](C)Oc2ccccc2Cl)cc1C ZINC000742379083 1050837386 /nfs/dbraw/zinc/83/73/86/1050837386.db2.gz MAWHEGLHLYIIDQ-AWEZNQCLSA-N 1 0 319.832 4.214 20 10 DICDRO Oc1ccc2ccncc2c1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000789531649 1050845769 /nfs/dbraw/zinc/84/57/69/1050845769.db2.gz RKZNBNNSFGQMAZ-UHFFFAOYSA-N 1 0 324.346 4.105 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(C(F)(F)F)CC2)cc1Cl ZINC001231867915 1050853078 /nfs/dbraw/zinc/85/30/78/1050853078.db2.gz OFJLWCYVWSKWQR-UHFFFAOYSA-N 1 0 307.743 4.128 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCSC1)c1ccc(N2CCCCC2)cc1 ZINC000790498825 1050964470 /nfs/dbraw/zinc/96/44/70/1050964470.db2.gz TYLSQYOPDLDAMC-CVEARBPZSA-N 1 0 304.503 4.081 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCSC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000790496815 1050964941 /nfs/dbraw/zinc/96/49/41/1050964941.db2.gz OBBMFKPGRDKYIQ-HUUCEWRRSA-N 1 0 322.493 4.220 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCSC1)c1ccc(N2CCCCC2)cc1 ZINC000790498830 1050965480 /nfs/dbraw/zinc/96/54/80/1050965480.db2.gz TYLSQYOPDLDAMC-JKSUJKDBSA-N 1 0 304.503 4.081 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000772994890 1050976833 /nfs/dbraw/zinc/97/68/33/1050976833.db2.gz CANWTPRCXJBSSV-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO Cc1cc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)ccc1F ZINC000772995244 1050979468 /nfs/dbraw/zinc/97/94/68/1050979468.db2.gz DEDQCQCIUQMPQR-HNNXBMFYSA-N 1 0 300.421 4.359 20 10 DICDRO c1cc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)cc2c1OCC2 ZINC000790621529 1050983032 /nfs/dbraw/zinc/98/30/32/1050983032.db2.gz AFXVAZDTVKECLT-UHFFFAOYSA-N 1 0 323.436 4.233 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(O)c1C ZINC000790695264 1050986436 /nfs/dbraw/zinc/98/64/36/1050986436.db2.gz LPUPFTCITRIJCU-CQSZACIVSA-N 1 0 314.385 4.076 20 10 DICDRO CC(C)=CCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000790683556 1050990338 /nfs/dbraw/zinc/99/03/38/1050990338.db2.gz PNUWMIPPXQZKQS-HNNXBMFYSA-N 1 0 322.880 4.184 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000773000419 1051015082 /nfs/dbraw/zinc/01/50/82/1051015082.db2.gz PIRBQMNPJUYAJN-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCc3c(O)cccc32)cc1 ZINC000790995454 1051015175 /nfs/dbraw/zinc/01/51/75/1051015175.db2.gz MTGPTGBFSLBUSV-HXUWFJFHSA-N 1 0 324.468 4.406 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CC3CCC2CC3)cc1 ZINC000400142967 1051019659 /nfs/dbraw/zinc/01/96/59/1051019659.db2.gz SHENUYIQNGBWCI-NKELODKYSA-N 1 0 300.490 4.449 20 10 DICDRO C[C@H]([NH2+]CCCC(C)(C)C)c1ccc(N2CCOCC2)cc1 ZINC000773010398 1051019499 /nfs/dbraw/zinc/01/94/99/1051019499.db2.gz JNDNUKPQNKZHSL-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccncc32)[C@H]1c1ccccc1 ZINC000743392844 1051024190 /nfs/dbraw/zinc/02/41/90/1051024190.db2.gz VLVYFOLLRAILCH-JLTOFOAXSA-N 1 0 304.393 4.133 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCSC1)c1ccc(N2CCCCCC2)cc1 ZINC000773030566 1051030832 /nfs/dbraw/zinc/03/08/32/1051030832.db2.gz TUZYSWUECKHNAO-DOTOQJQBSA-N 1 0 304.503 4.223 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)C)c1ccc(N(C)C)cc1 ZINC000773043527 1051033452 /nfs/dbraw/zinc/03/34/52/1051033452.db2.gz CNNGDXIFDUPZDY-YZGWKJHDSA-N 1 0 318.505 4.245 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCO[C@H]1C(C)C)c1ccc(N(C)C)cc1 ZINC000773043523 1051033649 /nfs/dbraw/zinc/03/36/49/1051033649.db2.gz CNNGDXIFDUPZDY-HOJAQTOUSA-N 1 0 318.505 4.245 20 10 DICDRO Cc1cc(CC[NH2+][C@@H](C)c2ccncc2)c(C)n1-c1ccccc1 ZINC000743464708 1051034322 /nfs/dbraw/zinc/03/43/22/1051034322.db2.gz NSQAHRXJWUJYJC-KRWDZBQOSA-N 1 0 319.452 4.382 20 10 DICDRO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(N(C)C)cc1 ZINC000773058450 1051043819 /nfs/dbraw/zinc/04/38/19/1051043819.db2.gz HTECGEJKMGYHIA-SJKOYZFVSA-N 1 0 316.832 4.190 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2COc3ccc(C)cc32)cc1 ZINC000773060746 1051045340 /nfs/dbraw/zinc/04/53/40/1051045340.db2.gz RYZVWOSPKOCHER-KXBFYZLASA-N 1 0 310.441 4.235 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC[C@H]2CCCC[C@@H]2O)cc1 ZINC000773080874 1051055060 /nfs/dbraw/zinc/05/50/60/1051055060.db2.gz NXNSJGIQPMUZTO-HQRMLTQVSA-N 1 0 318.505 4.125 20 10 DICDRO CC[C@H]([NH2+]CCC[C@@H]1CCCC[C@@H]1O)c1ccc(N(C)C)cc1 ZINC000773081901 1051056318 /nfs/dbraw/zinc/05/63/18/1051056318.db2.gz SJBWMTTWGSMDKO-IHPCNDPISA-N 1 0 318.505 4.125 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(C)cc(OC)c2)cc1 ZINC000773091577 1051059173 /nfs/dbraw/zinc/05/91/73/1051059173.db2.gz ITJVRVPZZRBXFX-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@H]1COc2ccccc21)c1ccc(N(C)C)cc1 ZINC000773105805 1051062942 /nfs/dbraw/zinc/06/29/42/1051062942.db2.gz RHCMHXZKGPSQIB-BEVDRBHNSA-N 1 0 324.468 4.358 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C2CC(OCc3ccccc3)C2)c(O)c1 ZINC000716284282 1051129675 /nfs/dbraw/zinc/12/96/75/1051129675.db2.gz JLQILOVRUULZOS-FAEJEUNOSA-N 1 0 311.425 4.099 20 10 DICDRO Cc1cc(F)ccc1C[N@@H+](C)Cc1c(O)ccc2ccncc21 ZINC000792707144 1051209306 /nfs/dbraw/zinc/20/93/06/1051209306.db2.gz KJFBBVJMOYQOIL-UHFFFAOYSA-N 1 0 310.372 4.020 20 10 DICDRO Cc1cccc(C[NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)c1O ZINC001171963347 1051248818 /nfs/dbraw/zinc/24/88/18/1051248818.db2.gz HZYYNDRLUQAOPZ-CYBMUJFWSA-N 1 0 323.358 4.440 20 10 DICDRO CCC[C@H]([NH2+]Cc1cc(Cl)ccc1O)[C@H](O)c1ccccc1 ZINC000793241493 1051270963 /nfs/dbraw/zinc/27/09/63/1051270963.db2.gz PBZYWYUVODNEEI-FUHWJXTLSA-N 1 0 319.832 4.038 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000793270679 1051275465 /nfs/dbraw/zinc/27/54/65/1051275465.db2.gz XZOSLXPWDGYONZ-SUMWQHHRSA-N 1 0 303.352 4.096 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2CCCc3ccc(F)cc32)c(O)c1 ZINC000793308614 1051278685 /nfs/dbraw/zinc/27/86/85/1051278685.db2.gz IGFVTEXGGRRIGK-SFHVURJKSA-N 1 0 315.388 4.097 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000793351514 1051292298 /nfs/dbraw/zinc/29/22/98/1051292298.db2.gz JBAPJHQUUFJPSZ-SUMWQHHRSA-N 1 0 303.352 4.096 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)[C@H](C)c2ccc(Cl)cc2)c(O)c1 ZINC000793386536 1051293895 /nfs/dbraw/zinc/29/38/95/1051293895.db2.gz VRUQBMVAUWZOQV-STQMWFEESA-N 1 0 319.832 4.336 20 10 DICDRO CC[C@@H](C[NH2+][C@@H](C)c1cc(OC)ccc1O)CC(F)(F)F ZINC000402560959 1051308540 /nfs/dbraw/zinc/30/85/40/1051308540.db2.gz JMLNTLFLTUWRCH-WDEREUQCSA-N 1 0 305.340 4.030 20 10 DICDRO CC1(C)CC[C@@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000793536692 1051312161 /nfs/dbraw/zinc/31/21/61/1051312161.db2.gz ULNHCZYBWRWNOP-BBRMVZONSA-N 1 0 324.415 4.035 20 10 DICDRO C[C@H]([NH2+]CCC1(O)CCC1)c1ccc(N2CCCCCC2)cc1 ZINC000793566183 1051321168 /nfs/dbraw/zinc/32/11/68/1051321168.db2.gz RKPSWFWTZZZHHS-KRWDZBQOSA-N 1 0 316.489 4.023 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)cc1C(C)C ZINC000793741398 1051337938 /nfs/dbraw/zinc/33/79/38/1051337938.db2.gz IDTFFCTVNRUIEV-SFHVURJKSA-N 1 0 317.473 4.073 20 10 DICDRO CC[C@@H](C)OCC[C@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172340512 1051362336 /nfs/dbraw/zinc/36/23/36/1051362336.db2.gz KJGMQKGWTLWTRK-ZWKOTPCHSA-N 1 0 318.505 4.312 20 10 DICDRO CCc1cc(CN(C)Cc2nccs2)c(O)c(C(C)(C)C)c1 ZINC000746389543 1051392478 /nfs/dbraw/zinc/39/24/78/1051392478.db2.gz LTPIWMPUTZVXPE-UHFFFAOYSA-N 1 0 318.486 4.341 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C(C)(C)C ZINC000766370405 1051411208 /nfs/dbraw/zinc/41/12/08/1051411208.db2.gz TYOMNJGUUJDWOX-APWZRJJASA-N 1 0 318.505 4.389 20 10 DICDRO CC(C)COCC[C@@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001172462457 1051415316 /nfs/dbraw/zinc/41/53/16/1051415316.db2.gz HAUYTBXAPDBZKQ-OAHLLOKOSA-N 1 0 301.430 4.086 20 10 DICDRO CCCCCC[C@@H](CCCC)[NH2+]C[C@H](O)c1ccc(O)c(O)c1 ZINC001172510482 1051426285 /nfs/dbraw/zinc/42/62/85/1051426285.db2.gz CYHGFPHDRQYJPV-APWZRJJASA-N 1 0 323.477 4.250 20 10 DICDRO CCCCCC[C@@H](CCCC)[NH2+]CCc1cc(O)c(O)cc1O ZINC001172516026 1051430836 /nfs/dbraw/zinc/43/08/36/1051430836.db2.gz FIOBBEPFVOLPPR-MRXNPFEDSA-N 1 0 323.477 4.465 20 10 DICDRO Oc1cc2c(cc1O)C[N@@H+]([C@@H]1CC[C@@H](c3ccccc3)C1)CCC2 ZINC001172570310 1051446254 /nfs/dbraw/zinc/44/62/54/1051446254.db2.gz VVPFWDWVAMPJRQ-IEBWSBKVSA-N 1 0 323.436 4.182 20 10 DICDRO C[C@@H]([NH2+]CCNc1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000766514480 1051454282 /nfs/dbraw/zinc/45/42/82/1051454282.db2.gz GTRYSEPQMDVWEM-GOSISDBHSA-N 1 0 323.484 4.440 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@]2(C)Cc2ccccc2)cc1 ZINC001168968247 1051481712 /nfs/dbraw/zinc/48/17/12/1051481712.db2.gz FDBLCNSXRNXKBC-NRFANRHFSA-N 1 0 308.469 4.350 20 10 DICDRO C[C@H](C[C@@H]1CCOC1)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766581515 1051515154 /nfs/dbraw/zinc/51/51/54/1051515154.db2.gz LYHBLKRDGWGHEW-KURKYZTESA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2c1cccc2OC)c1ccc(N(C)C)cc1 ZINC000766593707 1051530533 /nfs/dbraw/zinc/53/05/33/1051530533.db2.gz WQNRKROPCQADBS-UXHICEINSA-N 1 0 324.468 4.489 20 10 DICDRO C[C@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccc(N(C)C)cc1 ZINC001173042263 1051590296 /nfs/dbraw/zinc/59/02/96/1051590296.db2.gz LGANRUHSNZXDTP-INIZCTEOSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1cccc(C[NH2+]C2CCC(Oc3ccccc3)CC2)c1O ZINC001173198906 1051631520 /nfs/dbraw/zinc/63/15/20/1051631520.db2.gz KGUTZDLGTQJWSX-UHFFFAOYSA-N 1 0 311.425 4.180 20 10 DICDRO CCCC[C@@H](CC(C)C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001173246517 1051651065 /nfs/dbraw/zinc/65/10/65/1051651065.db2.gz PQFYTFDAJOSVJR-IBGZPJMESA-N 1 0 318.505 4.218 20 10 DICDRO CCSC[C@H](C)[NH2+][C@@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001173302318 1051680112 /nfs/dbraw/zinc/68/01/12/1051680112.db2.gz QJWQTGYPMXAQLT-SUMWQHHRSA-N 1 0 307.503 4.364 20 10 DICDRO CCSC[C@H](C)[NH2+][C@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001173302317 1051680201 /nfs/dbraw/zinc/68/02/01/1051680201.db2.gz QJWQTGYPMXAQLT-GUYCJALGSA-N 1 0 307.503 4.364 20 10 DICDRO CC[C@@H]1CC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000806137864 1051736574 /nfs/dbraw/zinc/73/65/74/1051736574.db2.gz SYYGUKPGJHFMDC-CXAGYDPISA-N 1 0 324.415 4.035 20 10 DICDRO C[C@H]1CC([NH2+]Cc2cc(-c3ccccc3)ccc2O)C[C@H](C)O1 ZINC000767427249 1051806375 /nfs/dbraw/zinc/80/63/75/1051806375.db2.gz XLOONKLUNQHPQP-GJZGRUSLSA-N 1 0 311.425 4.105 20 10 DICDRO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+]Cc1ccccc1O ZINC000767739405 1051845737 /nfs/dbraw/zinc/84/57/37/1051845737.db2.gz QESMVDDZIKIISP-HNNXBMFYSA-N 1 0 309.331 4.484 20 10 DICDRO FC1(F)CCC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000767929748 1051866249 /nfs/dbraw/zinc/86/62/49/1051866249.db2.gz PTGQNTJOLRTBCN-INIZCTEOSA-N 1 0 308.416 4.344 20 10 DICDRO CC[C@H]([NH2+]CCCc1c(C)noc1C)c1cccc(Cl)c1[O-] ZINC000806143514 1051880145 /nfs/dbraw/zinc/88/01/45/1051880145.db2.gz JYSNJERBYLXQNQ-INIZCTEOSA-N 1 0 322.836 4.324 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1nccc2ccccc21 ZINC000768134098 1051887762 /nfs/dbraw/zinc/88/77/62/1051887762.db2.gz PHUUTASOLPDSKU-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccccc2)[C@H](C)C2CC2)c1O ZINC000768153812 1051889015 /nfs/dbraw/zinc/88/90/15/1051889015.db2.gz KTMZRNUBJAPLTJ-OAHLLOKOSA-N 1 0 311.425 4.202 20 10 DICDRO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000768161423 1051890471 /nfs/dbraw/zinc/89/04/71/1051890471.db2.gz MKDPYYFKKICQMJ-QGZVFWFLSA-N 1 0 309.457 4.055 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2ccccc2Cl)c(O)c1 ZINC000768170667 1051892482 /nfs/dbraw/zinc/89/24/82/1051892482.db2.gz SWGYFUFRQWVFFI-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2ccccc2F)C2CC2)c1O ZINC000768202834 1051893488 /nfs/dbraw/zinc/89/34/88/1051893488.db2.gz BDFVDCRBOQGUIV-UHFFFAOYSA-N 1 0 315.388 4.095 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@@H]2CCCc3ccccc32)c1O ZINC000768193844 1051899741 /nfs/dbraw/zinc/89/97/41/1051899741.db2.gz SLOKMRQVGAIDID-GOSISDBHSA-N 1 0 311.425 4.300 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)c(O)c1 ZINC000768195059 1051901972 /nfs/dbraw/zinc/90/19/72/1051901972.db2.gz KDZGAYJFACCSFS-HNNXBMFYSA-N 1 0 303.427 4.190 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)c1 ZINC000768216247 1051902556 /nfs/dbraw/zinc/90/25/56/1051902556.db2.gz UHJDLAPIEAHWLB-ZDUSSCGKSA-N 1 0 303.377 4.123 20 10 DICDRO Oc1ccc(C2=CC[N@H+](Cc3c(O)cccc3Cl)CC2)cc1 ZINC000768215841 1051903205 /nfs/dbraw/zinc/90/32/05/1051903205.db2.gz NLXVQQRALTZORB-UHFFFAOYSA-N 1 0 315.800 4.041 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)c(O)c1 ZINC000768215351 1051905120 /nfs/dbraw/zinc/90/51/20/1051905120.db2.gz DMPRHCZAJQEUIS-ZDUSSCGKSA-N 1 0 303.377 4.123 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1O ZINC000768228106 1051906575 /nfs/dbraw/zinc/90/65/75/1051906575.db2.gz YAQQLJWHFAQCIN-QGZVFWFLSA-N 1 0 315.388 4.267 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2cc(Cl)ccc2O)cc1 ZINC000768237598 1051906615 /nfs/dbraw/zinc/90/66/15/1051906615.db2.gz QYAQELHEPDBJOP-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@H+](C[C@H]1CCOC1)C1CC1 ZINC000768258879 1051909220 /nfs/dbraw/zinc/90/92/20/1051909220.db2.gz YBRTVCJSISEBOT-MRXNPFEDSA-N 1 0 323.436 4.060 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)c(O)c1 ZINC000768267207 1051912210 /nfs/dbraw/zinc/91/22/10/1051912210.db2.gz OEFVIECVCUIGEN-GFCCVEGCSA-N 1 0 321.367 4.262 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccsc2)cc1F ZINC000768329893 1051918667 /nfs/dbraw/zinc/91/86/67/1051918667.db2.gz JXXNUCONQBGXDI-INIZCTEOSA-N 1 0 304.434 4.290 20 10 DICDRO CC[N@H+](Cc1ccccc1Cl)Cc1cccc(OC)c1O ZINC000768342056 1051920480 /nfs/dbraw/zinc/92/04/80/1051920480.db2.gz MOLYXVNQSFHVCT-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000768319450 1051920517 /nfs/dbraw/zinc/92/05/17/1051920517.db2.gz OIOOLJNWLHBFMQ-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@H]1c1ccccn1)CCCC2 ZINC000768443834 1051932614 /nfs/dbraw/zinc/93/26/14/1051932614.db2.gz UWAUREXARAMJFR-IBGZPJMESA-N 1 0 308.425 4.003 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc3c(cc2O)CCCC3)n1 ZINC000768463415 1051933433 /nfs/dbraw/zinc/93/34/33/1051933433.db2.gz SPXDIOQPVUOPCJ-FQEVSTJZSA-N 1 0 322.452 4.312 20 10 DICDRO Oc1ccc2ccccc2c1C[NH+]1CCC(c2cccnc2)CC1 ZINC000768459441 1051934471 /nfs/dbraw/zinc/93/44/71/1051934471.db2.gz LDKDUEWOKOLVNK-UHFFFAOYSA-N 1 0 318.420 4.320 20 10 DICDRO CC[C@H](c1ccccc1)[N@H+](CC)Cc1cc2c(cc1O)OCO2 ZINC000768514487 1051941984 /nfs/dbraw/zinc/94/19/84/1051941984.db2.gz JXJDTMTWODONLO-MRXNPFEDSA-N 1 0 313.397 4.094 20 10 DICDRO CC[N@H+](Cc1cc(Cl)ccc1O)[C@@H](C)c1cccc(O)c1 ZINC000768873594 1051974738 /nfs/dbraw/zinc/97/47/38/1051974738.db2.gz QNPDOWWPSHSVCN-LBPRGKRZSA-N 1 0 305.805 4.334 20 10 DICDRO CC[N@H+](Cc1c(O)cccc1OC)[C@@H](C)c1ccc(F)cc1 ZINC000768911954 1051981001 /nfs/dbraw/zinc/98/10/01/1051981001.db2.gz UNTDQLNLAQUPQA-ZDUSSCGKSA-N 1 0 303.377 4.123 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CCC(OCC(C)C)CC2)cc1 ZINC000768938461 1051984171 /nfs/dbraw/zinc/98/41/71/1051984171.db2.gz KONPDXVVNUEPCA-UHFFFAOYSA-N 1 0 318.505 4.170 20 10 DICDRO CCC[N@H+](Cc1cnc(Cl)c(C)c1)Cc1ccccc1O ZINC000769200663 1052007351 /nfs/dbraw/zinc/00/73/51/1052007351.db2.gz HMSVRIKVXMHRTA-UHFFFAOYSA-N 1 0 304.821 4.161 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2CCCc3ccc(C)cc32)c1O ZINC000808436045 1052020519 /nfs/dbraw/zinc/02/05/19/1052020519.db2.gz JMIILUQZQVVHEO-SFHVURJKSA-N 1 0 311.425 4.267 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2c3ccccc3O[C@@H]2C)cc1 ZINC000808443587 1052022563 /nfs/dbraw/zinc/02/25/63/1052022563.db2.gz GNMLRYKJIGRNPZ-FOIQADDNSA-N 1 0 310.441 4.145 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000769317435 1052024794 /nfs/dbraw/zinc/02/47/94/1052024794.db2.gz QWWKVUJYDZYNTI-SFHVURJKSA-N 1 0 317.816 4.009 20 10 DICDRO Cc1ccc(O)c(C[N@H+](Cc2ccccc2O)C2CCCC2)c1 ZINC000769388434 1052037040 /nfs/dbraw/zinc/03/70/40/1052037040.db2.gz LQPJOXLNEIDVDZ-UHFFFAOYSA-N 1 0 311.425 4.351 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000769425101 1052044462 /nfs/dbraw/zinc/04/44/62/1052044462.db2.gz CUCBTFWZAWGZFE-KRWDZBQOSA-N 1 0 319.857 4.336 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)cc1 ZINC000769427347 1052047353 /nfs/dbraw/zinc/04/73/53/1052047353.db2.gz KVXJYDJBMWLTDZ-IBGZPJMESA-N 1 0 312.482 4.043 20 10 DICDRO C[C@@H]1SCC[N@H+](Cc2ccc(N3CCCCC3)cc2)[C@H]1C ZINC000769446324 1052054880 /nfs/dbraw/zinc/05/48/80/1052054880.db2.gz NFOGIQMGJNUOMU-HOTGVXAUSA-N 1 0 304.503 4.003 20 10 DICDRO C[C@H]1SCC[N@H+](Cc2ccc(N3CCCCC3)cc2)[C@H]1C ZINC000769446326 1052055119 /nfs/dbraw/zinc/05/51/19/1052055119.db2.gz NFOGIQMGJNUOMU-JKSUJKDBSA-N 1 0 304.503 4.003 20 10 DICDRO CCOc1cccc(C[N@@H+]2C[C@H](c3ccccc3)C[C@H]2C)c1O ZINC000769445432 1052055862 /nfs/dbraw/zinc/05/58/62/1052055862.db2.gz IICNASNWFUNPHN-CRAIPNDOSA-N 1 0 311.425 4.169 20 10 DICDRO COc1cccc(C[N@@H+]2CCCCC[C@@H]2c2ccc(C)o2)c1O ZINC000769462191 1052061054 /nfs/dbraw/zinc/06/10/54/1052061054.db2.gz CAOPMZANCKPFGK-MRXNPFEDSA-N 1 0 315.413 4.420 20 10 DICDRO CSCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000769464315 1052061335 /nfs/dbraw/zinc/06/13/35/1052061335.db2.gz ZEDMARQSCDMZOE-MRXNPFEDSA-N 1 0 306.519 4.250 20 10 DICDRO CCn1nc(C)c(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)c1C ZINC000808690201 1052061801 /nfs/dbraw/zinc/06/18/01/1052061801.db2.gz JZHYUUAKUZSGQN-LLVKDONJSA-N 1 0 321.852 4.038 20 10 DICDRO CCC[N@H+](Cc1c(O)cccc1Cl)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000769469721 1052063513 /nfs/dbraw/zinc/06/35/13/1052063513.db2.gz DDBJILIKSXJJPM-VUCTXSBTSA-N 1 0 323.864 4.071 20 10 DICDRO COCc1ccccc1C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808674459 1052064924 /nfs/dbraw/zinc/06/49/24/1052064924.db2.gz SQQIUUZQKVGCNY-ZDUSSCGKSA-N 1 0 319.832 4.351 20 10 DICDRO COCc1ccc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cc1 ZINC000808673408 1052065739 /nfs/dbraw/zinc/06/57/39/1052065739.db2.gz CNZKJIHYRKEISM-CYBMUJFWSA-N 1 0 319.832 4.351 20 10 DICDRO Cc1csc(CC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)n1 ZINC000808675696 1052067337 /nfs/dbraw/zinc/06/73/37/1052067337.db2.gz PQGDDLBALNCQOI-NSHDSACASA-N 1 0 310.850 4.012 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)C[C@@H](O)c2ccco2)c1O ZINC000808703829 1052069283 /nfs/dbraw/zinc/06/92/83/1052069283.db2.gz XYMAZRJOVPQYGZ-SLEUVZQESA-N 1 0 323.820 4.110 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2cc(C)ccc2C)c1O ZINC000769503777 1052070238 /nfs/dbraw/zinc/07/02/38/1052070238.db2.gz LUDWACIAQLYNRV-SFHVURJKSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)c1O ZINC000769506937 1052071844 /nfs/dbraw/zinc/07/18/44/1052071844.db2.gz YXDZCGIDHCPDPT-UGSOOPFHSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCC[C@@H]2CCCCO2)c1O ZINC000808713544 1052073619 /nfs/dbraw/zinc/07/36/19/1052073619.db2.gz ITWOSLXLVCZPBV-ZFWWWQNUSA-N 1 0 311.853 4.354 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](C)c2nccs2)c1O ZINC000808713629 1052074257 /nfs/dbraw/zinc/07/42/57/1052074257.db2.gz JFVYCPPCVRXMCP-MNOVXSKESA-N 1 0 310.850 4.265 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c1O ZINC000808715961 1052075392 /nfs/dbraw/zinc/07/53/92/1052075392.db2.gz ZNBBQIUWAMTFQA-RZAIGCCYSA-N 1 0 323.864 4.210 20 10 DICDRO COc1cnccc1[C@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808714740 1052075679 /nfs/dbraw/zinc/07/56/79/1052075679.db2.gz BLIQTMJDAZZQBB-RYUDHWBXSA-N 1 0 320.820 4.169 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CCCCN2C2CC2)c1O ZINC000808715294 1052076673 /nfs/dbraw/zinc/07/66/73/1052076673.db2.gz CKRSUHKIFCYXMM-CJNGLKHVSA-N 1 0 322.880 4.022 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)[C@H](O)c1ccccc1 ZINC000808720366 1052077435 /nfs/dbraw/zinc/07/74/35/1052077435.db2.gz UDZLIBHRFCVCGW-MDOVXXIYSA-N 1 0 321.420 4.318 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c1O ZINC000808719490 1052077470 /nfs/dbraw/zinc/07/74/70/1052077470.db2.gz XDOGWXCVAXRUIS-WDEREUQCSA-N 1 0 303.780 4.440 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000769555563 1052083091 /nfs/dbraw/zinc/08/30/91/1052083091.db2.gz FBXANWOWHZXZAR-UHFFFAOYSA-N 1 0 315.363 4.350 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1ccccc1O ZINC000808727610 1052084181 /nfs/dbraw/zinc/08/41/81/1052084181.db2.gz JTMFXMJESIBILU-IMFGXOCKSA-N 1 0 311.425 4.353 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(N(C)C)cc1 ZINC000769788056 1052110016 /nfs/dbraw/zinc/11/00/16/1052110016.db2.gz GOFXIBJPSHBRLC-LBPRGKRZSA-N 1 0 323.362 4.017 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000769911257 1052120046 /nfs/dbraw/zinc/12/00/46/1052120046.db2.gz YVOSVBLQVZMERN-UHFFFAOYSA-N 1 0 318.461 4.294 20 10 DICDRO CCCCC[C@H]([NH2+]C)c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217755904 1052133969 /nfs/dbraw/zinc/13/39/69/1052133969.db2.gz HOKNPCGCNPMOGK-KRWDZBQOSA-N 1 0 324.428 4.368 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CCCC[NH2+]C3)cc2)C=C1 ZINC001217973446 1052179864 /nfs/dbraw/zinc/17/98/64/1052179864.db2.gz JUEUIUXYCBNRBB-GOSISDBHSA-N 1 0 311.385 4.329 20 10 DICDRO C[C@@H]1C[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)CC[NH2+]1 ZINC001218052621 1052190078 /nfs/dbraw/zinc/19/00/78/1052190078.db2.gz LROWHENNWWXHFL-ACJLOTCBSA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CC[C@@]23CC[NH2+]C3)=C1 ZINC001218120046 1052198911 /nfs/dbraw/zinc/19/89/11/1052198911.db2.gz SDVDPFICNHGEDY-NJOYMBDGSA-N 1 0 323.396 4.329 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@H]3C[C@H]4C[NH2+]C[C@H]4C3)cc2)cc1 ZINC001218134975 1052200779 /nfs/dbraw/zinc/20/07/79/1052200779.db2.gz PUHREUFDCCVCHI-GRSOZCAVSA-N 1 0 307.397 4.479 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@H]3CCO[C@]34CC[NH2+]C4)cc2)cc1 ZINC001218139555 1052200984 /nfs/dbraw/zinc/20/09/84/1052200984.db2.gz WFOGVDFTQWTBQZ-YTCPRFGJSA-N 1 0 323.396 4.002 20 10 DICDRO Cc1ccc(O[C@H]2[C@@H]3C[C@H]2C[NH2+]C3)c(/N=N/c2ccccc2)c1 ZINC001218148742 1052201944 /nfs/dbraw/zinc/20/19/44/1052201944.db2.gz BUIPQKJOMJWLMZ-CJAYWHTHSA-N 1 0 307.397 4.397 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CCC4(C[NH2+]C4)C3)cc2)C=C1 ZINC001218237752 1052210652 /nfs/dbraw/zinc/21/06/52/1052210652.db2.gz KNQCJRNWRCZVDS-GOSISDBHSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2C[C@H]3CC[NH2+][C@@H]3C2)=C1 ZINC001218249607 1052212842 /nfs/dbraw/zinc/21/28/42/1052212842.db2.gz KACSUIWQQPLIHV-KSDVFSPFSA-N 1 0 323.396 4.327 20 10 DICDRO C[NH2+][C@@H](C)C(=O)Nc1ccc(/N=N/c2ccccc2C)cc1C ZINC001219203783 1052277389 /nfs/dbraw/zinc/27/73/89/1052277389.db2.gz NTIZOHGKTXJGDN-OXBTWTFQSA-N 1 0 310.401 4.265 20 10 DICDRO Cc1nc(C)c(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC000315005463 1052329243 /nfs/dbraw/zinc/32/92/43/1052329243.db2.gz WZZGHHMTVWMWCZ-GWCFXTLKSA-N 1 0 302.443 4.112 20 10 DICDRO CCC(C)(C)C1CCC([NH2+]Cc2cccc(OC)c2O)CC1 ZINC000315403533 1052337848 /nfs/dbraw/zinc/33/78/48/1052337848.db2.gz GRRCEJXKYIGHCM-UHFFFAOYSA-N 1 0 305.462 4.485 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2csc(Cl)c2Cl)cc1 ZINC000762420613 1052380292 /nfs/dbraw/zinc/38/02/92/1052380292.db2.gz BEYVVXPFABUDIR-UHFFFAOYSA-N 1 0 315.269 4.411 20 10 DICDRO C[C@@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1cc(F)ccc1O ZINC000762626799 1052408785 /nfs/dbraw/zinc/40/87/85/1052408785.db2.gz YMKLJSHIEZUMSM-DNOWBOINSA-N 1 0 309.425 4.166 20 10 DICDRO CC[C@@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1ccccc1O ZINC000762643295 1052409584 /nfs/dbraw/zinc/40/95/84/1052409584.db2.gz OSHPSZJYGKOVHN-VMBOVVBDSA-N 1 0 305.462 4.417 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cc1 ZINC000762632749 1052409794 /nfs/dbraw/zinc/40/97/94/1052409794.db2.gz RYRNQVSARFYPCA-UHFFFAOYSA-N 1 0 316.395 4.200 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1O ZINC000236926879 1052432499 /nfs/dbraw/zinc/43/24/99/1052432499.db2.gz GATOCCVCNHLSKO-IBGZPJMESA-N 1 0 323.392 4.263 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)cc1C ZINC000763396410 1052622897 /nfs/dbraw/zinc/62/28/97/1052622897.db2.gz UDBYWGLLWYLDEO-KRWDZBQOSA-N 1 0 301.817 4.434 20 10 DICDRO CC1CCC([N@H+](Cc2c(O)ccc3ccncc32)C2CC2)CC1 ZINC000917436907 1052727366 /nfs/dbraw/zinc/72/73/66/1052727366.db2.gz HOOBISCBGNJUSQ-UHFFFAOYSA-N 1 0 310.441 4.484 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccccn2)Cc2ccccc2O)c1 ZINC000179570347 1053015703 /nfs/dbraw/zinc/01/57/03/1053015703.db2.gz NYTPOFFXSJNQOF-UHFFFAOYSA-N 1 0 318.420 4.298 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c1O ZINC000179670215 1053021094 /nfs/dbraw/zinc/02/10/94/1053021094.db2.gz QGQOQALJQXNTBT-INIZCTEOSA-N 1 0 322.408 4.221 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCCCC(=O)OC(C)(C)C)cc1C ZINC000237746708 1053025056 /nfs/dbraw/zinc/02/50/56/1053025056.db2.gz ZRNVPXNTMDZQQK-UHFFFAOYSA-N 1 0 321.461 4.001 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCc2c[nH]c3ccccc23)cc1C ZINC000237860586 1053033350 /nfs/dbraw/zinc/03/33/50/1053033350.db2.gz FQDLMWIWXTYZLI-UHFFFAOYSA-N 1 0 308.425 4.213 20 10 DICDRO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1cc(F)ccc1O)CCC2 ZINC000180222989 1053049539 /nfs/dbraw/zinc/04/95/39/1053049539.db2.gz ICLVCMAPMLKHSL-CQSZACIVSA-N 1 0 320.433 4.060 20 10 DICDRO Nc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000849352899 1053090154 /nfs/dbraw/zinc/09/01/54/1053090154.db2.gz RXZWCNCDCMTYBQ-NRFANRHFSA-N 1 0 321.468 4.036 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1c(F)cc(F)cc1F ZINC001350944251 1053120899 /nfs/dbraw/zinc/12/08/99/1053120899.db2.gz OJWQXGLVYHFYDS-MEBBXXQBSA-N 1 0 321.342 4.456 20 10 DICDRO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(N3CCCC3)cc2)o1 ZINC001318339328 1053162357 /nfs/dbraw/zinc/16/23/57/1053162357.db2.gz NNHKMVSUZCNZAJ-DNVCBOLYSA-N 1 0 310.441 4.293 20 10 DICDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001351313849 1053166187 /nfs/dbraw/zinc/16/61/87/1053166187.db2.gz DPLWQBZUFUQQCY-UHFFFAOYSA-N 1 0 310.432 4.448 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@@]3(C=Cc4ccccc4O3)C2)c(O)c1 ZINC001474728745 1053194539 /nfs/dbraw/zinc/19/45/39/1053194539.db2.gz PNNYAOWKVFOUNY-OAQYLSRUSA-N 1 0 321.420 4.141 20 10 DICDRO C[C@H]([NH2+]CCCc1ccccn1)c1ccc(N2CCCCC2)cc1 ZINC000181491048 1053222497 /nfs/dbraw/zinc/22/24/97/1053222497.db2.gz KKLNROHNRZGJAC-SFHVURJKSA-N 1 0 323.484 4.355 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CCC(F)(F)C2)cc1Cl ZINC001474743559 1053262209 /nfs/dbraw/zinc/26/22/09/1053262209.db2.gz PBDQNJHDCPLAAP-NSHDSACASA-N 1 0 303.780 4.269 20 10 DICDRO C[C@@H](COc1ccccc1F)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001319751819 1053269839 /nfs/dbraw/zinc/26/98/39/1053269839.db2.gz XVGPQFKYNYKUPT-GJZGRUSLSA-N 1 0 316.420 4.010 20 10 DICDRO CCO[C@H](CC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C)C(C)C ZINC001320119083 1053307340 /nfs/dbraw/zinc/30/73/40/1053307340.db2.gz WLLVPDFJYUNFTK-HLLBOEOZSA-N 1 0 305.462 4.290 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCCOC1CCCC1 ZINC001320119259 1053308377 /nfs/dbraw/zinc/30/83/77/1053308377.db2.gz YVLIRBYZDYNQGO-ZBFHGGJFSA-N 1 0 303.446 4.188 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCO[C@H](CC(C)C)C1 ZINC001320133888 1053309774 /nfs/dbraw/zinc/30/97/74/1053309774.db2.gz RQRPEXJSJRKGFH-TWMKSMIVSA-N 1 0 317.473 4.432 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001320246808 1053317851 /nfs/dbraw/zinc/31/78/51/1053317851.db2.gz PROJJTVWBROXBC-ZBFHGGJFSA-N 1 0 311.425 4.356 20 10 DICDRO Cc1nc(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)sc1C ZINC001320249351 1053318664 /nfs/dbraw/zinc/31/86/64/1053318664.db2.gz YENDCERPGMVGLD-RISCZKNCSA-N 1 0 316.470 4.155 20 10 DICDRO CCOCCC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC001320253755 1053320594 /nfs/dbraw/zinc/32/05/94/1053320594.db2.gz ZUAFNXKFAWOIMP-CVEARBPZSA-N 1 0 317.473 4.435 20 10 DICDRO COCCC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC001320411545 1053333018 /nfs/dbraw/zinc/33/30/18/1053333018.db2.gz PPFXZDHWTJARKE-LSDHHAIUSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc2c(c1)COC2 ZINC001320424393 1053333848 /nfs/dbraw/zinc/33/38/48/1053333848.db2.gz JTZHKXXDUMOPGM-SUMWQHHRSA-N 1 0 309.409 4.069 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2cccc(C(F)F)c2)c1 ZINC001320547997 1053343294 /nfs/dbraw/zinc/34/32/94/1053343294.db2.gz YWXMPHPEUCLSKD-UHFFFAOYSA-N 1 0 307.340 4.018 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001321037586 1053384378 /nfs/dbraw/zinc/38/43/78/1053384378.db2.gz OQZXJKFLFWTVFO-MLGOLLRUSA-N 1 0 315.388 4.186 20 10 DICDRO Fc1ccccc1CCC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001321067179 1053386324 /nfs/dbraw/zinc/38/63/24/1053386324.db2.gz KAELJBMLIXGBGN-UHFFFAOYSA-N 1 0 312.432 4.148 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(Br)o1)c1ccc(C)cc1O ZINC001321072483 1053387507 /nfs/dbraw/zinc/38/75/07/1053387507.db2.gz JNOCCZAMHZIADX-CYBMUJFWSA-N 1 0 324.218 4.297 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(N(C)C)cc1)c1ccc(C)cc1O ZINC001321075492 1053388666 /nfs/dbraw/zinc/38/86/66/1053388666.db2.gz XSVKOBDASMJVSZ-IBGZPJMESA-N 1 0 312.457 4.050 20 10 DICDRO C[C@@H](C[N+](C)(C)C)OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001229817013 1053410158 /nfs/dbraw/zinc/41/01/58/1053410158.db2.gz YJKQBLTWCUVEJM-AWEZNQCLSA-O 1 0 314.409 4.281 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CC(C)(C)OC1(C)C ZINC001323829246 1053603530 /nfs/dbraw/zinc/60/35/30/1053603530.db2.gz IVTGPRJMPDDTHK-UMVBOHGHSA-N 1 0 303.446 4.185 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CC(C)(C)OC1(C)C ZINC001323829244 1053603699 /nfs/dbraw/zinc/60/36/99/1053603699.db2.gz IVTGPRJMPDDTHK-NFAWXSAZSA-N 1 0 303.446 4.185 20 10 DICDRO CC[C@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001200391111 1053624842 /nfs/dbraw/zinc/62/48/42/1053624842.db2.gz WFVJJRRJDIKYQM-GOSISDBHSA-N 1 0 315.844 4.386 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)c1ccc(F)cc1 ZINC001324239520 1053636308 /nfs/dbraw/zinc/63/63/08/1053636308.db2.gz IBCDPSXOJRPGPY-KBXCAEBGSA-N 1 0 317.404 4.186 20 10 DICDRO C[N@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1ccc2ccccc2c1O ZINC001324337421 1053646801 /nfs/dbraw/zinc/64/68/01/1053646801.db2.gz PBBBCLUWLPQCNC-UHFFFAOYSA-N 1 0 323.440 4.198 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)cc1C(F)(F)F)c1ccccc1O ZINC000183418964 1053654828 /nfs/dbraw/zinc/65/48/28/1053654828.db2.gz MLWZJEPKEGYZSH-SNVBAGLBSA-N 1 0 313.294 4.401 20 10 DICDRO Cc1cccnc1C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC001325186754 1053705165 /nfs/dbraw/zinc/70/51/65/1053705165.db2.gz BEROZHXOZUSJDG-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO C[C@H]([NH2+]CCCOCc1ccccc1)c1cc(Cl)ccc1O ZINC001325338866 1053714468 /nfs/dbraw/zinc/71/44/68/1053714468.db2.gz CYRCCGRFGLBJOO-AWEZNQCLSA-N 1 0 319.832 4.303 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCCNc1ccccc1 ZINC001325339916 1053714538 /nfs/dbraw/zinc/71/45/38/1053714538.db2.gz LZBXWMMVDCRLBE-DOTOQJQBSA-N 1 0 310.441 4.341 20 10 DICDRO COCc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)cc1 ZINC001325340846 1053714723 /nfs/dbraw/zinc/71/47/23/1053714723.db2.gz SGQHUPJSMWNUEH-WMLDXEAASA-N 1 0 311.425 4.185 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1cc(C(C)C)no1 ZINC001325341339 1053714751 /nfs/dbraw/zinc/71/47/51/1053714751.db2.gz VCQZOFKVEVVYQB-SWLSCSKDSA-N 1 0 300.402 4.150 20 10 DICDRO COCc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)cc1 ZINC001325340845 1053715155 /nfs/dbraw/zinc/71/51/55/1053715155.db2.gz SGQHUPJSMWNUEH-RHSMWYFYSA-N 1 0 311.425 4.185 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1cc(C(C)C)no1 ZINC001325341338 1053715432 /nfs/dbraw/zinc/71/54/32/1053715432.db2.gz VCQZOFKVEVVYQB-IUODEOHRSA-N 1 0 300.402 4.150 20 10 DICDRO C[C@@H]([NH2+]C1(c2ccc(F)cc2F)CCC1)c1ccccc1O ZINC000183669262 1053719062 /nfs/dbraw/zinc/71/90/62/1053719062.db2.gz RGEUIOVXQDFVIZ-GFCCVEGCSA-N 1 0 303.352 4.400 20 10 DICDRO C[N@@H+]1CCC[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001231320930 1053726954 /nfs/dbraw/zinc/72/69/54/1053726954.db2.gz ZREPSHYAAILUKB-SFHVURJKSA-N 1 0 311.385 4.281 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC001326035483 1053744694 /nfs/dbraw/zinc/74/46/94/1053744694.db2.gz JQULCIXUHXUSBD-FSPWUOQZSA-N 1 0 322.452 4.498 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1O ZINC001231594156 1053790869 /nfs/dbraw/zinc/79/08/69/1053790869.db2.gz UFYYUCONRWFDIM-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO CC[N@H+](Cc1cccc(C)c1O)[C@H](C)Cc1ccc(OC)cc1 ZINC001231590987 1053791394 /nfs/dbraw/zinc/79/13/94/1053791394.db2.gz NCUFVZMELIMFBF-MRXNPFEDSA-N 1 0 313.441 4.162 20 10 DICDRO Cc1cccc(C[N@@H+]2CCSC[C@@H]2c2ccc(F)cc2)c1O ZINC001231593189 1053793212 /nfs/dbraw/zinc/79/32/12/1053793212.db2.gz QMLFXYWCVSHIAB-QGZVFWFLSA-N 1 0 317.429 4.130 20 10 DICDRO COc1cccc2c1C[N@H+](Cc1c(O)ccc3ccccc31)CC2 ZINC001231588133 1053793673 /nfs/dbraw/zinc/79/36/73/1053793673.db2.gz MRZUGKXSHMLJAP-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1c(O)ccc3ccccc31)C2 ZINC001231589318 1053793724 /nfs/dbraw/zinc/79/37/24/1053793724.db2.gz BUKROTSTLXTZPH-UHFFFAOYSA-N 1 0 305.377 4.070 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H]1Cc1ccccn1 ZINC001231590110 1053793826 /nfs/dbraw/zinc/79/38/26/1053793826.db2.gz KAMCXXHRIGRMCV-GOSISDBHSA-N 1 0 318.420 4.148 20 10 DICDRO Cc1cc(O)c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)cc1Br ZINC001237676552 1053826836 /nfs/dbraw/zinc/82/68/36/1053826836.db2.gz KUCDPPVFGJRSDJ-STQMWFEESA-N 1 0 324.262 4.085 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)cc1 ZINC001327255003 1053845788 /nfs/dbraw/zinc/84/57/88/1053845788.db2.gz QCCFUPBEIMZOOF-HYVNUMGLSA-N 1 0 308.416 4.056 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000273379432 1053848767 /nfs/dbraw/zinc/84/87/67/1053848767.db2.gz HZAVFPWAQHGTHF-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2c(C)oc3ccccc32)c1 ZINC000183919464 1053855801 /nfs/dbraw/zinc/85/58/01/1053855801.db2.gz RBMUQTQDUOHWLU-UHFFFAOYSA-N 1 0 311.381 4.135 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1SC ZINC001231787182 1053856436 /nfs/dbraw/zinc/85/64/36/1053856436.db2.gz LLKOIWIWCFNSBJ-UHFFFAOYSA-N 1 0 314.498 4.497 20 10 DICDRO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2O)s1 ZINC000274281544 1053861793 /nfs/dbraw/zinc/86/17/93/1053861793.db2.gz YMJOOWBKLHDVPX-QWRGUYRKSA-N 1 0 313.426 4.117 20 10 DICDRO COCCC(C)(C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000183938151 1053864210 /nfs/dbraw/zinc/86/42/10/1053864210.db2.gz SYMPAPMBEVCPEQ-QGZVFWFLSA-N 1 0 318.505 4.390 20 10 DICDRO COCCC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000183938131 1053864899 /nfs/dbraw/zinc/86/48/99/1053864899.db2.gz SYMPAPMBEVCPEQ-KRWDZBQOSA-N 1 0 318.505 4.390 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c1C ZINC001327614502 1053869219 /nfs/dbraw/zinc/86/92/19/1053869219.db2.gz UWUIDBYIQUSGFF-XJKSGUPXSA-N 1 0 311.425 4.356 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(C)cc(C)cc1O ZINC001231844352 1053887213 /nfs/dbraw/zinc/88/72/13/1053887213.db2.gz JFOBAOZMLSHHLC-SFHVURJKSA-N 1 0 311.425 4.355 20 10 DICDRO CCC[N@H+](Cc1ccccc1)Cc1ccc(N(C)C)cc1OC ZINC001231851432 1053889211 /nfs/dbraw/zinc/88/92/11/1053889211.db2.gz BXQHSMVWNJDCJN-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)cc1Cl ZINC001231866743 1053894101 /nfs/dbraw/zinc/89/41/01/1053894101.db2.gz CNLYDUYDQQWELC-UHFFFAOYSA-N 1 0 303.780 4.221 20 10 DICDRO CCOc1ccc(C[NH2+]CCCSc2nccs2)c(C)c1 ZINC001200691980 1053895919 /nfs/dbraw/zinc/89/59/19/1053895919.db2.gz JZZLKYWYUKZQOX-UHFFFAOYSA-N 1 0 322.499 4.122 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCC(=O)c2cccs2)cc1Cl ZINC001231870406 1053897052 /nfs/dbraw/zinc/89/70/52/1053897052.db2.gz YVLMFZNGGJXQAE-UHFFFAOYSA-N 1 0 323.845 4.120 20 10 DICDRO CCC[N@H+](CCc1ccccn1)Cc1cc(Cl)c(C)cc1O ZINC001231869958 1053897993 /nfs/dbraw/zinc/89/79/93/1053897993.db2.gz BYBUTDJXLIRFNZ-UHFFFAOYSA-N 1 0 318.848 4.204 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CC/C=C/c2cccnc2)cc1Cl ZINC001231870040 1053898670 /nfs/dbraw/zinc/89/86/70/1053898670.db2.gz GYJCMDVGGGQVAA-ZZXKWVIFSA-N 1 0 316.832 4.284 20 10 DICDRO Oc1c(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)ccc2ccccc21 ZINC001231879973 1053902678 /nfs/dbraw/zinc/90/26/78/1053902678.db2.gz YUHABKVRVFIOSE-GASCZTMLSA-N 1 0 303.352 4.023 20 10 DICDRO Oc1c(C[N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)ccc2ccccc21 ZINC001231879957 1053902754 /nfs/dbraw/zinc/90/27/54/1053902754.db2.gz YKSPBMUJTPOEHU-GASCZTMLSA-N 1 0 303.352 4.023 20 10 DICDRO Oc1c(C[NH+]2CCc3ccccc3CC2)ccc2ccccc21 ZINC001231881824 1053907206 /nfs/dbraw/zinc/90/72/06/1053907206.db2.gz ITVSNFRRZPSUDH-UHFFFAOYSA-N 1 0 303.405 4.146 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1cc(Cl)ccc1O ZINC001328103800 1053907594 /nfs/dbraw/zinc/90/75/94/1053907594.db2.gz RATVVZROLAOUKF-RYDUCSDGSA-N 1 0 301.764 4.130 20 10 DICDRO CC[C@@H]([NH2+][C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1cc(Cl)ccc1O ZINC001328103799 1053907944 /nfs/dbraw/zinc/90/79/44/1053907944.db2.gz RATVVZROLAOUKF-GWNIPJSYSA-N 1 0 301.764 4.130 20 10 DICDRO Oc1cc(O)c(C[N@H+]2CC=C(c3ccccc3)CC2)cc1Cl ZINC001232262434 1054005060 /nfs/dbraw/zinc/00/50/60/1054005060.db2.gz HKDWEMFKEAFELK-UHFFFAOYSA-N 1 0 315.800 4.041 20 10 DICDRO CC(C)C[N@H+](Cc1ccccc1)Cc1cc(Cl)c(O)cc1O ZINC001232258541 1054005272 /nfs/dbraw/zinc/00/52/72/1054005272.db2.gz AMJYHMSDCYXMRQ-UHFFFAOYSA-N 1 0 319.832 4.409 20 10 DICDRO c1cnc2cccc(C[NH2+]Cc3ccc(N4CCCC4)cc3)c2c1 ZINC001329786944 1054008294 /nfs/dbraw/zinc/00/82/94/1054008294.db2.gz SWCAVLXPHTVQIA-UHFFFAOYSA-N 1 0 317.436 4.125 20 10 DICDRO CC[N@H+](Cc1cccc(F)c1)Cc1cc(Cl)c(OC)cc1O ZINC001232268409 1054009580 /nfs/dbraw/zinc/00/95/80/1054009580.db2.gz NIJOTWDNDPMDLL-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO COc1cc(O)c(C[N@@H+]2Cc3ccccc3C[C@H]2C)cc1Cl ZINC001232269377 1054011203 /nfs/dbraw/zinc/01/12/03/1054011203.db2.gz XUGGQWJWEAXXPF-GFCCVEGCSA-N 1 0 317.816 4.001 20 10 DICDRO COCc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)cc1 ZINC001232300201 1054015833 /nfs/dbraw/zinc/01/58/33/1054015833.db2.gz KBWAIJUKCPZJDW-UHFFFAOYSA-N 1 0 324.468 4.065 20 10 DICDRO COc1ccccc1C1([NH2+][C@@H]2CCc3cccc(O)c32)CCC1 ZINC001330716161 1054048208 /nfs/dbraw/zinc/04/82/08/1054048208.db2.gz WMMMLVIWEQGUCD-MRXNPFEDSA-N 1 0 309.409 4.057 20 10 DICDRO Fc1ccc(C2([NH2+]Cc3ccc(N4CCCC4)cc3)CC2)cc1 ZINC001331361868 1054072037 /nfs/dbraw/zinc/07/20/37/1054072037.db2.gz IOEUTEQMBFKPLJ-UHFFFAOYSA-N 1 0 310.416 4.205 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCSc3ccc(F)cc31)CC2 ZINC000295816679 1054082740 /nfs/dbraw/zinc/08/27/40/1054082740.db2.gz DANGQBFQZCVEHO-GJZGRUSLSA-N 1 0 315.413 4.345 20 10 DICDRO CN(Cc1ccccc1O)Cc1cc(F)c(Cl)cc1Cl ZINC001232704045 1054105200 /nfs/dbraw/zinc/10/52/00/1054105200.db2.gz QNBXZPIGEQZJOT-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000848496408 1054117015 /nfs/dbraw/zinc/11/70/15/1054117015.db2.gz BAFQBWIBUTXEMO-QGZVFWFLSA-N 1 0 311.425 4.079 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](c1ccccn1)C1CC1 ZINC001332455127 1054119352 /nfs/dbraw/zinc/11/93/52/1054119352.db2.gz GUUZCAOBMNQOAU-PSGMQZRDSA-N 1 0 308.425 4.385 20 10 DICDRO C[C@]1(CC[NH2+]Cc2ccc(N3CCCC3)cc2)C[C@]1(F)Cl ZINC001332612111 1054123377 /nfs/dbraw/zinc/12/33/77/1054123377.db2.gz XBHPKEOQYIUJLG-DLBZAZTESA-N 1 0 310.844 4.081 20 10 DICDRO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2O)cc1 ZINC001232838937 1054128165 /nfs/dbraw/zinc/12/81/65/1054128165.db2.gz KOHFUJXQRMHUHT-LJQANCHMSA-N 1 0 310.441 4.104 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001332947076 1054133031 /nfs/dbraw/zinc/13/30/31/1054133031.db2.gz RQMGDGAOEXHUDL-GDBMZVCRSA-N 1 0 311.425 4.356 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000848560073 1054149889 /nfs/dbraw/zinc/14/98/89/1054149889.db2.gz JTEUFQGXJHRWSF-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@H](Cc1ccccn1)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000848565345 1054150953 /nfs/dbraw/zinc/15/09/53/1054150953.db2.gz NOXFPGLZDNBCHX-CABCVRRESA-N 1 0 306.409 4.222 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)Cc1ccccn1)c1cc(Cl)ccc1O ZINC000848564049 1054151148 /nfs/dbraw/zinc/15/11/48/1054151148.db2.gz AMLAVLMWJZPGAB-LRDDRELGSA-N 1 0 304.821 4.113 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)Cc2ccccn2)c1O ZINC000848565976 1054153058 /nfs/dbraw/zinc/15/30/58/1054153058.db2.gz VTEZZHCCGBKTNS-STQMWFEESA-N 1 0 304.821 4.031 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc2ncoc2c1 ZINC001232941309 1054153208 /nfs/dbraw/zinc/15/32/08/1054153208.db2.gz LYVDLEURKBPJDP-UHFFFAOYSA-N 1 0 321.424 4.060 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC3(CCCC3)O2)c(O)c1 ZINC000848571103 1054155973 /nfs/dbraw/zinc/15/59/73/1054155973.db2.gz PNXJYSAJOMNXFY-HOTGVXAUSA-N 1 0 303.446 4.151 20 10 DICDRO CC[NH+](CC)Cc1c(O)ccc2cc(Br)ccc21 ZINC001233193703 1054198274 /nfs/dbraw/zinc/19/82/74/1054198274.db2.gz DANVKSFEFQIJSX-UHFFFAOYSA-N 1 0 308.219 4.150 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC001335523240 1054219020 /nfs/dbraw/zinc/21/90/20/1054219020.db2.gz UGXPBVAVJAVFCS-NTZNESFSSA-N 1 0 302.443 4.365 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)c1 ZINC001233283924 1054222910 /nfs/dbraw/zinc/22/29/10/1054222910.db2.gz AYEZOLMEXQSVMI-SJORKVTESA-N 1 0 315.457 4.023 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@H]32)c1 ZINC001233283921 1054223444 /nfs/dbraw/zinc/22/34/44/1054223444.db2.gz AYEZOLMEXQSVMI-DLBZAZTESA-N 1 0 315.457 4.023 20 10 DICDRO CC(C)[N@H+](CCCCCO)Cc1cc(C(C)(C)C)ccc1O ZINC001233287059 1054224727 /nfs/dbraw/zinc/22/47/27/1054224727.db2.gz VDEGIJXIFIISOX-UHFFFAOYSA-N 1 0 307.478 4.063 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC(c3cccnc3)CC2)c1 ZINC001233286937 1054226458 /nfs/dbraw/zinc/22/64/58/1054226458.db2.gz PICVIJZXSXTXTC-UHFFFAOYSA-N 1 0 324.468 4.464 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)c1 ZINC000184884175 1054249866 /nfs/dbraw/zinc/24/98/66/1054249866.db2.gz XABXJVGCVBABSQ-AWEZNQCLSA-N 1 0 311.425 4.130 20 10 DICDRO C[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CCC1(F)F ZINC001233452026 1054275706 /nfs/dbraw/zinc/27/57/06/1054275706.db2.gz IAIRQEMUZRUQJF-JTQLQIEISA-N 1 0 323.305 4.278 20 10 DICDRO C[C@]1(F)CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001233452097 1054275787 /nfs/dbraw/zinc/27/57/87/1054275787.db2.gz KRCSRKULXIRQJU-AWEZNQCLSA-N 1 0 305.315 4.125 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1CCc2ccccc2CC1 ZINC001233454289 1054276288 /nfs/dbraw/zinc/27/62/88/1054276288.db2.gz OQRMBLGIVJTQOD-UHFFFAOYSA-N 1 0 321.342 4.012 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC001233452428 1054277039 /nfs/dbraw/zinc/27/70/39/1054277039.db2.gz WFJFBFQSLPCLSB-AWEZNQCLSA-N 1 0 321.342 4.401 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCO[C@@H](C(C)C)C1 ZINC001337785564 1054285496 /nfs/dbraw/zinc/28/54/96/1054285496.db2.gz OEWZYBGYZIODTN-WBTNSWJXSA-N 1 0 303.446 4.042 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCO[C@H](C(C)C)C1 ZINC001337785558 1054285958 /nfs/dbraw/zinc/28/59/58/1054285958.db2.gz OEWZYBGYZIODTN-AESZEHBQSA-N 1 0 303.446 4.042 20 10 DICDRO COc1cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)ccc1C ZINC001337786059 1054286340 /nfs/dbraw/zinc/28/63/40/1054286340.db2.gz UVAAHAARNJYYBN-ZBFHGGJFSA-N 1 0 311.425 4.356 20 10 DICDRO COC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C)c1ccccc1 ZINC001337801571 1054287256 /nfs/dbraw/zinc/28/72/56/1054287256.db2.gz UQZSMXKFGOENCT-PVAVHDDUSA-N 1 0 311.425 4.226 20 10 DICDRO COc1cccc(F)c1C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC001337821436 1054288415 /nfs/dbraw/zinc/28/84/15/1054288415.db2.gz NKUQCQYCDKCKTA-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](COC)c2ccc(Cl)cc2)c1O ZINC000848906966 1054293283 /nfs/dbraw/zinc/29/32/83/1054293283.db2.gz GBOAKNLVZFRHMR-KRWDZBQOSA-N 1 0 319.832 4.085 20 10 DICDRO CCc1cccc(C[NH2+][C@H](COC)c2ccc(Cl)cc2)c1O ZINC000848906969 1054293891 /nfs/dbraw/zinc/29/38/91/1054293891.db2.gz GBOAKNLVZFRHMR-QGZVFWFLSA-N 1 0 319.832 4.085 20 10 DICDRO CCC[N@H+](Cc1cccc(OC(F)(F)F)c1O)[C@H](C)CC ZINC001233726347 1054343706 /nfs/dbraw/zinc/34/37/06/1054343706.db2.gz CGOLPESUZWXHMX-LLVKDONJSA-N 1 0 305.340 4.301 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2c3ccccc3CCC[C@H]2C)c1O ZINC000185084757 1054352877 /nfs/dbraw/zinc/35/28/77/1054352877.db2.gz YZGAITMOWBCPNH-KUHUBIRLSA-N 1 0 311.425 4.204 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(Br)o2)c(O)c1 ZINC001340595889 1054364491 /nfs/dbraw/zinc/36/44/91/1054364491.db2.gz VTGPNSBBUSAVPQ-NSHDSACASA-N 1 0 324.218 4.215 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001342409743 1054420763 /nfs/dbraw/zinc/42/07/63/1054420763.db2.gz WVXDPPAGNSNDFT-XUJVJEKNSA-N 1 0 314.429 4.247 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@@H]3C[C@@H](C)c4c3c(O)ccc4C)nc2c1 ZINC001342405748 1054421083 /nfs/dbraw/zinc/42/10/83/1054421083.db2.gz GEOOVLBTOBGXKS-CZUORRHYSA-N 1 0 321.424 4.223 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCc2c1cccc2O ZINC001342391532 1054421123 /nfs/dbraw/zinc/42/11/23/1054421123.db2.gz ZWRMCWLVVRMEHC-WQVCFCJDSA-N 1 0 309.409 4.232 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C1(C2CC2)CCOCC1 ZINC001342709328 1054429670 /nfs/dbraw/zinc/42/96/70/1054429670.db2.gz KAJYBCIWHUIQJP-UHFFFAOYSA-N 1 0 323.436 4.108 20 10 DICDRO CCN(CC)[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccco1 ZINC000185227862 1054481463 /nfs/dbraw/zinc/48/14/63/1054481463.db2.gz UNJBHHKFIQPOIQ-NVXWUHKLSA-N 1 0 316.445 4.027 20 10 DICDRO C[C@@H]([NH2+]CCc1ccccc1O)c1ccc2ccccc2c1O ZINC000185303070 1054511967 /nfs/dbraw/zinc/51/19/67/1054511967.db2.gz FCERNIDLZRPQAQ-CQSZACIVSA-N 1 0 307.393 4.144 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(C(F)F)cc2)cc1 ZINC000763808889 1054523018 /nfs/dbraw/zinc/52/30/18/1054523018.db2.gz GZFWXHYGYCZCDA-UHFFFAOYSA-N 1 0 304.384 4.322 20 10 DICDRO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000185323853 1054524109 /nfs/dbraw/zinc/52/41/09/1054524109.db2.gz ZKZPBADMWKDZJA-STQMWFEESA-N 1 0 316.470 4.448 20 10 DICDRO COc1ccc2ccc(O)c(C[N@H+](C)CCc3ccccc3)c2c1 ZINC001234518118 1054541092 /nfs/dbraw/zinc/54/10/92/1054541092.db2.gz DNIUSKKHEOLZNS-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO COc1ccc2ccc(O)c(C[N@H+](C)CC3CC(F)(F)C3)c2c1 ZINC001234561815 1054547285 /nfs/dbraw/zinc/54/72/85/1054547285.db2.gz BSICOKADELNENJ-UHFFFAOYSA-N 1 0 321.367 4.031 20 10 DICDRO FC1(F)[C@@H]2CC[C@@H]([NH2+]Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001346843220 1054551195 /nfs/dbraw/zinc/55/11/95/1054551195.db2.gz VRNGHPBWONGIDD-NXHRZFHOSA-N 1 0 320.427 4.200 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F)c1cc2c(cc1O)CCCC2 ZINC001346860723 1054552077 /nfs/dbraw/zinc/55/20/77/1054552077.db2.gz PPHXPXNSDSGWSB-WGHIXYSZSA-N 1 0 321.411 4.355 20 10 DICDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185564548 1054583027 /nfs/dbraw/zinc/58/30/27/1054583027.db2.gz SYJLOWRNFFTIKR-KGLIPLIRSA-N 1 0 301.430 4.400 20 10 DICDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185564566 1054583256 /nfs/dbraw/zinc/58/32/56/1054583256.db2.gz SYJLOWRNFFTIKR-UONOGXRCSA-N 1 0 301.430 4.400 20 10 DICDRO C[N@H+](CCc1ccccn1)Cc1cccc(-c2ccccc2)c1O ZINC001234993206 1054637345 /nfs/dbraw/zinc/63/73/45/1054637345.db2.gz XBOPNVNHWBOLAM-UHFFFAOYSA-N 1 0 318.420 4.129 20 10 DICDRO C[N@@H+](Cc1cccc(-c2ccccc2)c1O)C[C@H]1CCCCO1 ZINC001234993919 1054637420 /nfs/dbraw/zinc/63/74/20/1054637420.db2.gz CQAJUQVDDRQKPP-GOSISDBHSA-N 1 0 311.425 4.060 20 10 DICDRO Oc1c(C[NH+]2CCC3(CCOC3)CC2)cccc1-c1ccccc1 ZINC001234991281 1054638766 /nfs/dbraw/zinc/63/87/66/1054638766.db2.gz LUCNTEUPRWFKMG-UHFFFAOYSA-N 1 0 323.436 4.062 20 10 DICDRO CO[C@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)[C@H](C)C1 ZINC001235000867 1054640797 /nfs/dbraw/zinc/64/07/97/1054640797.db2.gz QVMRIDZKQQUCEO-QAPCUYQASA-N 1 0 311.425 4.059 20 10 DICDRO Cc1ncccc1C[N@@H+](C)Cc1cccc(-c2ccccc2)c1O ZINC001234998051 1054641833 /nfs/dbraw/zinc/64/18/33/1054641833.db2.gz HKLJHDZMFRYUIQ-UHFFFAOYSA-N 1 0 318.420 4.395 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1c[nH]c(-c3ccccc3F)c1)CC2 ZINC001235042044 1054647363 /nfs/dbraw/zinc/64/73/63/1054647363.db2.gz HHYLBSPPXQMQOC-UHFFFAOYSA-N 1 0 322.383 4.085 20 10 DICDRO COCC1CCC([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001348493451 1054651473 /nfs/dbraw/zinc/65/14/73/1054651473.db2.gz PUDWIGLYBOPNHR-LMPOIIKSSA-N 1 0 303.446 4.044 20 10 DICDRO CCC(CC)[N@H+](CC)Cc1cc(Br)cc(F)c1[O-] ZINC001235067925 1054651914 /nfs/dbraw/zinc/65/19/14/1054651914.db2.gz ANUCOAQBOLCULO-UHFFFAOYSA-N 1 0 318.230 4.304 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)c1cc(Br)ccc1O ZINC001349314797 1054735892 /nfs/dbraw/zinc/73/58/92/1054735892.db2.gz ZQRUDIDJSSPAAV-ZMLRMANQSA-N 1 0 316.214 4.086 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2cccc(C(F)F)c2)c1O ZINC001349571684 1054767677 /nfs/dbraw/zinc/76/76/77/1054767677.db2.gz ASTVSDACENBYGR-NSHDSACASA-N 1 0 307.340 4.189 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001235683540 1054775361 /nfs/dbraw/zinc/77/53/61/1054775361.db2.gz GYCANGQDLCAYFV-CYBMUJFWSA-N 1 0 301.352 4.074 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c(O)c1 ZINC001235685554 1054779468 /nfs/dbraw/zinc/77/94/68/1054779468.db2.gz QBJZRSNGUWFWNS-INIZCTEOSA-N 1 0 324.468 4.464 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F)c1ccc(N(C)C)cc1 ZINC001350154223 1054881809 /nfs/dbraw/zinc/88/18/09/1054881809.db2.gz IBSPQAQJFCUXGB-XBVQOTNRSA-N 1 0 308.416 4.227 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCC[C@H](C)[C@H]3C)CC2)cc1 ZINC000764434106 1055186246 /nfs/dbraw/zinc/18/62/46/1055186246.db2.gz SRDSWNDHOSYRRC-RZQQEMMASA-N 1 0 316.489 4.078 20 10 DICDRO CCC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000764437679 1055187500 /nfs/dbraw/zinc/18/75/00/1055187500.db2.gz UUQHIVWIXQZVQW-KBPBESRZSA-N 1 0 310.869 4.016 20 10 DICDRO Cc1cc(Cl)nc(Cl)c1CN(C)Cc1ccccc1O ZINC001236612434 1055203724 /nfs/dbraw/zinc/20/37/24/1055203724.db2.gz PUWYJULMVLMYTC-UHFFFAOYSA-N 1 0 311.212 4.034 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)N(C)C)c1ccc(N2CCCCCC2)cc1 ZINC000764534228 1055205817 /nfs/dbraw/zinc/20/58/17/1055205817.db2.gz WVXCQVXFHGNRJH-QGZVFWFLSA-N 1 0 317.521 4.058 20 10 DICDRO CC(C)c1ccc(CN([C@@H]2CC[NH2+]C2)C2CCCCC2)c(O)c1 ZINC001236663004 1055218672 /nfs/dbraw/zinc/21/86/72/1055218672.db2.gz MRYGSGWPCNGTDG-LJQANCHMSA-N 1 0 316.489 4.012 20 10 DICDRO Cc1cc(Br)c([O-])c(C[N@H+](C)CC2CCCC2)c1 ZINC001236668457 1055220800 /nfs/dbraw/zinc/22/08/00/1055220800.db2.gz DVLGJQWIRPPTTD-UHFFFAOYSA-N 1 0 312.251 4.085 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[NH+]1CC2(C1)CCCC2 ZINC001236780287 1055254421 /nfs/dbraw/zinc/25/44/21/1055254421.db2.gz ZZMGCTISQFCUTQ-UHFFFAOYSA-N 1 0 323.436 4.347 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[N@@H+]1CCC12CCCC2 ZINC001236778856 1055255062 /nfs/dbraw/zinc/25/50/62/1055255062.db2.gz MTPLEHUWNRCTFD-UHFFFAOYSA-N 1 0 323.436 4.490 20 10 DICDRO C[C@@H]1CCC[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001236789054 1055259757 /nfs/dbraw/zinc/25/97/57/1055259757.db2.gz MIVYBWSRBXYXSX-MRXNPFEDSA-N 1 0 311.425 4.203 20 10 DICDRO CCc1ccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c(O)c1 ZINC001236795135 1055261268 /nfs/dbraw/zinc/26/12/68/1055261268.db2.gz RAXQJJDTHIALJQ-SFHVURJKSA-N 1 0 313.466 4.245 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccccc2)c(Cl)c1 ZINC001236797711 1055262038 /nfs/dbraw/zinc/26/20/38/1055262038.db2.gz AGZJQTOQNQMKGG-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1cc(O)c(C[NH+]2CCC3(CCCC3)CC2)c(Cl)c1 ZINC001236796750 1055262473 /nfs/dbraw/zinc/26/24/73/1055262473.db2.gz YTGMNYRRVLORED-UHFFFAOYSA-N 1 0 309.837 4.210 20 10 DICDRO CCc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c(O)c1 ZINC001236795132 1055262498 /nfs/dbraw/zinc/26/24/98/1055262498.db2.gz RAXQJJDTHIALJQ-GOSISDBHSA-N 1 0 313.466 4.245 20 10 DICDRO CC[C@@H]1CCCC[C@@H]1[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000764810589 1055265403 /nfs/dbraw/zinc/26/54/03/1055265403.db2.gz NSWFMYBXJGATIO-UZLBHIALSA-N 1 0 316.489 4.222 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccc2)c(Cl)c1 ZINC001236797713 1055266701 /nfs/dbraw/zinc/26/67/01/1055266701.db2.gz AGZJQTOQNQMKGG-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2O)CCC1(F)F ZINC001236826751 1055278433 /nfs/dbraw/zinc/27/84/33/1055278433.db2.gz MFPDVRSZBVIVHG-CYBMUJFWSA-N 1 0 305.368 4.413 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CC[C@@H](F)C(F)(F)CC1 ZINC001236825704 1055278480 /nfs/dbraw/zinc/27/84/80/1055278480.db2.gz CPVJHRRRMYXLMI-MRXNPFEDSA-N 1 0 309.331 4.115 20 10 DICDRO Cc1ccc2c(c1)C[N@@H+](Cc1cc3ccccc3cc1O)CC2 ZINC001236825683 1055279512 /nfs/dbraw/zinc/27/95/12/1055279512.db2.gz CADSGBDKWIMXJR-UHFFFAOYSA-N 1 0 303.405 4.412 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2cc3ccccc3cc2O)cc1 ZINC001236828727 1055281070 /nfs/dbraw/zinc/28/10/70/1055281070.db2.gz FGPMIYCPVIFSEH-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC001236838809 1055287070 /nfs/dbraw/zinc/28/70/70/1055287070.db2.gz CWUJHQGWUSTALQ-IBGZPJMESA-N 1 0 304.393 4.278 20 10 DICDRO CCC[N@H+](Cc1ccc(N2CCOCC2)cc1Cl)[C@H](C)CC ZINC001236928467 1055316109 /nfs/dbraw/zinc/31/61/09/1055316109.db2.gz LUQSFSXJCLVRQL-OAHLLOKOSA-N 1 0 324.896 4.187 20 10 DICDRO CCOc1ccc(C[N@H+](C)C23CC4CC(CC(C4)C2)C3)c(O)c1 ZINC001237041931 1055347906 /nfs/dbraw/zinc/34/79/06/1055347906.db2.gz QQDKNTOBESVYPW-UHFFFAOYSA-N 1 0 315.457 4.192 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)CCc2ccc(F)cc2)c(O)c1 ZINC001237048852 1055350280 /nfs/dbraw/zinc/35/02/80/1055350280.db2.gz JHCPHIYXYMMYSO-UHFFFAOYSA-N 1 0 301.405 4.329 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c(O)c1 ZINC001237046119 1055350592 /nfs/dbraw/zinc/35/05/92/1055350592.db2.gz PTBFCARYHUYASY-OAHLLOKOSA-N 1 0 301.352 4.085 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2C)c(O)c1 ZINC001237048859 1055351094 /nfs/dbraw/zinc/35/10/94/1055351094.db2.gz XZTMVHNSCFKFMW-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c(O)c1 ZINC001237054245 1055352997 /nfs/dbraw/zinc/35/29/97/1055352997.db2.gz UBGBPMBPKJARHG-LJQANCHMSA-N 1 0 311.425 4.169 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c(O)c1 ZINC001237053600 1055355611 /nfs/dbraw/zinc/35/56/11/1055355611.db2.gz OLUDATZYNFQWNP-AWEZNQCLSA-N 1 0 301.352 4.290 20 10 DICDRO COC[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765328329 1055362045 /nfs/dbraw/zinc/36/20/45/1055362045.db2.gz DXVFPRQFDOSLAE-IAGOWNOFSA-N 1 0 304.478 4.000 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)cc1 ZINC000765330986 1055362218 /nfs/dbraw/zinc/36/22/18/1055362218.db2.gz LWKMQRQKWSWGIY-INIZCTEOSA-N 1 0 312.457 4.392 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CCCC2(CC(F)C2)CC1 ZINC001237130346 1055378626 /nfs/dbraw/zinc/37/86/26/1055378626.db2.gz MNKLZALTCCEBHB-UHFFFAOYSA-N 1 0 315.791 4.289 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC001237137246 1055379098 /nfs/dbraw/zinc/37/90/98/1055379098.db2.gz NPFUFKCXVPVLHL-HNNXBMFYSA-N 1 0 322.330 4.143 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001237140686 1055382307 /nfs/dbraw/zinc/38/23/07/1055382307.db2.gz NMPHCUMAYXYACI-HNNXBMFYSA-N 1 0 307.315 4.358 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccnc3c(Cl)cccc13)CC2 ZINC001237148536 1055383581 /nfs/dbraw/zinc/38/35/81/1055383581.db2.gz AWOZGNNSBCIDCZ-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C(C)(C)c2ccccc2)c1O ZINC000385710186 1055385743 /nfs/dbraw/zinc/38/57/43/1055385743.db2.gz IVCOZLDIWOMSEB-UHFFFAOYSA-N 1 0 305.805 4.079 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1cncc(F)c1 ZINC000765449457 1055390937 /nfs/dbraw/zinc/39/09/37/1055390937.db2.gz KVXMJCPFTGFWRY-HNNXBMFYSA-N 1 0 313.420 4.062 20 10 DICDRO CCCCN(CCCC)c1ccc(C[N@H+](C)CCF)c(O)c1 ZINC001237212203 1055403830 /nfs/dbraw/zinc/40/38/30/1055403830.db2.gz JWDJOTQYXRWXLO-UHFFFAOYSA-N 1 0 310.457 4.200 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCOC2CCCC2)cc1 ZINC000765499083 1055407506 /nfs/dbraw/zinc/40/75/06/1055407506.db2.gz GCZGEWFPLATWJA-MRXNPFEDSA-N 1 0 304.478 4.143 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCOC2CCCC2)cc1 ZINC000765499081 1055408708 /nfs/dbraw/zinc/40/87/08/1055408708.db2.gz GCZGEWFPLATWJA-INIZCTEOSA-N 1 0 304.478 4.143 20 10 DICDRO Cc1ccccc1O[C@H]1CCC[N@H+](Cc2c(C)cccc2O)C1 ZINC001237488912 1055458501 /nfs/dbraw/zinc/45/85/01/1055458501.db2.gz AOOGXUZIQVLEJA-KRWDZBQOSA-N 1 0 311.425 4.052 20 10 DICDRO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2c(C)cccc2O)cc1 ZINC001237488167 1055459883 /nfs/dbraw/zinc/45/98/83/1055459883.db2.gz SBLSHRIGNNLDEV-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001237494854 1055460845 /nfs/dbraw/zinc/46/08/45/1055460845.db2.gz MEAREXLVBDHSPR-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001237492431 1055460888 /nfs/dbraw/zinc/46/08/88/1055460888.db2.gz PQLWHYPRYZZBFA-INIZCTEOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cccc(O)c1C[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC001237490204 1055462212 /nfs/dbraw/zinc/46/22/12/1055462212.db2.gz RUAXDFDBMHHUOU-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CC[N@H+](Cc1cccc(-c2ccccc2)n1)Cc1ccccc1O ZINC001237551787 1055475493 /nfs/dbraw/zinc/47/54/93/1055475493.db2.gz JOXUENXCVZBQCI-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(Cl)cc(F)c1[O-] ZINC001237622273 1055485114 /nfs/dbraw/zinc/48/51/14/1055485114.db2.gz PNAFJSMMLOVKCZ-NSHDSACASA-N 1 0 323.795 4.386 20 10 DICDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(Cl)cc(F)c1[O-] ZINC001237622271 1055485300 /nfs/dbraw/zinc/48/53/00/1055485300.db2.gz PNAFJSMMLOVKCZ-LLVKDONJSA-N 1 0 323.795 4.386 20 10 DICDRO CCC[N@H+](CCOC)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237641114 1055490167 /nfs/dbraw/zinc/49/01/67/1055490167.db2.gz MAUNENGLKLNFQF-UHFFFAOYSA-N 1 0 317.404 4.057 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCC[C@@H](F)C1 ZINC001237642471 1055491928 /nfs/dbraw/zinc/49/19/28/1055491928.db2.gz CAEKFIVBJYBBHP-QGZVFWFLSA-N 1 0 303.352 4.132 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1cccc(F)c1F ZINC001620867621 1055494459 /nfs/dbraw/zinc/49/44/59/1055494459.db2.gz UCGONEWXUVNPOH-GFCCVEGCSA-N 1 0 303.352 4.141 20 10 DICDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)cc(C)c2O)cn1 ZINC001237687168 1055501913 /nfs/dbraw/zinc/50/19/13/1055501913.db2.gz SQZUGVGKKQAJNI-QGZVFWFLSA-N 1 0 316.832 4.395 20 10 DICDRO COc1ccc(C[C@H](C)C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC001620886467 1055510527 /nfs/dbraw/zinc/51/05/27/1055510527.db2.gz KNWZTTRJODAHRQ-ZDUSSCGKSA-N 1 0 319.832 4.023 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2nc3ccccc3s2)cc1C ZINC000765623884 1055522242 /nfs/dbraw/zinc/52/22/42/1055522242.db2.gz POEHWWBODZQTRK-ZDUSSCGKSA-N 1 0 312.438 4.464 20 10 DICDRO CC[C@H](C)N(C)CC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765655160 1055533453 /nfs/dbraw/zinc/53/34/53/1055533453.db2.gz LAFIABKHYJWNOB-ZWKOTPCHSA-N 1 0 317.521 4.058 20 10 DICDRO [NH3+]CC[C@H]1CN(c2cccc(-c3cccnc3)c2)c2ccccc21 ZINC001168550040 1055534836 /nfs/dbraw/zinc/53/48/36/1055534836.db2.gz RVBZMXMKZJADMI-SFHVURJKSA-N 1 0 315.420 4.333 20 10 DICDRO Cc1c2ccccc2n(C)c1CNc1cc2c(c[nH+]1)CCCC2 ZINC001620950774 1055567388 /nfs/dbraw/zinc/56/73/88/1055567388.db2.gz MPFHHPHFSHHCFN-UHFFFAOYSA-N 1 0 305.425 4.373 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1O ZINC001238058321 1055596399 /nfs/dbraw/zinc/59/63/99/1055596399.db2.gz QMBDIEQPQZCSKE-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cc(F)cc(C[N@H+](C)Cc2cccc3cccnc32)c1O ZINC001238062341 1055596586 /nfs/dbraw/zinc/59/65/86/1055596586.db2.gz OUHYYAMKJGHSDI-UHFFFAOYSA-N 1 0 310.372 4.020 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c1O ZINC001238060415 1055598374 /nfs/dbraw/zinc/59/83/74/1055598374.db2.gz APSUHIYRUHEDQM-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cnc(-c2ccccc2)c(C[N@H+](C)Cc2ccccc2O)c1 ZINC001238621218 1055700487 /nfs/dbraw/zinc/70/04/87/1055700487.db2.gz MCSKBYRWWYUJHZ-UHFFFAOYSA-N 1 0 318.420 4.395 20 10 DICDRO Cc1ccc(F)c(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)c1 ZINC001620974419 1055813271 /nfs/dbraw/zinc/81/32/71/1055813271.db2.gz MJWKQKOVIPMMMK-INIZCTEOSA-N 1 0 314.448 4.229 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3c2cccc3Cl)cc1F ZINC001649071211 1055883497 /nfs/dbraw/zinc/88/34/97/1055883497.db2.gz ZNKQWRULEMUOGW-QGZVFWFLSA-N 1 0 318.823 4.322 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccc(F)cc3Cl)ccc21 ZINC001620752084 1055925850 /nfs/dbraw/zinc/92/58/50/1055925850.db2.gz UOMAOOPYFGQNFD-UHFFFAOYSA-N 1 0 318.823 4.151 20 10 DICDRO C[C@@H]([NH2+]CCc1csc(C(C)(C)C)n1)c1cc(F)ccc1O ZINC000186202206 1055935919 /nfs/dbraw/zinc/93/59/19/1055935919.db2.gz MZJJHUNHGAFBHL-LLVKDONJSA-N 1 0 322.449 4.179 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(F)cc1Cl ZINC001620787756 1055962884 /nfs/dbraw/zinc/96/28/84/1055962884.db2.gz JTILRZHGQITZCW-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC1(c2ccccc2F)CCC1 ZINC001620994287 1055963574 /nfs/dbraw/zinc/96/35/74/1055963574.db2.gz IGVLTXGNEVEODP-UHFFFAOYSA-N 1 0 319.807 4.396 20 10 DICDRO C[C@H]1CC(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C[C@H](C)C1 ZINC001620999417 1055969924 /nfs/dbraw/zinc/96/99/24/1055969924.db2.gz QAOZRDRQMUVVCX-SDKBWNRFSA-N 1 0 300.490 4.428 20 10 DICDRO C[C@@H]1CCCC[C@H]1CC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001620796533 1055975207 /nfs/dbraw/zinc/97/52/07/1055975207.db2.gz MZMWXNHXOJKJDX-KGLIPLIRSA-N 1 0 310.432 4.337 20 10 DICDRO Cc1cc(C[NH2+]C[C@@H]2CCSC2)c(C)n1-c1cccc(C)c1 ZINC001621030050 1055992229 /nfs/dbraw/zinc/99/22/29/1055992229.db2.gz SIVMKMDNXIERPN-KRWDZBQOSA-N 1 0 314.498 4.245 20 10 DICDRO CSc1cccc(F)c1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC001621327118 1056034205 /nfs/dbraw/zinc/03/42/05/1056034205.db2.gz INGOZWJWTOSURU-UHFFFAOYSA-N 1 0 318.461 4.212 20 10 DICDRO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)CCC2 ZINC000765817525 1056177554 /nfs/dbraw/zinc/17/75/54/1056177554.db2.gz LWJKUBQABYKNFI-MLGOLLRUSA-N 1 0 317.408 4.037 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)c1 ZINC000765818593 1056182525 /nfs/dbraw/zinc/18/25/25/1056182525.db2.gz FUYYNRONXGCYQR-RHSMWYFYSA-N 1 0 313.445 4.206 20 10 DICDRO C[C@H](C[NH2+]Cc1cc(F)c(N(C)C)cc1F)Cc1cccs1 ZINC001620821393 1056224688 /nfs/dbraw/zinc/22/46/88/1056224688.db2.gz VRHZRXOTCCQCMM-LBPRGKRZSA-N 1 0 324.440 4.061 20 10 DICDRO C[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)Cc1cccs1 ZINC001620821406 1056224839 /nfs/dbraw/zinc/22/48/39/1056224839.db2.gz VUYQIOYZSGBXQS-MQDFFIGUSA-N 1 0 314.498 4.296 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1scnc1C1CC1 ZINC000475205947 1056406283 /nfs/dbraw/zinc/40/62/83/1056406283.db2.gz WKDCFBNSQFUGPK-UHFFFAOYSA-N 1 0 311.454 4.110 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@H]1CC[C@@H](C2CC2)O1)C1CCCC1 ZINC001615466349 1056513054 /nfs/dbraw/zinc/51/30/54/1056513054.db2.gz XNCGVSHEYWNKHV-QUCCMNQESA-N 1 0 315.457 4.094 20 10 DICDRO CCC[C@@](C)(O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765941264 1056532172 /nfs/dbraw/zinc/53/21/72/1056532172.db2.gz GHOWDWMDOGTXKW-DNVCBOLYSA-N 1 0 322.468 4.018 20 10 DICDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765943214 1056538015 /nfs/dbraw/zinc/53/80/15/1056538015.db2.gz AEUNFCRJLMOSNL-ABSDTBQOSA-N 1 0 318.505 4.125 20 10 DICDRO Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001615622031 1056545944 /nfs/dbraw/zinc/54/59/44/1056545944.db2.gz OFEUFOKRHTZXIY-IEBWSBKVSA-N 1 0 308.469 4.439 20 10 DICDRO Cn1ccc2ccc(-c3cnccc3C[NH+]3CCCCC3)cc21 ZINC001240576831 1056586256 /nfs/dbraw/zinc/58/62/56/1056586256.db2.gz MQYHLSSGWZYGFI-UHFFFAOYSA-N 1 0 305.425 4.226 20 10 DICDRO C[C@@H]([NH2+]CC1(O)CCCC1)c1ccc(N2CCCCCC2)cc1 ZINC000765952659 1056590901 /nfs/dbraw/zinc/59/09/01/1056590901.db2.gz UWBIKBRCEVLBRL-QGZVFWFLSA-N 1 0 316.489 4.023 20 10 DICDRO CCOc1ccc(N(CC)C[C@H]2CCCC[N@@H+]2C(C)C)cc1 ZINC001616180965 1056616315 /nfs/dbraw/zinc/61/63/15/1056616315.db2.gz STANWOGLFYXSDX-GOSISDBHSA-N 1 0 304.478 4.175 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc3c(c2)CCC3)ccc1N(C)C ZINC001616801403 1056720558 /nfs/dbraw/zinc/72/05/58/1056720558.db2.gz MZVUSGAFSQRJHH-MRXNPFEDSA-N 1 0 308.469 4.401 20 10 DICDRO CCCOc1cc(C)ccc1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC001620833199 1056738176 /nfs/dbraw/zinc/73/81/76/1056738176.db2.gz ILBIZBFJZZVNHY-UHFFFAOYSA-N 1 0 313.441 4.391 20 10 DICDRO Cc1cc(C)c2c(c1)C[N@H+](Cc1ccc(N(C)C)c(C)c1)CC2 ZINC001617311725 1056812057 /nfs/dbraw/zinc/81/20/57/1056812057.db2.gz XGHSELQGUJDRDX-UHFFFAOYSA-N 1 0 308.469 4.236 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCC[C@@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000765971229 1056816578 /nfs/dbraw/zinc/81/65/78/1056816578.db2.gz TYDKFVLYLRAFEP-VDGAXYAQSA-N 1 0 316.489 4.021 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)[C@H](CC)C(=O)OC(C)(C)C ZINC001617538929 1056846544 /nfs/dbraw/zinc/84/65/44/1056846544.db2.gz PTPHFYCQKCVTRT-MRXNPFEDSA-N 1 0 321.461 4.115 20 10 DICDRO C[C@H]([NH2+][C@@H]1Cc2cccc(Cl)c2C1)c1ccc(N(C)C)cc1 ZINC001168703638 1056882892 /nfs/dbraw/zinc/88/28/92/1056882892.db2.gz ICSXJLHGJWPGLL-XJKSGUPXSA-N 1 0 314.860 4.224 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000479433701 1056982461 /nfs/dbraw/zinc/98/24/61/1056982461.db2.gz AVWQKNFACRBNLQ-GOSISDBHSA-N 1 0 308.400 4.403 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCC[C@@H](C2CCOCC2)C1)c1ccccc1O ZINC000922330517 1057010557 /nfs/dbraw/zinc/01/05/57/1057010557.db2.gz YLBSKYABIULNGF-OIISXLGYSA-N 1 0 303.446 4.028 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](C)c2ccc(F)cc2C)c1 ZINC000922665247 1057046935 /nfs/dbraw/zinc/04/69/35/1057046935.db2.gz KABCBFLRGSXZEV-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2C)c(O)c1 ZINC000922671197 1057046993 /nfs/dbraw/zinc/04/69/93/1057046993.db2.gz OINZRNJYWFHTKC-ZDUSSCGKSA-N 1 0 303.377 4.089 20 10 DICDRO CC(C)[N@H+](Cc1cnc(Cl)s1)Cc1ccc(N(C)C)cc1 ZINC000766024053 1057123705 /nfs/dbraw/zinc/12/37/05/1057123705.db2.gz YYSQXUUDKXYWEI-UHFFFAOYSA-N 1 0 323.893 4.273 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccc2c(c1)CCO2 ZINC000766028761 1057127936 /nfs/dbraw/zinc/12/79/36/1057127936.db2.gz DZHQWPNAMJRTRN-FQEVSTJZSA-N 1 0 324.468 4.237 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccc2ccccc2n1 ZINC000766030762 1057131483 /nfs/dbraw/zinc/13/14/83/1057131483.db2.gz XDNNMDHYZPIZOE-MRXNPFEDSA-N 1 0 319.452 4.460 20 10 DICDRO Cn1ccc2c1cccc2-c1cncc(C[NH+]2CCCCC2)c1 ZINC001241823206 1057175923 /nfs/dbraw/zinc/17/59/23/1057175923.db2.gz XXFWRKFXWNKGFX-UHFFFAOYSA-N 1 0 305.425 4.226 20 10 DICDRO c1csc(SCCC[NH2+][C@H](Cc2ccccc2)C2CC2)n1 ZINC000766072655 1057285623 /nfs/dbraw/zinc/28/56/23/1057285623.db2.gz KHTGZJHXBSVHBW-MRXNPFEDSA-N 1 0 318.511 4.236 20 10 DICDRO c1csc(SCCC[NH2+][C@H]2CCCc3ccccc32)n1 ZINC000766074196 1057286083 /nfs/dbraw/zinc/28/60/83/1057286083.db2.gz UFZHQFNDNTXICQ-HNNXBMFYSA-N 1 0 304.484 4.293 20 10 DICDRO CSC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766082155 1057299461 /nfs/dbraw/zinc/29/94/61/1057299461.db2.gz BXNQYHLWZONDMR-CVEARBPZSA-N 1 0 306.519 4.469 20 10 DICDRO CSCC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766083887 1057302163 /nfs/dbraw/zinc/30/21/63/1057302163.db2.gz QMXFFFAZHLGYTE-JKSUJKDBSA-N 1 0 306.519 4.469 20 10 DICDRO CC(C)CCCC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000766121500 1057358473 /nfs/dbraw/zinc/35/84/73/1057358473.db2.gz PBOWWHRCKLVUJR-QGZVFWFLSA-N 1 0 304.478 4.000 20 10 DICDRO CCc1ccccc1C[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000766122163 1057361778 /nfs/dbraw/zinc/36/17/78/1057361778.db2.gz QTXXTUQNNXEEPG-UHFFFAOYSA-N 1 0 324.468 4.016 20 10 DICDRO c1c(C2=CC[C@@H]([NH+]3CCCC3)CC2)cc2c3c1CCCN3CCC2 ZINC001242692150 1057448721 /nfs/dbraw/zinc/44/87/21/1057448721.db2.gz GURTXTWALSFZMW-OAQYLSRUSA-N 1 0 322.496 4.417 20 10 DICDRO C[C@@H]([NH2+]Cc1cccnc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000020550971 1057637754 /nfs/dbraw/zinc/63/77/54/1057637754.db2.gz VUSSKOOBVHFPNF-OAHLLOKOSA-N 1 0 313.420 4.062 20 10 DICDRO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000727643353 1057661500 /nfs/dbraw/zinc/66/15/00/1057661500.db2.gz RSCZMDVTPDFNBU-MRXNPFEDSA-N 1 0 324.468 4.319 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1ccc(F)c2cccnc12 ZINC000727830940 1057676715 /nfs/dbraw/zinc/67/67/15/1057676715.db2.gz XHXOPVUDJLOEGA-UHFFFAOYSA-N 1 0 324.399 4.492 20 10 DICDRO CCC[N@@H+](Cc1c(O)ccc2ccccc21)C[C@@H]1CCCCO1 ZINC000730255393 1057709981 /nfs/dbraw/zinc/70/99/81/1057709981.db2.gz GLKCFKUEDIKMSA-KRWDZBQOSA-N 1 0 313.441 4.327 20 10 DICDRO CC1CCN(c2ccc(C[NH2+]Cc3ccc(Cl)o3)cc2)CC1 ZINC000731041534 1057733490 /nfs/dbraw/zinc/73/34/90/1057733490.db2.gz FRDJHCFRUWUUGB-UHFFFAOYSA-N 1 0 318.848 4.459 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2csc3ccccc32)c1O ZINC000731452413 1057744414 /nfs/dbraw/zinc/74/44/14/1057744414.db2.gz YATVCTQCWAHREZ-LBPRGKRZSA-N 1 0 313.422 4.466 20 10 DICDRO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1ccccc1O ZINC000732203117 1057770446 /nfs/dbraw/zinc/77/04/46/1057770446.db2.gz PPLYALAKPMFPAI-LBPRGKRZSA-N 1 0 320.230 4.348 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000732233192 1057771562 /nfs/dbraw/zinc/77/15/62/1057771562.db2.gz XLYMVTASYOGUPM-IAGOWNOFSA-N 1 0 301.817 4.472 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCSCc1ccccc1 ZINC000733323211 1057811873 /nfs/dbraw/zinc/81/18/73/1057811873.db2.gz PPIUWQLNCMPMGU-UHFFFAOYSA-N 1 0 307.846 4.069 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCCCc2ccccc2)cc1F ZINC000733322974 1057811911 /nfs/dbraw/zinc/81/19/11/1057811911.db2.gz YVCRHLAYIZDNCN-UHFFFAOYSA-N 1 0 300.421 4.004 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H]1CCCc2ccccc21 ZINC000733322667 1057812234 /nfs/dbraw/zinc/81/22/34/1057812234.db2.gz RPLGIYJZDXIZNF-AWEZNQCLSA-N 1 0 301.817 4.255 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCCSc2ccccc2)cc1F ZINC000733323362 1057812930 /nfs/dbraw/zinc/81/29/30/1057812930.db2.gz WHNDKXODHOJTIH-UHFFFAOYSA-N 1 0 318.461 4.164 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@H](C)C[C@@H]2C)ccc1OC ZINC000733327969 1057813524 /nfs/dbraw/zinc/81/35/24/1057813524.db2.gz NSSPBKXGLSHGTJ-RLFYNMQTSA-N 1 0 305.462 4.146 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2CC(C)(c3ccccc3)C2)cc1F ZINC000733326488 1057813539 /nfs/dbraw/zinc/81/35/39/1057813539.db2.gz GROIQXDXPCULJM-UHFFFAOYSA-N 1 0 312.432 4.102 20 10 DICDRO CC(C)(C)c1csc(CC[NH2+]Cc2c(O)cccc2Cl)n1 ZINC000733327764 1057813633 /nfs/dbraw/zinc/81/36/33/1057813633.db2.gz AUWZAFXUKMTVHS-UHFFFAOYSA-N 1 0 324.877 4.132 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCCc1ccc(Cl)cc1 ZINC000733328574 1057813644 /nfs/dbraw/zinc/81/36/44/1057813644.db2.gz VMKUUVAVNIUDJI-UHFFFAOYSA-N 1 0 310.224 4.421 20 10 DICDRO C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccc(N)cc1 ZINC001246175132 1058719045 /nfs/dbraw/zinc/71/90/45/1058719045.db2.gz YIYMZAZHOAEGHL-GFCCVEGCSA-N 1 0 308.347 4.008 20 10 DICDRO CCC[N@H+](CCCc1scnc1C)Cc1ccccc1O ZINC001559571567 1059401718 /nfs/dbraw/zinc/40/17/18/1059401718.db2.gz XBAUVUXAFWYYLU-UHFFFAOYSA-N 1 0 304.459 4.002 20 10 DICDRO COc1ccc(N(C)C[C@H]2CCCC[N@@H+]2C(C)C)cc1Cl ZINC001559624290 1059452972 /nfs/dbraw/zinc/45/29/72/1059452972.db2.gz DWTZYWDAFQTYPP-OAHLLOKOSA-N 1 0 310.869 4.048 20 10 DICDRO C[C@@H]1CCC[C@@H](C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)C1 ZINC001559635146 1059464228 /nfs/dbraw/zinc/46/42/28/1059464228.db2.gz LYWDYRFCVQSETL-LMMKCTJWSA-N 1 0 317.473 4.200 20 10 DICDRO CCC[C@H](O)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC001559659035 1059490050 /nfs/dbraw/zinc/49/00/50/1059490050.db2.gz YOKAFZMGYDKLQL-APWZRJJASA-N 1 0 313.441 4.116 20 10 DICDRO COc1ccc(C[NH2+][C@H](Cc2ccc(F)cc2)C(C)C)cc1C ZINC001559705737 1059532197 /nfs/dbraw/zinc/53/21/97/1059532197.db2.gz YDWCQVDPHCYQDS-LJQANCHMSA-N 1 0 315.432 4.500 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1ccccc1F ZINC001559964069 1059773108 /nfs/dbraw/zinc/77/31/08/1059773108.db2.gz KQQWQQVPNOWOKS-SFHVURJKSA-N 1 0 300.421 4.441 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)CC[C@@H]2CCC[C@H](C)C2)cc1 ZINC001559966974 1059777329 /nfs/dbraw/zinc/77/73/29/1059777329.db2.gz PWGRNLFVJXYTSB-ROUUACIJSA-N 1 0 318.505 4.280 20 10 DICDRO Cc1ccc2c(C[N@@H+](C)Cc3ccc(N(C)C)cc3)cccc2n1 ZINC001248573326 1059894996 /nfs/dbraw/zinc/89/49/96/1059894996.db2.gz IPTJDIPYIGKWAN-UHFFFAOYSA-N 1 0 319.452 4.241 20 10 DICDRO CC(C)c1ccc(CC[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001560250168 1060015355 /nfs/dbraw/zinc/01/53/55/1060015355.db2.gz FARZWUUBLNUZIW-UHFFFAOYSA-N 1 0 309.453 4.467 20 10 DICDRO C[N@H+](Cc1ccccn1)Cc1cc(Cl)c(C(C)(C)C)cc1O ZINC001248879801 1060030159 /nfs/dbraw/zinc/03/01/59/1060030159.db2.gz DFUMDXVQGPOZEF-UHFFFAOYSA-N 1 0 318.848 4.370 20 10 DICDRO CC(C)(C)c1cc(O)c(C[N@@H+]2CCC[C@@]3(CCO3)C2)cc1Cl ZINC001248883971 1060035406 /nfs/dbraw/zinc/03/54/06/1060035406.db2.gz UVRJCVTYDUOVQD-GOSISDBHSA-N 1 0 323.864 4.098 20 10 DICDRO CC(C)(C)c1cc(O)c(C[N@@H+]2CCC[C@]3(CCO3)C2)cc1Cl ZINC001248883972 1060037850 /nfs/dbraw/zinc/03/78/50/1060037850.db2.gz UVRJCVTYDUOVQD-SFHVURJKSA-N 1 0 323.864 4.098 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)COc2ccccc2)cc1C ZINC001560295932 1060081033 /nfs/dbraw/zinc/08/10/33/1060081033.db2.gz UUJIMYNRWJNJPY-KRWDZBQOSA-N 1 0 313.441 4.341 20 10 DICDRO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001560300908 1060086572 /nfs/dbraw/zinc/08/65/72/1060086572.db2.gz ALVMQMGWMDDSQJ-LZQZEXGQSA-N 1 0 301.474 4.420 20 10 DICDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1c(O)cccc1Br ZINC001560322587 1060109135 /nfs/dbraw/zinc/10/91/35/1060109135.db2.gz LJYZYGAAXZOFOR-GHMZBOCLSA-N 1 0 312.251 4.069 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](C)Oc2ccccc2)cc1C ZINC001560338996 1060126045 /nfs/dbraw/zinc/12/60/45/1060126045.db2.gz VYUXUTQCAVTHNA-KRWDZBQOSA-N 1 0 313.441 4.341 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1NCc1cc(Cl)cc(F)c1O ZINC001560384268 1060169202 /nfs/dbraw/zinc/16/92/02/1060169202.db2.gz OVZQOFFYXXNAJF-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO COc1cc(C[NH2+]C[C@@]2(C)CCCS2)c(O)c(C(C)(C)C)c1 ZINC001560394971 1060181523 /nfs/dbraw/zinc/18/15/23/1060181523.db2.gz XIMSZKWEVDUUKV-GOSISDBHSA-N 1 0 323.502 4.074 20 10 DICDRO C[N@H+](Cc1ccccc1)Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249224004 1060194237 /nfs/dbraw/zinc/19/42/37/1060194237.db2.gz QQZCOSARXATAJL-UHFFFAOYSA-N 1 0 309.409 4.208 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCC[C@H](C(F)F)C3)ccc2O1 ZINC001249252109 1060201828 /nfs/dbraw/zinc/20/18/28/1060201828.db2.gz GKEOVINNTKBSCX-ZDUSSCGKSA-N 1 0 323.383 4.054 20 10 DICDRO CC[N@H+](Cc1ccc(SC)c(OC)c1)Cc1ccccc1O ZINC001249377975 1060232771 /nfs/dbraw/zinc/23/27/71/1060232771.db2.gz CMQIEIUWBQWZKZ-UHFFFAOYSA-N 1 0 317.454 4.145 20 10 DICDRO CCO[C@@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)c1ccccc1 ZINC001560456857 1060248547 /nfs/dbraw/zinc/24/85/47/1060248547.db2.gz JRXKQLPNPDVUKM-SFHVURJKSA-N 1 0 319.832 4.221 20 10 DICDRO CC[N@H+](Cc1cc(C(C)(C)C)c[nH]1)Cc1ccc(N(C)C)cc1 ZINC001249480277 1060259402 /nfs/dbraw/zinc/25/94/02/1060259402.db2.gz MAHVQAOFAPXWQP-UHFFFAOYSA-N 1 0 313.489 4.400 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1cc(F)ccc1F ZINC001560508332 1060307622 /nfs/dbraw/zinc/30/76/22/1060307622.db2.gz RSHORGWSBNFADY-CQSZACIVSA-N 1 0 318.411 4.060 20 10 DICDRO COc1cc(C[NH2+][C@@H]2CCC[C@@H](F)C2)c(O)c(C(C)(C)C)c1 ZINC001560516052 1060314410 /nfs/dbraw/zinc/31/44/10/1060314410.db2.gz RILDIDHXUUJEHW-ZIAGYGMSSA-N 1 0 309.425 4.069 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1c(O)cc(C)cc1Cl)CC2 ZINC001560521344 1060319323 /nfs/dbraw/zinc/31/93/23/1060319323.db2.gz BSCJYXCFRSGDOA-KRWDZBQOSA-N 1 0 301.817 4.440 20 10 DICDRO COc1cc(C[NH2+]C2CC3(CCC3)C2)c(O)c(C(C)(C)C)c1 ZINC001560521916 1060319963 /nfs/dbraw/zinc/31/99/63/1060319963.db2.gz UHXYUXZVZGQIPH-UHFFFAOYSA-N 1 0 303.446 4.121 20 10 DICDRO COc1cc(C[NH2+]CC2CCC(F)CC2)c(O)c(C(C)(C)C)c1 ZINC001560522363 1060320901 /nfs/dbraw/zinc/32/09/01/1060320901.db2.gz LATBNECVRKRSNX-UHFFFAOYSA-N 1 0 323.452 4.316 20 10 DICDRO COc1cc(C[NH2+]C2(C3CCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC001560521499 1060321611 /nfs/dbraw/zinc/32/16/11/1060321611.db2.gz HELKBDBKUQFIAJ-UHFFFAOYSA-N 1 0 303.446 4.121 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+]C[C@@H]3CCCC(C)(C)C3)C2)cc1 ZINC001560529174 1060328908 /nfs/dbraw/zinc/32/89/08/1060328908.db2.gz UKLUKIIMEJBABJ-SJORKVTESA-N 1 0 316.489 4.080 20 10 DICDRO CC[C@](C)([NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O)C1CC1 ZINC001560536589 1060341256 /nfs/dbraw/zinc/34/12/56/1060341256.db2.gz OWDONNJRGBMFMK-IBGZPJMESA-N 1 0 305.462 4.367 20 10 DICDRO CC(C)CCO[C@H]1CC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC001560537306 1060343273 /nfs/dbraw/zinc/34/32/73/1060343273.db2.gz UOUILRKTOMTCFH-WGSAOQKQSA-N 1 0 317.473 4.085 20 10 DICDRO COc1cc(C[NH2+]CC(C)(C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC001560604104 1060416564 /nfs/dbraw/zinc/41/65/64/1060416564.db2.gz ZYPTVHJXZQNYNJ-UHFFFAOYSA-N 1 0 305.462 4.224 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CCC(C)(C)CO2)c(Cl)c1 ZINC001560604743 1060417538 /nfs/dbraw/zinc/41/75/38/1060417538.db2.gz BHLQRVGFBZNNOK-CYBMUJFWSA-N 1 0 311.853 4.039 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C2CC2)[C@H]2CCCOC2)cc1C ZINC001560607595 1060421488 /nfs/dbraw/zinc/42/14/88/1060421488.db2.gz JRPSMWNXXDVBOV-AZUAARDMSA-N 1 0 317.473 4.079 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)c(Cl)c1 ZINC001560614782 1060427590 /nfs/dbraw/zinc/42/75/90/1060427590.db2.gz WZVXWMOHULMCCG-CQSZACIVSA-N 1 0 322.235 4.264 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCCc2ccsc2)cc1 ZINC001560623252 1060434406 /nfs/dbraw/zinc/43/44/06/1060434406.db2.gz SDQPGZLSPIPCDD-UHFFFAOYSA-N 1 0 302.487 4.317 20 10 DICDRO CC(C)[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001560647619 1060469919 /nfs/dbraw/zinc/46/99/19/1060469919.db2.gz BCVQQPXSVSKLFZ-CYBMUJFWSA-N 1 0 314.395 4.249 20 10 DICDRO CO[C@@H](CC(C)C)C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC001560664802 1060492834 /nfs/dbraw/zinc/49/28/34/1060492834.db2.gz GVINGPLVMYWLHE-IBGZPJMESA-N 1 0 306.494 4.024 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2CC(C)C)c1O ZINC001560667358 1060493528 /nfs/dbraw/zinc/49/35/28/1060493528.db2.gz GKKGNVLJEGHVEY-HNNXBMFYSA-N 1 0 311.853 4.455 20 10 DICDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2c(O)cc(C)cc2Cl)C1 ZINC001560676646 1060518194 /nfs/dbraw/zinc/51/81/94/1060518194.db2.gz IGSGAMGABYAALR-CHWSQXEVSA-N 1 0 313.894 4.460 20 10 DICDRO C[C@@H]1c2ccccc2OCC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001560680501 1060520892 /nfs/dbraw/zinc/52/08/92/1060520892.db2.gz CIXDUNBNMNEVBI-DKRLNXSXSA-N 1 0 322.452 4.221 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1O)[C@@H](C)c1cccc(O)c1 ZINC001560692836 1060540312 /nfs/dbraw/zinc/54/03/12/1060540312.db2.gz PMLDWUJLZIBXAE-LBPRGKRZSA-N 1 0 305.805 4.334 20 10 DICDRO Cc1ccc(C2CC[NH+](Cc3ccc(Cl)cc3O)CC2)cn1 ZINC001560704829 1060560735 /nfs/dbraw/zinc/56/07/35/1060560735.db2.gz UPPQJHVXTTZRFQ-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC001560719158 1060581915 /nfs/dbraw/zinc/58/19/15/1060581915.db2.gz WVKCLPJGQIXHJC-KRWDZBQOSA-N 1 0 300.471 4.460 20 10 DICDRO CC(C)[C@@H](C)[N@H+](Cc1c(O)cccc1Br)C1CC1 ZINC001560724718 1060587763 /nfs/dbraw/zinc/58/77/63/1060587763.db2.gz SMEOOGDTTVIXEJ-LLVKDONJSA-N 1 0 312.251 4.164 20 10 DICDRO Cc1cc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c(O)cc1Br ZINC001250120733 1060627547 /nfs/dbraw/zinc/62/75/47/1060627547.db2.gz OSMNOAHHCSUCFO-BETUJISGSA-N 1 0 324.262 4.085 20 10 DICDRO Cc1cc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c(O)cc1Br ZINC001250120734 1060627613 /nfs/dbraw/zinc/62/76/13/1060627613.db2.gz OSMNOAHHCSUCFO-CHWSQXEVSA-N 1 0 324.262 4.085 20 10 DICDRO Cc1cc(F)cc2c1C[N@H+](C/C=C\c1ccc(N(C)C)cc1)CC2 ZINC001560783782 1060645152 /nfs/dbraw/zinc/64/51/52/1060645152.db2.gz LUVBXKGJNPBCGK-PLNGDYQASA-N 1 0 324.443 4.272 20 10 DICDRO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001560786535 1060646290 /nfs/dbraw/zinc/64/62/90/1060646290.db2.gz XAYRFPBAGIDSGL-SFHVURJKSA-N 1 0 319.807 4.425 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C(C)(C)C)C2)c1O ZINC001560785033 1060647078 /nfs/dbraw/zinc/64/70/78/1060647078.db2.gz CBEUEWFTGIVKOJ-ZDUSSCGKSA-N 1 0 311.853 4.312 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@@H]2C)c1O ZINC001560786824 1060649423 /nfs/dbraw/zinc/64/94/23/1060649423.db2.gz CFBUJOPDMVSYBS-AGIUHOORSA-N 1 0 311.853 4.216 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC=C(c3ccco3)C2)c(Cl)c1 ZINC001560826581 1060683713 /nfs/dbraw/zinc/68/37/13/1060683713.db2.gz RBSRGKPKWQRILR-UHFFFAOYSA-N 1 0 303.789 4.236 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)C1CCCC1 ZINC001560831902 1060688683 /nfs/dbraw/zinc/68/86/83/1060688683.db2.gz WASZCXMENRQWQL-GFCCVEGCSA-N 1 0 314.395 4.440 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H](C)Cc2ccccc2C(F)(F)F)c1 ZINC001560937404 1060799304 /nfs/dbraw/zinc/79/93/04/1060799304.db2.gz CZPUMFPHZNKEIJ-CYBMUJFWSA-N 1 0 323.358 4.440 20 10 DICDRO CC1CC(C[NH2+]Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001560944582 1060809715 /nfs/dbraw/zinc/80/97/15/1060809715.db2.gz SDQFNWIMWIBNLL-UHFFFAOYSA-N 1 0 311.425 4.107 20 10 DICDRO C[C@@H]([NH2+]C1CCC(c2ccc(O)cc2)CC1)c1ccccc1O ZINC001560971802 1060835017 /nfs/dbraw/zinc/83/50/17/1060835017.db2.gz SJJUXZCQPPIJIC-HPUBIQBYSA-N 1 0 311.425 4.475 20 10 DICDRO CCc1cccc(C[NH2+]CC(CC)(CC)C(F)(F)F)c1O ZINC001560975434 1060841022 /nfs/dbraw/zinc/84/10/22/1060841022.db2.gz AOMDBVMYPGFLHZ-UHFFFAOYSA-N 1 0 303.368 4.413 20 10 DICDRO Oc1c(C[NH2+]Cc2cccc3[nH]ccc32)ccc2ccccc21 ZINC001560981453 1060844291 /nfs/dbraw/zinc/84/42/91/1060844291.db2.gz PICDTRLWJZJCJT-UHFFFAOYSA-N 1 0 302.377 4.317 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@H+](C)Cc2ccc3cc[nH]c3c2)cc1 ZINC001560979711 1060845462 /nfs/dbraw/zinc/84/54/62/1060845462.db2.gz DRGAHEAEFUKAID-PLNGDYQASA-N 1 0 319.452 4.379 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2ccc(C(C)(C)C)s2)c1O ZINC001560999127 1060858645 /nfs/dbraw/zinc/85/86/45/1060858645.db2.gz NWFGMFJZTGDPLP-UHFFFAOYSA-N 1 0 319.470 4.358 20 10 DICDRO CCC[N@H+](Cc1ccc(N(C)C)c(C)c1)Cc1ccccc1O ZINC001473195967 1060952431 /nfs/dbraw/zinc/95/24/31/1060952431.db2.gz NCXCRGDSRZICRM-UHFFFAOYSA-N 1 0 312.457 4.179 20 10 DICDRO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001462172441 1060991317 /nfs/dbraw/zinc/99/13/17/1060991317.db2.gz BEUMFMJFFWULNJ-LVQRLBQTSA-N 1 0 312.379 4.039 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCOC3(CCCCC3)C2)c1 ZINC001462192817 1061014071 /nfs/dbraw/zinc/01/40/71/1061014071.db2.gz RPZKLWMUHJMNRI-UHFFFAOYSA-N 1 0 303.446 4.051 20 10 DICDRO CCN(C[C@H](C)COCc1ccccc1)c1ccc(OC)cc1 ZINC001473246321 1061022643 /nfs/dbraw/zinc/02/26/43/1061022643.db2.gz AUBSWTVYKXJSFY-KRWDZBQOSA-N 1 0 313.441 4.374 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2Cc3ccccc3C3(CCC3)C2)c1O ZINC001462214400 1061032579 /nfs/dbraw/zinc/03/25/79/1061032579.db2.gz JIOZNKVTGCBZHV-UHFFFAOYSA-N 1 0 323.436 4.147 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC001462268428 1061064920 /nfs/dbraw/zinc/06/49/20/1061064920.db2.gz SDESRYNOUHFRBK-UAPYVXQJSA-N 1 0 312.432 4.236 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](CC(C)(C)C)C2(C)C)c1 ZINC001462334323 1061110189 /nfs/dbraw/zinc/11/01/89/1061110189.db2.gz LWHFRRXAYJFLRL-HNNXBMFYSA-N 1 0 305.462 4.438 20 10 DICDRO Cc1ccc(CC(C)(C)[NH2+]Cc2cccc(Cl)c2[O-])cc1 ZINC001462361191 1061128891 /nfs/dbraw/zinc/12/88/91/1061128891.db2.gz WAFRQVBQQCABBT-UHFFFAOYSA-N 1 0 303.833 4.465 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(OC)c(C)c2)C12CCCCC2 ZINC001473446325 1061162677 /nfs/dbraw/zinc/16/26/77/1061162677.db2.gz CGPZHBUIHWINBH-RTBURBONSA-N 1 0 317.473 4.221 20 10 DICDRO COc1ccc(O)c(C[NH2+]CCCCCCc2ccccc2)c1 ZINC001462439174 1061173832 /nfs/dbraw/zinc/17/38/32/1061173832.db2.gz JAPWVEYFUDDOQQ-UHFFFAOYSA-N 1 0 313.441 4.294 20 10 DICDRO CCc1ccc(C2CC[NH+](Cc3cc(F)ccc3O)CC2)cc1 ZINC001462478980 1061198058 /nfs/dbraw/zinc/19/80/58/1061198058.db2.gz KIGOOSQOIYFLNT-UHFFFAOYSA-N 1 0 313.416 4.473 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C2([C@@H]3CCCCO3)CCC2)c1 ZINC001462529468 1061237547 /nfs/dbraw/zinc/23/75/47/1061237547.db2.gz HLRJPBLMNBYDBO-SFHVURJKSA-N 1 0 303.446 4.097 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH+]2CCC(F)CC2)cc1 ZINC001462533715 1061244533 /nfs/dbraw/zinc/24/45/33/1061244533.db2.gz DHSAKIDRJCWBEI-UHFFFAOYSA-N 1 0 318.461 4.318 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@H]2C[C@@H]2Cc2ccccc2)c1 ZINC001462660225 1061322138 /nfs/dbraw/zinc/32/21/38/1061322138.db2.gz IZDLZACAYFMPKP-RBUKOAKNSA-N 1 0 309.453 4.484 20 10 DICDRO CCc1ccc2c(c1)C[N@@H+](Cc1c(O)cc(C)cc1Cl)CC2 ZINC001462689456 1061339703 /nfs/dbraw/zinc/33/97/03/1061339703.db2.gz YXCIJMAUPWNBRY-UHFFFAOYSA-N 1 0 315.844 4.475 20 10 DICDRO C[C@H]([NH2+]Cc1coc(-c2ccccc2F)n1)c1ccccc1O ZINC001473723930 1061370847 /nfs/dbraw/zinc/37/08/47/1061370847.db2.gz MXZQPXBFHYGUFS-LBPRGKRZSA-N 1 0 312.344 4.037 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2ccc(OC)c(C)c2)cc1 ZINC001473842992 1061430488 /nfs/dbraw/zinc/43/04/88/1061430488.db2.gz KKQWHMBNWORXIB-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO Cc1cccc(OC[C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001251726863 1061461495 /nfs/dbraw/zinc/46/14/95/1061461495.db2.gz LNXVVSUXPXBDCW-GOSISDBHSA-N 1 0 324.468 4.152 20 10 DICDRO Cc1ccc(OCC[NH2+]Cc2ccc(N3CCCC3)cc2)c(C)c1 ZINC001251730643 1061461612 /nfs/dbraw/zinc/46/16/12/1061461612.db2.gz WESVZLLHBREQNL-UHFFFAOYSA-N 1 0 324.468 4.072 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)C1 ZINC001473938389 1061484661 /nfs/dbraw/zinc/48/46/61/1061484661.db2.gz LAWKBQLEEPZRJI-VQFNDLOPSA-N 1 0 318.530 4.154 20 10 DICDRO C[C@H]1CC([NH2+]Cc2ccc(N3CCSCC3)cc2)C[C@H](C)C1 ZINC001473938388 1061484995 /nfs/dbraw/zinc/48/49/95/1061484995.db2.gz LAWKBQLEEPZRJI-HZPDHXFCSA-N 1 0 318.530 4.154 20 10 DICDRO Cc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001473991129 1061534968 /nfs/dbraw/zinc/53/49/68/1061534968.db2.gz AAHJFZVTWMDRRB-NRFANRHFSA-N 1 0 306.453 4.372 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@H](C)SC2)cc1F ZINC001473994799 1061536663 /nfs/dbraw/zinc/53/66/63/1061536663.db2.gz GCSPMPUGZRQGMC-ZFWWWQNUSA-N 1 0 310.482 4.046 20 10 DICDRO Oc1ccc(CCC[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC001473997023 1061539963 /nfs/dbraw/zinc/53/99/63/1061539963.db2.gz KFTYQBWTZIZSSS-UHFFFAOYSA-N 1 0 324.468 4.105 20 10 DICDRO CCCc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)s1 ZINC001473996409 1061540881 /nfs/dbraw/zinc/54/08/81/1061540881.db2.gz UXUQJKUWQWZDMF-UHFFFAOYSA-N 1 0 302.487 4.365 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCc2ccccc21 ZINC001474001852 1061542440 /nfs/dbraw/zinc/54/24/40/1061542440.db2.gz ASTAAIWYKZAFKH-QGZVFWFLSA-N 1 0 304.437 4.306 20 10 DICDRO c1ccc(OCC2CC2)c(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001474016888 1061556324 /nfs/dbraw/zinc/55/63/24/1061556324.db2.gz ACGGJNCYUCGAGR-UHFFFAOYSA-N 1 0 323.436 4.090 20 10 DICDRO CCS[C@@H]1CCC[C@@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC001474038398 1061584202 /nfs/dbraw/zinc/58/42/02/1061584202.db2.gz PVTQFZHTZUHCFR-LJJUJYJISA-N 1 0 318.530 4.420 20 10 DICDRO CC[C@@H](C[NH2+]Cc1ccc(OC)c(C)c1)Oc1ccccc1F ZINC001474040306 1061585314 /nfs/dbraw/zinc/58/53/14/1061585314.db2.gz XSFQYUHFJBRULN-INIZCTEOSA-N 1 0 317.404 4.090 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(C)cc2SC)cc1C ZINC001474067420 1061613406 /nfs/dbraw/zinc/61/34/06/1061613406.db2.gz RXSZXCMANUAYHN-UHFFFAOYSA-N 1 0 301.455 4.324 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H](CC)[C@H]2CCCO2)cc1 ZINC001474099238 1061645068 /nfs/dbraw/zinc/64/50/68/1061645068.db2.gz IEILFENISWDFNO-WOJBJXKFSA-N 1 0 318.505 4.360 20 10 DICDRO C[C@@H]([NH2+]C1CCc2ccccc2CC1)c1ccc(N(C)C)cc1 ZINC001474117374 1061666689 /nfs/dbraw/zinc/66/66/89/1061666689.db2.gz WKBMALZWJSSWTA-MRXNPFEDSA-N 1 0 308.469 4.351 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](CO)CCC(C)(C)C)cc1C ZINC001474126432 1061674183 /nfs/dbraw/zinc/67/41/83/1061674183.db2.gz SMUWVVQBEAUEEE-KRWDZBQOSA-N 1 0 307.478 4.061 20 10 DICDRO COCC1(C[NH2+]Cc2c(C)c3ccccc3n2C)CCCCC1 ZINC001474168640 1061712358 /nfs/dbraw/zinc/71/23/58/1061712358.db2.gz DZDOZPZUDGMBRC-UHFFFAOYSA-N 1 0 314.473 4.173 20 10 DICDRO CCOCc1cc(C[NH2+][C@]2(C)CCCC[C@H]2C)ccc1OC ZINC001474169226 1061715903 /nfs/dbraw/zinc/71/59/03/1061715903.db2.gz AJNDJTBMBCMRQH-DNVCBOLYSA-N 1 0 305.462 4.290 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@@H]1CCCC[C@H]1C ZINC001474184579 1061732543 /nfs/dbraw/zinc/73/25/43/1061732543.db2.gz GNZYSNRSUMUPCD-AYBZRNKSSA-N 1 0 302.506 4.408 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC001474195270 1061743857 /nfs/dbraw/zinc/74/38/57/1061743857.db2.gz PXYGVEVZZWOPIV-INIZCTEOSA-N 1 0 312.457 4.068 20 10 DICDRO Cc1cc[nH+]c(NCc2c(O)ccc(Cl)c2F)c1C1CC1 ZINC001474202203 1061754685 /nfs/dbraw/zinc/75/46/85/1061754685.db2.gz RLODWOLEVZQNHI-UHFFFAOYSA-N 1 0 306.768 4.378 20 10 DICDRO CC[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001474205721 1061759427 /nfs/dbraw/zinc/75/94/27/1061759427.db2.gz KPONHMWYGMXKRC-LJQANCHMSA-N 1 0 313.416 4.262 20 10 DICDRO c1ccc(S[C@H]2C[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001474225699 1061787348 /nfs/dbraw/zinc/78/73/48/1061787348.db2.gz RXPOTNKCDQNGJZ-SAABIXHNSA-N 1 0 311.450 4.034 20 10 DICDRO Cc1cc(C[NH2+]Cc2cnccc2C)c(C)n1-c1cccc(C)c1 ZINC001474234025 1061796010 /nfs/dbraw/zinc/79/60/10/1061796010.db2.gz ILFMALZFHCBXDF-UHFFFAOYSA-N 1 0 319.452 4.396 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@H]2CC(C)(C)CO2)cc1 ZINC001474257966 1061827050 /nfs/dbraw/zinc/82/70/50/1061827050.db2.gz WBKIAAOLLXDZAI-LJQANCHMSA-N 1 0 318.505 4.218 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C(C)(C)c2ccc(F)cc2)cc1 ZINC001474268196 1061836429 /nfs/dbraw/zinc/83/64/29/1061836429.db2.gz HLSFFBJEMWJUTR-WAYWQWQTSA-N 1 0 312.432 4.430 20 10 DICDRO COc1ccc(N2CCC([NH2+]C3(C)C(C)(C)C3(C)C)CC2)cc1 ZINC001474289238 1061858618 /nfs/dbraw/zinc/85/86/18/1061858618.db2.gz BQEMCKRYMFDLCR-UHFFFAOYSA-N 1 0 316.489 4.078 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2O)n1 ZINC001474327461 1061911364 /nfs/dbraw/zinc/91/13/64/1061911364.db2.gz DQSSESGKHGENMU-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO CC(C)(C)C1=CC[N@H+](Cc2ccc(Br)cc2O)CC1 ZINC001474354860 1061966803 /nfs/dbraw/zinc/96/68/03/1061966803.db2.gz FLVYFZYXBCPSCF-UHFFFAOYSA-N 1 0 324.262 4.333 20 10 DICDRO CC(C)[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCS1 ZINC001474361110 1061985204 /nfs/dbraw/zinc/98/52/04/1061985204.db2.gz XVSHUWNHKLPFKE-QGZVFWFLSA-N 1 0 301.455 4.119 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CCC(C(F)(F)F)CC2)c1 ZINC001474378090 1062025341 /nfs/dbraw/zinc/02/53/41/1062025341.db2.gz GYDDIOPSCGBUMG-UHFFFAOYSA-N 1 0 301.352 4.290 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cc(F)ccc2O)cc1 ZINC001474398880 1062054243 /nfs/dbraw/zinc/05/42/43/1062054243.db2.gz YCGGOSFHSKHAIS-UHFFFAOYSA-N 1 0 316.420 4.010 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@H](C)c2ccc(F)cc2)c1O ZINC001474407763 1062068737 /nfs/dbraw/zinc/06/87/37/1062068737.db2.gz HSOBLHYAIOGJKS-CYBMUJFWSA-N 1 0 303.377 4.041 20 10 DICDRO c1ccc2c(c1)CCC([NH2+]Cc1ccc(N3CCCC3)cc1)CC2 ZINC001254450572 1062110348 /nfs/dbraw/zinc/11/03/48/1062110348.db2.gz WXCRZSRTPVKENL-UHFFFAOYSA-N 1 0 320.480 4.324 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]Cc2ccc(Br)o2)c1 ZINC001474459116 1062137201 /nfs/dbraw/zinc/13/72/01/1062137201.db2.gz UIJLTTXUWZRRAH-UHFFFAOYSA-N 1 0 324.218 4.161 20 10 DICDRO COc1ccc(C[NH2+]Cc2cccc(CC3CCC3)c2)c(O)c1 ZINC001474473205 1062150445 /nfs/dbraw/zinc/15/04/45/1062150445.db2.gz KOJMCWJBXACJJF-UHFFFAOYSA-N 1 0 311.425 4.033 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)c1 ZINC001474486434 1062163531 /nfs/dbraw/zinc/16/35/31/1062163531.db2.gz MCUWTWGMSYTHIR-BXUZGUMPSA-N 1 0 301.352 4.288 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c1 ZINC001474486437 1062164114 /nfs/dbraw/zinc/16/41/14/1062164114.db2.gz MCUWTWGMSYTHIR-SMDDNHRTSA-N 1 0 301.352 4.288 20 10 DICDRO COC1(C[NH2+]Cc2cc(C(C)C)ccc2O)CCC(C)CC1 ZINC001474493709 1062172435 /nfs/dbraw/zinc/17/24/35/1062172435.db2.gz XGIBOBKOESBMFW-UHFFFAOYSA-N 1 0 305.462 4.201 20 10 DICDRO COc1cccc(C[NH2+]C/C=C\c2cc(C)c(C)cc2C)c1O ZINC001474500178 1062180332 /nfs/dbraw/zinc/18/03/32/1062180332.db2.gz BWNIDKUTRSSTHQ-VURMDHGXSA-N 1 0 311.425 4.129 20 10 DICDRO CC(C)C[C@@H](CN1CCCC1)[NH2+]Cc1cc(C(C)C)ccc1O ZINC001474536459 1062221676 /nfs/dbraw/zinc/22/16/76/1062221676.db2.gz AQQWZZWVVLEHEO-IBGZPJMESA-N 1 0 318.505 4.116 20 10 DICDRO COc1cc(C)cc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1O ZINC001474539708 1062230340 /nfs/dbraw/zinc/23/03/40/1062230340.db2.gz ULUHTSNJWWXRNK-CYBMUJFWSA-N 1 0 313.388 4.014 20 10 DICDRO C[C@H](COc1ccccc1F)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC001254721283 1062239127 /nfs/dbraw/zinc/23/91/27/1062239127.db2.gz ONGXLOJOEHNHBG-NEPJUHHUSA-N 1 0 323.795 4.303 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@]2(C)CC=CCC2)c1O ZINC001474575081 1062282762 /nfs/dbraw/zinc/28/27/62/1062282762.db2.gz XQAMKCCSJWCKSI-OAHLLOKOSA-N 1 0 310.235 4.052 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)ccc1N1CCCCC1 ZINC001459689031 1062307252 /nfs/dbraw/zinc/30/72/52/1062307252.db2.gz PXULEULULOXIRA-UHFFFAOYSA-N 1 0 324.468 4.323 20 10 DICDRO CCN(CCCc1c(F)cccc1F)c1ccc(OC)cc1 ZINC001459708087 1062322181 /nfs/dbraw/zinc/32/21/81/1062322181.db2.gz RHTOLFMGVFZQMZ-UHFFFAOYSA-N 1 0 305.368 4.433 20 10 DICDRO CC(C)[C@H]1[N@H+](Cc2c([O-])ccc(Cl)c2F)CC12CC=CC2 ZINC001474610345 1062324743 /nfs/dbraw/zinc/32/47/43/1062324743.db2.gz YDKCZMQJDGPYMF-MRXNPFEDSA-N 1 0 309.812 4.361 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C[C@H]2C[C@H](C)C[C@H](C)C2)c1O ZINC001474621898 1062344246 /nfs/dbraw/zinc/34/42/46/1062344246.db2.gz KTJJGOPSGOUJDY-ITGUQSILSA-N 1 0 311.853 4.216 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@@H](C)C[C@@H](C)CC(C)C)C2)cc1 ZINC001474624440 1062347867 /nfs/dbraw/zinc/34/78/67/1062347867.db2.gz UBPGRIQFMBGRGY-BZSNNMDCSA-N 1 0 318.505 4.324 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)COc1ccccc1F)c1ccccc1O ZINC001255175416 1062351114 /nfs/dbraw/zinc/35/11/14/1062351114.db2.gz LAONNKRSIATCRE-XJKSGUPXSA-N 1 0 303.377 4.040 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]CC1(C(F)(F)F)CCCC1 ZINC001474651169 1062379534 /nfs/dbraw/zinc/37/95/34/1062379534.db2.gz GJQLDRWGLTVVEL-UHFFFAOYSA-N 1 0 307.743 4.258 20 10 DICDRO Cc1cc(C[NH2+][C@H]2CSC[C@H]2C)c(C)n1-c1cccc(C)c1 ZINC001474662549 1062391852 /nfs/dbraw/zinc/39/18/52/1062391852.db2.gz CMNVXDCGKDFJSD-KUHUBIRLSA-N 1 0 314.498 4.244 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@@H]1CCc2cc(Cl)ccc21 ZINC001474664313 1062395205 /nfs/dbraw/zinc/39/52/05/1062395205.db2.gz VGVIMNOFQWXQTQ-OAHLLOKOSA-N 1 0 308.208 4.476 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H]2CCCC[C@@H]2C(C)(C)C)c1O ZINC001459790409 1062402148 /nfs/dbraw/zinc/40/21/48/1062402148.db2.gz DNENQBFYKHLYKV-IRXDYDNUSA-N 1 0 321.436 4.428 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1c2ccccc2CC[C@@H]1F ZINC001474680211 1062411844 /nfs/dbraw/zinc/41/18/44/1062411844.db2.gz VGUXPAVQYLEZKW-PMACEKPBSA-N 1 0 312.432 4.176 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C[C@@]23C[C@@H]2CCCC3)c1O ZINC001474708560 1062433939 /nfs/dbraw/zinc/43/39/39/1062433939.db2.gz WVXZGSDQEPOYMG-XJKSGUPXSA-N 1 0 324.262 4.133 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H](C3CCCC3)C2)cc1F ZINC001474751313 1062462631 /nfs/dbraw/zinc/46/26/31/1062462631.db2.gz BEVBIGHCUPBQPS-OAHLLOKOSA-N 1 0 322.443 4.433 20 10 DICDRO Cc1cc(C)c2c(c1)CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)C2 ZINC001474759935 1062467098 /nfs/dbraw/zinc/46/70/98/1062467098.db2.gz DDCRPWTVDARTFC-WAYWQWQTSA-N 1 0 320.480 4.441 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001255697689 1062523845 /nfs/dbraw/zinc/52/38/45/1062523845.db2.gz SEDWOGHKDWELJA-CHWSQXEVSA-N 1 0 301.352 4.220 20 10 DICDRO C[C@@H]([NH2+]CCSc1ccc(F)cc1F)c1ccccc1O ZINC001460634444 1062953494 /nfs/dbraw/zinc/95/34/94/1062953494.db2.gz BUYOEXKFPXHHDI-LLVKDONJSA-N 1 0 309.381 4.113 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3cc(F)ccc3[C@@H]2C)ccc1N(C)C ZINC001460721502 1063015944 /nfs/dbraw/zinc/01/59/44/1063015944.db2.gz BPQDRTOFAGCHQN-HNNXBMFYSA-N 1 0 312.432 4.319 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2cccc(Cl)c2)cc1 ZINC001460998628 1063174509 /nfs/dbraw/zinc/17/45/09/1063174509.db2.gz AVBMOSQHMIRINU-XQRVVYSFSA-N 1 0 300.833 4.209 20 10 DICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]C[C@H]2C[C@@H]2C)cc1 ZINC001461051239 1063219756 /nfs/dbraw/zinc/21/97/56/1063219756.db2.gz ITACXFQJBPQERA-FXAWDEMLSA-N 1 0 308.469 4.459 20 10 DICDRO C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)CC1 ZINC001461058282 1063223191 /nfs/dbraw/zinc/22/31/91/1063223191.db2.gz XVEIJCGIPZLAHM-FUHWJXTLSA-N 1 0 318.530 4.298 20 10 DICDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)CC1 ZINC001461058285 1063224006 /nfs/dbraw/zinc/22/40/06/1063224006.db2.gz XVEIJCGIPZLAHM-SJLPKXTDSA-N 1 0 318.530 4.298 20 10 DICDRO CCC(C)(C)C1CCC([NH2+]CCc2ccc(O)c(O)c2)CC1 ZINC001257402480 1063252669 /nfs/dbraw/zinc/25/26/69/1063252669.db2.gz COLAFTHGMXIXKF-UHFFFAOYSA-N 1 0 305.462 4.225 20 10 DICDRO Cc1ccccc1C1(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC001461142912 1063291085 /nfs/dbraw/zinc/29/10/85/1063291085.db2.gz WKMAKQPGALIGOE-SOFGYWHQSA-N 1 0 320.480 4.396 20 10 DICDRO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC001461160241 1063300101 /nfs/dbraw/zinc/30/01/01/1063300101.db2.gz JTKMFJNVCYYHKY-CQSZACIVSA-N 1 0 318.411 4.498 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)cc(C)n1 ZINC001461169590 1063303993 /nfs/dbraw/zinc/30/39/93/1063303993.db2.gz JEYOKHLZQPZJJT-UHFFFAOYSA-N 1 0 323.484 4.225 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCc2ccccc2Cl)cc1 ZINC001461175083 1063308570 /nfs/dbraw/zinc/30/85/70/1063308570.db2.gz SLFXNJZWDQIIIM-AATRIKPKSA-N 1 0 314.860 4.252 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](C)c2c(C)noc2C)cc1C ZINC001461369455 1063451900 /nfs/dbraw/zinc/45/19/00/1063451900.db2.gz FZNBSCIEBRXNTO-CQSZACIVSA-N 1 0 316.445 4.282 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCCC3(CCCCC3)C2)c1O ZINC001473152144 1063457215 /nfs/dbraw/zinc/45/72/15/1063457215.db2.gz NKEDKBHAZUKBLJ-UHFFFAOYSA-N 1 0 319.420 4.280 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CC2(C)CCCCCC2)cc1F ZINC001461383714 1063464992 /nfs/dbraw/zinc/46/49/92/1063464992.db2.gz UHJHQVOCSNVLEH-UHFFFAOYSA-N 1 0 310.432 4.481 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)C[C@H](O)c1ccccc1 ZINC001461416501 1063487059 /nfs/dbraw/zinc/48/70/59/1063487059.db2.gz XFGDDFDEZFUWLH-VFNWGFHPSA-N 1 0 322.452 4.089 20 10 DICDRO COc1cc(C[NH2+]CC(C)(C)C(C)C)c(O)c(C(C)(C)C)c1 ZINC001461435563 1063503568 /nfs/dbraw/zinc/50/35/68/1063503568.db2.gz BATYXXRKEBNVJI-UHFFFAOYSA-N 1 0 307.478 4.470 20 10 DICDRO CC(C)=CCC[C@H](C)[NH2+]Cc1ccc(Br)cc1O ZINC001258083698 1063504877 /nfs/dbraw/zinc/50/48/77/1063504877.db2.gz NHIOADUMFMVZFU-LBPRGKRZSA-N 1 0 312.251 4.379 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H](C)Cc1ccco1 ZINC001258186059 1063550672 /nfs/dbraw/zinc/55/06/72/1063550672.db2.gz VMTCDSRJKQUODB-IFXJQAMLSA-N 1 0 313.441 4.446 20 10 DICDRO CSCC[C@@H](C)[NH2+][C@@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001258213549 1063563090 /nfs/dbraw/zinc/56/30/90/1063563090.db2.gz RPBNDMFHQYVWHL-CXAGYDPISA-N 1 0 307.503 4.364 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)c(C)s1 ZINC001461586959 1063595326 /nfs/dbraw/zinc/59/53/26/1063595326.db2.gz SVCTWWLEIBZLPJ-AWEZNQCLSA-N 1 0 316.514 4.460 20 10 DICDRO FC1CCC(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001461615620 1063615175 /nfs/dbraw/zinc/61/51/75/1063615175.db2.gz HUVGIHWJCWFNGF-UHFFFAOYSA-N 1 0 304.453 4.295 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CO1 ZINC001461618342 1063616972 /nfs/dbraw/zinc/61/69/72/1063616972.db2.gz UGFANODBAWFVIR-BBRMVZONSA-N 1 0 319.489 4.254 20 10 DICDRO CC(C)(C)O[C@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)C12CCC2 ZINC001461643902 1063629601 /nfs/dbraw/zinc/62/96/01/1063629601.db2.gz HSTZWCBDGBQJAJ-CVEARBPZSA-N 1 0 323.864 4.262 20 10 DICDRO CC(C)(C)O[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)C12CCC2 ZINC001461643906 1063630423 /nfs/dbraw/zinc/63/04/23/1063630423.db2.gz HSTZWCBDGBQJAJ-HZPDHXFCSA-N 1 0 323.864 4.262 20 10 DICDRO CCCC1CCC([N@@H+]2CCCc3cc(O)c(O)cc3C2)CC1 ZINC001258534161 1063686522 /nfs/dbraw/zinc/68/65/22/1063686522.db2.gz OLVOJARDARLCCF-UHFFFAOYSA-N 1 0 303.446 4.205 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cccc2ncccc12 ZINC001461733374 1063686739 /nfs/dbraw/zinc/68/67/39/1063686739.db2.gz AXCPYIGZQDSFCH-UHFFFAOYSA-N 1 0 315.420 4.325 20 10 DICDRO CSC1(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)CCCCC1 ZINC001461757253 1063699788 /nfs/dbraw/zinc/69/97/88/1063699788.db2.gz XIBOTZZUUBNHSY-FPLPWBNLSA-N 1 0 318.530 4.421 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H](C)Cc1cccnc1 ZINC001258621214 1063713114 /nfs/dbraw/zinc/71/31/14/1063713114.db2.gz YVUDSASTPSXVJO-MGPUTAFESA-N 1 0 324.468 4.248 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H](C)Cc1cccnc1 ZINC001258621215 1063714015 /nfs/dbraw/zinc/71/40/15/1063714015.db2.gz YVUDSASTPSXVJO-QRWLVFNGSA-N 1 0 324.468 4.248 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCSC(C)(C)C2)cc1 ZINC001461790628 1063720854 /nfs/dbraw/zinc/72/08/54/1063720854.db2.gz YWDBLDSUXBSQMY-MRXNPFEDSA-N 1 0 306.519 4.297 20 10 DICDRO CCCCC[C@H](CCC)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001258660884 1063730619 /nfs/dbraw/zinc/73/06/19/1063730619.db2.gz AJNADVISBZDRIN-IBGZPJMESA-N 1 0 318.505 4.362 20 10 DICDRO Oc1cccc(Br)c1C[NH2+]C[C@@H]1C[C@@H]1C1CCCC1 ZINC001461830793 1063740498 /nfs/dbraw/zinc/74/04/98/1063740498.db2.gz PEUDBZLWOWAVEA-QWHCGFSZSA-N 1 0 324.262 4.071 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2C[C@H]2C2CCCC2)ccc1OC ZINC001461830701 1063741806 /nfs/dbraw/zinc/74/18/06/1063741806.db2.gz NEGHVQRQJKQVMK-MJGOQNOKSA-N 1 0 317.473 4.148 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(OC)cc2)c1O ZINC001461839508 1063743347 /nfs/dbraw/zinc/74/33/47/1063743347.db2.gz USVQLBWFMWRLOG-LJQANCHMSA-N 1 0 311.425 4.300 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H](C(C)(C)C)CC2)c(O)c1OC ZINC001461876980 1063767741 /nfs/dbraw/zinc/76/77/41/1063767741.db2.gz ZOFVEZKCRBJTKX-HNNXBMFYSA-N 1 0 321.461 4.058 20 10 DICDRO CCSCC[C@@H](C)[N@H+](C)Cc1cc(Cl)c(C)cc1O ZINC001461883177 1063771751 /nfs/dbraw/zinc/77/17/51/1063771751.db2.gz PPHXVRJJBKMPRQ-GFCCVEGCSA-N 1 0 301.883 4.318 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)CCC2CCCCC2)c1O ZINC001461918054 1063799477 /nfs/dbraw/zinc/79/94/77/1063799477.db2.gz YBFRPHBDXXLCKK-UHFFFAOYSA-N 1 0 311.853 4.456 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC001461926413 1063810969 /nfs/dbraw/zinc/81/09/69/1063810969.db2.gz JLMNVBBFSSYWAR-YLJYHZDGSA-N 1 0 308.469 4.439 20 10 DICDRO CC[C@@H](C)C[C@@H](CC)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258795493 1063832633 /nfs/dbraw/zinc/83/26/33/1063832633.db2.gz RSFCWHKWFITGLS-IEBWSBKVSA-N 1 0 318.505 4.170 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2ccc(C)cc2)c1 ZINC001461991741 1063863710 /nfs/dbraw/zinc/86/37/10/1063863710.db2.gz ZIROJIHGTDMJQW-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(Cl)cc(OC)c1O)c1ccc(F)cc1 ZINC001461994105 1063866350 /nfs/dbraw/zinc/86/63/50/1063866350.db2.gz YBEWEKWBIUJXSE-OAHLLOKOSA-N 1 0 323.795 4.434 20 10 DICDRO C[C@H](c1ccccc1)[N@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC001462032484 1063892381 /nfs/dbraw/zinc/89/23/81/1063892381.db2.gz RVQOHUWMEXYHBA-CYBMUJFWSA-N 1 0 304.384 4.224 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1COc2ccccc21 ZINC001261139647 1063911178 /nfs/dbraw/zinc/91/11/78/1063911178.db2.gz UJFQQMOTWWDOTI-IIAWOOMASA-N 1 0 309.409 4.015 20 10 DICDRO CO[C@@](C)([C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)C1CC1 ZINC001261366004 1063920514 /nfs/dbraw/zinc/92/05/14/1063920514.db2.gz FLECSEGAIVCTQN-AEVLCDIHSA-N 1 0 303.446 4.042 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1COCc2ccccc21 ZINC001261374204 1063922497 /nfs/dbraw/zinc/92/24/97/1063922497.db2.gz BVYBFOBINRXBNC-XOKHGSTOSA-N 1 0 309.409 4.110 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC(C)(C)[C@@H]1CCCCO1 ZINC001261850077 1063949384 /nfs/dbraw/zinc/94/93/84/1063949384.db2.gz YNZWGDXGYMFMBH-VYDXJSESSA-N 1 0 317.473 4.434 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCOCc1ccccc1 ZINC000390060864 1064145920 /nfs/dbraw/zinc/14/59/20/1064145920.db2.gz TXZCMYFHCOSHIH-NVXWUHKLSA-N 1 0 311.425 4.055 20 10 DICDRO COCc1cccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC000390964363 1064175736 /nfs/dbraw/zinc/17/57/36/1064175736.db2.gz MBTBMQWHXFYCPA-WMLDXEAASA-N 1 0 311.425 4.185 20 10 DICDRO COCc1ccccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000390973529 1064177043 /nfs/dbraw/zinc/17/70/43/1064177043.db2.gz PWNSFPITLTZMCY-PBHICJAKSA-N 1 0 311.425 4.185 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000393892074 1064308697 /nfs/dbraw/zinc/30/86/97/1064308697.db2.gz UBPNWOFJQMLIKT-HKUYNNGSSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CCC3(CCCC3)C2)c1O ZINC000394092853 1064319611 /nfs/dbraw/zinc/31/96/11/1064319611.db2.gz PAQRPBKKROMPAO-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO CC1([NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CCCC1 ZINC000728063405 1064413297 /nfs/dbraw/zinc/41/32/97/1064413297.db2.gz NDDDBOPXLIQFIQ-UHFFFAOYSA-N 1 0 317.433 4.007 20 10 DICDRO O=[N+]([O-])c1cc(C[NH2+]C2CCCCC2)ccc1N1CCCCC1 ZINC000743503761 1064957186 /nfs/dbraw/zinc/95/71/86/1064957186.db2.gz SRDMGYHDFSASJF-UHFFFAOYSA-N 1 0 317.433 4.007 20 10 DICDRO CN(C)c1ccc(C[N@H+](CCc2cccc(F)c2)C2CC2)cc1 ZINC001307424799 1065385504 /nfs/dbraw/zinc/38/55/04/1065385504.db2.gz VRLNRSNREOSKFI-UHFFFAOYSA-N 1 0 312.432 4.099 20 10 DICDRO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001307481078 1065427116 /nfs/dbraw/zinc/42/71/16/1065427116.db2.gz WFKZWTIKJXMCAA-YJBOKZPZSA-N 1 0 312.432 4.270 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1c[nH]c(=O)c2ccccc12 ZINC001307500461 1065444809 /nfs/dbraw/zinc/44/48/09/1065444809.db2.gz DFTASAMVRUDSFS-UHFFFAOYSA-N 1 0 322.408 4.058 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](C)c1ccc(OC)cc1 ZINC001307502422 1065446036 /nfs/dbraw/zinc/44/60/36/1065446036.db2.gz WTJLNSPLMVHGAH-MRXNPFEDSA-N 1 0 313.441 4.417 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1ccccc1N(C)C ZINC001307720605 1065584955 /nfs/dbraw/zinc/58/49/55/1065584955.db2.gz AIFAZKBUNINUME-UHFFFAOYSA-N 1 0 312.457 4.261 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)ccc1N(C)C ZINC001307785164 1065619284 /nfs/dbraw/zinc/61/92/84/1065619284.db2.gz YUKSJZMFEKLVQD-HXUWFJFHSA-N 1 0 308.469 4.441 20 10 DICDRO Cc1ccc([C@@H](C)C[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001308275860 1065874059 /nfs/dbraw/zinc/87/40/59/1065874059.db2.gz HIPVQZQHJLOCCG-QWNKOJSDSA-N 1 0 308.469 4.468 20 10 DICDRO Cc1cc(C)cc(CC[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC001308276605 1065876385 /nfs/dbraw/zinc/87/63/85/1065876385.db2.gz WLSAIRAOZNLCHD-AATRIKPKSA-N 1 0 308.469 4.215 20 10 DICDRO Cc1ccc(O[C@H](C)C[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001308287206 1065885030 /nfs/dbraw/zinc/88/50/30/1065885030.db2.gz SPLYETLCHJFJSP-DUMMIQTOSA-N 1 0 324.468 4.131 20 10 DICDRO CCCCO[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1(C)C ZINC001308303371 1065899294 /nfs/dbraw/zinc/89/92/94/1065899294.db2.gz OGDUFBRBFMIYIK-RBUKOAKNSA-N 1 0 317.473 4.085 20 10 DICDRO Cc1ccc(NCc2ccc(N3CCCC3)cc2)c(C[NH+](C)C)c1 ZINC001308322300 1065913570 /nfs/dbraw/zinc/91/35/70/1065913570.db2.gz UWTVKAXYXMDOFR-UHFFFAOYSA-N 1 0 323.484 4.269 20 10 DICDRO C[C@H](O)C[C@H](C)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001308345868 1065930278 /nfs/dbraw/zinc/93/02/78/1065930278.db2.gz XSAHQYYYBUTPPR-KBPBESRZSA-N 1 0 321.505 4.236 20 10 DICDRO CCCOc1ccc(C[NH2+]CCC[C@H]2CCCCO2)cc1C ZINC001308366765 1065944179 /nfs/dbraw/zinc/94/41/79/1065944179.db2.gz RNYIYMYKIAWDIQ-GOSISDBHSA-N 1 0 305.462 4.223 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@H](C)CC2)ccc1OC ZINC001308375319 1065949409 /nfs/dbraw/zinc/94/94/09/1065949409.db2.gz WTVSCZPXTLJKMD-MAUKXSAKSA-N 1 0 305.462 4.290 20 10 DICDRO C[C@@H](CC[NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1 ZINC001308387133 1065956211 /nfs/dbraw/zinc/95/62/11/1065956211.db2.gz BTSWLGXJGSOVNV-HNNXBMFYSA-N 1 0 300.421 4.175 20 10 DICDRO C[C@H](CC[NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1 ZINC001308387134 1065956520 /nfs/dbraw/zinc/95/65/20/1065956520.db2.gz BTSWLGXJGSOVNV-OAHLLOKOSA-N 1 0 300.421 4.175 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CSC[C@H]2C)cc1 ZINC001308400743 1065964103 /nfs/dbraw/zinc/96/41/03/1065964103.db2.gz DCCRSTWHXIECIZ-QAPCUYQASA-N 1 0 306.519 4.154 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@]2(C)CC2(Cl)Cl)cc1 ZINC001308409920 1065970144 /nfs/dbraw/zinc/97/01/44/1065970144.db2.gz YCFYKPJAPYRETQ-OAHLLOKOSA-N 1 0 315.288 4.206 20 10 DICDRO C[C@H](F)CC[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001308421069 1065977398 /nfs/dbraw/zinc/97/73/98/1065977398.db2.gz QAIQJSKGCHRNPF-INIZCTEOSA-N 1 0 312.432 4.087 20 10 DICDRO Cc1cccc(C2([NH2+]Cc3ccc(N(C)C)c(F)c3)CCC2)c1 ZINC001308446266 1065994215 /nfs/dbraw/zinc/99/42/15/1065994215.db2.gz MYKCTCZTVIAVNE-UHFFFAOYSA-N 1 0 312.432 4.369 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc2c(c1)CCCO2 ZINC001308471393 1066010602 /nfs/dbraw/zinc/01/06/02/1066010602.db2.gz LCKWJOPNKNBRMO-HNNXBMFYSA-N 1 0 323.436 4.187 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@H](C)CC2CCC2)c1O ZINC001474651778 1066024095 /nfs/dbraw/zinc/02/40/95/1066024095.db2.gz ZUVHWJJOVACBBX-LLVKDONJSA-N 1 0 312.251 4.131 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC(C)(C)C(C)(F)F)cc1F ZINC001308493016 1066026182 /nfs/dbraw/zinc/02/61/82/1066026182.db2.gz OVFXPRJJXDWMDE-UHFFFAOYSA-N 1 0 316.411 4.443 20 10 DICDRO CC(C)[C@H](Cc1ccccc1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308520177 1066042473 /nfs/dbraw/zinc/04/24/73/1066042473.db2.gz VTMPAHNDZBSSMD-FQEVSTJZSA-N 1 0 309.453 4.369 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccc(F)cc1 ZINC001308540351 1066057535 /nfs/dbraw/zinc/05/75/35/1066057535.db2.gz FGRSRVLQMXRBMO-LLVKDONJSA-N 1 0 308.347 4.021 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2N(C)C)cc1C ZINC001308553537 1066065152 /nfs/dbraw/zinc/06/51/52/1066065152.db2.gz AXXBPINFUZVISJ-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(Cl)c1 ZINC001308558248 1066068077 /nfs/dbraw/zinc/06/80/77/1066068077.db2.gz MDOAWBBLJCOKSK-UHFFFAOYSA-N 1 0 318.848 4.052 20 10 DICDRO C[C@@]1(C[N@H+](Cc2ccco2)Cc2ccccc2O)CCCS1 ZINC001308560473 1066068880 /nfs/dbraw/zinc/06/88/80/1066068880.db2.gz PWWLBSUPRYZMJQ-SFHVURJKSA-N 1 0 317.454 4.273 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCCc3sccc3C2)c(Cl)c1 ZINC001308562238 1066071240 /nfs/dbraw/zinc/07/12/40/1066071240.db2.gz XNRYEVCCPNBKTC-UHFFFAOYSA-N 1 0 307.846 4.364 20 10 DICDRO CCSCC[C@H](C)[N@H+](C)Cc1c(O)cc(C)cc1Cl ZINC001308578248 1066093276 /nfs/dbraw/zinc/09/32/76/1066093276.db2.gz NYNNUKVRYCQASY-LBPRGKRZSA-N 1 0 301.883 4.318 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@H](C)Cc2ccc(OC)cc2)c1O ZINC001308582578 1066100251 /nfs/dbraw/zinc/10/02/51/1066100251.db2.gz UFMBABWYTHFJSQ-OAHLLOKOSA-N 1 0 313.441 4.026 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)cc1Cl ZINC001308594816 1066106517 /nfs/dbraw/zinc/10/65/17/1066106517.db2.gz RPOUIBFOZCCBNG-HOCLYGCPSA-N 1 0 311.878 4.214 20 10 DICDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc(Br)cc1O ZINC001308601227 1066110338 /nfs/dbraw/zinc/11/03/38/1066110338.db2.gz RGQWGGQTOJYFGA-AWEZNQCLSA-N 1 0 312.251 4.165 20 10 DICDRO CC(C)Oc1cccc(C[N@H+](C)Cc2cc(F)cc(F)c2[O-])c1 ZINC001308607032 1066113328 /nfs/dbraw/zinc/11/33/28/1066113328.db2.gz HEJARNFMSXBFMU-UHFFFAOYSA-N 1 0 321.367 4.090 20 10 DICDRO Cc1cccc(OCC[N@@H+](C)Cc2c(O)cc(C)cc2Cl)c1 ZINC001308612276 1066117142 /nfs/dbraw/zinc/11/71/42/1066117142.db2.gz NSCPPXBVJTUACI-UHFFFAOYSA-N 1 0 319.832 4.173 20 10 DICDRO Cc1ccc(C[N@@H+]2CCCC[C@@H]2Cc2ccc(F)cc2)c(O)c1 ZINC001308615470 1066120912 /nfs/dbraw/zinc/12/09/12/1066120912.db2.gz NEJNWIFWRVPSEW-LJQANCHMSA-N 1 0 313.416 4.437 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)c1O ZINC001308618944 1066122308 /nfs/dbraw/zinc/12/23/08/1066122308.db2.gz LFPQKJLWZGLWCQ-HXUWFJFHSA-N 1 0 324.468 4.358 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCCC3(CCCCC3)C2)c1O ZINC001308635327 1066130380 /nfs/dbraw/zinc/13/03/80/1066130380.db2.gz SGEUEXYIKAQNLH-UHFFFAOYSA-N 1 0 303.446 4.256 20 10 DICDRO C[C@@H]1C[N@H+](Cc2c(O)cccc2Br)[C@H]2CCCC[C@@H]12 ZINC001308637667 1066131655 /nfs/dbraw/zinc/13/16/55/1066131655.db2.gz PLYFWTLMQUYJJC-XUJVJEKNSA-N 1 0 324.262 4.165 20 10 DICDRO CCC1(CC)C[N@H+](Cc2cc(Cl)c(C)cc2O)CCS1 ZINC001308670116 1066147226 /nfs/dbraw/zinc/14/72/26/1066147226.db2.gz XHGAXAREDUXPTK-UHFFFAOYSA-N 1 0 313.894 4.462 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1C[C@H]1c1ccccc1 ZINC001308656232 1066138977 /nfs/dbraw/zinc/13/89/77/1066138977.db2.gz IMJLTSHCAJNIAD-FPOVZHCZSA-N 1 0 308.469 4.378 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)CC1(OC)CCCCCC1 ZINC001308655338 1066139838 /nfs/dbraw/zinc/13/98/38/1066139838.db2.gz FAXGNFMKTZIFSH-UHFFFAOYSA-N 1 0 318.505 4.314 20 10 DICDRO CCc1ccc(C[N@H+](Cc2cc(OC)ccc2O)C2CC2)cc1 ZINC001308664321 1066144365 /nfs/dbraw/zinc/14/43/65/1066144365.db2.gz ZXSADEACSRENTL-UHFFFAOYSA-N 1 0 311.425 4.128 20 10 DICDRO CN(CCC1CCCCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC001308670100 1066146916 /nfs/dbraw/zinc/14/69/16/1066146916.db2.gz MVQQRLAOUZMVIR-UHFFFAOYSA-N 1 0 304.478 4.034 20 10 DICDRO C[C@@H](CN(C)c1ccc(OCC[NH+](C)C)cc1)C1CCCCC1 ZINC001308670652 1066147927 /nfs/dbraw/zinc/14/79/27/1066147927.db2.gz SILQNJQVBAPILR-KRWDZBQOSA-N 1 0 318.505 4.280 20 10 DICDRO C[C@H]1COc2ccccc2C[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001308686057 1066155146 /nfs/dbraw/zinc/15/51/46/1066155146.db2.gz XWOKAMZAFZKAEI-LXXRFIIISA-N 1 0 322.452 4.049 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCCO[C@@H]2CC(C)C)cc1Cl ZINC001308710191 1066193005 /nfs/dbraw/zinc/19/30/05/1066193005.db2.gz DAXVVWSOMPRWKT-DOTOQJQBSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC001308717187 1066195447 /nfs/dbraw/zinc/19/54/47/1066195447.db2.gz CNBDBFSXJUDNLH-HXUWFJFHSA-N 1 0 312.432 4.132 20 10 DICDRO CCCC[N@H+](Cc1ccc2nccnc2c1)Cc1ccccc1O ZINC001308714635 1066195598 /nfs/dbraw/zinc/19/55/98/1066195598.db2.gz HNWIRSZIRUBTFC-UHFFFAOYSA-N 1 0 321.424 4.138 20 10 DICDRO CCCC[N@H+](Cc1cccc2c1OCC2)Cc1ccccc1O ZINC001308714622 1066195884 /nfs/dbraw/zinc/19/58/84/1066195884.db2.gz HFDHQRAAHPZCBF-UHFFFAOYSA-N 1 0 311.425 4.129 20 10 DICDRO CCO[C@H](C[NH2+]Cc1cc(C(C)C)ccc1O)c1ccccc1 ZINC001308727762 1066202791 /nfs/dbraw/zinc/20/27/91/1066202791.db2.gz XJNNUARIHCGSIB-HXUWFJFHSA-N 1 0 313.441 4.383 20 10 DICDRO COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(C)cc1O ZINC001308731402 1066206255 /nfs/dbraw/zinc/20/62/55/1066206255.db2.gz HYYVCGHGRJWTBV-KRWDZBQOSA-N 1 0 319.832 4.174 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc(Cl)cc1O)[C@@H](O)c1ccccc1 ZINC001308736039 1066211000 /nfs/dbraw/zinc/21/10/00/1066211000.db2.gz NBLFNTPPPJUWSQ-WMZOPIPTSA-N 1 0 319.832 4.038 20 10 DICDRO COc1cc(C)c(C[N@@H+]2Cc3ccccc3C3(CCC3)C2)c(O)c1 ZINC001308753797 1066227888 /nfs/dbraw/zinc/22/78/88/1066227888.db2.gz AHNMPNYFIJHGII-UHFFFAOYSA-N 1 0 323.436 4.147 20 10 DICDRO COc1cc(C)c(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2)c(O)c1 ZINC001308753237 1066228774 /nfs/dbraw/zinc/22/87/74/1066228774.db2.gz MOBDIDUZNXQABI-LIRRHRJNSA-N 1 0 311.425 4.292 20 10 DICDRO Oc1c(C[NH+]2CC(Cc3ccc(F)cc3)C2)ccc2ccccc21 ZINC001308807608 1066285137 /nfs/dbraw/zinc/28/51/37/1066285137.db2.gz RSEQHNYGJIOLBN-UHFFFAOYSA-N 1 0 321.395 4.359 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC001308825878 1066301280 /nfs/dbraw/zinc/30/12/80/1066301280.db2.gz QGIGIAOQKUSFDC-LWCVALJOSA-N 1 0 300.490 4.160 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C/C=C/c1ccc(F)c(F)c1 ZINC001308845743 1066324305 /nfs/dbraw/zinc/32/43/05/1066324305.db2.gz KLPMUJGQYSXERK-OWOJBTEDSA-N 1 0 309.743 4.127 20 10 DICDRO Oc1cc(Cl)ccc1C[NH+]1CCC2(CCSCC2)CC1 ZINC001308891629 1066372688 /nfs/dbraw/zinc/37/26/88/1066372688.db2.gz RSTVDMQUORZJSH-UHFFFAOYSA-N 1 0 311.878 4.155 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c1 ZINC001308901890 1066380802 /nfs/dbraw/zinc/38/08/02/1066380802.db2.gz JSXHLVLFWDFHGE-AWEZNQCLSA-N 1 0 301.352 4.290 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)c(Cl)c1 ZINC001308906837 1066384613 /nfs/dbraw/zinc/38/46/13/1066384613.db2.gz SICLRGQXNIZADA-HNNXBMFYSA-N 1 0 323.864 4.278 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@@H]2CCCC3(CC3)C2)c1O ZINC001308956973 1066418240 /nfs/dbraw/zinc/41/82/40/1066418240.db2.gz UMDBJVRBZDCTQR-CQSZACIVSA-N 1 0 324.262 4.276 20 10 DICDRO CCOc1cccc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1O ZINC000092483678 185321530 /nfs/dbraw/zinc/32/15/30/185321530.db2.gz KTLGUYIOWUJQQV-ZDUSSCGKSA-N 1 0 301.386 4.110 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)c1nccs1 ZINC000186740175 200001033 /nfs/dbraw/zinc/00/10/33/200001033.db2.gz FBPNUEYFRLTPOG-CHWSQXEVSA-N 1 0 312.438 4.456 20 10 DICDRO COc1cccc(Cl)c1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000188281385 200220882 /nfs/dbraw/zinc/22/08/82/200220882.db2.gz JTIMDWAHZSZSFG-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO Oc1cccc2c1CC[C@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000105487295 194106692 /nfs/dbraw/zinc/10/66/92/194106692.db2.gz XFDIAIIHOBNMQI-HXUWFJFHSA-N 1 0 322.452 4.160 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1OC ZINC000272824570 130067696 /nfs/dbraw/zinc/06/76/96/130067696.db2.gz GKOZLBAAABZFKJ-AWEZNQCLSA-N 1 0 315.413 4.040 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c(O)c1C ZINC000273356963 130111254 /nfs/dbraw/zinc/11/12/54/130111254.db2.gz CXMDGFOHKPPUQI-CVEARBPZSA-N 1 0 303.446 4.151 20 10 DICDRO CC(C)Oc1ccccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000273420899 130119367 /nfs/dbraw/zinc/11/93/67/130119367.db2.gz RZRAHUCMLIUPFR-ZDUSSCGKSA-N 1 0 303.377 4.169 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(O)c1C ZINC000273431225 130120926 /nfs/dbraw/zinc/12/09/26/130120926.db2.gz VTLQWTKMLFBGKH-UONOGXRCSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cnn(-c3ccccc3)c2)c(O)c1C ZINC000273438534 130121968 /nfs/dbraw/zinc/12/19/68/130121968.db2.gz XVHCYDIPHVQKNU-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2-n2ccnc2)c(O)c1C ZINC000273442941 130122328 /nfs/dbraw/zinc/12/23/28/130122328.db2.gz ZDFMLERSRQJSAI-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(O)c1C ZINC000273445467 130122953 /nfs/dbraw/zinc/12/29/53/130122953.db2.gz DZXNODCREOPLES-LBPRGKRZSA-N 1 0 302.443 4.194 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(O)c1 ZINC000273476835 130125857 /nfs/dbraw/zinc/12/58/57/130125857.db2.gz LBCVPGJGIVOBGL-CHWSQXEVSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273492601 130128026 /nfs/dbraw/zinc/12/80/26/130128026.db2.gz XBWXVZPLXJYGJD-FZMZJTMJSA-N 1 0 304.459 4.228 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1cc2c(cc1O)CCCC2 ZINC000273528131 130132149 /nfs/dbraw/zinc/13/21/49/130132149.db2.gz VVHLMRHAUXRBRD-RHSMWYFYSA-N 1 0 315.457 4.023 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(O)c1C ZINC000273521623 130132371 /nfs/dbraw/zinc/13/23/71/130132371.db2.gz UNZIYUMWSHKMGC-KGLIPLIRSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2-n2cccn2)c(O)c1C ZINC000273588481 130139779 /nfs/dbraw/zinc/13/97/79/130139779.db2.gz ONNXXPFJKTVHCK-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCOC)c1ccc(C)o1)c1ccccc1O ZINC000274807681 130263169 /nfs/dbraw/zinc/26/31/69/130263169.db2.gz XDJZLLKXUBLYQX-HZPDHXFCSA-N 1 0 303.402 4.112 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(C)cc1O ZINC000285854650 131206062 /nfs/dbraw/zinc/20/60/62/131206062.db2.gz ZFUWQDOZEBQAKU-XHDPSFHLSA-N 1 0 306.356 4.176 20 10 DICDRO Cc1ccnc([C@@H](C)[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c1 ZINC000286034473 131216056 /nfs/dbraw/zinc/21/60/56/131216056.db2.gz KGYJQVWAIBIQEE-GOSISDBHSA-N 1 0 323.484 4.477 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)c(O)c1 ZINC000286888147 131254260 /nfs/dbraw/zinc/25/42/60/131254260.db2.gz CWFDUMPWBRNQML-CVEARBPZSA-N 1 0 321.424 4.298 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccccc1O ZINC000286930952 131256612 /nfs/dbraw/zinc/25/66/12/131256612.db2.gz GGJCMFUPWMNWAR-SJORKVTESA-N 1 0 319.832 4.210 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)C[C@@H](C)O)c1cc(Cl)cc(Cl)c1[O-] ZINC000287712692 131296940 /nfs/dbraw/zinc/29/69/40/131296940.db2.gz OEIHBBQBIKONFF-RBZYPMLTSA-N 1 0 320.260 4.147 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1)CC2 ZINC000296933147 131992658 /nfs/dbraw/zinc/99/26/58/131992658.db2.gz QBRJCKLIUUQUPW-LZQZEXGQSA-N 1 0 323.436 4.137 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297144908 132001415 /nfs/dbraw/zinc/00/14/15/132001415.db2.gz ZRTPFEPZIVKPHI-IRXDYDNUSA-N 1 0 309.409 4.055 20 10 DICDRO Cc1ccc(OC(F)F)c(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000297941725 132041231 /nfs/dbraw/zinc/04/12/31/132041231.db2.gz YCNNRFKDEDPNGW-CQSZACIVSA-N 1 0 319.351 4.079 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1 ZINC000119653087 132135601 /nfs/dbraw/zinc/13/56/01/132135601.db2.gz QWMBHMODQYPIPA-GHMZBOCLSA-N 1 0 307.340 4.091 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(F)c2)c1 ZINC000121505434 132155904 /nfs/dbraw/zinc/15/59/04/132155904.db2.gz ZLSKOCYZKAUVNH-GHMZBOCLSA-N 1 0 307.340 4.091 20 10 DICDRO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000079249409 331681562 /nfs/dbraw/zinc/68/15/62/331681562.db2.gz WCJJRPZJKMGCMP-OAHLLOKOSA-N 1 0 311.425 4.260 20 10 DICDRO Fc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCO3)CCS2 ZINC000043288553 332266091 /nfs/dbraw/zinc/26/60/91/332266091.db2.gz FQTAREULTQHLNR-MRXNPFEDSA-N 1 0 315.413 4.087 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000184611547 333198866 /nfs/dbraw/zinc/19/88/66/333198866.db2.gz XDNWXGDQNZNIDY-KBPBESRZSA-N 1 0 315.461 4.372 20 10 DICDRO CCOCc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1 ZINC000184989955 333203108 /nfs/dbraw/zinc/20/31/08/333203108.db2.gz HVVDTFMAQDWMIJ-ZDUSSCGKSA-N 1 0 319.832 4.433 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOc2c(Cl)cccc21)c1cc(F)ccc1O ZINC000185185516 333205377 /nfs/dbraw/zinc/20/53/77/333205377.db2.gz VXDHWYBDCHVKMZ-BMIGLBTASA-N 1 0 321.779 4.359 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccccc1 ZINC000186034315 333216543 /nfs/dbraw/zinc/21/65/43/333216543.db2.gz YWMRGMLRZIWBLY-MLGOLLRUSA-N 1 0 305.805 4.084 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccccc1O ZINC000120564814 333290450 /nfs/dbraw/zinc/29/04/50/333290450.db2.gz IHMDNZWNASPHKG-HNNXBMFYSA-N 1 0 307.340 4.235 20 10 DICDRO Cc1cc(C)n(CCC[NH2+][C@@H](C)c2ccc3ccccc3c2O)n1 ZINC000184872236 333367813 /nfs/dbraw/zinc/36/78/13/333367813.db2.gz TYMYSQKJUGIOFV-INIZCTEOSA-N 1 0 323.440 4.100 20 10 DICDRO CCc1cnc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)s1 ZINC000185584462 333370496 /nfs/dbraw/zinc/37/04/96/333370496.db2.gz XCEJVVGIZONBEJ-LBPRGKRZSA-N 1 0 312.438 4.415 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CCCCO)c1ccc(N2CCCCC2)c(F)c1 ZINC000296373678 335144023 /nfs/dbraw/zinc/14/40/23/335144023.db2.gz JIEHMLSLDQIFPQ-JKSUJKDBSA-N 1 0 322.468 4.018 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c(O)c1 ZINC000285331965 334147071 /nfs/dbraw/zinc/14/70/71/334147071.db2.gz UHOWWBFCMCLGJW-CVEARBPZSA-N 1 0 303.446 4.151 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccnc1)c1cc(Cl)cc(Cl)c1[O-] ZINC000286989671 334155412 /nfs/dbraw/zinc/15/54/12/334155412.db2.gz PAERAZYJPSUCCK-CQSZACIVSA-N 1 0 311.212 4.335 20 10 DICDRO COc1ccc2[nH]cc(C3=CCN(c4cc[nH+]c(C)c4)CC3)c2c1 ZINC000302221996 336354768 /nfs/dbraw/zinc/35/47/68/336354768.db2.gz OIFCRRFYFJCHBC-UHFFFAOYSA-N 1 0 319.408 4.174 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cc(F)ccc1O ZINC000368234441 336840975 /nfs/dbraw/zinc/84/09/75/336840975.db2.gz KTWXBSZVMWPXIV-DZGCQCFKSA-N 1 0 307.409 4.064 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)c1 ZINC000373257116 336954659 /nfs/dbraw/zinc/95/46/59/336954659.db2.gz TWWUQQJHRLTVFA-KNBMTAEXSA-N 1 0 311.425 4.129 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3cnn(C(C)C)c32)c1 ZINC000375171309 337005123 /nfs/dbraw/zinc/00/51/23/337005123.db2.gz OCMLDNRTERCULZ-RHSMWYFYSA-N 1 0 313.445 4.206 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c(O)c1 ZINC000375344663 337008542 /nfs/dbraw/zinc/00/85/42/337008542.db2.gz HNCJMPGWGAVHPV-MLGOLLRUSA-N 1 0 301.361 4.014 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000193901869 337079966 /nfs/dbraw/zinc/07/99/66/337079966.db2.gz CRWSVMUIGDGVID-UONOGXRCSA-N 1 0 313.401 4.073 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](c2ccco2)c2ccccc2)cc1C ZINC000174249386 337140018 /nfs/dbraw/zinc/14/00/18/337140018.db2.gz RQLZQHGWDDAHKH-FQEVSTJZSA-N 1 0 307.393 4.481 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1cc(F)ccc1O ZINC000185153094 337202353 /nfs/dbraw/zinc/20/23/53/337202353.db2.gz NSFBLJUVAJXLFM-VLIAUNLRSA-N 1 0 322.383 4.367 20 10 DICDRO COc1ccc(C(C)(C)[NH2+]Cc2cc(C)c(C)cc2O)cc1F ZINC000527780684 337763662 /nfs/dbraw/zinc/76/36/62/337763662.db2.gz GOTKXILGUKUPDV-UHFFFAOYSA-N 1 0 317.404 4.182 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(Cl)cn2)cc1 ZINC000182113438 520288483 /nfs/dbraw/zinc/28/84/83/520288483.db2.gz DOYRBKGWPJMIJF-ZDUSSCGKSA-N 1 0 303.837 4.042 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@H](C)c2cc(C)ccc2O)on1 ZINC000185561770 521633940 /nfs/dbraw/zinc/63/39/40/521633940.db2.gz GGZHMQOKJBIEGU-CYBMUJFWSA-N 1 0 302.418 4.443 20 10 DICDRO CCc1cnc(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)s1 ZINC000130533016 522039913 /nfs/dbraw/zinc/03/99/13/522039913.db2.gz BTEOJLWNGWNRAF-INIZCTEOSA-N 1 0 303.475 4.012 20 10 DICDRO CC[C@H]([NH2+][C@H](C)C[C@H](O)c1ccc(F)cc1)c1ccccc1O ZINC000156418573 522733161 /nfs/dbraw/zinc/73/31/61/522733161.db2.gz POURYCSJVBJQIQ-FMEYXAORSA-N 1 0 317.404 4.084 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1O ZINC000156145856 522737666 /nfs/dbraw/zinc/73/76/66/522737666.db2.gz RYXLPUQXBCAFOL-BEFAXECRSA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(COC)cc1)c1ccc(N(C)C)cc1 ZINC000124420310 522875328 /nfs/dbraw/zinc/87/53/28/522875328.db2.gz LCDBYILRVHMZSR-HXUWFJFHSA-N 1 0 312.457 4.140 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)C[C@H](O)c1ccc(F)cc1)c1ccccc1O ZINC000156418696 522932400 /nfs/dbraw/zinc/93/24/00/522932400.db2.gz POURYCSJVBJQIQ-XVSDVWIESA-N 1 0 317.404 4.084 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)C[C@H](O)c1cccs1)c1ccccc1O ZINC000156420627 522934073 /nfs/dbraw/zinc/93/40/73/522934073.db2.gz OCYBNUOPJOGYDS-XPKDYRNWSA-N 1 0 305.443 4.007 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1O ZINC000156145976 522936547 /nfs/dbraw/zinc/93/65/47/522936547.db2.gz RYXLPUQXBCAFOL-DNVCBOLYSA-N 1 0 321.424 4.380 20 10 DICDRO COc1ccc(C[NH2+]C2(c3nccs3)CCCC2)cc1C ZINC000265246390 524068712 /nfs/dbraw/zinc/06/87/12/524068712.db2.gz NAESWPIAIOZCPG-UHFFFAOYSA-N 1 0 302.443 4.019 20 10 DICDRO C[C@H](CC1CC1)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000157730009 524097669 /nfs/dbraw/zinc/09/76/69/524097669.db2.gz OAOAZOUCMHVCDR-CYBMUJFWSA-N 1 0 324.415 4.035 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3c2cccc3Cl)c1 ZINC000182472021 524765761 /nfs/dbraw/zinc/76/57/61/524765761.db2.gz ITMVCCOUJHTCFH-DIFFPNOSSA-N 1 0 317.816 4.392 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Cl)cc2F)c1 ZINC000187580707 524771489 /nfs/dbraw/zinc/77/14/89/524771489.db2.gz LHWLACQKXUDGSO-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)c1 ZINC000157988404 525364232 /nfs/dbraw/zinc/36/42/32/525364232.db2.gz LIKPQUUYSPJYBF-KNBMTAEXSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1cncs1 ZINC000157500575 525445956 /nfs/dbraw/zinc/44/59/56/525445956.db2.gz QPBXMMUWMHMFKJ-HNNXBMFYSA-N 1 0 315.486 4.230 20 10 DICDRO C[C@H]([NH2+]Cc1ccn(C)c1)c1ccc(N2CCCCC2)c(F)c1 ZINC000158461511 525469722 /nfs/dbraw/zinc/46/97/22/525469722.db2.gz XSJWKQVWYIYDOA-HNNXBMFYSA-N 1 0 315.436 4.005 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)c1cc(F)ccc1O ZINC000158057098 525575536 /nfs/dbraw/zinc/57/55/36/525575536.db2.gz WFDXMSGLOZMHRL-CRFBAAHOSA-N 1 0 315.388 4.102 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(OC(F)F)cc1)c1ccccc1O ZINC000179874576 525610125 /nfs/dbraw/zinc/61/01/25/525610125.db2.gz ZRJRMMISVSDDJB-NWDGAFQWSA-N 1 0 307.340 4.405 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000158129725 525647777 /nfs/dbraw/zinc/64/77/77/525647777.db2.gz YSPWOLNXFIPPTH-BSIFCXSSSA-N 1 0 324.468 4.324 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1[N+](=O)[O-] ZINC000186093193 525747785 /nfs/dbraw/zinc/74/77/85/525747785.db2.gz LZBFWFJXPFMRPU-VXGBXAGGSA-N 1 0 318.348 4.160 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)CCC2 ZINC000364950807 527112997 /nfs/dbraw/zinc/11/29/97/527112997.db2.gz KAAVFIHVPCPQHU-BXUZGUMPSA-N 1 0 302.443 4.194 20 10 DICDRO CCSc1cc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)ccn1 ZINC000285120867 535731686 /nfs/dbraw/zinc/73/16/86/535731686.db2.gz LBNSFOCHBPAYRZ-CQSZACIVSA-N 1 0 316.470 4.367 20 10 DICDRO CCSc1cc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)ccn1 ZINC000275145670 535732222 /nfs/dbraw/zinc/73/22/22/535732222.db2.gz UIUIYXIJJDDENI-AWEZNQCLSA-N 1 0 316.470 4.367 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(N(C)C)cc1 ZINC000297340832 535805458 /nfs/dbraw/zinc/80/54/58/535805458.db2.gz OMPUMAAACMJYOE-MRXNPFEDSA-N 1 0 321.827 4.181 20 10 DICDRO CC[C@H]([NH2+]C1(c2nc(C)cs2)CCC1)c1ccccc1O ZINC000274751080 535892580 /nfs/dbraw/zinc/89/25/80/535892580.db2.gz HOEMMNGTJTVAFX-AWEZNQCLSA-N 1 0 302.443 4.277 20 10 DICDRO CSC1CCC(C[NH2+]Cc2c(O)cc(C)cc2Cl)CC1 ZINC001474267409 1061831522 /nfs/dbraw/zinc/83/15/22/1061831522.db2.gz WQJYZTCMHWTBGM-UHFFFAOYSA-N 1 0 313.894 4.365 20 10 DICDRO CC(C)=CCC[C@@H](C)[NH2+]Cc1cc(Br)ccc1O ZINC001258083478 1063504410 /nfs/dbraw/zinc/50/44/10/1063504410.db2.gz KNHFLWXSDZRHAK-GFCCVEGCSA-N 1 0 312.251 4.379 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCSc2ccc(F)cc21)c1ccccc1O ZINC000036968717 1035911001 /nfs/dbraw/zinc/91/10/01/1035911001.db2.gz XHOVFKLGRWPOLP-ABAIWWIYSA-N 1 0 303.402 4.419 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCSc2ccc(F)cc21)c1ccccc1O ZINC000036968713 1035911186 /nfs/dbraw/zinc/91/11/86/1035911186.db2.gz XHOVFKLGRWPOLP-IAQYHMDHSA-N 1 0 303.402 4.419 20 10 DICDRO Oc1ccccc1C[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000037073325 1035936375 /nfs/dbraw/zinc/93/63/75/1035936375.db2.gz NTKVASXRAIJOID-AWEZNQCLSA-N 1 0 305.830 4.372 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2cc(C)sc2C)c1O ZINC000037122995 1035943056 /nfs/dbraw/zinc/94/30/56/1035943056.db2.gz PHMXNDISBZOZTA-LBPRGKRZSA-N 1 0 305.443 4.320 20 10 DICDRO COc1ccc(N2CCC[N@H+](C[C@@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC001167107686 1036093262 /nfs/dbraw/zinc/09/32/62/1036093262.db2.gz GRUQKKJSWLZDIS-QZTJIDSGSA-N 1 0 316.489 4.034 20 10 DICDRO c1cc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000120781329 1036123013 /nfs/dbraw/zinc/12/30/13/1036123013.db2.gz DDMRGJVDDVSNRT-IBGZPJMESA-N 1 0 310.441 4.437 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000160533639 1037185738 /nfs/dbraw/zinc/18/57/38/1037185738.db2.gz BUFXTWCJVZHKOY-MRXNPFEDSA-N 1 0 311.473 4.060 20 10 DICDRO CC(C)c1ccccc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167431070 1037260347 /nfs/dbraw/zinc/26/03/47/1037260347.db2.gz FNTLZBHTWCHQRI-UHFFFAOYSA-N 1 0 323.484 4.174 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)c1 ZINC000175987719 1037492250 /nfs/dbraw/zinc/49/22/50/1037492250.db2.gz SPVMVWFIZGHCBJ-UHFFFAOYSA-N 1 0 321.367 4.094 20 10 DICDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1c(O)cccc1Br ZINC000706842348 1037500203 /nfs/dbraw/zinc/50/02/03/1037500203.db2.gz ASLXXZDWHGRFJY-FZMZJTMJSA-N 1 0 312.251 4.213 20 10 DICDRO CCC(C)(C)[C@H](C)[NH2+]Cc1c(O)cccc1Br ZINC000706854345 1037502502 /nfs/dbraw/zinc/50/25/02/1037502502.db2.gz ZGUKBTZHEZAVIA-JTQLQIEISA-N 1 0 300.240 4.069 20 10 DICDRO C[C@@H]1CC[C@H]([NH2+]Cc2c(O)cccc2Br)C[C@H]1C ZINC000706843712 1037502577 /nfs/dbraw/zinc/50/25/77/1037502577.db2.gz WTLKAFWGNQEHJP-UTUOFQBUSA-N 1 0 312.251 4.069 20 10 DICDRO CCc1nc(CC[NH2+][C@H](C)c2ccc(N(C)CC)cc2)cs1 ZINC000157063075 1037525378 /nfs/dbraw/zinc/52/53/78/1037525378.db2.gz ZNDLHRGHUWNNLN-CQSZACIVSA-N 1 0 317.502 4.055 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)c(O)c1C ZINC000834883759 1037699027 /nfs/dbraw/zinc/69/90/27/1037699027.db2.gz HCEKZPHDFYGAQV-FZMZJTMJSA-N 1 0 302.245 4.244 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(OC)c(F)c1)c1ccc(F)cc1[O-] ZINC000796675976 1037804037 /nfs/dbraw/zinc/80/40/37/1037804037.db2.gz OLYNVVOHQYCMQU-ZBEGNZNMSA-N 1 0 321.367 4.481 20 10 DICDRO C[N@H+](Cc1c[nH]c2cccc(Cl)c12)Cc1ccccc1O ZINC001140446945 1037938671 /nfs/dbraw/zinc/93/86/71/1037938671.db2.gz QGCJBPDRULKUQD-UHFFFAOYSA-N 1 0 300.789 4.159 20 10 DICDRO CCC(CC)(CC)[NH2+]Cc1cccc(Br)c1[O-] ZINC000086642181 1038174645 /nfs/dbraw/zinc/17/46/45/1038174645.db2.gz LAGHDDNRABOVND-UHFFFAOYSA-N 1 0 300.240 4.213 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2cc(Cl)ccc2Cl)cc1 ZINC000229185951 1038250150 /nfs/dbraw/zinc/25/01/50/1038250150.db2.gz DFZWMBVXMZPJBP-UHFFFAOYSA-N 1 0 309.240 4.349 20 10 DICDRO CCC1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCOCC1 ZINC000761338297 1038274403 /nfs/dbraw/zinc/27/44/03/1038274403.db2.gz ROPZIVCENGCZCZ-UHFFFAOYSA-N 1 0 311.425 4.108 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]C2CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000171128473 1038339556 /nfs/dbraw/zinc/33/95/56/1038339556.db2.gz 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CCOCc1ccc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000815558441 1041962990 /nfs/dbraw/zinc/96/29/90/1041962990.db2.gz CYOXZCHXSIURBR-MRXNPFEDSA-N 1 0 313.441 4.396 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]Cc1nccs1 ZINC000815562495 1041963226 /nfs/dbraw/zinc/96/32/26/1041963226.db2.gz GXDPHWYLPKOAKT-KRWDZBQOSA-N 1 0 324.449 4.312 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCOc2ccccc2F)c(O)c1 ZINC000815559909 1041963320 /nfs/dbraw/zinc/96/33/20/1041963320.db2.gz SZZOUPMZBXOXQI-OAHLLOKOSA-N 1 0 317.404 4.268 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C2CCN(c3ccccc3)CC2)c(O)c1 ZINC000815564103 1041963596 /nfs/dbraw/zinc/96/35/96/1041963596.db2.gz XIZHCEHEPBFSCO-QGZVFWFLSA-N 1 0 324.468 4.329 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]Cc1ccoc1 ZINC000815563795 1041963788 /nfs/dbraw/zinc/96/37/88/1041963788.db2.gz OIOGSDQWJMEDDP-LJQANCHMSA-N 1 0 307.393 4.449 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc3ccccc3n2)c(O)c1 ZINC000815566726 1041964162 /nfs/dbraw/zinc/96/41/62/1041964162.db2.gz CUKCWDQXXRYSOQ-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000815580548 1041965703 /nfs/dbraw/zinc/96/57/03/1041965703.db2.gz MGTSTIKGQISDNL-ZWKOTPCHSA-N 1 0 324.468 4.329 20 10 DICDRO CSC[C@H](C)[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815582002 1041967263 /nfs/dbraw/zinc/96/72/63/1041967263.db2.gz VHGIPCFIWIHRPK-YJBOKZPZSA-N 1 0 315.482 4.407 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2nc3c(cccc3C)o2)c(O)c1 ZINC000815585907 1041967942 /nfs/dbraw/zinc/96/79/42/1041967942.db2.gz VLYAGACQETXCTP-OAHLLOKOSA-N 1 0 324.424 4.352 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cc(F)ccc2F)c(O)c1 ZINC000815585612 1041968515 /nfs/dbraw/zinc/96/85/15/1041968515.db2.gz MWPZXNVXWSRZAO-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](O)c2ccccc2Cl)c(O)c1 ZINC000815594053 1041969493 /nfs/dbraw/zinc/96/94/93/1041969493.db2.gz DTIWOOPAVSGDTI-DYVFJYSZSA-N 1 0 319.832 4.047 20 10 DICDRO CS[C@H](C)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815597950 1041970068 /nfs/dbraw/zinc/97/00/68/1041970068.db2.gz JIPGCAUGKDTHIS-QAPCUYQASA-N 1 0 315.482 4.407 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C2CCC(OC(C)C)CC2)c(O)c1 ZINC000815598201 1041971003 /nfs/dbraw/zinc/97/10/03/1041971003.db2.gz PAJWBVYIDOYJKF-GTPINHCMSA-N 1 0 305.462 4.396 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccc3ccccc3n2)c(O)c1 ZINC000815570360 1041971658 /nfs/dbraw/zinc/97/16/58/1041971658.db2.gz AJIOFBFLIHNWRA-INIZCTEOSA-N 1 0 320.436 4.451 20 10 DICDRO CO[C@H](C)CC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815573177 1041972766 /nfs/dbraw/zinc/97/27/66/1041972766.db2.gz ALGJVEKPPKRHHC-APWZRJJASA-N 1 0 313.441 4.081 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccc(F)c(F)c2F)c(O)c1 ZINC000815615477 1041974012 /nfs/dbraw/zinc/97/40/12/1041974012.db2.gz QHOIUMBHQPGLBB-LBPRGKRZSA-N 1 0 323.358 4.320 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c(O)c1 ZINC000815619376 1041975184 /nfs/dbraw/zinc/97/51/84/1041975184.db2.gz MCKNVQLNZGGAMQ-XJKSGUPXSA-N 1 0 315.388 4.323 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]C[C@H]1CCC=CO1 ZINC000815618999 1041976156 /nfs/dbraw/zinc/97/61/56/1041976156.db2.gz ZMQNIDVLENALMC-UYAOXDASSA-N 1 0 323.436 4.348 20 10 DICDRO Cc1cc(C[N@@H+]2Cc3ccccc3OC(C)(C)C2)ccc1N(C)C ZINC001170795401 1041980943 /nfs/dbraw/zinc/98/09/43/1041980943.db2.gz SWPOTNRSSFVCCK-UHFFFAOYSA-N 1 0 324.468 4.234 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1cc(F)ccc1O ZINC000815637894 1041982322 /nfs/dbraw/zinc/98/23/22/1041982322.db2.gz ITIMAZAJYMBGDJ-NSHDSACASA-N 1 0 309.331 4.494 20 10 DICDRO COCC1(CC[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CCC1 ZINC000815641632 1041982588 /nfs/dbraw/zinc/98/25/88/1041982588.db2.gz DHIIBMAHGXQSOF-HNNXBMFYSA-N 1 0 317.473 4.128 20 10 DICDRO COCC1(CC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CCC1 ZINC000815642363 1041982770 /nfs/dbraw/zinc/98/27/70/1041982770.db2.gz ZZSSSFXXXUZTPT-ZDUSSCGKSA-N 1 0 311.853 4.211 20 10 DICDRO COC1(CC[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CCC1 ZINC000815642150 1041983244 /nfs/dbraw/zinc/98/32/44/1041983244.db2.gz TVTCXBMMBPQUFF-QGZVFWFLSA-N 1 0 316.489 4.287 20 10 DICDRO COC1(CC[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CCC1 ZINC000815642149 1041983321 /nfs/dbraw/zinc/98/33/21/1041983321.db2.gz TVTCXBMMBPQUFF-KRWDZBQOSA-N 1 0 316.489 4.287 20 10 DICDRO CC[C@H]([NH2+][C@@H](CC)C(C)(C)O)c1ccc(C(F)(F)F)cc1O ZINC000815651952 1041986353 /nfs/dbraw/zinc/98/63/53/1041986353.db2.gz JWRGPRXMCFMIJF-JSGCOSHPSA-N 1 0 319.367 4.001 20 10 DICDRO C[N@H+](Cc1ccc(Cl)nc1)Cc1ccc2ccccc2c1O ZINC000816483948 1042056243 /nfs/dbraw/zinc/05/62/43/1042056243.db2.gz LFELFMRBILIIJA-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1ccc3ccccc3c1O)CC2 ZINC000816496943 1042058013 /nfs/dbraw/zinc/05/80/13/1042058013.db2.gz FXHPIFUYZIBPDH-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO COc1ccc(C)cc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816531657 1042062180 /nfs/dbraw/zinc/06/21/80/1042062180.db2.gz YZIUSGHGXVMCSS-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO Oc1c(C[NH2+]CCCOc2ccccc2)ccc2ccccc21 ZINC000816530590 1042062224 /nfs/dbraw/zinc/06/22/24/1042062224.db2.gz NIZPRBLJOMOAFS-UHFFFAOYSA-N 1 0 307.393 4.104 20 10 DICDRO Oc1c(C[NH2+][C@H]2C[C@@H]2Cc2ccccc2)ccc2ccccc21 ZINC000816551487 1042064755 /nfs/dbraw/zinc/06/47/55/1042064755.db2.gz CWRGNWQKKHDKCD-ICSRJNTNSA-N 1 0 303.405 4.266 20 10 DICDRO Oc1c(C[NH2+][C@@H]2C[C@@H]2Cc2ccccc2)ccc2ccccc21 ZINC000816551486 1042064838 /nfs/dbraw/zinc/06/48/38/1042064838.db2.gz CWRGNWQKKHDKCD-AZUAARDMSA-N 1 0 303.405 4.266 20 10 DICDRO C[NH+](C)Cc1cccc(NCc2ccc3ccccc3c2O)c1 ZINC000816522940 1042064990 /nfs/dbraw/zinc/06/49/90/1042064990.db2.gz VKZIASKKFNGNKL-UHFFFAOYSA-N 1 0 306.409 4.219 20 10 DICDRO Oc1c(C[NH2+]CCc2ccc(F)c(F)c2)ccc2ccccc21 ZINC000816588458 1042066447 /nfs/dbraw/zinc/06/64/47/1042066447.db2.gz OYWDSYKGHOOPPO-UHFFFAOYSA-N 1 0 313.347 4.156 20 10 DICDRO CC(C)[C@@H]1OCCC[C@H]1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816555261 1042067049 /nfs/dbraw/zinc/06/70/49/1042067049.db2.gz YQCORIOIEAHRKP-PXNSSMCTSA-N 1 0 313.441 4.086 20 10 DICDRO CC1(C)CC[N@H+](Cc2ccc3ccccc3c2O)CCS1 ZINC000816594175 1042067279 /nfs/dbraw/zinc/06/72/79/1042067279.db2.gz RVTLBMQPXQUNEC-UHFFFAOYSA-N 1 0 301.455 4.263 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)ccc2ccccc21 ZINC000816592160 1042067375 /nfs/dbraw/zinc/06/73/75/1042067375.db2.gz AXTQWBUSQNWATO-GFCCVEGCSA-N 1 0 309.331 4.320 20 10 DICDRO OCCC[C@H]([NH2+]Cc1ccc2ccccc2c1O)c1ccccc1 ZINC000816552159 1042067822 /nfs/dbraw/zinc/06/78/22/1042067822.db2.gz CMKHMPWWGLYJJY-FQEVSTJZSA-N 1 0 321.420 4.149 20 10 DICDRO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816560677 1042068347 /nfs/dbraw/zinc/06/83/47/1042068347.db2.gz XGBZDIWYSFZPIJ-QZTJIDSGSA-N 1 0 313.441 4.229 20 10 DICDRO C[C@H](C[N@H+](C)Cc1ccc2ccccc2c1O)c1nccs1 ZINC000816568858 1042068738 /nfs/dbraw/zinc/06/87/38/1042068738.db2.gz RXCRFCYWOPBZRD-CYBMUJFWSA-N 1 0 312.438 4.237 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+]Cc1ccc3ccccc3c1O)CCC2 ZINC000816566019 1042068980 /nfs/dbraw/zinc/06/89/80/1042068980.db2.gz IYJYGUKTCPDYOC-MRXNPFEDSA-N 1 0 324.449 4.478 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@H](Cc3ccncc3)C2)ccc2ccccc21 ZINC000816566606 1042069318 /nfs/dbraw/zinc/06/93/18/1042069318.db2.gz ADTJMVLEHURJNJ-QGZVFWFLSA-N 1 0 318.420 4.005 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000816625148 1042070070 /nfs/dbraw/zinc/07/00/70/1042070070.db2.gz UKLFRWQJBPYXQH-FUKZOUPISA-N 1 0 323.770 4.360 20 10 DICDRO Oc1c(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)ccc2ccccc21 ZINC000816649767 1042075809 /nfs/dbraw/zinc/07/58/09/1042075809.db2.gz JVAXKWKETQBURW-ICSRJNTNSA-N 1 0 303.405 4.439 20 10 DICDRO CCOCCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000165145036 1042100091 /nfs/dbraw/zinc/10/00/91/1042100091.db2.gz CMDCURRDEBDFQL-QGZVFWFLSA-N 1 0 304.478 4.144 20 10 DICDRO COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000817576257 1042116487 /nfs/dbraw/zinc/11/64/87/1042116487.db2.gz OXXWLLIPHMAYQK-ZDUSSCGKSA-N 1 0 318.848 4.265 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@H]2CC23CCSCC3)c2c1c(F)ccc2O ZINC000817588263 1042118379 /nfs/dbraw/zinc/11/83/79/1042118379.db2.gz DFEIEPSYCMIGDI-BZPMIXESSA-N 1 0 321.461 4.203 20 10 DICDRO CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CCO1 ZINC000817585676 1042118784 /nfs/dbraw/zinc/11/87/84/1042118784.db2.gz GUYLNJWGZLBTKM-XKGZKEIXSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1cc2c(s1)CCCC2 ZINC000817956145 1042131561 /nfs/dbraw/zinc/13/15/61/1042131561.db2.gz RRKIXRQMLWDBIR-CYBMUJFWSA-N 1 0 300.471 4.102 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(OC(F)F)cc1 ZINC000817955822 1042131575 /nfs/dbraw/zinc/13/15/75/1042131575.db2.gz IOAGTSLXBBCIDB-QGZVFWFLSA-N 1 0 320.383 4.154 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000817956729 1042131678 /nfs/dbraw/zinc/13/16/78/1042131678.db2.gz BFYZMTFXGGUGGX-QFBILLFUSA-N 1 0 314.860 4.391 20 10 DICDRO CC(C)c1ccc([C@H](N)C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000817954213 1042131832 /nfs/dbraw/zinc/13/18/32/1042131832.db2.gz WBYVMHOFUKMMJE-SCLBCKFNSA-N 1 0 316.420 4.005 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccc(Cl)c1[O-] ZINC000817963109 1042132448 /nfs/dbraw/zinc/13/24/48/1042132448.db2.gz NKXJSGJSNUHZFR-SJCJKPOMSA-N 1 0 318.848 4.306 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1OC(F)F ZINC000817956359 1042132685 /nfs/dbraw/zinc/13/26/85/1042132685.db2.gz XEYQKDPZDKNFHA-MRXNPFEDSA-N 1 0 320.383 4.154 20 10 DICDRO C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]CCc1ccc(N)cc1 ZINC000817957825 1042132725 /nfs/dbraw/zinc/13/27/25/1042132725.db2.gz PJSFHNPFGMGONE-CYBMUJFWSA-N 1 0 322.374 4.051 20 10 DICDRO CCOc1cccc2cc([C@H](C)[NH2+]CCc3ccc(N)cc3)oc21 ZINC000817958737 1042132735 /nfs/dbraw/zinc/13/27/35/1042132735.db2.gz XSZKIOLWQMONRS-AWEZNQCLSA-N 1 0 324.424 4.307 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)c(O)c1 ZINC000817967186 1042133545 /nfs/dbraw/zinc/13/35/45/1042133545.db2.gz DRLDUHGLAFBYBN-KDOFPFPSSA-N 1 0 310.441 4.319 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(Cl)cc(Cl)c1[O-] ZINC000817976084 1042134555 /nfs/dbraw/zinc/13/45/55/1042134555.db2.gz FNJKQOCZDGBKTL-QMTHXVAHSA-N 1 0 319.276 4.257 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1cc(Cl)ccc1O ZINC000817968097 1042135209 /nfs/dbraw/zinc/13/52/09/1042135209.db2.gz PAHCCBYFZLFPSY-PIGZYNQJSA-N 1 0 316.832 4.356 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)c(O)c1C ZINC000817977398 1042136062 /nfs/dbraw/zinc/13/60/62/1042136062.db2.gz JGVHHWNZRBXZHD-OAHLLOKOSA-N 1 0 310.441 4.218 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1[O-] ZINC000817983354 1042136251 /nfs/dbraw/zinc/13/62/51/1042136251.db2.gz MQNWUTMNGMFYDD-QZTJIDSGSA-N 1 0 316.420 4.052 20 10 DICDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(Cl)ccc2O)CCO1 ZINC000756873747 1042147146 /nfs/dbraw/zinc/14/71/46/1042147146.db2.gz JKKBQHWYWLTMFZ-BPLDGKMQSA-N 1 0 311.853 4.290 20 10 DICDRO CCCCc1ccc(N(C)C(=O)c2ccccc2CC[NH2+]C)cc1 ZINC000818515762 1042153471 /nfs/dbraw/zinc/15/34/71/1042153471.db2.gz VHABESSEAGDCQX-UHFFFAOYSA-N 1 0 324.468 4.068 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)cc1 ZINC000165885420 1042189785 /nfs/dbraw/zinc/18/97/85/1042189785.db2.gz AOVWEWXXBDGPGF-QZTJIDSGSA-N 1 0 324.468 4.243 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000319705773 1042218147 /nfs/dbraw/zinc/21/81/47/1042218147.db2.gz NHFQYYUSRTVYRA-KBPBESRZSA-N 1 0 315.413 4.211 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000319705774 1042218269 /nfs/dbraw/zinc/21/82/69/1042218269.db2.gz NHFQYYUSRTVYRA-KGLIPLIRSA-N 1 0 315.413 4.211 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCn2ccc3ccccc32)c(O)c1 ZINC000320159007 1042312802 /nfs/dbraw/zinc/31/28/02/1042312802.db2.gz KQIBCYJVMSSMJJ-INIZCTEOSA-N 1 0 308.425 4.396 20 10 DICDRO CC(C)C[N@H+](Cc1ccccn1)Cc1ccc(Cl)cc1O ZINC001207630488 1042316000 /nfs/dbraw/zinc/31/60/00/1042316000.db2.gz CYRYVSXMHDUWER-UHFFFAOYSA-N 1 0 304.821 4.099 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)cc1 ZINC000236957355 1042427207 /nfs/dbraw/zinc/42/72/07/1042427207.db2.gz WFLZUTGMNGGIAK-UHFFFAOYSA-N 1 0 312.432 4.451 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000248576384 1042442576 /nfs/dbraw/zinc/44/25/76/1042442576.db2.gz TXSFGOGCSSJSIC-MOXGXCLJSA-N 1 0 312.457 4.124 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccccc2Cl)c1O ZINC000894145390 1042472065 /nfs/dbraw/zinc/47/20/65/1042472065.db2.gz CCNOYNYITXOOBW-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](c2cccs2)C2CC2)c1O ZINC000894161213 1042476186 /nfs/dbraw/zinc/47/61/86/1042476186.db2.gz REZRZEWGRFPDCP-INIZCTEOSA-N 1 0 303.427 4.012 20 10 DICDRO CC[C@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc(OC)cc3)CC2)C1 ZINC000237071782 1042491175 /nfs/dbraw/zinc/49/11/75/1042491175.db2.gz GULRZCPFEFDLEP-FUHWJXTLSA-N 1 0 316.489 4.222 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)cc(OC)c1)c1ccc(C)cc1O ZINC000280011082 1042560958 /nfs/dbraw/zinc/56/09/58/1042560958.db2.gz GRUJPFRKHCMKCD-KRWDZBQOSA-N 1 0 303.377 4.089 20 10 DICDRO CC[C@H]([NH2+][C@H](C)C[C@@H](O)c1cccs1)c1ccc(C)cc1O ZINC000280099156 1042564152 /nfs/dbraw/zinc/56/41/52/1042564152.db2.gz MYLKAULFSQTSQE-UKPHBRMFSA-N 1 0 319.470 4.315 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1-n1ccnc1)c1ccc(C)cc1O ZINC000280245609 1042568222 /nfs/dbraw/zinc/56/82/22/1042568222.db2.gz WHDUEHUMYRTQKX-GOSISDBHSA-N 1 0 321.424 4.127 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CC2(Cl)Cl)cc1 ZINC000838529995 1042663748 /nfs/dbraw/zinc/66/37/48/1042663748.db2.gz URWGHXDLUIRAGO-CQSZACIVSA-N 1 0 315.288 4.158 20 10 DICDRO CCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000319815712 1042874908 /nfs/dbraw/zinc/87/49/08/1042874908.db2.gz LHEISDVIXDDPOD-MRXNPFEDSA-N 1 0 312.457 4.392 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccccc2SC)c1O ZINC000894663790 1042971464 /nfs/dbraw/zinc/97/14/64/1042971464.db2.gz CBFDNCNCFXFBJB-CYBMUJFWSA-N 1 0 317.454 4.282 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(Br)c2)c(O)c1 ZINC000048817908 1042979561 /nfs/dbraw/zinc/97/95/61/1042979561.db2.gz JNDAYNHYXWAWPJ-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO CC[C@@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccc(C)cc1O ZINC000794803165 1043050718 /nfs/dbraw/zinc/05/07/18/1043050718.db2.gz QSGBRGLOTQDAFA-OAHLLOKOSA-N 1 0 309.413 4.126 20 10 DICDRO CC[C@H]([NH2+]Cc1ccnc(SC)c1)c1ccc(C)cc1O ZINC000794811336 1043056550 /nfs/dbraw/zinc/05/65/50/1043056550.db2.gz POVNGQOZKSXHRZ-HNNXBMFYSA-N 1 0 302.443 4.058 20 10 DICDRO CC[C@H]([NH2+]C1(c2cccc(OC)c2)CC1)c1ccc(C)cc1O ZINC000794815438 1043058744 /nfs/dbraw/zinc/05/87/44/1043058744.db2.gz UVPQORRLBODMDJ-SFHVURJKSA-N 1 0 311.425 4.439 20 10 DICDRO CC[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccc(C)cc1O ZINC000794814394 1043058915 /nfs/dbraw/zinc/05/89/15/1043058915.db2.gz FHHCYRDJFXXFKP-LSDHHAIUSA-N 1 0 319.351 4.153 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccc(C)cc1O ZINC000794815224 1043059374 /nfs/dbraw/zinc/05/93/74/1043059374.db2.gz NPBQUWWGVOFGDV-QGZVFWFLSA-N 1 0 305.368 4.262 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(C)cc1O ZINC000794815213 1043059692 /nfs/dbraw/zinc/05/96/92/1043059692.db2.gz JLCXTJNGRPXZBU-ZVDOUQERSA-N 1 0 324.468 4.187 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)c1c(C)noc1C ZINC000794820211 1043064968 /nfs/dbraw/zinc/06/49/68/1043064968.db2.gz YYXMCPASPJXFKW-JKSUJKDBSA-N 1 0 302.418 4.497 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc3ncccc3c2)c2c1c(F)ccc2O ZINC000794827063 1043066461 /nfs/dbraw/zinc/06/64/61/1043066461.db2.gz FRBKUKNOAGPBOX-PXAZEXFGSA-N 1 0 322.383 4.418 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3ncccc3c2)c2c1c(F)ccc2O ZINC000794827078 1043066612 /nfs/dbraw/zinc/06/66/12/1043066612.db2.gz FRBKUKNOAGPBOX-YVEFUNNKSA-N 1 0 322.383 4.418 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cnc(Cl)c(F)c2)cc1 ZINC000865417754 1043093679 /nfs/dbraw/zinc/09/36/79/1043093679.db2.gz CJDKOCWXYJPBDL-UHFFFAOYSA-N 1 0 321.827 4.010 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](CC(C)C)C1)c1ccc(N(C)C)cc1 ZINC000777311018 1043096623 /nfs/dbraw/zinc/09/66/23/1043096623.db2.gz ZEAWMHMNGPOQQT-HOJAQTOUSA-N 1 0 318.505 4.387 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](CC(C)C)C1)c1ccc(N(C)C)cc1 ZINC000777311020 1043097502 /nfs/dbraw/zinc/09/75/02/1043097502.db2.gz ZEAWMHMNGPOQQT-RLLQIKCJSA-N 1 0 318.505 4.387 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)cc1 ZINC000777310037 1043098229 /nfs/dbraw/zinc/09/82/29/1043098229.db2.gz RONCKLKNGXELLT-QRFRQXIXSA-N 1 0 318.505 4.387 20 10 DICDRO CCOCc1cc(C[NH2+]Cc2csc(C)c2C)ccc1OC ZINC000865679944 1043124502 /nfs/dbraw/zinc/12/45/02/1043124502.db2.gz KRUXNOPNINYKEJ-UHFFFAOYSA-N 1 0 319.470 4.200 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)cc1 ZINC000178545680 1043133467 /nfs/dbraw/zinc/13/34/67/1043133467.db2.gz PLPNCVDTUVBTRE-HZPDHXFCSA-N 1 0 312.457 4.047 20 10 DICDRO COc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000866228837 1043162610 /nfs/dbraw/zinc/16/26/10/1043162610.db2.gz LEDORAWRTCRBDR-OAQYLSRUSA-N 1 0 322.452 4.073 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1O ZINC000183446640 1043165165 /nfs/dbraw/zinc/16/51/65/1043165165.db2.gz YOSLVCMMLXRJLR-OXFYSEKESA-N 1 0 311.425 4.211 20 10 DICDRO CC(C)[C@@H]([NH2+]CCCSc1nccs1)c1ccccn1 ZINC000866269694 1043169855 /nfs/dbraw/zinc/16/98/55/1043169855.db2.gz LMESMTJBPFQAMB-CQSZACIVSA-N 1 0 307.488 4.007 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccnc1 ZINC000185004837 1043193496 /nfs/dbraw/zinc/19/34/96/1043193496.db2.gz YYYRTIWJDVRWBJ-FQEVSTJZSA-N 1 0 309.457 4.313 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H]2CCCO2)c1 ZINC000185225051 1043195970 /nfs/dbraw/zinc/19/59/70/1043195970.db2.gz YIXOXGJQDNUQJK-YSSFQJQWSA-N 1 0 311.425 4.272 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+][C@H](C)c2cc(OC)ccc2O)c1 ZINC000185229897 1043196872 /nfs/dbraw/zinc/19/68/72/1043196872.db2.gz IGXLEFMZKFRNKS-ZIAGYGMSSA-N 1 0 315.413 4.211 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2csc(C(C)C)n2)c1 ZINC000185310151 1043199274 /nfs/dbraw/zinc/19/92/74/1043199274.db2.gz FSAMJUPLXVIFIU-CYBMUJFWSA-N 1 0 304.459 4.174 20 10 DICDRO COc1cc(C)cc(C[NH2+]C2(c3ccccc3F)CCC2)c1O ZINC000895077400 1043200173 /nfs/dbraw/zinc/20/01/73/1043200173.db2.gz DSRWZGUZSGRWEC-UHFFFAOYSA-N 1 0 315.388 4.017 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cs1 ZINC000185425155 1043201085 /nfs/dbraw/zinc/20/10/85/1043201085.db2.gz XSSRGAVMKKQRNB-UWVGGRQHSA-N 1 0 310.850 4.476 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc3cccnc3c2)c(O)c1 ZINC000866431334 1043201620 /nfs/dbraw/zinc/20/16/20/1043201620.db2.gz OPJSVLFTMRXNEO-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3cccnc3c2)c2c1c(F)ccc2O ZINC000866431535 1043202203 /nfs/dbraw/zinc/20/22/03/1043202203.db2.gz VZQKCZAWDFCWRG-SJCJKPOMSA-N 1 0 322.383 4.418 20 10 DICDRO Cc1cccnc1[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)C(C)C ZINC000185458500 1043202767 /nfs/dbraw/zinc/20/27/67/1043202767.db2.gz FCELNLYHSCIJLC-CXAGYDPISA-N 1 0 302.393 4.283 20 10 DICDRO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000866455238 1043204634 /nfs/dbraw/zinc/20/46/34/1043204634.db2.gz KHBBRJLBFAWEMD-NWDGAFQWSA-N 1 0 316.470 4.448 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)C[C@H](O)c2ccc(F)cc2)c1 ZINC000185838282 1043208614 /nfs/dbraw/zinc/20/86/14/1043208614.db2.gz AKKQPWOUIQOALT-TYILLQQXSA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866480601 1043209405 /nfs/dbraw/zinc/20/94/05/1043209405.db2.gz FVZMEAHXDBMEIC-WMZOPIPTSA-N 1 0 303.446 4.172 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1cc(Cl)ccc1O ZINC000186009154 1043210812 /nfs/dbraw/zinc/21/08/12/1043210812.db2.gz LXEVBYWFHJVBPL-BONVTDFDSA-N 1 0 321.779 4.359 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c1 ZINC000186009217 1043212006 /nfs/dbraw/zinc/21/20/06/1043212006.db2.gz PNXADIXHINRFIZ-MLGOLLRUSA-N 1 0 301.361 4.014 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc2ccccc2c1)c1ccccc1O ZINC000121090392 1043213848 /nfs/dbraw/zinc/21/38/48/1043213848.db2.gz GOYAPIFCTAVKAF-PZJWPPBQSA-N 1 0 321.420 4.320 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1cc(Cl)ccc1O ZINC000186129003 1043213986 /nfs/dbraw/zinc/21/39/86/1043213986.db2.gz PWICMWLACAJEQN-JSGCOSHPSA-N 1 0 309.837 4.188 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCSCCC(F)(F)F)c1 ZINC000866543064 1043220110 /nfs/dbraw/zinc/22/01/10/1043220110.db2.gz LEKALTALXPKKAK-NSHDSACASA-N 1 0 307.381 4.037 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccc(C)cc1O ZINC000866540360 1043221111 /nfs/dbraw/zinc/22/11/11/1043221111.db2.gz MQZUHLROYTYLQY-MRXNPFEDSA-N 1 0 314.385 4.158 20 10 DICDRO CC[C@H]([NH2+]CCSCCC(F)(F)F)c1ccccc1O ZINC000866543479 1043222695 /nfs/dbraw/zinc/22/26/95/1043222695.db2.gz RENGFSKJDFPRHB-LBPRGKRZSA-N 1 0 307.381 4.119 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCOc3c(F)cccc32)c(O)c1 ZINC000186506768 1043225630 /nfs/dbraw/zinc/22/56/30/1043225630.db2.gz FNFFTRLAMYKDMX-CXAGYDPISA-N 1 0 315.388 4.404 20 10 DICDRO CCC(CC)[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(OC)ccc2O)CCO1 ZINC000186502709 1043225782 /nfs/dbraw/zinc/22/57/82/1043225782.db2.gz WXZLKIUCLBTDCI-ZUEVXXBESA-N 1 0 321.461 4.035 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1cc(F)ccc1O ZINC000186506946 1043227394 /nfs/dbraw/zinc/22/73/94/1043227394.db2.gz GRSLPIINCYNYGZ-MEDUHNTESA-N 1 0 319.351 4.235 20 10 DICDRO C[C@H]([NH2+][C@H]1CC12CCCC2)c1cc(Br)ccc1O ZINC000760040485 1043228743 /nfs/dbraw/zinc/22/87/43/1043228743.db2.gz KSYKILUBPXXCIL-HZMBPMFUSA-N 1 0 310.235 4.138 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1cc(Cl)ccc1O ZINC000186615449 1043231943 /nfs/dbraw/zinc/23/19/43/1043231943.db2.gz FHCDOQVUVGRGEJ-LBPRGKRZSA-N 1 0 319.832 4.124 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)c1 ZINC000237205907 1043235476 /nfs/dbraw/zinc/23/54/76/1043235476.db2.gz OOUSRQMIRHKYQM-SFHVURJKSA-N 1 0 317.404 4.417 20 10 DICDRO CCSc1cc(C[NH2+][C@H](C)c2cc(C)ccc2O)ccn1 ZINC000187793952 1043251186 /nfs/dbraw/zinc/25/11/86/1043251186.db2.gz RKVOLVPJJCJJAE-CYBMUJFWSA-N 1 0 302.443 4.058 20 10 DICDRO CCCNc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000193363624 1043284405 /nfs/dbraw/zinc/28/44/05/1043284405.db2.gz QCVBXKPNJDBCSX-ZDUSSCGKSA-N 1 0 302.393 4.204 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccc(F)cc1F ZINC000122687650 1043321663 /nfs/dbraw/zinc/32/16/63/1043321663.db2.gz MYCZLCVCISVMMQ-CYBMUJFWSA-N 1 0 304.384 4.190 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1cc(F)c(F)c(F)c1 ZINC000122716559 1043324142 /nfs/dbraw/zinc/32/41/42/1043324142.db2.gz JAMBJQAGENAXKR-GFCCVEGCSA-N 1 0 322.374 4.329 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)cn1 ZINC000268747816 1043326806 /nfs/dbraw/zinc/32/68/06/1043326806.db2.gz BKGGASRAYQVLBM-QGZVFWFLSA-N 1 0 309.457 4.231 20 10 DICDRO CC(C)N(Cc1ncc(C2CC2)o1)Cc1ccc(N(C)C)cc1 ZINC000270534546 1043389015 /nfs/dbraw/zinc/38/90/15/1043389015.db2.gz GEYXHEONZSWXNI-UHFFFAOYSA-N 1 0 313.445 4.029 20 10 DICDRO Cc1cc(C[N@H+](Cc2ccccc2O)[C@@H](C)c2ccccc2)on1 ZINC000270787520 1043396979 /nfs/dbraw/zinc/39/69/79/1043396979.db2.gz LGAKLHURILSISM-INIZCTEOSA-N 1 0 322.408 4.452 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1ccc(N2CCCCC2)cc1 ZINC000271527191 1043431255 /nfs/dbraw/zinc/43/12/55/1043431255.db2.gz QIROGHJPWYCCAN-HNAYVOBHSA-N 1 0 324.472 4.128 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000271580703 1043438662 /nfs/dbraw/zinc/43/86/62/1043438662.db2.gz QWJWFFDZEVGUAW-KZNAEPCWSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000271585338 1043440928 /nfs/dbraw/zinc/44/09/28/1043440928.db2.gz XMKYUQUHUVYKEY-VYDXJSESSA-N 1 0 320.452 4.034 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc3ncccc23)c(O)c1 ZINC000872124095 1043468954 /nfs/dbraw/zinc/46/89/54/1043468954.db2.gz COSMYJHPDRKYFN-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc2ncccc12)c1ccc(C)cc1O ZINC000872125111 1043471014 /nfs/dbraw/zinc/47/10/14/1043471014.db2.gz YFAFXFVYRBQWEB-GOSISDBHSA-N 1 0 306.409 4.490 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc2ncccc12)c1ccc(N(C)C)cc1 ZINC000872125102 1043471610 /nfs/dbraw/zinc/47/16/10/1043471610.db2.gz XWYGFFXBZIRQIU-OAHLLOKOSA-N 1 0 305.425 4.152 20 10 DICDRO Cc1nccnc1[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000872133344 1043475977 /nfs/dbraw/zinc/47/59/77/1043475977.db2.gz LWIBJRFZCVHJCQ-WBVHZDCISA-N 1 0 324.472 4.187 20 10 DICDRO CCC[N@H+](Cc1ccc2ncccc2c1)Cc1ccccc1O ZINC000124038718 1043490417 /nfs/dbraw/zinc/49/04/17/1043490417.db2.gz ZHLUUTOHOXTJPP-UHFFFAOYSA-N 1 0 306.409 4.353 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000124413969 1043521328 /nfs/dbraw/zinc/52/13/28/1043521328.db2.gz PMNMTPRUTWPYMC-STQMWFEESA-N 1 0 304.384 4.443 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2cc3ccccc3o2)c1O ZINC000191130244 1043525866 /nfs/dbraw/zinc/52/58/66/1043525866.db2.gz CKNFNLGYQNEDCW-CYBMUJFWSA-N 1 0 311.381 4.388 20 10 DICDRO CC1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC(F)(F)C1 ZINC000873197993 1043526398 /nfs/dbraw/zinc/52/63/98/1043526398.db2.gz LUNIDLABBYAUQN-UHFFFAOYSA-N 1 0 303.352 4.337 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000124472224 1043532253 /nfs/dbraw/zinc/53/22/53/1043532253.db2.gz VWAXXGBMLKQDGU-CVEARBPZSA-N 1 0 312.457 4.481 20 10 DICDRO C[C@H](c1ccccc1)[N@H+](CCC(C)(C)O)Cc1ccccc1O ZINC000124557620 1043540144 /nfs/dbraw/zinc/54/01/44/1043540144.db2.gz OJMOSEZEPQWJCD-MRXNPFEDSA-N 1 0 313.441 4.116 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C)cc(OC)c1O)c1ccccc1F ZINC000895183010 1043550116 /nfs/dbraw/zinc/55/01/16/1043550116.db2.gz HGVGSJCYLBSCJW-MRXNPFEDSA-N 1 0 303.377 4.089 20 10 DICDRO CCc1cccc2c(CC[NH2+][C@@H](C)c3ccccc3O)c[nH]c21 ZINC000783510976 1043558644 /nfs/dbraw/zinc/55/86/44/1043558644.db2.gz VINVQVOORJSFBT-AWEZNQCLSA-N 1 0 308.425 4.329 20 10 DICDRO Cc1cccc(C[NH2+][C@H](C)c2ccc(Br)cc2)c1O ZINC000124654162 1043558910 /nfs/dbraw/zinc/55/89/10/1043558910.db2.gz FEWMEWGMQIVDDI-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)c1O ZINC000874082697 1043568190 /nfs/dbraw/zinc/56/81/90/1043568190.db2.gz YQEKSPBVZMNNCM-LBPRGKRZSA-N 1 0 321.367 4.180 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2)cc1 ZINC000037423691 1043667288 /nfs/dbraw/zinc/66/72/88/1043667288.db2.gz RPYPOJSSPYMSQW-UHFFFAOYSA-N 1 0 309.240 4.349 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccc(N(C)C)cc1 ZINC000927059374 1043675387 /nfs/dbraw/zinc/67/53/87/1043675387.db2.gz DPRCVFHKODGDTK-RBUKOAKNSA-N 1 0 309.457 4.266 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1cc(Cl)ccc1O ZINC000927060715 1043675811 /nfs/dbraw/zinc/67/58/11/1043675811.db2.gz FIAZZNCUJUNEFM-IAQYHMDHSA-N 1 0 302.805 4.169 20 10 DICDRO CC(C)[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1cnn(C)c1 ZINC000927067781 1043680475 /nfs/dbraw/zinc/68/04/75/1043680475.db2.gz GRTXCPJRTJFFIW-LIRRHRJNSA-N 1 0 323.440 4.327 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1ccc2ccccc2c1O ZINC000927107073 1043687535 /nfs/dbraw/zinc/68/75/35/1043687535.db2.gz BKLDMAWXZSJBGM-CYBMUJFWSA-N 1 0 321.424 4.007 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1Cl ZINC000825903650 1043710679 /nfs/dbraw/zinc/71/06/79/1043710679.db2.gz NPZICPNOWWFUFC-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2CCSc3c(F)cccc32)c(O)c1 ZINC000876912782 1043723742 /nfs/dbraw/zinc/72/37/42/1043723742.db2.gz YIVJCAIHAXIHBF-OAHLLOKOSA-N 1 0 303.402 4.166 20 10 DICDRO Cc1ccc(C[NH2+][C@H](c2nc3ccccc3[nH]2)C(C)C)c(O)c1 ZINC000876984085 1043730794 /nfs/dbraw/zinc/73/07/94/1043730794.db2.gz DOTBZBCIAQWHIX-SFHVURJKSA-N 1 0 309.413 4.064 20 10 DICDRO COCCCC[C@H]([NH2+]Cc1ccc(C)cc1O)c1ccccc1 ZINC000877489426 1043765555 /nfs/dbraw/zinc/76/55/55/1043765555.db2.gz NQVRXWJUAJPTSA-IBGZPJMESA-N 1 0 313.441 4.348 20 10 DICDRO Cc1ccc(C[NH2+]C(C)(C)c2nc3ccccc3s2)c(O)c1 ZINC000877651318 1043783172 /nfs/dbraw/zinc/78/31/72/1043783172.db2.gz WORRPUCNRNZTDH-UHFFFAOYSA-N 1 0 312.438 4.335 20 10 DICDRO Cc1nn(-c2ccc(C)cc2)cc1C[NH2+][C@H](C)c1ccccc1O ZINC000877755582 1043792281 /nfs/dbraw/zinc/79/22/81/1043792281.db2.gz GNSRQIUKPRQIGE-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)cc(C(F)(F)F)c1)c1ccccc1O ZINC000877756258 1043792816 /nfs/dbraw/zinc/79/28/16/1043792816.db2.gz CINUGYLSUMTWOT-SNVBAGLBSA-N 1 0 313.294 4.401 20 10 DICDRO Cc1c(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)c2ccccc2n1C ZINC001138252670 1043833199 /nfs/dbraw/zinc/83/31/99/1043833199.db2.gz PLKYVCMWOWONJO-CYBMUJFWSA-N 1 0 306.400 4.354 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1ccc(N(C)C)cc1 ZINC000878454767 1043895322 /nfs/dbraw/zinc/89/53/22/1043895322.db2.gz HXLWFDHVJAKKER-LLVKDONJSA-N 1 0 312.335 4.215 20 10 DICDRO CCSc1ccccc1C[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000930216514 1043896939 /nfs/dbraw/zinc/89/69/39/1043896939.db2.gz JQUAYCUNUQPHCE-CYBMUJFWSA-N 1 0 317.454 4.364 20 10 DICDRO C[C@@H]([NH2+][C@@H]1c2ccccc2CC12CCOCC2)c1ccccc1O ZINC000290104807 1043917304 /nfs/dbraw/zinc/91/73/04/1043917304.db2.gz IGMQRLMBOPUVST-FOIQADDNSA-N 1 0 323.436 4.137 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)C2CCC(F)(F)CC2)c1O ZINC000290212363 1043928161 /nfs/dbraw/zinc/92/81/61/1043928161.db2.gz QREWRYOHFGELFB-UHFFFAOYSA-N 1 0 319.779 4.064 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1ccccc1O)c1cccc(Cl)c1 ZINC000290209568 1043929046 /nfs/dbraw/zinc/92/90/46/1043929046.db2.gz HGCHSVPTDVAKCQ-WBMJQRKESA-N 1 0 305.805 4.084 20 10 DICDRO CC[N@H+](Cc1cc(Cl)cc(OC)c1O)[C@H](C)c1cccnc1 ZINC000290473475 1043953564 /nfs/dbraw/zinc/95/35/64/1043953564.db2.gz NRGALBAGBDWQOZ-GFCCVEGCSA-N 1 0 320.820 4.032 20 10 DICDRO C[C@@]1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCCS1 ZINC000127889718 1043975797 /nfs/dbraw/zinc/97/57/97/1043975797.db2.gz QHMXFKLORYSCCQ-SFHVURJKSA-N 1 0 304.503 4.052 20 10 DICDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000879648918 1043979198 /nfs/dbraw/zinc/97/91/98/1043979198.db2.gz GCVZDNUZTILOCU-CHWSQXEVSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000879648919 1043979226 /nfs/dbraw/zinc/97/92/26/1043979226.db2.gz GCVZDNUZTILOCU-OLZOCXBDSA-N 1 0 300.358 4.021 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2cc(Cl)ccc2O)c(C)c1 ZINC000826139444 1044004834 /nfs/dbraw/zinc/00/48/34/1044004834.db2.gz CBOBFEMRYSLVAP-UHFFFAOYSA-N 1 0 305.805 4.043 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](c1ccccc1)N1CCCC1)c1ccccc1O ZINC000324040109 1044028891 /nfs/dbraw/zinc/02/88/91/1044028891.db2.gz RCDXELNEOAQEGZ-WOJBJXKFSA-N 1 0 324.468 4.270 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c(O)c1 ZINC000281127701 1044098452 /nfs/dbraw/zinc/09/84/52/1044098452.db2.gz NCOQECDLIFDXRB-VIFPVBQESA-N 1 0 313.294 4.108 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2OCCc3sccc32)c(O)c1 ZINC000291953376 1044119238 /nfs/dbraw/zinc/11/92/38/1044119238.db2.gz RBRGXTNNZLXNFO-JCGVRSQUSA-N 1 0 317.454 4.115 20 10 DICDRO CCc1cnc(CC[NH2+][C@H](C)c2ccc(N(C)CC)cc2)s1 ZINC000130227012 1044196687 /nfs/dbraw/zinc/19/66/87/1044196687.db2.gz XJZANRCPMKUQCE-CQSZACIVSA-N 1 0 317.502 4.055 20 10 DICDRO COc1ccc(N2CCC([NH2+]CCC3=CCCCC3)CC2)cc1 ZINC000130923973 1044221039 /nfs/dbraw/zinc/22/10/39/1044221039.db2.gz XUZNPLSZKHURRP-UHFFFAOYSA-N 1 0 314.473 4.144 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000883265553 1044252046 /nfs/dbraw/zinc/25/20/46/1044252046.db2.gz FGQZNYPOZGSOCX-AWEZNQCLSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc(C)nc2Cl)c(Cl)c1 ZINC000883293595 1044260750 /nfs/dbraw/zinc/26/07/50/1044260750.db2.gz YWNDRNJXXGGSFJ-UHFFFAOYSA-N 1 0 311.212 4.001 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C)nc2Cl)c(O)c1 ZINC000883302387 1044263528 /nfs/dbraw/zinc/26/35/28/1044263528.db2.gz XBMRPNKQSKPGRS-ZDUSSCGKSA-N 1 0 304.821 4.217 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)o1 ZINC000293301445 1044269346 /nfs/dbraw/zinc/26/93/46/1044269346.db2.gz DTLKLEBFFCZRNS-ZDUSSCGKSA-N 1 0 302.418 4.109 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)[C@@H]1CCCOC1 ZINC000883353401 1044281737 /nfs/dbraw/zinc/28/17/37/1044281737.db2.gz UDCDWYOMWYMJDH-OGWOLHLISA-N 1 0 313.441 4.401 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2c3ccccc3CC[C@H]2F)c1 ZINC000883376479 1044289030 /nfs/dbraw/zinc/28/90/30/1044289030.db2.gz LRVPTQSJTSIQQA-WILYLXEWSA-N 1 0 315.388 4.077 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2c3ccccc3CC[C@@H]2F)c1 ZINC000883376476 1044289548 /nfs/dbraw/zinc/28/95/48/1044289548.db2.gz LRVPTQSJTSIQQA-KHDYIWLOSA-N 1 0 315.388 4.077 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2c3ccccc3CC[C@H]2F)c1O ZINC000883377850 1044291948 /nfs/dbraw/zinc/29/19/48/1044291948.db2.gz SADVDVGJNYXPOD-XZOAIXRZSA-N 1 0 315.388 4.077 20 10 DICDRO CC[C@H]([NH2+]C1CCC2(COC2)CC1)c1cc(Cl)ccc1O ZINC000883381845 1044294009 /nfs/dbraw/zinc/29/40/09/1044294009.db2.gz UMBYRBYZXOSCBE-HNNXBMFYSA-N 1 0 309.837 4.046 20 10 DICDRO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000192789191 1044307927 /nfs/dbraw/zinc/30/79/27/1044307927.db2.gz AQBAFERIOOVAIE-KGLIPLIRSA-N 1 0 315.413 4.130 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1OC)c1ccccc1O ZINC000192789511 1044308245 /nfs/dbraw/zinc/30/82/45/1044308245.db2.gz AHJKLJQRJXEBJO-GUYCJALGSA-N 1 0 315.413 4.211 20 10 DICDRO Cc1ccoc1C[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC000293642176 1044308580 /nfs/dbraw/zinc/30/85/80/1044308580.db2.gz KVODMWHXSXBTBF-NSHDSACASA-N 1 0 324.218 4.215 20 10 DICDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000192789218 1044309280 /nfs/dbraw/zinc/30/92/80/1044309280.db2.gz AQBAFERIOOVAIE-ZIAGYGMSSA-N 1 0 315.413 4.130 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccc(OC)cc1 ZINC000192786243 1044309517 /nfs/dbraw/zinc/30/95/17/1044309517.db2.gz QFKDMEHUQLOPDM-UGSOOPFHSA-N 1 0 315.413 4.211 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccc(OC)cc1 ZINC000192786281 1044309600 /nfs/dbraw/zinc/30/96/00/1044309600.db2.gz QFKDMEHUQLOPDM-FZKQIMNGSA-N 1 0 315.413 4.211 20 10 DICDRO Fc1ccc2c(c1)CC[C@@H]2[NH2+]CCCSc1nccs1 ZINC000132151563 1044315879 /nfs/dbraw/zinc/31/58/79/1044315879.db2.gz JOYGTBGROUEFAI-AWEZNQCLSA-N 1 0 308.447 4.042 20 10 DICDRO c1csc(SCCC[NH2+][C@H]2CCSc3ccccc32)n1 ZINC000132190649 1044317292 /nfs/dbraw/zinc/31/72/92/1044317292.db2.gz JLAJPCYHEYAAKS-ZDUSSCGKSA-N 1 0 322.524 4.452 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1OC)c1ccccc1O ZINC000192808387 1044318399 /nfs/dbraw/zinc/31/83/99/1044318399.db2.gz VLHPRYYWDPCKKZ-MLGOLLRUSA-N 1 0 303.377 4.342 20 10 DICDRO c1csc(SCCC[NH2+][C@@H]2CCCOc3ccccc32)n1 ZINC000132251411 1044319604 /nfs/dbraw/zinc/31/96/04/1044319604.db2.gz BXALOSWNBVAOCE-CQSZACIVSA-N 1 0 320.483 4.129 20 10 DICDRO CC[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccccc1O ZINC000293753886 1044325163 /nfs/dbraw/zinc/32/51/63/1044325163.db2.gz QNTQEYXQFYZKJY-CQSZACIVSA-N 1 0 324.346 4.089 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cc(C(F)(F)F)ccn2)c(O)c1 ZINC000293760444 1044325725 /nfs/dbraw/zinc/32/57/25/1044325725.db2.gz REFRKXKJHGBZDR-GFCCVEGCSA-N 1 0 324.346 4.008 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(N(C)C)cc1 ZINC000133040968 1044353201 /nfs/dbraw/zinc/35/32/01/1044353201.db2.gz YMGKAKYRYLPFTB-GOSISDBHSA-N 1 0 304.384 4.272 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000361066273 1044354791 /nfs/dbraw/zinc/35/47/91/1044354791.db2.gz KBOTXANPAWNBHB-INIZCTEOSA-N 1 0 308.381 4.261 20 10 DICDRO COCC[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000840835807 1044359600 /nfs/dbraw/zinc/35/96/00/1044359600.db2.gz AQIXUQBSEPYBDX-ROUUACIJSA-N 1 0 318.505 4.390 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccccc1O ZINC000361292548 1044384471 /nfs/dbraw/zinc/38/44/71/1044384471.db2.gz HCOZALBJTNTBJX-MGPUTAFESA-N 1 0 304.393 4.227 20 10 DICDRO Cc1csc(C2([NH2+]Cc3ccc(N(C)C)cc3)CCCC2)n1 ZINC000112711107 1044446148 /nfs/dbraw/zinc/44/61/48/1044446148.db2.gz PWBAHPREZDWCNA-UHFFFAOYSA-N 1 0 315.486 4.077 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(C(F)(F)F)n1)c1ccccc1O ZINC000294666434 1044446211 /nfs/dbraw/zinc/44/62/11/1044446211.db2.gz ALWMQDXAWVGNLB-CYBMUJFWSA-N 1 0 310.319 4.047 20 10 DICDRO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000294821905 1044464187 /nfs/dbraw/zinc/46/41/87/1044464187.db2.gz QMLXQFOOVVAMBZ-STQMWFEESA-N 1 0 320.458 4.024 20 10 DICDRO COc1cccc(C[NH2+]C(C)(C)c2cccc(Cl)c2)c1O ZINC000119373438 1044493910 /nfs/dbraw/zinc/49/39/10/1044493910.db2.gz BVNSXXUFLOQEHE-UHFFFAOYSA-N 1 0 305.805 4.079 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000120871769 1044514642 /nfs/dbraw/zinc/51/46/42/1044514642.db2.gz LZQIAPOLGXQNQC-NQIIRXRSSA-N 1 0 324.468 4.010 20 10 DICDRO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1ccc2ccccc2c1O ZINC000134791865 1044532532 /nfs/dbraw/zinc/53/25/32/1044532532.db2.gz PCEUOLMTUHQXTA-KGUHOSCRSA-N 1 0 323.436 4.154 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCCOc3c(F)cccc31)CC2 ZINC000296335787 1044609821 /nfs/dbraw/zinc/60/98/21/1044609821.db2.gz GPVSQYSLKJIGQT-HZPDHXFCSA-N 1 0 313.372 4.022 20 10 DICDRO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C)c(C)cc2O)o1 ZINC000137087862 1044615340 /nfs/dbraw/zinc/61/53/40/1044615340.db2.gz HMMDSNKUMXVQRC-KRWDZBQOSA-N 1 0 315.413 4.086 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1N1CCCCC1)CC2 ZINC000296572291 1044629036 /nfs/dbraw/zinc/62/90/36/1044629036.db2.gz VFQPOSFKBLSRQC-GOSISDBHSA-N 1 0 322.452 4.160 20 10 DICDRO COC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc(Cl)cc1 ZINC000296575137 1044629941 /nfs/dbraw/zinc/62/99/41/1044629941.db2.gz VLBFKZHRULKLHF-JKSUJKDBSA-N 1 0 317.816 4.010 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000090763043 1044748470 /nfs/dbraw/zinc/74/84/70/1044748470.db2.gz FCBXTJWNYGELOC-ACJLOTCBSA-N 1 0 315.461 4.202 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)Oc1ccccc1F)c1ccccc1O ZINC000156068691 1044761261 /nfs/dbraw/zinc/76/12/61/1044761261.db2.gz BSGLUKVWSAXHCH-CJNGLKHVSA-N 1 0 303.377 4.040 20 10 DICDRO Cc1csc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000126271826 1044812594 /nfs/dbraw/zinc/81/25/94/1044812594.db2.gz RQEXUUGDPKWAHH-OAHLLOKOSA-N 1 0 315.486 4.293 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC000371488615 1044880199 /nfs/dbraw/zinc/88/01/99/1044880199.db2.gz SFSSELZLRLLADJ-MRXNPFEDSA-N 1 0 310.422 4.339 20 10 DICDRO CC[C@H]([NH2+]CCc1c[nH]c2cccc(OC)c12)c1ccccc1O ZINC000157901046 1044954121 /nfs/dbraw/zinc/95/41/21/1044954121.db2.gz YAVYYANJMNGVTM-INIZCTEOSA-N 1 0 324.424 4.166 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCc2cnn(C(C)C)c21)c1ccccc1O ZINC000373456157 1044979453 /nfs/dbraw/zinc/97/94/53/1044979453.db2.gz YNLVAAKTKRBVTP-IRXDYDNUSA-N 1 0 313.445 4.288 20 10 DICDRO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(Cl)c2[O-])o1 ZINC000137069768 1044990921 /nfs/dbraw/zinc/99/09/21/1044990921.db2.gz BPYVDTBDJIATRQ-OAHLLOKOSA-N 1 0 321.804 4.122 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000778995299 1045111130 /nfs/dbraw/zinc/11/11/30/1045111130.db2.gz QUSVWCJTYFCWFW-OAHLLOKOSA-N 1 0 324.449 4.382 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000778999637 1045112282 /nfs/dbraw/zinc/11/22/82/1045112282.db2.gz JAWFQFSBTWFORJ-HNNXBMFYSA-N 1 0 324.399 4.392 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000779026018 1045166538 /nfs/dbraw/zinc/16/65/38/1045166538.db2.gz SNSGLSPWDOOPPG-CQSZACIVSA-N 1 0 317.429 4.146 20 10 DICDRO Cc1cc(Br)cc([C@@H](C)[NH2+][C@H]2CC=CCC2)c1O ZINC000779032277 1045176638 /nfs/dbraw/zinc/17/66/38/1045176638.db2.gz OHDSVHSLAQZSAG-YPMHNXCESA-N 1 0 310.235 4.222 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccnc2ccccc12 ZINC000527528759 1045234923 /nfs/dbraw/zinc/23/49/23/1045234923.db2.gz ZNUOLAYRBVTOKA-UHFFFAOYSA-N 1 0 315.420 4.325 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c(O)c1 ZINC000527795213 1045263530 /nfs/dbraw/zinc/26/35/30/1045263530.db2.gz OIGHNESZJYXXCS-QGZVFWFLSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(Br)c2)c1 ZINC000048817991 1045276549 /nfs/dbraw/zinc/27/65/49/1045276549.db2.gz VEZCJDJHQXICJX-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1cc(F)ccc1O ZINC000527966825 1045289295 /nfs/dbraw/zinc/28/92/95/1045289295.db2.gz OVKCJQSKMCQJRO-SGTLLEGYSA-N 1 0 300.377 4.118 20 10 DICDRO CO[C@@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000779149423 1045323101 /nfs/dbraw/zinc/32/31/01/1045323101.db2.gz LRFVNCRLXHDELI-PIGZYNQJSA-N 1 0 323.795 4.051 20 10 DICDRO CO[C@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000779149421 1045323381 /nfs/dbraw/zinc/32/33/81/1045323381.db2.gz LRFVNCRLXHDELI-DIFFPNOSSA-N 1 0 323.795 4.051 20 10 DICDRO CSCc1cccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000188721705 1045338206 /nfs/dbraw/zinc/33/82/06/1045338206.db2.gz SOFHQTWJSVAWCU-AWEZNQCLSA-N 1 0 301.455 4.414 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1cccc(C)c1O)CC3 ZINC000779168016 1045347542 /nfs/dbraw/zinc/34/75/42/1045347542.db2.gz VBWWUWUMDIZJGE-INIZCTEOSA-N 1 0 320.436 4.137 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cccnc1C(F)(F)F ZINC000528390203 1045348801 /nfs/dbraw/zinc/34/88/01/1045348801.db2.gz ASIDSORHXHHDLM-UHFFFAOYSA-N 1 0 324.346 4.218 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)[C@H](C)c2ccccc2)c1O ZINC000779197443 1045368450 /nfs/dbraw/zinc/36/84/50/1045368450.db2.gz APJNUCWIONQAKS-QWHCGFSZSA-N 1 0 315.388 4.016 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(F)ccc1F ZINC000077454626 1045521602 /nfs/dbraw/zinc/52/16/02/1045521602.db2.gz VJXZKWHGWAQJCV-SFHVURJKSA-N 1 0 304.384 4.272 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cc(Cl)ccc1OC ZINC000750874550 1045565411 /nfs/dbraw/zinc/56/54/11/1045565411.db2.gz AUNTYGPETQYUTO-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCSC2CCCCC2)c1 ZINC000800368922 1045611348 /nfs/dbraw/zinc/61/13/48/1045611348.db2.gz FNAXVMXYUPTEKE-ZDUSSCGKSA-N 1 0 309.475 4.117 20 10 DICDRO COCC1(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CCC1 ZINC000800492407 1045630554 /nfs/dbraw/zinc/63/05/54/1045630554.db2.gz AEWCTCOIPCHJOO-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1ccccc1O ZINC000800495434 1045631820 /nfs/dbraw/zinc/63/18/20/1045631820.db2.gz NRUYAERKLMFEES-NVXWUHKLSA-N 1 0 301.817 4.254 20 10 DICDRO C[C@@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1cc(F)ccc1O ZINC000800496169 1045633251 /nfs/dbraw/zinc/63/32/51/1045633251.db2.gz SSNWJDYUGUJFRH-MEBBXXQBSA-N 1 0 305.780 4.003 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c1 ZINC000800494864 1045633525 /nfs/dbraw/zinc/63/35/25/1045633525.db2.gz GIPXEPWTIXHBBP-LRDDRELGSA-N 1 0 301.817 4.172 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)c(O)c1 ZINC000800496860 1045633589 /nfs/dbraw/zinc/63/35/89/1045633589.db2.gz ZVEIFZHJNXEKEU-BLLLJJGKSA-N 1 0 301.817 4.172 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CC2CCC(F)(F)CC2)c2c1c(F)ccc2O ZINC000800499869 1045634932 /nfs/dbraw/zinc/63/49/32/1045634932.db2.gz NTQVYPAVRDXGCN-GXFFZTMASA-N 1 0 313.363 4.495 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCC12CCOCC2)c1ccc(N(C)C)cc1 ZINC000800498251 1045635860 /nfs/dbraw/zinc/63/58/60/1045635860.db2.gz GAZACDSNTOWKKZ-RTBURBONSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]CCc2cccc3[nH]ccc32)c1O ZINC000800537308 1045639779 /nfs/dbraw/zinc/63/97/79/1045639779.db2.gz RVOHWCMKAUMPAK-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO CCOc1cccc(C[N@H+](CC)Cc2c[nH]c3ccccc23)c1O ZINC000191190077 1045663528 /nfs/dbraw/zinc/66/35/28/1045663528.db2.gz IORTYTLZOCANNF-UHFFFAOYSA-N 1 0 324.424 4.294 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)cc1C ZINC000752266448 1045669716 /nfs/dbraw/zinc/66/97/16/1045669716.db2.gz QMYLZGQRJUSVER-ZFWWWQNUSA-N 1 0 315.379 4.467 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000752267260 1045669886 /nfs/dbraw/zinc/66/98/86/1045669886.db2.gz WZKNIJYISIBIFZ-GXTWGEPZSA-N 1 0 301.352 4.159 20 10 DICDRO FCCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000800966875 1045671860 /nfs/dbraw/zinc/67/18/60/1045671860.db2.gz DYSYPZLJJDUNDA-PKOBYXMFSA-N 1 0 304.453 4.295 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2ccccc2OC1)c1cc(Cl)ccc1O ZINC000800987419 1045678029 /nfs/dbraw/zinc/67/80/29/1045678029.db2.gz XSRVYGACWORHHP-DOMZBBRYSA-N 1 0 317.816 4.090 20 10 DICDRO Cc1cccc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)c1O ZINC000779432084 1045711458 /nfs/dbraw/zinc/71/14/58/1045711458.db2.gz JXEPOIDLEMAMHP-MRXNPFEDSA-N 1 0 317.816 4.358 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCC2(CCCC2)O1 ZINC000801518721 1045728677 /nfs/dbraw/zinc/72/86/77/1045728677.db2.gz REANIKRRJVDLFZ-KRWDZBQOSA-N 1 0 303.446 4.096 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCC2(CCCC2)O1 ZINC000801518722 1045728773 /nfs/dbraw/zinc/72/87/73/1045728773.db2.gz REANIKRRJVDLFZ-QGZVFWFLSA-N 1 0 303.446 4.096 20 10 DICDRO CCCC[N@H+](Cc1sc(C)nc1C)Cc1ccccc1O ZINC000801595698 1045748028 /nfs/dbraw/zinc/74/80/28/1045748028.db2.gz IKEORAAAMGHKEP-UHFFFAOYSA-N 1 0 304.459 4.268 20 10 DICDRO Oc1ccccc1C[N@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000191780891 1045749285 /nfs/dbraw/zinc/74/92/85/1045749285.db2.gz JXCIIXJEOHDVCJ-UHFFFAOYSA-N 1 0 309.331 4.347 20 10 DICDRO CCCC[N@H+](Cc1cn2cc(C)ccc2n1)Cc1ccccc1O ZINC000801598259 1045752392 /nfs/dbraw/zinc/75/23/92/1045752392.db2.gz XVNTUHIRHPKFSK-UHFFFAOYSA-N 1 0 323.440 4.151 20 10 DICDRO CCCC[N@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccccc1O ZINC000801599275 1045753177 /nfs/dbraw/zinc/75/31/77/1045753177.db2.gz IMVUYWMRWMVQQC-UHFFFAOYSA-N 1 0 316.445 4.480 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc2cccnc12 ZINC000753527302 1045758799 /nfs/dbraw/zinc/75/87/99/1045758799.db2.gz KVXPVIHKAIDFSY-UHFFFAOYSA-N 1 0 319.452 4.241 20 10 DICDRO CC(C)([NH2+]Cc1ccc(OCc2ccccc2)cc1O)C1CC1 ZINC000753565976 1045763594 /nfs/dbraw/zinc/76/35/94/1045763594.db2.gz LHPDRFGRTSQTTD-UHFFFAOYSA-N 1 0 311.425 4.249 20 10 DICDRO C[C@H]([NH2+]CC[C@@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000753762584 1045800038 /nfs/dbraw/zinc/80/00/38/1045800038.db2.gz WRDCTWISMJNGLP-ZWKOTPCHSA-N 1 0 316.489 4.144 20 10 DICDRO COc1ccc(C2(C[NH2+][C@@H](C)c3ccccc3O)CCC2)cc1 ZINC000753762540 1045800398 /nfs/dbraw/zinc/80/03/98/1045800398.db2.gz VETXWDPCOOYFCU-HNNXBMFYSA-N 1 0 311.425 4.173 20 10 DICDRO COc1ccc(C2(C[NH2+][C@H](C)c3ccccc3O)CCC2)cc1 ZINC000753762541 1045800446 /nfs/dbraw/zinc/80/04/46/1045800446.db2.gz VETXWDPCOOYFCU-OAHLLOKOSA-N 1 0 311.425 4.173 20 10 DICDRO C[N@H+](CC[C@@H]1CCCCO1)Cc1ccc(N2CCCCC2)cc1 ZINC000753999774 1045831905 /nfs/dbraw/zinc/83/19/05/1045831905.db2.gz QMEVINBCLKFEMW-FQEVSTJZSA-N 1 0 316.489 4.068 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc3ccccc3s2)c1 ZINC000754139757 1045852490 /nfs/dbraw/zinc/85/24/90/1045852490.db2.gz HNIUCFLXHFRTPM-LBPRGKRZSA-N 1 0 313.422 4.466 20 10 DICDRO COC1CCN(c2ccc(C[N@H+](C(C)C)C3CCC3)cc2)CC1 ZINC000828333994 1045903839 /nfs/dbraw/zinc/90/38/39/1045903839.db2.gz ORUDBOBIFSFHHX-UHFFFAOYSA-N 1 0 316.489 4.065 20 10 DICDRO COc1cc(C)cc(C[N@H+](Cc2cccc(F)c2)C(C)C)c1O ZINC000754722054 1045917866 /nfs/dbraw/zinc/91/78/66/1045917866.db2.gz AZHSUHWPHWWVKW-UHFFFAOYSA-N 1 0 317.404 4.259 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccccc2)c1O ZINC000754723352 1045918381 /nfs/dbraw/zinc/91/83/81/1045918381.db2.gz QLTQCMCLSFXYLV-IBGZPJMESA-N 1 0 311.425 4.292 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c1O ZINC000754725863 1045921980 /nfs/dbraw/zinc/92/19/80/1045921980.db2.gz COEXCDRTPVDPQR-LJQANCHMSA-N 1 0 301.430 4.032 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H]2C)c1O ZINC000754740542 1045923412 /nfs/dbraw/zinc/92/34/12/1045923412.db2.gz UVJNTBNVCHOIMF-YJBOKZPZSA-N 1 0 311.425 4.087 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)c1 ZINC000754741920 1045923859 /nfs/dbraw/zinc/92/38/59/1045923859.db2.gz OQBAUPBRVVKIPO-GOSISDBHSA-N 1 0 313.466 4.299 20 10 DICDRO Cc1cc(C)c(O)c(C[NH+]2CCC(N(C)c3ccccc3)CC2)c1 ZINC000754739183 1045924079 /nfs/dbraw/zinc/92/40/79/1045924079.db2.gz KJFPHDNUTXNYNG-UHFFFAOYSA-N 1 0 324.468 4.110 20 10 DICDRO Cc1cnccc1CC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000754842128 1045931239 /nfs/dbraw/zinc/93/12/39/1045931239.db2.gz HUIMIXOSROGRDO-UHFFFAOYSA-N 1 0 318.420 4.095 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)cc1F ZINC000192796132 1045935031 /nfs/dbraw/zinc/93/50/31/1045935031.db2.gz PFJZKRHSMPQJHP-STQMWFEESA-N 1 0 303.377 4.260 20 10 DICDRO CC[C@@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000802309005 1045949943 /nfs/dbraw/zinc/94/99/43/1045949943.db2.gz LPTIUSCTUPVOOD-AXVVYFOYSA-N 1 0 318.505 4.387 20 10 DICDRO C[C@@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1cc(Cl)ccc1O ZINC000802308903 1045951898 /nfs/dbraw/zinc/95/18/98/1045951898.db2.gz KPOMXRWSKWYYQZ-JHJVBQTASA-N 1 0 311.853 4.290 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)OCO2)c1ccc2ccccc2c1O ZINC000192918266 1045954366 /nfs/dbraw/zinc/95/43/66/1045954366.db2.gz DDOMGFRWCWAQGX-CYBMUJFWSA-N 1 0 321.376 4.125 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2ccc(C3CCC3)cc2)c(O)c1 ZINC000755222953 1045965186 /nfs/dbraw/zinc/96/51/86/1045965186.db2.gz HQIKVWIZENGMMJ-UHFFFAOYSA-N 1 0 311.425 4.348 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)ccc1N1CCCCC1 ZINC000829312957 1045967948 /nfs/dbraw/zinc/96/79/48/1045967948.db2.gz HMRPZIYKXJEPBQ-FQEVSTJZSA-N 1 0 324.472 4.046 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)ccc1N1CCCCC1 ZINC000829312970 1045968013 /nfs/dbraw/zinc/96/80/13/1045968013.db2.gz HMRPZIYKXJEPBQ-HXUWFJFHSA-N 1 0 324.472 4.046 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2ccc(C)s2)c1 ZINC000080240998 1046011079 /nfs/dbraw/zinc/01/10/79/1046011079.db2.gz VUHPUALNOLTXBC-YPMHNXCESA-N 1 0 305.443 4.053 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000802657557 1046026606 /nfs/dbraw/zinc/02/66/06/1046026606.db2.gz IVTTUTVXEITTOF-AWEZNQCLSA-N 1 0 317.326 4.086 20 10 DICDRO CCCC[N@H+](Cc1c[nH]nc1C(C)(C)C)Cc1ccccc1O ZINC000802657423 1046027405 /nfs/dbraw/zinc/02/74/05/1046027405.db2.gz CXMBMZKJWLAJCL-UHFFFAOYSA-N 1 0 315.461 4.215 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1O ZINC000802657472 1046028015 /nfs/dbraw/zinc/02/80/15/1046028015.db2.gz FWZQREZUBJAAPF-CQSZACIVSA-N 1 0 313.363 4.255 20 10 DICDRO CCCC[N@H+](Cc1c(C)nn(CC)c1C)Cc1ccccc1O ZINC000802657516 1046028613 /nfs/dbraw/zinc/02/86/13/1046028613.db2.gz HDCFWLBHTNJORV-UHFFFAOYSA-N 1 0 315.461 4.028 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000755928773 1046029247 /nfs/dbraw/zinc/02/92/47/1046029247.db2.gz ZMDDCSWZCWHNTB-MRXNPFEDSA-N 1 0 322.383 4.069 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCCC(F)(F)F)c1 ZINC000756079536 1046049065 /nfs/dbraw/zinc/04/90/65/1046049065.db2.gz QJZMKDXYZJEQQI-GHMZBOCLSA-N 1 0 305.340 4.173 20 10 DICDRO C[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)CCS1 ZINC000756146727 1046056037 /nfs/dbraw/zinc/05/60/37/1046056037.db2.gz LTHLAGMGLIUBQQ-HNNXBMFYSA-N 1 0 313.466 4.387 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1cccc(F)c1 ZINC000756318225 1046064582 /nfs/dbraw/zinc/06/45/82/1046064582.db2.gz LDVUWDBCMKXKIB-UHFFFAOYSA-N 1 0 311.356 4.327 20 10 DICDRO Oc1ccccc1C[N@H+](CCc1ccccc1)Cc1ccco1 ZINC000756317320 1046065044 /nfs/dbraw/zinc/06/50/44/1046065044.db2.gz JVYMBWOQPVGNCB-UHFFFAOYSA-N 1 0 307.393 4.230 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCc2ccc(F)cc2)c2c1c(F)ccc2O ZINC000756339525 1046066402 /nfs/dbraw/zinc/06/64/02/1046066402.db2.gz BCBDEVRMYBJMOF-NHYWBVRUSA-N 1 0 303.352 4.051 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2)c2c1c(F)ccc2O ZINC000756339527 1046067979 /nfs/dbraw/zinc/06/79/79/1046067979.db2.gz BCBDEVRMYBJMOF-XHDPSFHLSA-N 1 0 303.352 4.051 20 10 DICDRO C[C@H](CCc1ccco1)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756356645 1046068706 /nfs/dbraw/zinc/06/87/06/1046068706.db2.gz HDPOQMOPGHRGJK-LALPHHSUSA-N 1 0 303.377 4.284 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCc2cccc(F)c2)c2c1c(F)ccc2O ZINC000756357173 1046069002 /nfs/dbraw/zinc/06/90/02/1046069002.db2.gz CJRGKZYYNCXKIO-ABAIWWIYSA-N 1 0 303.352 4.051 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCSCc2ccccc2F)c1 ZINC000756355720 1046070205 /nfs/dbraw/zinc/07/02/05/1046070205.db2.gz RMXWIPGBWMGMHC-AWEZNQCLSA-N 1 0 319.445 4.424 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2OC(F)F)c(O)c1C ZINC000756366895 1046071583 /nfs/dbraw/zinc/07/15/83/1046071583.db2.gz JQPBTDKRCNMQDJ-ZDUSSCGKSA-N 1 0 321.367 4.461 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1F ZINC000756376668 1046071668 /nfs/dbraw/zinc/07/16/68/1046071668.db2.gz GWDQERFECBCGTF-QMTHXVAHSA-N 1 0 319.351 4.017 20 10 DICDRO COCc1ccccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756373763 1046071831 /nfs/dbraw/zinc/07/18/31/1046071831.db2.gz YODMCIFXKMVYBE-MLGOLLRUSA-N 1 0 315.388 4.016 20 10 DICDRO CSC1(C[NH2+][C@H](C)c2ccc3ccccc3c2O)CCC1 ZINC000193804039 1046071968 /nfs/dbraw/zinc/07/19/68/1046071968.db2.gz NSWOSUKYXSBIGS-CYBMUJFWSA-N 1 0 301.455 4.482 20 10 DICDRO C[C@@H]([NH2+]CCCSc1ccccc1)c1cc(F)ccc1O ZINC000756369955 1046072123 /nfs/dbraw/zinc/07/21/23/1046072123.db2.gz FMOQMZCCWSDPQN-CYBMUJFWSA-N 1 0 305.418 4.364 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)cc1F ZINC000756376667 1046072262 /nfs/dbraw/zinc/07/22/62/1046072262.db2.gz GWDQERFECBCGTF-IINYFYTJSA-N 1 0 319.351 4.017 20 10 DICDRO C[C@@H]([NH2+]Cc1cn2ccccc2n1)c1ccc2ccccc2c1O ZINC000756364739 1046072494 /nfs/dbraw/zinc/07/24/94/1046072494.db2.gz VBBORYQNBYLYGC-CQSZACIVSA-N 1 0 317.392 4.044 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(OC(C)C)cc2)c1 ZINC000756383910 1046073397 /nfs/dbraw/zinc/07/33/97/1046073397.db2.gz LNNAPGIUIMFTAQ-INIZCTEOSA-N 1 0 313.441 4.381 20 10 DICDRO C[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000756381101 1046073585 /nfs/dbraw/zinc/07/35/85/1046073585.db2.gz WXBDPWFXNMETLX-QWRGUYRKSA-N 1 0 324.218 4.030 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCN(c3ccccc3)C2)c(O)c1C ZINC000756400786 1046076713 /nfs/dbraw/zinc/07/67/13/1046076713.db2.gz FFLXCISNYHKZTH-ROUUACIJSA-N 1 0 324.468 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCCN(C)c2ccccc2)c(O)c1 ZINC000756447831 1046082641 /nfs/dbraw/zinc/08/26/41/1046082641.db2.gz YUIVAPPNXHMTEQ-KRWDZBQOSA-N 1 0 312.457 4.268 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)COc2ccc(F)cc2F)c(O)c1 ZINC000756453366 1046084834 /nfs/dbraw/zinc/08/48/34/1046084834.db2.gz GDCVOAVCPPWNHZ-CHWSQXEVSA-N 1 0 321.367 4.097 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1cc(Br)ccc1O ZINC000756474413 1046086007 /nfs/dbraw/zinc/08/60/07/1046086007.db2.gz IGGZZWMLVIQLRW-VXGBXAGGSA-N 1 0 310.235 4.162 20 10 DICDRO COc1cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)ccc1C ZINC000756480712 1046086075 /nfs/dbraw/zinc/08/60/75/1046086075.db2.gz UEMFQWHHDLPUEG-SWLSCSKDSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCOc2ccc(Cl)cc2)c1 ZINC000756472203 1046086988 /nfs/dbraw/zinc/08/69/88/1046086988.db2.gz YOLDDBNMDLXKCO-ZDUSSCGKSA-N 1 0 305.805 4.084 20 10 DICDRO COc1cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)ccc1C ZINC000756480715 1046087596 /nfs/dbraw/zinc/08/75/96/1046087596.db2.gz UEMFQWHHDLPUEG-WFASDCNBSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cc3c(s2)CCCC3)c(O)c1 ZINC000756483319 1046089735 /nfs/dbraw/zinc/08/97/35/1046089735.db2.gz MBPVGFHNSLJZCO-ZDUSSCGKSA-N 1 0 301.455 4.492 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)c1 ZINC000756483506 1046090060 /nfs/dbraw/zinc/09/00/60/1046090060.db2.gz RVQQXMFRFJBFSN-DYVFJYSZSA-N 1 0 315.388 4.404 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)cc1 ZINC000756498703 1046091230 /nfs/dbraw/zinc/09/12/30/1046091230.db2.gz YREJAOMMPVFTTB-MQIPJXDCSA-N 1 0 315.388 4.439 20 10 DICDRO CCOc1cccc(C[N@H+](CC)Cc2ccc(N(C)C)cc2)c1 ZINC001138102663 1046092295 /nfs/dbraw/zinc/09/22/95/1046092295.db2.gz XFKBMJKGYMWPEQ-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(N(C)C)c1)c1cc2c(cc1O)CCCC2 ZINC000756534491 1046096777 /nfs/dbraw/zinc/09/67/77/1046096777.db2.gz KXOYMLTWAYOGPS-OAHLLOKOSA-N 1 0 324.468 4.188 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc2c1OCO2)c1ccc2ccccc2c1O ZINC000194401254 1046098197 /nfs/dbraw/zinc/09/81/97/1046098197.db2.gz PZSCIQYMXQQMKX-CYBMUJFWSA-N 1 0 321.376 4.125 20 10 DICDRO CC(C)[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Nc1ccccc1 ZINC000756555977 1046100342 /nfs/dbraw/zinc/10/03/42/1046100342.db2.gz NNKGFZSCQDHUNV-KSSFIOAISA-N 1 0 316.420 4.319 20 10 DICDRO CCC1([NH2+]Cc2ccc(N3CCC(OC)CC3)cc2)CCCC1 ZINC000830786993 1046100583 /nfs/dbraw/zinc/10/05/83/1046100583.db2.gz LUYGVCZNLCGNEA-UHFFFAOYSA-N 1 0 316.489 4.114 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)cs1 ZINC000756568386 1046100593 /nfs/dbraw/zinc/10/05/93/1046100593.db2.gz DQSOVGFZHJTYIK-NHCYSSNCSA-N 1 0 320.433 4.449 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCN(c3ccccc3)C2)c(O)c1C ZINC000756582376 1046104238 /nfs/dbraw/zinc/10/42/38/1046104238.db2.gz HYMJWGBKEHZDKW-QZTJIDSGSA-N 1 0 324.468 4.329 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCCNc2ccccc2)c2c1c(F)ccc2O ZINC000756589822 1046104420 /nfs/dbraw/zinc/10/44/20/1046104420.db2.gz NCUVFKMDDAQHOM-CZUORRHYSA-N 1 0 314.404 4.171 20 10 DICDRO CCCC(O)(CCC)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756594930 1046106598 /nfs/dbraw/zinc/10/65/98/1046106598.db2.gz QLZIXMQFHBPBBQ-TZMCWYRMSA-N 1 0 309.425 4.001 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)Oc2ccccc2F)c(O)c1C ZINC000756609718 1046110543 /nfs/dbraw/zinc/11/05/43/1046110543.db2.gz NAJXSXIXFWTAQI-UKRRQHHQSA-N 1 0 317.404 4.266 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(Cl)ccc2O)C12CCC2 ZINC000756613484 1046110789 /nfs/dbraw/zinc/11/07/89/1046110789.db2.gz PSDNCXLINMSJHP-HFBAOOFYSA-N 1 0 309.837 4.044 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(Cl)cc1 ZINC000756614705 1046110896 /nfs/dbraw/zinc/11/08/96/1046110896.db2.gz UXLYFEROBDYUPH-ACJLOTCBSA-N 1 0 319.832 4.392 20 10 DICDRO CCCN(Cc1ncc(C(C)C)s1)c1ccc(C[NH3+])cc1 ZINC000194980816 1046111350 /nfs/dbraw/zinc/11/13/50/1046111350.db2.gz YIINULNDGSAEHO-UHFFFAOYSA-N 1 0 303.475 4.142 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)c2ccc(F)cc2F)c1 ZINC000756620901 1046111911 /nfs/dbraw/zinc/11/19/11/1046111911.db2.gz OHDIBXGMTDLJTA-CHWSQXEVSA-N 1 0 305.368 4.433 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccc(F)cc2F)c(O)c1 ZINC000756620510 1046112269 /nfs/dbraw/zinc/11/22/69/1046112269.db2.gz KKUHETDAJUZHQR-OLZOCXBDSA-N 1 0 305.368 4.433 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)C(C)(C)C ZINC000756627122 1046112454 /nfs/dbraw/zinc/11/24/54/1046112454.db2.gz QTDLBGISAOKOCW-DYVFJYSZSA-N 1 0 301.430 4.257 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)c2ccc(F)cc2F)c1 ZINC000756620902 1046112759 /nfs/dbraw/zinc/11/27/59/1046112759.db2.gz OHDIBXGMTDLJTA-OLZOCXBDSA-N 1 0 305.368 4.433 20 10 DICDRO CCO[C@@H](CC[NH2+][C@H](C)c1cc(C)ccc1O)C1CCCC1 ZINC000756634655 1046114469 /nfs/dbraw/zinc/11/44/69/1046114469.db2.gz CCYSBTHTRPVMAK-BEFAXECRSA-N 1 0 305.462 4.337 20 10 DICDRO CSCc1cc(F)ccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756644515 1046116439 /nfs/dbraw/zinc/11/64/39/1046116439.db2.gz FHKUIHVDBDZLHD-LLVKDONJSA-N 1 0 323.408 4.384 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2cccnc2)C(C)C)c(O)c1C ZINC000756649221 1046118427 /nfs/dbraw/zinc/11/84/27/1046118427.db2.gz MQPBGYPFXDLADZ-APWZRJJASA-N 1 0 312.457 4.494 20 10 DICDRO CC(C)c1csc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000756657740 1046118859 /nfs/dbraw/zinc/11/88/59/1046118859.db2.gz FWFXAZUOEXWLFO-PWSUYJOCSA-N 1 0 320.433 4.449 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@@H](O)c2ccccc2)c(O)c1C ZINC000756674821 1046119482 /nfs/dbraw/zinc/11/94/82/1046119482.db2.gz BNWSYXRIVAPMON-SIXWZSSISA-N 1 0 313.441 4.172 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@H](O)c2ccccc2)c(O)c1C ZINC000756674819 1046119594 /nfs/dbraw/zinc/11/95/94/1046119594.db2.gz BNWSYXRIVAPMON-ALKREAHSSA-N 1 0 313.441 4.172 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)c1 ZINC000756675378 1046120770 /nfs/dbraw/zinc/12/07/70/1046120770.db2.gz FNQZCNDIZLNETK-USXIJHARSA-N 1 0 311.425 4.388 20 10 DICDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000756681438 1046120793 /nfs/dbraw/zinc/12/07/93/1046120793.db2.gz BPVOLNWWUFUZTL-CRAIPNDOSA-N 1 0 311.425 4.410 20 10 DICDRO CCC[N@H+](Cc1ccc(N2CCCCC2)cc1)C1CCOCC1 ZINC001138220927 1046123109 /nfs/dbraw/zinc/12/31/09/1046123109.db2.gz RTLGKVDMYVEHOE-UHFFFAOYSA-N 1 0 316.489 4.068 20 10 DICDRO CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756735815 1046123738 /nfs/dbraw/zinc/12/37/38/1046123738.db2.gz IXXUVVZNRVWTEH-BFDPJXHCSA-N 1 0 321.436 4.120 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000756747881 1046125236 /nfs/dbraw/zinc/12/52/36/1046125236.db2.gz SEAJCSCWQQGJQM-GNWWPAOBSA-N 1 0 315.388 4.135 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c(F)c1 ZINC000756755831 1046125811 /nfs/dbraw/zinc/12/58/11/1046125811.db2.gz CUQUVMLOIGMGNC-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)c1cc(Cl)ccc1O ZINC000756757406 1046126617 /nfs/dbraw/zinc/12/66/17/1046126617.db2.gz BNOFCTZVCNKJSR-XNKSSIQNSA-N 1 0 313.828 4.282 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)c(O)c1 ZINC000756762549 1046128093 /nfs/dbraw/zinc/12/80/93/1046128093.db2.gz XQPMTKCPLFXMSS-NHYWBVRUSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)c(O)c1C ZINC000756757797 1046128225 /nfs/dbraw/zinc/12/82/25/1046128225.db2.gz CDCWDGCVDVNKGH-BLLLJJGKSA-N 1 0 317.816 4.447 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H](c3ccccc3)[C@H]2C)c1 ZINC000756758635 1046128536 /nfs/dbraw/zinc/12/85/36/1046128536.db2.gz HEHTUSQOCTYBCO-QOIYZWAUSA-N 1 0 311.425 4.244 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)c(O)c1 ZINC000756762547 1046128597 /nfs/dbraw/zinc/12/85/97/1046128597.db2.gz XQPMTKCPLFXMSS-IAQYHMDHSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c2ccccc2n1C ZINC001138252522 1046129837 /nfs/dbraw/zinc/12/98/37/1046129837.db2.gz JUZCIRNKSZEORN-LJQANCHMSA-N 1 0 305.425 4.219 20 10 DICDRO Cc1c(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c2ccccc2n1C ZINC001138257099 1046131536 /nfs/dbraw/zinc/13/15/36/1046131536.db2.gz VZVGKNNTBNKYET-NRFANRHFSA-N 1 0 320.436 4.060 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1c(C)noc1C ZINC000756776324 1046131510 /nfs/dbraw/zinc/13/15/10/1046131510.db2.gz OIMNHWHKWFCXRO-MLGOLLRUSA-N 1 0 302.418 4.416 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@@H]2c2nccs2)c2ccccc2n1C ZINC001138258344 1046131979 /nfs/dbraw/zinc/13/19/79/1046131979.db2.gz QTDGKUGSIZXAJP-QGZVFWFLSA-N 1 0 311.454 4.280 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3SCCS[C@@H]23)c(O)c1C ZINC000756777702 1046131783 /nfs/dbraw/zinc/13/17/83/1046131783.db2.gz KPNCIEVASCBOAD-GUSZCTEKSA-N 1 0 323.527 4.039 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1c(C)noc1C ZINC000756776321 1046132230 /nfs/dbraw/zinc/13/22/30/1046132230.db2.gz OIMNHWHKWFCXRO-LRDDRELGSA-N 1 0 302.418 4.416 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)c(O)c1 ZINC000756775431 1046132547 /nfs/dbraw/zinc/13/25/47/1046132547.db2.gz QBGOJZXZEJHGNR-CQSZACIVSA-N 1 0 314.429 4.124 20 10 DICDRO COc1ccc(C[C@@H](C)C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000756786018 1046133429 /nfs/dbraw/zinc/13/34/29/1046133429.db2.gz WQMPWCRRMDZBPS-CVEARBPZSA-N 1 0 313.441 4.239 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1cc(Cl)ccc1O ZINC000756785072 1046133442 /nfs/dbraw/zinc/13/34/42/1046133442.db2.gz RWEBTLXDNGDBKW-PIGZYNQJSA-N 1 0 302.805 4.243 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000756783335 1046133614 /nfs/dbraw/zinc/13/36/14/1046133614.db2.gz XTELJTWHIWWWBF-LPMFXHHGSA-N 1 0 317.404 4.267 20 10 DICDRO CCCCCn1cc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c(C)n1 ZINC000756780868 1046133624 /nfs/dbraw/zinc/13/36/24/1046133624.db2.gz XGSXSMUUWHLQGU-INIZCTEOSA-N 1 0 315.461 4.247 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000756783334 1046134045 /nfs/dbraw/zinc/13/40/45/1046134045.db2.gz XTELJTWHIWWWBF-KSMMKXTCSA-N 1 0 317.404 4.267 20 10 DICDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756790914 1046135409 /nfs/dbraw/zinc/13/54/09/1046135409.db2.gz PROBXYMJAARSTB-PZROIBLQSA-N 1 0 321.367 4.097 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1O ZINC000193901191 1046135580 /nfs/dbraw/zinc/13/55/80/1046135580.db2.gz RZZJKBHRXHHCAO-WBMJQRKESA-N 1 0 300.358 4.102 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(Cc3ccccc3)CCC2)c1 ZINC000756844243 1046142720 /nfs/dbraw/zinc/14/27/20/1046142720.db2.gz LUPBZOPRUKSTOY-OAHLLOKOSA-N 1 0 311.425 4.217 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c(O)c1C ZINC000756858255 1046145806 /nfs/dbraw/zinc/14/58/06/1046145806.db2.gz SPMOFBKFRUKOOP-WQCNXYOZSA-N 1 0 315.457 4.007 20 10 DICDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CCO1 ZINC000756874514 1046147652 /nfs/dbraw/zinc/14/76/52/1046147652.db2.gz QCBQKRWBTJVGIT-KQTLUZQSSA-N 1 0 321.436 4.263 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccc3c(c2)CCCN3C)cc1 ZINC001138356499 1046155240 /nfs/dbraw/zinc/15/52/40/1046155240.db2.gz PLXGLYXCXTXYOM-INIZCTEOSA-N 1 0 324.468 4.271 20 10 DICDRO CN1CCCc2cc(C[N@@H+]3CCCC4(CC(F)C4)CC3)ccc21 ZINC001138356956 1046155281 /nfs/dbraw/zinc/15/52/81/1046155281.db2.gz VZKDUCSUYBWLGX-UHFFFAOYSA-N 1 0 316.464 4.173 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@@H](c3ccccc3)C3CC3)ccc21 ZINC000321018260 1046156740 /nfs/dbraw/zinc/15/67/40/1046156740.db2.gz NSXRIYTWAHCTQK-NRFANRHFSA-N 1 0 306.453 4.310 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@H](c3ccccc3)C3CC3)ccc21 ZINC000321018261 1046156946 /nfs/dbraw/zinc/15/69/46/1046156946.db2.gz NSXRIYTWAHCTQK-OAQYLSRUSA-N 1 0 306.453 4.310 20 10 DICDRO CN1CCCc2cc(C[N@H+](C)[C@H]3CCc4ccccc43)ccc21 ZINC001138360356 1046157314 /nfs/dbraw/zinc/15/73/14/1046157314.db2.gz ULZYDGZGMAXGMP-NRFANRHFSA-N 1 0 306.453 4.188 20 10 DICDRO CC[C@H]([NH2+]Cc1nccc2c1CCCC2)c1ccc(C)cc1O ZINC000903181126 1046184319 /nfs/dbraw/zinc/18/43/19/1046184319.db2.gz DUNQXAMJVJLVLZ-SFHVURJKSA-N 1 0 310.441 4.215 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CC(C)(C)OC2(C)C)c2c1c(F)ccc2O ZINC000757632164 1046195054 /nfs/dbraw/zinc/19/50/54/1046195054.db2.gz VZJLRIXXBINEBC-QKCSRTOESA-N 1 0 307.409 4.015 20 10 DICDRO COCC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccco1 ZINC000757639274 1046195077 /nfs/dbraw/zinc/19/50/77/1046195077.db2.gz QIVGHQOUZOSBJV-KWCYVHTRSA-N 1 0 319.376 4.040 20 10 DICDRO COCC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccco1 ZINC000757639283 1046195851 /nfs/dbraw/zinc/19/58/51/1046195851.db2.gz QIVGHQOUZOSBJV-XBFCOCLRSA-N 1 0 319.376 4.040 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCNc2cccc(F)c2)c(O)c1C ZINC000757655288 1046197272 /nfs/dbraw/zinc/19/72/72/1046197272.db2.gz DIQDXDWACOYZAX-HNNXBMFYSA-N 1 0 316.420 4.301 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2COc3cc(F)cc(F)c32)c(O)c1C ZINC000757663094 1046199577 /nfs/dbraw/zinc/19/95/77/1046199577.db2.gz HTBFDRFMYWMKTH-ABAIWWIYSA-N 1 0 319.351 4.072 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCNc1ccccc1 ZINC000757684461 1046201031 /nfs/dbraw/zinc/20/10/31/1046201031.db2.gz AYDJHCCBLKLXMR-UHFFFAOYSA-N 1 0 318.420 4.261 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cnc(-c3ccccc3)s1)CC2 ZINC001138531298 1046213269 /nfs/dbraw/zinc/21/32/69/1046213269.db2.gz IXJYOAVMZUQNGZ-UHFFFAOYSA-N 1 0 322.433 4.074 20 10 DICDRO C[C@@H]([NH2+]C1CC2(C1)CO[C@H](C)C2)c1ccc2ccccc2c1O ZINC000903284039 1046221535 /nfs/dbraw/zinc/22/15/35/1046221535.db2.gz VBOGWKOFMRETAA-GGRHHHIRSA-N 1 0 311.425 4.154 20 10 DICDRO C[C@H]([NH2+]C1CC2(C1)CO[C@H](C)C2)c1ccc2ccccc2c1O ZINC000903284037 1046222076 /nfs/dbraw/zinc/22/20/76/1046222076.db2.gz VBOGWKOFMRETAA-DBTHTNCCSA-N 1 0 311.425 4.154 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)[C@H](C)c2cccnc2)cc1F ZINC000757890730 1046223535 /nfs/dbraw/zinc/22/35/35/1046223535.db2.gz JAQAOSFRXXUJMO-OAHLLOKOSA-N 1 0 315.436 4.260 20 10 DICDRO Cc1cc(CO)cc(C)c1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000903303810 1046230174 /nfs/dbraw/zinc/23/01/74/1046230174.db2.gz WEWFGJMVPGILTG-CYBMUJFWSA-N 1 0 319.832 4.006 20 10 DICDRO Cc1cccnc1[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)C(C)(C)C ZINC000903327924 1046240515 /nfs/dbraw/zinc/24/05/15/1046240515.db2.gz BJJQNZMEUCRBSC-HNAYVOBHSA-N 1 0 310.441 4.460 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1cc(Cl)ccc1O ZINC000903335731 1046247863 /nfs/dbraw/zinc/24/78/63/1046247863.db2.gz STTXFNLKJLHWEC-APPDUMDISA-N 1 0 302.805 4.243 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)c1 ZINC000903404359 1046268031 /nfs/dbraw/zinc/26/80/31/1046268031.db2.gz JEGIXCUCJUFONP-GJZGRUSLSA-N 1 0 313.445 4.109 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cnn(CC3CCC3)c2)c1 ZINC000903404360 1046268193 /nfs/dbraw/zinc/26/81/93/1046268193.db2.gz JEGIXCUCJUFONP-HUUCEWRRSA-N 1 0 313.445 4.109 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)c1cc(Cl)ccc1O ZINC000903429104 1046276420 /nfs/dbraw/zinc/27/64/20/1046276420.db2.gz RUKIZOIQFCCESI-DIFFPNOSSA-N 1 0 302.805 4.243 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1cc(Cl)ccc1O ZINC000903429102 1046276732 /nfs/dbraw/zinc/27/67/32/1046276732.db2.gz RUKIZOIQFCCESI-APPDUMDISA-N 1 0 302.805 4.243 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](c2ccncc2)C2CC2)cc1 ZINC000903427692 1046277307 /nfs/dbraw/zinc/27/73/07/1046277307.db2.gz IQMFQOIIYBSIRH-YWZLYKJASA-N 1 0 309.457 4.340 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccc(Cl)cc1O ZINC000903427838 1046278237 /nfs/dbraw/zinc/27/82/37/1046278237.db2.gz AAZAKQQPDVKYEV-GTNSWQLSSA-N 1 0 302.805 4.243 20 10 DICDRO CC[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903430338 1046279033 /nfs/dbraw/zinc/27/90/33/1046279033.db2.gz YUOAISLYCDPCBX-WOJBJXKFSA-N 1 0 309.457 4.340 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccncc2)C2CC2)c2c1c(F)ccc2O ZINC000903429227 1046279833 /nfs/dbraw/zinc/27/98/33/1046279833.db2.gz TYRBTWOQOXGPPI-VZMUKZCBSA-N 1 0 312.388 4.216 20 10 DICDRO c1cncc([C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C2CC2)c1 ZINC000758622923 1046281211 /nfs/dbraw/zinc/28/12/11/1046281211.db2.gz JFBQTBRQYATSHI-OAQYLSRUSA-N 1 0 321.468 4.313 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](COC)c2ccccc2)cc1 ZINC000089668754 1046295937 /nfs/dbraw/zinc/29/59/37/1046295937.db2.gz ONDLYXJIVFCMAY-UZLBHIALSA-N 1 0 312.457 4.181 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](COC)c2ccccc2)cc1 ZINC000089668755 1046296818 /nfs/dbraw/zinc/29/68/18/1046296818.db2.gz ONDLYXJIVFCMAY-JXFKEZNVSA-N 1 0 312.457 4.181 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2oc3ccccc3c2C)c1 ZINC000089726136 1046303434 /nfs/dbraw/zinc/30/34/34/1046303434.db2.gz LYKVCNSCTSVWEJ-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO C[C@H](C[NH2+]CCCSc1nccs1)c1ccc(F)cc1 ZINC000759189020 1046332721 /nfs/dbraw/zinc/33/27/21/1046332721.db2.gz ICBCWZYPAPAQTA-GFCCVEGCSA-N 1 0 310.463 4.158 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](COC)c2ccccc2)cc1 ZINC000246441215 1046354996 /nfs/dbraw/zinc/35/49/96/1046354996.db2.gz ONDLYXJIVFCMAY-OXJNMPFZSA-N 1 0 312.457 4.181 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCC1 ZINC000090457245 1046372084 /nfs/dbraw/zinc/37/20/84/1046372084.db2.gz HXTQQXQRPKJAKZ-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO C[C@@H]([NH2+]CCCn1ccc2ccccc21)c1cc(F)ccc1O ZINC000321730910 1046379869 /nfs/dbraw/zinc/37/98/69/1046379869.db2.gz OIDVAZNBBPAWIF-CQSZACIVSA-N 1 0 312.388 4.227 20 10 DICDRO C[C@H]([NH2+]CCc1cc(F)c(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000780743625 1046402077 /nfs/dbraw/zinc/40/20/77/1046402077.db2.gz HKRQFWCXTNMHJY-LBPRGKRZSA-N 1 0 322.374 4.063 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)c1O ZINC000780792085 1046404826 /nfs/dbraw/zinc/40/48/26/1046404826.db2.gz STHQXKJNCRMFMG-MENFKHAKSA-N 1 0 309.409 4.079 20 10 DICDRO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000780793435 1046406183 /nfs/dbraw/zinc/40/61/83/1046406183.db2.gz NPFKZNQKRRQSDD-YPMHNXCESA-N 1 0 318.358 4.055 20 10 DICDRO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(Cl)ccc1O ZINC000780792698 1046407230 /nfs/dbraw/zinc/40/72/30/1046407230.db2.gz IOJMYMNCOWWDDZ-GXSJLCMTSA-N 1 0 307.743 4.208 20 10 DICDRO CC(C)OC1CCC([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000090771741 1046422759 /nfs/dbraw/zinc/42/27/59/1046422759.db2.gz BPWQNOFZLYYHDF-DMKPSLHHSA-N 1 0 304.478 4.139 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)c2nc(C)cs2)cc1 ZINC000246861742 1046432652 /nfs/dbraw/zinc/43/26/52/1046432652.db2.gz CBYWZVPCEITVFM-UONOGXRCSA-N 1 0 303.475 4.319 20 10 DICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1ccc(N(C)C)c(C)c1 ZINC001139673970 1046497258 /nfs/dbraw/zinc/49/72/58/1046497258.db2.gz OPVCAASBWKVQIO-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000782291610 1046514420 /nfs/dbraw/zinc/51/44/20/1046514420.db2.gz WTKMNMLRUDOVPX-KRWDZBQOSA-N 1 0 318.420 4.005 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](C)C[C@H](C)O)c1ccc(N2CCCCCC2)cc1 ZINC000248008050 1046525450 /nfs/dbraw/zinc/52/54/50/1046525450.db2.gz KZTMBRZOOYGAJD-OKZBNKHCSA-N 1 0 318.505 4.125 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1Br ZINC000782530453 1046534295 /nfs/dbraw/zinc/53/42/95/1046534295.db2.gz GIQTZPVDAIDULU-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccc(F)c1 ZINC000783232751 1046565373 /nfs/dbraw/zinc/56/53/73/1046565373.db2.gz WLFYEGHMZGBHRK-QGZVFWFLSA-N 1 0 304.384 4.272 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](CC(F)(F)F)C(C)C)c1 ZINC000783329582 1046583054 /nfs/dbraw/zinc/58/30/54/1046583054.db2.gz HSRXRHVHPRSULX-GXFFZTMASA-N 1 0 305.340 4.028 20 10 DICDRO CCC[N@H+](Cc1c(O)cccc1Br)[C@H](C)CC ZINC001140098819 1046587867 /nfs/dbraw/zinc/58/78/67/1046587867.db2.gz MOKWWIFEOYOQOH-LLVKDONJSA-N 1 0 300.240 4.165 20 10 DICDRO Oc1cccc(Br)c1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001140101249 1046589824 /nfs/dbraw/zinc/58/98/24/1046589824.db2.gz NCOQNOZWIZRSQO-OAHLLOKOSA-N 1 0 318.214 4.102 20 10 DICDRO C[C@H]([NH2+]Cc1ccnc(Oc2ccccc2)c1)c1ccccc1O ZINC000783500511 1046600796 /nfs/dbraw/zinc/60/07/96/1046600796.db2.gz WMMYKYJDFDYVSR-HNNXBMFYSA-N 1 0 320.392 4.430 20 10 DICDRO C[C@@H]([NH2+]CCc1ccccc1Br)c1ccccc1O ZINC000783510010 1046601813 /nfs/dbraw/zinc/60/18/13/1046601813.db2.gz YHMGOUCLXZSVLO-GFCCVEGCSA-N 1 0 320.230 4.048 20 10 DICDRO Cc1ccc([C@@H](C[NH2+][C@H](C)c2ccccc2O)N2CCCC2)cc1 ZINC000783507317 1046601946 /nfs/dbraw/zinc/60/19/46/1046601946.db2.gz CBAZYAONTXMGBM-YLJYHZDGSA-N 1 0 324.468 4.188 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccc(F)cc1)[C@H]1CCCO1)c1ccccc1O ZINC000783504662 1046601969 /nfs/dbraw/zinc/60/19/69/1046601969.db2.gz IJRNYXOHBYIZCT-BKTGTZMESA-N 1 0 315.388 4.102 20 10 DICDRO CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1[O-] ZINC000841744128 1046602304 /nfs/dbraw/zinc/60/23/04/1046602304.db2.gz MBIQDDRVXXTTRT-UONOGXRCSA-N 1 0 312.885 4.207 20 10 DICDRO CC[C@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1cccc(F)c1 ZINC000783519480 1046603686 /nfs/dbraw/zinc/60/36/86/1046603686.db2.gz LKGBJRYHAJEQIL-DZGCQCFKSA-N 1 0 303.377 4.040 20 10 DICDRO Cc1ccc(C)c(C[NH+]2CCC(c3cccs3)CC2)c1O ZINC001140179679 1046609468 /nfs/dbraw/zinc/60/94/68/1046609468.db2.gz LNQLKWQALFKWNH-UHFFFAOYSA-N 1 0 301.455 4.450 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1c(C)ccc(C)c1O ZINC001140184705 1046609946 /nfs/dbraw/zinc/60/99/46/1046609946.db2.gz FJUBMIQTUGMJRB-UHFFFAOYSA-N 1 0 312.457 4.097 20 10 DICDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)c1O ZINC001140179045 1046610308 /nfs/dbraw/zinc/61/03/08/1046610308.db2.gz FURQYWMAMOPAKM-GOSISDBHSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c(C)cc1O ZINC001140199963 1046613509 /nfs/dbraw/zinc/61/35/09/1046613509.db2.gz JLQAMPNEEOMHBC-UHFFFAOYSA-N 1 0 324.468 4.241 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C)c1cc(F)ccc1O ZINC000248498507 1046618391 /nfs/dbraw/zinc/61/83/91/1046618391.db2.gz MGBULJUZYGGWOZ-OGHNNQOOSA-N 1 0 309.425 4.023 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)ccc2O)CCO1 ZINC000248485981 1046618441 /nfs/dbraw/zinc/61/84/41/1046618441.db2.gz FIOFQINRPLPNJJ-MRAWALMUSA-N 1 0 309.425 4.166 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCO[C@H]2C(C)(C)C)c1 ZINC000248483713 1046618546 /nfs/dbraw/zinc/61/85/46/1046618546.db2.gz CXDNIASFCGAGHY-HDMKZQKVSA-N 1 0 305.462 4.193 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCO[C@H]2C(C)(C)C)c(O)c1 ZINC000248492750 1046618861 /nfs/dbraw/zinc/61/88/61/1046618861.db2.gz JPSSCTQDXFNDEF-RLFYNMQTSA-N 1 0 305.462 4.193 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000834519439 1046625043 /nfs/dbraw/zinc/62/50/43/1046625043.db2.gz UIONNDKQMVRGFN-SFHVURJKSA-N 1 0 310.441 4.016 20 10 DICDRO CC(C)COc1ccccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834526934 1046627364 /nfs/dbraw/zinc/62/73/64/1046627364.db2.gz QUDUHTJCNJKNNH-KRWDZBQOSA-N 1 0 311.425 4.204 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](c2ccccc2)N(C)C)c(O)c1 ZINC000248640270 1046631666 /nfs/dbraw/zinc/63/16/66/1046631666.db2.gz NOTBVMYCEZVCFG-TWOQFEAHSA-N 1 0 312.457 4.043 20 10 DICDRO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(C)ccc1O)CCC2 ZINC000093768013 1046637358 /nfs/dbraw/zinc/63/73/58/1046637358.db2.gz BQZARTBTIDLFQL-HNNXBMFYSA-N 1 0 316.470 4.229 20 10 DICDRO CSCc1cc(F)ccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834620417 1046639584 /nfs/dbraw/zinc/63/95/84/1046639584.db2.gz RKHYUZATMAZFNN-INIZCTEOSA-N 1 0 317.429 4.171 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)c(OCC2CC2)c1 ZINC000834619102 1046639603 /nfs/dbraw/zinc/63/96/03/1046639603.db2.gz BFUFFEIXDLTIFY-SFHVURJKSA-N 1 0 323.436 4.267 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c(OCC2CC2)c1 ZINC000834619096 1046639997 /nfs/dbraw/zinc/63/99/97/1046639997.db2.gz BFUFFEIXDLTIFY-GOSISDBHSA-N 1 0 323.436 4.267 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(OC3CCCC3)cc1)CC2 ZINC000834640516 1046643194 /nfs/dbraw/zinc/64/31/94/1046643194.db2.gz NLZODPFYHJRELB-IBGZPJMESA-N 1 0 323.436 4.491 20 10 DICDRO CO[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1Cl ZINC000834681030 1046648907 /nfs/dbraw/zinc/64/89/07/1046648907.db2.gz SXQDJQLQNDGKJD-WBVHZDCISA-N 1 0 317.816 4.010 20 10 DICDRO CCOc1cc(Cl)ccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834688981 1046650485 /nfs/dbraw/zinc/65/04/85/1046650485.db2.gz HGMQWNGVFPNTTH-HNNXBMFYSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC([C@@H]3CCOC3)CC2)cc1C(C)C ZINC000784006033 1046651438 /nfs/dbraw/zinc/65/14/38/1046651438.db2.gz CPWPGNLDPGCIRK-QGZVFWFLSA-N 1 0 317.473 4.073 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cccc(-c3nccs3)c1)CC2 ZINC001140337134 1046664049 /nfs/dbraw/zinc/66/40/49/1046664049.db2.gz ZYJZGEIDNIFCEQ-UHFFFAOYSA-N 1 0 322.433 4.074 20 10 DICDRO CCOC1CC2(C1)CC[N@H+](Cc1cc(C(C)C)c(C)cc1O)C2 ZINC000795719361 1046664201 /nfs/dbraw/zinc/66/42/01/1046664201.db2.gz CKYCUSVNBKFWAJ-UHFFFAOYSA-N 1 0 317.473 4.215 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(O)cccc1Cl ZINC001140344941 1046668930 /nfs/dbraw/zinc/66/89/30/1046668930.db2.gz NYDDGCNCWCXEBG-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)c(C)c1 ZINC000834783102 1046670538 /nfs/dbraw/zinc/67/05/38/1046670538.db2.gz CMXONJBHNGRNMW-SFHVURJKSA-N 1 0 311.425 4.267 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2c(F)cc(F)cc21)c1ccccc1O ZINC000834814098 1046674176 /nfs/dbraw/zinc/67/41/76/1046674176.db2.gz FCASJHXRIGMDGZ-GTNSWQLSSA-N 1 0 303.352 4.399 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CSc2ccccc21)c1cc(F)ccc1O ZINC000834819074 1046675768 /nfs/dbraw/zinc/67/57/68/1046675768.db2.gz SEEAQBVWUDTWGX-NEPJUHHUSA-N 1 0 303.402 4.071 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCC2CCOCC2)cc1 ZINC000834819370 1046675804 /nfs/dbraw/zinc/67/58/04/1046675804.db2.gz VBWFNZHILDEAII-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCCC2CCOCC2)c1O ZINC000834819017 1046676322 /nfs/dbraw/zinc/67/63/22/1046676322.db2.gz RKQWMVSFVNTZRL-ZDUSSCGKSA-N 1 0 311.853 4.211 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CSc2ccccc21)c1cc(F)ccc1O ZINC000834819078 1046676486 /nfs/dbraw/zinc/67/64/86/1046676486.db2.gz SEEAQBVWUDTWGX-RYUDHWBXSA-N 1 0 303.402 4.071 20 10 DICDRO C[C@H]([NH2+]CCCC(C)(F)F)c1cc(Br)ccc1O ZINC000834818972 1046676640 /nfs/dbraw/zinc/67/66/40/1046676640.db2.gz QSQHHQCPZWOHAW-VIFPVBQESA-N 1 0 322.193 4.241 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000795793862 1046679021 /nfs/dbraw/zinc/67/90/21/1046679021.db2.gz BPHRUTRLKKBVNQ-HXUWFJFHSA-N 1 0 309.457 4.087 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000834856397 1046689131 /nfs/dbraw/zinc/68/91/31/1046689131.db2.gz QHWOPDMVRBHUEQ-SFHVURJKSA-N 1 0 311.473 4.166 20 10 DICDRO C[C@@H](CCCCO)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834876395 1046693501 /nfs/dbraw/zinc/69/35/01/1046693501.db2.gz BKUZZBPOFKHHRN-ROUUACIJSA-N 1 0 318.505 4.269 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000834881764 1046695093 /nfs/dbraw/zinc/69/50/93/1046695093.db2.gz ALMAZQGNHVEGLU-HZPDHXFCSA-N 1 0 303.446 4.009 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000834881766 1046695490 /nfs/dbraw/zinc/69/54/90/1046695490.db2.gz ALMAZQGNHVEGLU-JKSUJKDBSA-N 1 0 303.446 4.009 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c1O ZINC000834883218 1046697001 /nfs/dbraw/zinc/69/70/01/1046697001.db2.gz NONRVPYYKUPWLS-ZIAGYGMSSA-N 1 0 323.864 4.354 20 10 DICDRO CCOC1CC(C[N@H+](Cc2ccccc2O)C2CCCCC2)C1 ZINC000795910913 1046697525 /nfs/dbraw/zinc/69/75/25/1046697525.db2.gz HEUZEBLDVRROCE-UHFFFAOYSA-N 1 0 317.473 4.342 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834885301 1046698319 /nfs/dbraw/zinc/69/83/19/1046698319.db2.gz VGYSPPUWJFDKHB-FZMZJTMJSA-N 1 0 302.245 4.244 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)cc1 ZINC000834883971 1046698443 /nfs/dbraw/zinc/69/84/43/1046698443.db2.gz VMHVERWCJSMLJN-DLBZAZTESA-N 1 0 316.489 4.143 20 10 DICDRO COC[C@H](C[NH2+][C@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000834885780 1046698841 /nfs/dbraw/zinc/69/88/41/1046698841.db2.gz YAWVBWMXBHKYQC-HIFRSBDPSA-N 1 0 319.832 4.126 20 10 DICDRO CO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000834885857 1046700887 /nfs/dbraw/zinc/70/08/87/1046700887.db2.gz FRUBKYDIRMQVBX-LSBZLQRGSA-N 1 0 320.452 4.034 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@H](C(C)C)C1)c1ccc(C)cc1O ZINC000834885935 1046701146 /nfs/dbraw/zinc/70/11/46/1046701146.db2.gz NSMUOKXNCPIPLX-AYBZRNKSSA-N 1 0 305.462 4.193 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccc(N2CCCCC2)cc1 ZINC000834895711 1046704252 /nfs/dbraw/zinc/70/42/52/1046704252.db2.gz CVOGJVZYGSCACE-BXWFABGCSA-N 1 0 324.472 4.230 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccc(N2CCCCC2)cc1 ZINC000834895716 1046704460 /nfs/dbraw/zinc/70/44/60/1046704460.db2.gz CVOGJVZYGSCACE-JTDSTZFVSA-N 1 0 324.472 4.230 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCc3cc(F)c(F)c(F)c31)CC2 ZINC000834897189 1046706117 /nfs/dbraw/zinc/70/61/17/1046706117.db2.gz RHWQASFKBLWFAO-CHWSQXEVSA-N 1 0 319.326 4.074 20 10 DICDRO C[C@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO[C@@H]1C1CC1 ZINC000784688769 1046707824 /nfs/dbraw/zinc/70/78/24/1046707824.db2.gz YHNOGJJOEIRUQA-RTWAWAEBSA-N 1 0 323.436 4.106 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000834897598 1046708084 /nfs/dbraw/zinc/70/80/84/1046708084.db2.gz UYCNPDNFTWVPSM-HZMBPMFUSA-N 1 0 321.342 4.456 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)cn1 ZINC000834902404 1046713462 /nfs/dbraw/zinc/71/34/62/1046713462.db2.gz HQGJECBDGFIAHQ-OAHLLOKOSA-N 1 0 310.441 4.134 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C2CCC(OC(F)F)CC2)c(O)c1C ZINC000834903197 1046714976 /nfs/dbraw/zinc/71/49/76/1046714976.db2.gz JUKMXDLDCOXZBT-IYXRBSQSSA-N 1 0 313.388 4.210 20 10 DICDRO COc1ccc(C[NH2+]C(C)(C)Cc2ccccc2OC)cc1C ZINC000729687010 1046715231 /nfs/dbraw/zinc/71/52/31/1046715231.db2.gz VNKKXPCPRTWANY-UHFFFAOYSA-N 1 0 313.441 4.123 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)C(C)(C)O)c1ccc(N2CCCCC2)cc1 ZINC000834903753 1046715038 /nfs/dbraw/zinc/71/50/38/1046715038.db2.gz QSXXUSFBHOPOMQ-INIZCTEOSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCN(C)c2ccccc21)c1ccc(N(C)C)cc1 ZINC000834905204 1046715950 /nfs/dbraw/zinc/71/59/50/1046715950.db2.gz RIBGTWZVURBTHM-OXQOHEQNSA-N 1 0 323.484 4.375 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001140466246 1046739515 /nfs/dbraw/zinc/73/95/15/1046739515.db2.gz CLJNRECLSHLBHZ-GFCCVEGCSA-N 1 0 305.780 4.174 20 10 DICDRO CCC[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccccn1 ZINC000835038224 1046742996 /nfs/dbraw/zinc/74/29/96/1046742996.db2.gz OUMGUASWXVGHLV-GXVATQTDSA-N 1 0 309.457 4.292 20 10 DICDRO CCCO[C@@H]1CCC[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835028514 1046745265 /nfs/dbraw/zinc/74/52/65/1046745265.db2.gz KXYZGBKJPRLSFV-MWGFUINXSA-N 1 0 316.489 4.047 20 10 DICDRO CC[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000835041476 1046746148 /nfs/dbraw/zinc/74/61/48/1046746148.db2.gz MEJHTSBCFIGCRV-JTHGQSKGSA-N 1 0 313.445 4.112 20 10 DICDRO CC(C)c1csc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)n1 ZINC000835042492 1046746836 /nfs/dbraw/zinc/74/68/36/1046746836.db2.gz IXJFUUBEGCIAHI-AATRIKPKSA-N 1 0 315.486 4.136 20 10 DICDRO CC[C@](C)([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1nccs1 ZINC000835040612 1046747000 /nfs/dbraw/zinc/74/70/00/1046747000.db2.gz QMHIQIXUUYNTCY-MJRGOJFPSA-N 1 0 315.486 4.137 20 10 DICDRO CC(C)[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cccnc1 ZINC000835043569 1046747516 /nfs/dbraw/zinc/74/75/16/1046747516.db2.gz SCMGUCFYSGOJLP-JEUZPXFCSA-N 1 0 323.484 4.190 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C(C)(C)CC(F)(F)F)cc1 ZINC000835044572 1046748488 /nfs/dbraw/zinc/74/84/88/1046748488.db2.gz AKBQKMVZYUEECO-AATRIKPKSA-N 1 0 300.368 4.086 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH+]2CCC(c3ccncc3)CC2)cc1 ZINC000835053837 1046750361 /nfs/dbraw/zinc/75/03/61/1046750361.db2.gz PHPBCHGWCKMCOA-ONEGZZNKSA-N 1 0 321.468 4.040 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835054438 1046752003 /nfs/dbraw/zinc/75/20/03/1046752003.db2.gz VNPJXHIRBQVXDC-HCZHMGAMSA-N 1 0 309.457 4.244 20 10 DICDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)[C@@H]1CCOC(C)(C)C1 ZINC000835052700 1046752294 /nfs/dbraw/zinc/75/22/94/1046752294.db2.gz IXUKXNRWSXVKMA-IHHMQQGQSA-N 1 0 316.489 4.045 20 10 DICDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)[C@H](C)c1cccnc1 ZINC000835053897 1046752444 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Cc1ccc(O)c(C[N@@H+]2CCC[C@H](Oc3ccccc3C)C2)c1 ZINC001140621282 1046815333 /nfs/dbraw/zinc/81/53/33/1046815333.db2.gz TZKMBRMWBJIKAX-SFHVURJKSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001140624195 1046819558 /nfs/dbraw/zinc/81/95/58/1046819558.db2.gz KEJKRBXCHDJFMF-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO CCC[N@H+](Cc1cc(C)nc(Cl)c1)Cc1ccccc1O ZINC000797590343 1046859811 /nfs/dbraw/zinc/85/98/11/1046859811.db2.gz VTLNDGUTMPBQAP-UHFFFAOYSA-N 1 0 304.821 4.161 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(Cl)ccc1N ZINC001140719865 1046871993 /nfs/dbraw/zinc/87/19/93/1046871993.db2.gz WQMOVEKLCJYAJQ-UHFFFAOYSA-N 1 0 317.864 4.010 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cc(F)cc2cccnc21 ZINC000303122035 1046878524 /nfs/dbraw/zinc/87/85/24/1046878524.db2.gz AHTGAVHDTKMAFK-UHFFFAOYSA-N 1 0 324.399 4.492 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1c(Cl)cccc1OC ZINC001140730625 1046881215 /nfs/dbraw/zinc/88/12/15/1046881215.db2.gz SPVZABKCQBDOOP-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1O ZINC001140745588 1046882049 /nfs/dbraw/zinc/88/20/49/1046882049.db2.gz LVGSPRHRXQQGSL-INIZCTEOSA-N 1 0 317.816 4.397 20 10 DICDRO Cc1c(O)ccc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2)c1O ZINC001140748532 1046884341 /nfs/dbraw/zinc/88/43/41/1046884341.db2.gz HWOBVTMEOUQIAH-GFCCVEGCSA-N 1 0 305.805 4.253 20 10 DICDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1ccc(O)c(C)c1O ZINC001140747773 1046884599 /nfs/dbraw/zinc/88/45/99/1046884599.db2.gz LTDZVOCEFPPVGZ-UHFFFAOYSA-N 1 0 305.805 4.082 20 10 DICDRO CSc1ccc(CC[NH2+]Cc2cc(C)c(C)cc2O)cc1 ZINC000797878793 1046899615 /nfs/dbraw/zinc/89/96/15/1046899615.db2.gz CJSRZGZIWWWXBD-UHFFFAOYSA-N 1 0 301.455 4.063 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(O)cc(Cl)c1 ZINC001140791003 1046901089 /nfs/dbraw/zinc/90/10/89/1046901089.db2.gz VXUOAQXSZVEMJZ-UHFFFAOYSA-N 1 0 318.848 4.134 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(SC)cc2)c1 ZINC000797999047 1046917542 /nfs/dbraw/zinc/91/75/42/1046917542.db2.gz OKOLMLZTGWKLSQ-CYBMUJFWSA-N 1 0 317.454 4.016 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCN2C2CCCCC2)c(O)c1 ZINC000798002297 1046920154 /nfs/dbraw/zinc/92/01/54/1046920154.db2.gz CTCSEUMOALKHKS-FUHWJXTLSA-N 1 0 316.489 4.148 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCN2C2CCCCC2)c1 ZINC000798002902 1046920184 /nfs/dbraw/zinc/92/01/84/1046920184.db2.gz WBKJCFBILYQMGY-SJLPKXTDSA-N 1 0 316.489 4.148 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000798086475 1046927617 /nfs/dbraw/zinc/92/76/17/1046927617.db2.gz RECLHYJRASSINK-YGUOUDRMSA-N 1 0 305.780 4.221 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccc(C)c2)c(O)c1 ZINC001140850139 1046929781 /nfs/dbraw/zinc/92/97/81/1046929781.db2.gz DXCYLAISAURZKD-UHFFFAOYSA-N 1 0 312.457 4.179 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C/C=C/c2ccccc2)c(O)c1 ZINC001140855743 1046931277 /nfs/dbraw/zinc/93/12/77/1046931277.db2.gz JKQIHGABEOMRRY-FMIVXFBMSA-N 1 0 324.468 4.384 20 10 DICDRO Cc1cc([C@@H]2CCCN2Cc2ccc(N(C)C)cc2Cl)no1 ZINC001140921925 1046950078 /nfs/dbraw/zinc/95/00/78/1046950078.db2.gz WEODTIABIOEQSI-KRWDZBQOSA-N 1 0 319.836 4.040 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)CCC1(F)F ZINC001140921667 1046950705 /nfs/dbraw/zinc/95/07/05/1046950705.db2.gz MGYCHMCKGOBPQB-GFCCVEGCSA-N 1 0 316.823 4.273 20 10 DICDRO COc1cccc(CN(C)Cc2ccc(N(C)C)cc2Cl)c1 ZINC001140924235 1046951493 /nfs/dbraw/zinc/95/14/93/1046951493.db2.gz OSMUFJKKJSICMY-UHFFFAOYSA-N 1 0 318.848 4.047 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(Cl)c1 ZINC001140923523 1046951622 /nfs/dbraw/zinc/95/16/22/1046951622.db2.gz CNJZAUMTCAGCJH-GOSISDBHSA-N 1 0 315.848 4.138 20 10 DICDRO Cc1ccc(C[NH+]2CCC(Sc3ccccc3)CC2)c(O)c1 ZINC001140957677 1046961655 /nfs/dbraw/zinc/96/16/55/1046961655.db2.gz IFHIFCIALMLMQK-UHFFFAOYSA-N 1 0 313.466 4.457 20 10 DICDRO Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000798925578 1046985657 /nfs/dbraw/zinc/98/56/57/1046985657.db2.gz BWTUHPALGQLKNC-MOPGFXCFSA-N 1 0 322.452 4.141 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C2CC(c3ccccc3)C2)c1O ZINC000798962452 1046993310 /nfs/dbraw/zinc/99/33/10/1046993310.db2.gz SSKMUCXNGOFYDS-UHFFFAOYSA-N 1 0 317.816 4.090 20 10 DICDRO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000799149214 1047004671 /nfs/dbraw/zinc/00/46/71/1047004671.db2.gz QAVDZNVIVYUWPN-LJQANCHMSA-N 1 0 321.424 4.006 20 10 DICDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ccc2c(c1)OCCN2C ZINC001141144763 1047025004 /nfs/dbraw/zinc/02/50/04/1047025004.db2.gz KHXIGEFYTRZCQY-SFHVURJKSA-N 1 0 310.441 4.098 20 10 DICDRO CCC(O)(CC)C(C)(C)C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001203098028 1047026954 /nfs/dbraw/zinc/02/69/54/1047026954.db2.gz OKHHVDRDUHGMSP-UHFFFAOYSA-N 1 0 313.869 4.021 20 10 DICDRO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cc(O)ccc1O ZINC001141158193 1047030129 /nfs/dbraw/zinc/03/01/29/1047030129.db2.gz VSVZYBQRHPYZGM-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)c2c1c(F)ccc2O ZINC000799729987 1047058764 /nfs/dbraw/zinc/05/87/64/1047058764.db2.gz XFQTUBBTMRPNJF-YVEFUNNKSA-N 1 0 324.399 4.393 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc3[nH]ccc3c2)c(O)c1C ZINC000799728182 1047059039 /nfs/dbraw/zinc/05/90/39/1047059039.db2.gz HNRULERWBNCWQJ-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1Cc2[nH]c3ccccc3c2C1 ZINC000799735292 1047059460 /nfs/dbraw/zinc/05/94/60/1047059460.db2.gz NUMWOHIWGIKSGQ-QGZVFWFLSA-N 1 0 319.452 4.010 20 10 DICDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCc3ccsc3C2)c1 ZINC000760288318 1047080825 /nfs/dbraw/zinc/08/08/25/1047080825.db2.gz HXLALCHQQCSZJZ-UHFFFAOYSA-N 1 0 317.454 4.015 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)C2CCC(F)CC2)c1O ZINC000827537413 1047114035 /nfs/dbraw/zinc/11/40/35/1047114035.db2.gz AROALDYKBNYLON-IFQILLTASA-N 1 0 315.816 4.061 20 10 DICDRO C[C@@H]([NH2+]CCCCOc1ccccc1)c1ccc(N(C)C)cc1 ZINC001116291450 1047127516 /nfs/dbraw/zinc/12/75/16/1047127516.db2.gz PEHSPEURXROZIW-QGZVFWFLSA-N 1 0 312.457 4.262 20 10 DICDRO CN(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC001116489386 1047147938 /nfs/dbraw/zinc/14/79/38/1047147938.db2.gz YHTLFPAMJNQKFG-VQTJNVASSA-N 1 0 324.468 4.022 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC001116569054 1047158717 /nfs/dbraw/zinc/15/87/17/1047158717.db2.gz ZLXWVEPQMHIDLR-PMPSAXMXSA-N 1 0 315.457 4.330 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC1([C@@H](C)CCO)CCC1 ZINC001116589328 1047159724 /nfs/dbraw/zinc/15/97/24/1047159724.db2.gz UEOLGRYOMXGMOS-OWCLPIDISA-N 1 0 317.473 4.027 20 10 DICDRO C[C@@H]([NH2+]CCCCOc1ccccc1)c1cc(F)ccc1O ZINC001116584248 1047160264 /nfs/dbraw/zinc/16/02/64/1047160264.db2.gz BNSYABMOEHSMBG-CQSZACIVSA-N 1 0 303.377 4.041 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)cc1C ZINC000098172995 1047161748 /nfs/dbraw/zinc/16/17/48/1047161748.db2.gz RQTMGJHWHPGXJX-KRWDZBQOSA-N 1 0 315.388 4.146 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cnc(C2CC2)nc1)C1CCCC1 ZINC000838830303 1047163722 /nfs/dbraw/zinc/16/37/22/1047163722.db2.gz SQVIRAYYLGBYGM-UHFFFAOYSA-N 1 0 323.440 4.004 20 10 DICDRO c1ccc(CC2([NH2+]Cc3ccc(N4CCCC4)cc3)CC2)cc1 ZINC001116648047 1047165417 /nfs/dbraw/zinc/16/54/17/1047165417.db2.gz QEIVQMQJZSWIFI-UHFFFAOYSA-N 1 0 306.453 4.152 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccc(Cl)cn1 ZINC001116673451 1047166566 /nfs/dbraw/zinc/16/65/66/1047166566.db2.gz HFTWHHFAGDNRIA-SNVBAGLBSA-N 1 0 313.879 4.025 20 10 DICDRO Cc1cc(NCc2cc(Cl)ccc2O)ccc1C[NH+](C)C ZINC000839190250 1047204641 /nfs/dbraw/zinc/20/46/41/1047204641.db2.gz YIRPHYHSBZMROF-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO c1cncc(C2CC[NH+](Cc3ccc(N4CCCC4)cc3)CC2)c1 ZINC001117629546 1047232976 /nfs/dbraw/zinc/23/29/76/1047232976.db2.gz LXSWJUIZMUFJMN-UHFFFAOYSA-N 1 0 321.468 4.061 20 10 DICDRO Cc1cncc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)c1 ZINC000760440876 1047236757 /nfs/dbraw/zinc/23/67/57/1047236757.db2.gz KIMFKROKPSPGKE-UHFFFAOYSA-N 1 0 304.393 4.052 20 10 DICDRO COC1CCN(c2ccc(C[NH2+]C(C(C)C)C(C)C)cc2)CC1 ZINC000828722047 1047250580 /nfs/dbraw/zinc/25/05/80/1047250580.db2.gz JLKSGUGTOWDNFI-UHFFFAOYSA-N 1 0 318.505 4.072 20 10 DICDRO CC(C)CCOCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000387723371 1047285913 /nfs/dbraw/zinc/28/59/13/1047285913.db2.gz NIEYXSJGKVBXCQ-HNNXBMFYSA-N 1 0 301.430 4.259 20 10 DICDRO COc1cc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c(O)cc1C ZINC000840139536 1047288738 /nfs/dbraw/zinc/28/87/38/1047288738.db2.gz JNTUGKUSJDBWGV-SFHVURJKSA-N 1 0 313.397 4.029 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)COCc2ccccc2)c(O)c1 ZINC000389898441 1047292359 /nfs/dbraw/zinc/29/23/59/1047292359.db2.gz ABMDTAIMNQOPTE-DLBZAZTESA-N 1 0 313.441 4.204 20 10 DICDRO C[C@H](CCOCc1ccccc1)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000389927843 1047293248 /nfs/dbraw/zinc/29/32/48/1047293248.db2.gz FQZTYRSRLVFCEN-HUUCEWRRSA-N 1 0 317.404 4.177 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)c2cncs2)c(O)c(C(C)(C)C)c1 ZINC000897930707 1047297211 /nfs/dbraw/zinc/29/72/11/1047297211.db2.gz RTVQLGICFQFFLV-NSHDSACASA-N 1 0 320.458 4.006 20 10 DICDRO CCN(CC)[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000390364170 1047298240 /nfs/dbraw/zinc/29/82/40/1047298240.db2.gz RVGQXSUYRXALDY-LPHOPBHVSA-N 1 0 312.457 4.126 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCCN1Cc1ccccc1)c1ccccc1O ZINC000390569513 1047299194 /nfs/dbraw/zinc/29/91/94/1047299194.db2.gz RWAXVYHONHRBLQ-UYAOXDASSA-N 1 0 324.468 4.098 20 10 DICDRO CC[C@H](C)[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)OC ZINC000394444154 1047312418 /nfs/dbraw/zinc/31/24/18/1047312418.db2.gz LYGOOYVXRPBWEU-SUNYJGFJSA-N 1 0 301.430 4.257 20 10 DICDRO CC[C@H](C)[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)OC ZINC000394444130 1047312764 /nfs/dbraw/zinc/31/27/64/1047312764.db2.gz LYGOOYVXRPBWEU-DEYYWGMASA-N 1 0 301.430 4.257 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1cccc2c1CCOC2 ZINC001118932727 1047317384 /nfs/dbraw/zinc/31/73/84/1047317384.db2.gz BZQVIKXJZPDRPY-KSSFIOAISA-N 1 0 323.436 4.111 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)c1O ZINC000725846627 1047318401 /nfs/dbraw/zinc/31/84/01/1047318401.db2.gz JPBCYSREIZQDFZ-UHFFFAOYSA-N 1 0 323.392 4.341 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]Cc1ccc(Cl)nc1 ZINC000725847278 1047320040 /nfs/dbraw/zinc/32/00/40/1047320040.db2.gz XYXPSMWVZCJVDI-UHFFFAOYSA-N 1 0 324.811 4.397 20 10 DICDRO CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000725851189 1047321974 /nfs/dbraw/zinc/32/19/74/1047321974.db2.gz JTCKWSZGZBQREG-UHFFFAOYSA-N 1 0 318.420 4.450 20 10 DICDRO Cc1cc(C[NH2+]Cc2cccc(O)c2)c(C)n1-c1cccc(C)c1 ZINC000725851730 1047322222 /nfs/dbraw/zinc/32/22/22/1047322222.db2.gz XLNMCUXOSRFGQO-UHFFFAOYSA-N 1 0 320.436 4.398 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1C[C@@H](C)O[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000840872656 1047349364 /nfs/dbraw/zinc/34/93/64/1047349364.db2.gz LWINJEOCIGDNBS-VXIBKDFQSA-N 1 0 316.489 4.141 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@H](C)Cc1ccc(N(C)C)cc1C ZINC000840894725 1047356683 /nfs/dbraw/zinc/35/66/83/1047356683.db2.gz SDEKRFAWORJPAP-SJORKVTESA-N 1 0 311.473 4.046 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2c(O)cc(C)cc2Cl)cc1F ZINC000840902299 1047357313 /nfs/dbraw/zinc/35/73/13/1047357313.db2.gz NTQNKYPNTRRJIM-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO Cc1ncc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)s1 ZINC000840892917 1047357445 /nfs/dbraw/zinc/35/74/45/1047357445.db2.gz DXCBUIHRBCIHQO-UONOGXRCSA-N 1 0 317.502 4.108 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C)c1ccncc1 ZINC000840895470 1047357597 /nfs/dbraw/zinc/35/75/97/1047357597.db2.gz YLPLOPFVGGOGIG-JXFKEZNVSA-N 1 0 311.473 4.128 20 10 DICDRO COc1ccccc1C(C)(C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840932916 1047360513 /nfs/dbraw/zinc/36/05/13/1047360513.db2.gz WENPOUYYFWXLBW-UHFFFAOYSA-N 1 0 312.457 4.095 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOc3ccc(F)cc32)c(Cl)c1 ZINC000840938427 1047360817 /nfs/dbraw/zinc/36/08/17/1047360817.db2.gz DKBXNPQXLSNXLR-OAHLLOKOSA-N 1 0 321.779 4.107 20 10 DICDRO CCC(CC)c1cc(C[NH2+]Cc2ccc(N(C)C)cc2C)on1 ZINC000840934119 1047361776 /nfs/dbraw/zinc/36/17/76/1047361776.db2.gz MIIPDZZVAMOIKU-UHFFFAOYSA-N 1 0 315.461 4.242 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOc3c(F)cccc32)c(Cl)c1 ZINC000840940169 1047363292 /nfs/dbraw/zinc/36/32/92/1047363292.db2.gz VPFGVWXXYUZZAP-OAHLLOKOSA-N 1 0 321.779 4.107 20 10 DICDRO COc1cc(C[NH2+]Cc2ccc(N(C)C)cc2C)ccc1Cl ZINC000840951948 1047363998 /nfs/dbraw/zinc/36/39/98/1047363998.db2.gz OMRGVFZSOLSFQD-UHFFFAOYSA-N 1 0 318.848 4.013 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)c1 ZINC000840961729 1047364670 /nfs/dbraw/zinc/36/46/70/1047364670.db2.gz BWFFBZBGKCLNQM-FQEVSTJZSA-N 1 0 323.436 4.054 20 10 DICDRO CSCc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000796514424 1047366921 /nfs/dbraw/zinc/36/69/21/1047366921.db2.gz LDLXSOKBSBPPBV-UHFFFAOYSA-N 1 0 318.461 4.045 20 10 DICDRO C[C@H]1[C@@H]([NH3+])CCN1C(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000841004528 1047369347 /nfs/dbraw/zinc/36/93/47/1047369347.db2.gz JWTXVKFGIHTIOZ-GUYCJALGSA-N 1 0 323.400 4.055 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@H]2c2ccccc2Cl)cc1 ZINC000841033846 1047373540 /nfs/dbraw/zinc/37/35/40/1047373540.db2.gz BYBSEPUTXQEDNK-HKUYNNGSSA-N 1 0 314.860 4.391 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H]2SCCc3ccccc32)cc1C ZINC000749300067 1047408310 /nfs/dbraw/zinc/40/83/10/1047408310.db2.gz WDQCQWGYAIUDEI-IBGZPJMESA-N 1 0 313.466 4.124 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1SCCc2ccccc21 ZINC000749300065 1047409466 /nfs/dbraw/zinc/40/94/66/1047409466.db2.gz WDNAMJZYECQJQY-KRWDZBQOSA-N 1 0 319.857 4.166 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccccc1 ZINC000841744484 1047447197 /nfs/dbraw/zinc/44/71/97/1047447197.db2.gz HYWOCFKLFIQXJM-SJCJKPOMSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1[O-] ZINC000841748193 1047448240 /nfs/dbraw/zinc/44/82/40/1047448240.db2.gz IHRXTRSAYCCMLL-GXTWGEPZSA-N 1 0 309.837 4.188 20 10 DICDRO CCCOc1ncccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841743796 1047449094 /nfs/dbraw/zinc/44/90/94/1047449094.db2.gz CEKFQKFZKRNDGJ-LBPRGKRZSA-N 1 0 320.820 4.080 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000841747974 1047449623 /nfs/dbraw/zinc/44/96/23/1047449623.db2.gz GCKWMZRZRSUUBR-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COc1cc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)ccc1C ZINC000841747775 1047449940 /nfs/dbraw/zinc/44/99/40/1047449940.db2.gz SXUKHLHFVXRFGQ-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc(Cl)cc2O)o1 ZINC000841748911 1047449976 /nfs/dbraw/zinc/44/99/76/1047449976.db2.gz BVWLECJJSFZAKP-NHYWBVRUSA-N 1 0 323.820 4.239 20 10 DICDRO C[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccc(Cl)cc1O ZINC000841748950 1047450782 /nfs/dbraw/zinc/45/07/82/1047450782.db2.gz CFCDKMMTMOHFEL-DYVFJYSZSA-N 1 0 319.832 4.210 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccc(Cl)cc1O ZINC000841753750 1047452086 /nfs/dbraw/zinc/45/20/86/1047452086.db2.gz VPQZRFYZXIAAFY-BONVTDFDSA-N 1 0 321.779 4.359 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841757257 1047453235 /nfs/dbraw/zinc/45/32/35/1047453235.db2.gz COYSTNILIZJRJQ-ZJUUUORDSA-N 1 0 310.850 4.476 20 10 DICDRO CC[C@@H]([NH2+][C@H]1COCc2ccccc21)c1cc(Cl)ccc1O ZINC000841758231 1047453603 /nfs/dbraw/zinc/45/36/03/1047453603.db2.gz ABMBTAMHNZWALI-SJORKVTESA-N 1 0 317.816 4.358 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841759716 1047453776 /nfs/dbraw/zinc/45/37/76/1047453776.db2.gz POKIRADTPNAZET-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841760600 1047453828 /nfs/dbraw/zinc/45/38/28/1047453828.db2.gz SYCCRRZIVDXZAP-ZBEGNZNMSA-N 1 0 317.816 4.392 20 10 DICDRO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841757253 1047453932 /nfs/dbraw/zinc/45/39/32/1047453932.db2.gz COYSTNILIZJRJQ-NXEZZACHSA-N 1 0 310.850 4.476 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1F ZINC000841763697 1047454881 /nfs/dbraw/zinc/45/48/81/1047454881.db2.gz OKLNREXONRHIJC-NSHDSACASA-N 1 0 323.795 4.434 20 10 DICDRO COCc1cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)ccc1F ZINC000841765560 1047455646 /nfs/dbraw/zinc/45/56/46/1047455646.db2.gz ZQSSUKSLWKJKSO-NSHDSACASA-N 1 0 323.795 4.182 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](c3cccnc3)C2)cc1C(C)C ZINC000842621438 1047492918 /nfs/dbraw/zinc/49/29/18/1047492918.db2.gz GEEOYRLWSMVRHW-KRWDZBQOSA-N 1 0 310.441 4.209 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)CC(F)F ZINC000842728365 1047499334 /nfs/dbraw/zinc/49/93/34/1047499334.db2.gz FVASVASWTQNJIV-JTQLQIEISA-N 1 0 324.337 4.152 20 10 DICDRO CCOc1ccc(C[NH2+]C2(c3ccccc3Cl)CC2)c(O)c1 ZINC000842724935 1047499390 /nfs/dbraw/zinc/49/93/90/1047499390.db2.gz KHXVENICUGIWTC-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO CCOc1ccc(C[NH2+]C2(c3cccc(F)c3)CCC2)c(O)c1 ZINC000842744682 1047502019 /nfs/dbraw/zinc/50/20/19/1047502019.db2.gz ZTUWDVMJISWXMI-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO CC(C)C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccncc1 ZINC000842836015 1047506968 /nfs/dbraw/zinc/50/69/68/1047506968.db2.gz LHBMQTRWXYWSKX-HXUWFJFHSA-N 1 0 323.484 4.341 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C1CCC(F)(F)CC1 ZINC000842873606 1047511246 /nfs/dbraw/zinc/51/12/46/1047511246.db2.gz XOJDDZPVZLCUEO-CQSZACIVSA-N 1 0 310.432 4.160 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc(Br)ccc1O)CC(F)F ZINC000842890856 1047512186 /nfs/dbraw/zinc/51/21/86/1047512186.db2.gz UKUMYQHSZUSZRG-IUCAKERBSA-N 1 0 322.193 4.097 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCS[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000842928417 1047513606 /nfs/dbraw/zinc/51/36/06/1047513606.db2.gz KDKFDSSCXJUTMF-HDMKZQKVSA-N 1 0 304.503 4.222 20 10 DICDRO C[N@H+](Cc1nc2ccccc2o1)Cc1cccc(C(C)(C)C)c1O ZINC001143112309 1047532069 /nfs/dbraw/zinc/53/20/69/1047532069.db2.gz PNFKJYWAZFJQCC-UHFFFAOYSA-N 1 0 324.424 4.463 20 10 DICDRO COCC[C@H]1CCCC[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143111065 1047532185 /nfs/dbraw/zinc/53/21/85/1047532185.db2.gz WGNINHLUADAYQR-MRXNPFEDSA-N 1 0 305.462 4.081 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c1O ZINC001143110550 1047532239 /nfs/dbraw/zinc/53/22/39/1047532239.db2.gz IVEYQLNMBLPCGY-MRXNPFEDSA-N 1 0 324.468 4.464 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H]2c2nccs2)c1O ZINC001143111501 1047532409 /nfs/dbraw/zinc/53/24/09/1047532409.db2.gz CFOLJGRDYOHUGJ-HNNXBMFYSA-N 1 0 316.470 4.483 20 10 DICDRO CC(C)OC1CC[NH+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143110953 1047532598 /nfs/dbraw/zinc/53/25/98/1047532598.db2.gz UBVFEDYOFOPPLG-UHFFFAOYSA-N 1 0 305.462 4.079 20 10 DICDRO CC(C)[N@H+](CCCCCO)Cc1cccc(C(C)(C)C)c1O ZINC001143116852 1047533389 /nfs/dbraw/zinc/53/33/89/1047533389.db2.gz MMZWEALWJRHLBH-UHFFFAOYSA-N 1 0 307.478 4.063 20 10 DICDRO CC[C@@H]([NH2+]CCCCCC[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000843342764 1047543106 /nfs/dbraw/zinc/54/31/06/1047543106.db2.gz UCYLTJGBHHEMIC-CYBMUJFWSA-N 1 0 319.276 4.259 20 10 DICDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000237491518 1047555014 /nfs/dbraw/zinc/55/50/14/1047555014.db2.gz FAFHXKBVDRRKEG-CVEARBPZSA-N 1 0 312.457 4.130 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1[C@@H](c2ccccc2)C1(F)F)c1ccccc1O ZINC000926974105 1047663798 /nfs/dbraw/zinc/66/37/98/1047663798.db2.gz PKRANCNMKMSJSK-SRCQZFHVSA-N 1 0 303.352 4.092 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCCC3(CCCC3)CC2)c1O ZINC001206661298 1047722775 /nfs/dbraw/zinc/72/27/75/1047722775.db2.gz SPVXXNIISURVIM-UHFFFAOYSA-N 1 0 303.446 4.256 20 10 DICDRO c1cc(C[NH+]2CCCCC2)cc(Nc2ccc3c(c2)CCN3)c1 ZINC001159523351 1047860105 /nfs/dbraw/zinc/86/01/05/1047860105.db2.gz XCOIFHAVUUPLAY-UHFFFAOYSA-N 1 0 307.441 4.384 20 10 DICDRO c1ccc(Nc2ccc3c(c2)CCCN3)c(C[NH+]2CCCC2)c1 ZINC001159516627 1047860894 /nfs/dbraw/zinc/86/08/94/1047860894.db2.gz XADZEVVFADLMKI-UHFFFAOYSA-N 1 0 307.441 4.384 20 10 DICDRO CSc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(O)c(O)c1 ZINC001203881129 1047863045 /nfs/dbraw/zinc/86/30/45/1047863045.db2.gz LYZHMBXWKAVCSJ-HNNXBMFYSA-N 1 0 315.438 4.157 20 10 DICDRO COc1ccc(C[NH2+]Cc2cc(C)ccc2O)cc1C(C)(C)C ZINC001182960788 1047866490 /nfs/dbraw/zinc/86/64/90/1047866490.db2.gz UXUMAYIRLLLXJM-UHFFFAOYSA-N 1 0 313.441 4.297 20 10 DICDRO COCc1csc(C[NH2+]Cc2cc(C(C)C)ccc2O)c1 ZINC001182930311 1047869771 /nfs/dbraw/zinc/86/97/71/1047869771.db2.gz ZVJXBPVAVHKBJH-UHFFFAOYSA-N 1 0 305.443 4.013 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C2(CC(C)C)CC2)c1O ZINC001182998998 1047874342 /nfs/dbraw/zinc/87/43/42/1047874342.db2.gz FUDQAAJMNSZDDR-UHFFFAOYSA-N 1 0 312.251 4.131 20 10 DICDRO c1cc(Nc2ccc3c(c2)CCCN3)cc(C2CC[NH2+]CC2)c1 ZINC001159756937 1047915965 /nfs/dbraw/zinc/91/59/65/1047915965.db2.gz GGEIAKFSIJSGRR-UHFFFAOYSA-N 1 0 307.441 4.255 20 10 DICDRO [O-]c1c(F)cccc1C[NH2+]CC1(c2cccc(Cl)c2)CCC1 ZINC001183370843 1047923655 /nfs/dbraw/zinc/92/36/55/1047923655.db2.gz KUDLPZKPYOXINL-UHFFFAOYSA-N 1 0 319.807 4.396 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cc1C ZINC001198260658 1047936168 /nfs/dbraw/zinc/93/61/68/1047936168.db2.gz NXSJSJVDEIQIJU-MRXNPFEDSA-N 1 0 312.457 4.229 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2C[C@@H]3C[C@]3(c3ccccc3)C2)cc1Cl ZINC001183799032 1047966680 /nfs/dbraw/zinc/96/66/80/1047966680.db2.gz IYWKONCXTSYNEC-QFBILLFUSA-N 1 0 313.828 4.128 20 10 DICDRO COc1ccc(C)cc1CC[NH2+]Cc1c(C)c2ccccc2n1C ZINC001199038317 1048027398 /nfs/dbraw/zinc/02/73/98/1048027398.db2.gz MPLGDQAGYOIANO-UHFFFAOYSA-N 1 0 322.452 4.136 20 10 DICDRO CC[C@H](C)C[N@H+](CC)Cc1cc(Br)cc(C)c1O ZINC000160970663 1048027415 /nfs/dbraw/zinc/02/74/15/1048027415.db2.gz GGZKBXZNOCQVBF-NSHDSACASA-N 1 0 314.267 4.331 20 10 DICDRO Cc1cccc(C)c1OCC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001199571852 1048075587 /nfs/dbraw/zinc/07/55/87/1048075587.db2.gz XRKBWUMONIIVJX-RMKNXTFCSA-N 1 0 324.468 4.051 20 10 DICDRO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000776013663 1048088955 /nfs/dbraw/zinc/08/89/55/1048088955.db2.gz MXCBWDZYUQZNPQ-AAEUAGOBSA-N 1 0 318.358 4.055 20 10 DICDRO CCOc1cccc(C[N@@H+](Cc2ccccc2)CC(C)C)c1O ZINC001203602126 1048103721 /nfs/dbraw/zinc/10/37/21/1048103721.db2.gz BJAGDRXUXNDLSJ-UHFFFAOYSA-N 1 0 313.441 4.449 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCCOc3ccccc32)cc1 ZINC001199971742 1048128591 /nfs/dbraw/zinc/12/85/91/1048128591.db2.gz FKUPKFZLWOPDET-MWGFUINXSA-N 1 0 322.452 4.269 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCCOc3ccccc32)cc1 ZINC001199971740 1048128614 /nfs/dbraw/zinc/12/86/14/1048128614.db2.gz FKUPKFZLWOPDET-CYXJOQHWSA-N 1 0 322.452 4.269 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(F)cc1F ZINC001200942639 1048166988 /nfs/dbraw/zinc/16/69/88/1048166988.db2.gz YJIYJBDSOSZAII-LBPRGKRZSA-N 1 0 303.352 4.141 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1O)CC2 ZINC000776175418 1048269679 /nfs/dbraw/zinc/26/96/79/1048269679.db2.gz ZGKSFFDILMACIE-KRWDZBQOSA-N 1 0 301.817 4.440 20 10 DICDRO CC(C)Nc1ccc(Nc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC001201498145 1048287052 /nfs/dbraw/zinc/28/70/52/1048287052.db2.gz PVBAQNYMGUSJIC-UHFFFAOYSA-N 1 0 313.445 4.191 20 10 DICDRO Cc1cccc([C@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC001201627425 1048337832 /nfs/dbraw/zinc/33/78/32/1048337832.db2.gz XJLFUVYERDXWDK-ZDUSSCGKSA-N 1 0 304.384 4.190 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC001201693718 1048361065 /nfs/dbraw/zinc/36/10/65/1048361065.db2.gz QBQZOZKFCFYECC-OAHLLOKOSA-N 1 0 307.441 4.295 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCCOc3c(F)cccc32)cc1C ZINC001201733750 1048373360 /nfs/dbraw/zinc/37/33/60/1048373360.db2.gz AIVCGRZPIVDSSF-QGZVFWFLSA-N 1 0 315.388 4.146 20 10 DICDRO CCCN(Cc1coc(-c2ccccc2)n1)c1ccc(C[NH3+])cc1 ZINC000775140656 1048430961 /nfs/dbraw/zinc/43/09/61/1048430961.db2.gz OXPGYNPDGUNBJY-UHFFFAOYSA-N 1 0 321.424 4.217 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)C1CCC(C(F)(F)F)CC1 ZINC000775140205 1048431415 /nfs/dbraw/zinc/43/14/15/1048431415.db2.gz KQWCTBXYGDBNIC-UHFFFAOYSA-N 1 0 314.395 4.483 20 10 DICDRO c1ccc(C[C@@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001202058935 1048433744 /nfs/dbraw/zinc/43/37/44/1048433744.db2.gz SMJIORWNAUCVMC-FXAWDEMLSA-N 1 0 307.437 4.123 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)CCc1ccc(O)cc1 ZINC000775141213 1048433822 /nfs/dbraw/zinc/43/38/22/1048433822.db2.gz ZNUWMMNFHODTJB-MRXNPFEDSA-N 1 0 312.457 4.089 20 10 DICDRO COc1cc(C[NH2+]CC2CC(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC001202031395 1048440359 /nfs/dbraw/zinc/44/03/59/1048440359.db2.gz IFYPOBBLQBFIND-UHFFFAOYSA-N 1 0 305.462 4.224 20 10 DICDRO Cc1ccc(C)n1-c1ccc(N[C@H]2C[NH2+]Cc3ccsc32)cc1 ZINC001163227904 1048440657 /nfs/dbraw/zinc/44/06/57/1048440657.db2.gz FFEQZDVFXIJUHN-SFHVURJKSA-N 1 0 323.465 4.412 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2ccc(Cl)cc2F)cc1 ZINC001202093448 1048447521 /nfs/dbraw/zinc/44/75/21/1048447521.db2.gz VGUSJYDJSASBNT-ONEGZZNKSA-N 1 0 318.823 4.348 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]CC(C)(C)[C@H]2CCCCO2)c1O ZINC000776247238 1048463739 /nfs/dbraw/zinc/46/37/39/1048463739.db2.gz BDPKRCGLVXOOBF-OAHLLOKOSA-N 1 0 311.853 4.039 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H]2COc3c2cccc3Cl)c1O ZINC000776251066 1048465646 /nfs/dbraw/zinc/46/56/46/1048465646.db2.gz PHHYEOPYSLLWPA-AWEZNQCLSA-N 1 0 324.207 4.231 20 10 DICDRO Cc1cccc(C)c1C[NH2+]Cc1cc(Br)ccc1O ZINC000776253868 1048466855 /nfs/dbraw/zinc/46/68/55/1048466855.db2.gz WCILALVSOSIUGF-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)c1O ZINC000776252821 1048467322 /nfs/dbraw/zinc/46/73/22/1048467322.db2.gz FXTVZJBRNABOJZ-HUUCEWRRSA-N 1 0 311.853 4.037 20 10 DICDRO CCCN(CCC)c1ccc(C[N@@H+]2CCC23CCOCC3)cc1 ZINC000775160057 1048513587 /nfs/dbraw/zinc/51/35/87/1048513587.db2.gz UKXXPOIFQWYRAS-UHFFFAOYSA-N 1 0 316.489 4.068 20 10 DICDRO Cc1cc(Nc2ccc(Cc3ccc(N)cc3)cc2)cc(C)[nH+]1 ZINC001176058269 1048553953 /nfs/dbraw/zinc/55/39/53/1048553953.db2.gz VIWBMRULWRIDMX-UHFFFAOYSA-N 1 0 303.409 4.037 20 10 DICDRO Cc1cc(C[NH+]2CCC(F)(F)CC2)c(C)n1-c1ccccc1 ZINC001137853892 1048566643 /nfs/dbraw/zinc/56/66/43/1048566643.db2.gz AAOXBOQCHAPMRS-UHFFFAOYSA-N 1 0 304.384 4.325 20 10 DICDRO Cc1cc(C[NH2+][C@H](Cc2ccccc2)C(C)C)ccc1N(C)C ZINC001176129577 1048579356 /nfs/dbraw/zinc/57/93/56/1048579356.db2.gz FGVFWOMULPYVLW-HXUWFJFHSA-N 1 0 310.485 4.418 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Br)cc2)c(O)c1 ZINC000042352864 1048579208 /nfs/dbraw/zinc/57/92/08/1048579208.db2.gz ZIZNSZRLHIQYLK-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO COc1cc(C[NH2+]Cc2ccc(F)cc2)c(O)c(C(C)(C)C)c1 ZINC000850005038 1048610556 /nfs/dbraw/zinc/61/05/56/1048610556.db2.gz SURLXGJUSPBLLZ-UHFFFAOYSA-N 1 0 317.404 4.127 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(COC)cs2)cc1 ZINC000850034496 1048612089 /nfs/dbraw/zinc/61/20/89/1048612089.db2.gz KZQKXWBYDAYSFF-UHFFFAOYSA-N 1 0 318.486 4.031 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(Br)c1)c1ccccc1O ZINC000042418764 1048625425 /nfs/dbraw/zinc/62/54/25/1048625425.db2.gz DNLDJDJAYPCZSE-NSHDSACASA-N 1 0 306.203 4.006 20 10 DICDRO C[C@@H]([NH2+]Cc1cc2ccncc2s1)c1ccc(N(C)C)cc1 ZINC000850251930 1048628849 /nfs/dbraw/zinc/62/88/49/1048628849.db2.gz IWWDXQHTZSUNSG-CYBMUJFWSA-N 1 0 311.454 4.213 20 10 DICDRO Cc1cccc2[nH]c(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)cc21 ZINC000850252142 1048629252 /nfs/dbraw/zinc/62/92/52/1048629252.db2.gz MUCUJSZFAHNZKX-OAHLLOKOSA-N 1 0 307.441 4.393 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](c2ccccc2F)C(C)C)c1 ZINC000850362930 1048640940 /nfs/dbraw/zinc/64/09/40/1048640940.db2.gz VRGFDEKHWOEUEL-LJQANCHMSA-N 1 0 317.404 4.417 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2cc3cc(C)ccc3o2)c(O)c1 ZINC000850376289 1048644810 /nfs/dbraw/zinc/64/48/10/1048644810.db2.gz FIYNNWGLCUFBIN-UHFFFAOYSA-N 1 0 311.381 4.135 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cc2cnccc2o1 ZINC000850423681 1048651931 /nfs/dbraw/zinc/65/19/31/1048651931.db2.gz YFQBNLMTQPPNJF-OAHLLOKOSA-N 1 0 321.424 4.279 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(C(F)F)nc1 ZINC000850430146 1048653815 /nfs/dbraw/zinc/65/38/15/1048653815.db2.gz ITSFMSQAHDQSNY-LLVKDONJSA-N 1 0 323.362 4.075 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](C)c2ccccn2)c1O ZINC000850481429 1048670973 /nfs/dbraw/zinc/67/09/73/1048670973.db2.gz GWRPATOOQWJVRX-STQMWFEESA-N 1 0 304.821 4.203 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccccn1 ZINC000850482965 1048671110 /nfs/dbraw/zinc/67/11/10/1048671110.db2.gz SZBFWHZRKFKMJA-CABCVRRESA-N 1 0 310.441 4.120 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2noc3ccccc23)c(O)c1C ZINC000850483910 1048671324 /nfs/dbraw/zinc/67/13/24/1048671324.db2.gz YBGLKNAOMTYCGY-AWEZNQCLSA-N 1 0 310.397 4.044 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2noc3ccccc23)c(O)c1C ZINC000850483911 1048671504 /nfs/dbraw/zinc/67/15/04/1048671504.db2.gz YBGLKNAOMTYCGY-CQSZACIVSA-N 1 0 310.397 4.044 20 10 DICDRO CSCC1(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000850506120 1048673257 /nfs/dbraw/zinc/67/32/57/1048673257.db2.gz FWJHEKFTMMTRKE-DGCLKSJQSA-N 1 0 309.450 4.203 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)c(O)c1 ZINC000850521432 1048676681 /nfs/dbraw/zinc/67/66/81/1048676681.db2.gz VLEQKMQTJFMSRQ-CYBMUJFWSA-N 1 0 315.388 4.232 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)c(O)c1 ZINC000850521433 1048676810 /nfs/dbraw/zinc/67/68/10/1048676810.db2.gz VLEQKMQTJFMSRQ-ZDUSSCGKSA-N 1 0 315.388 4.232 20 10 DICDRO C[C@H]([NH2+][C@H]1COC2(CCC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000850526779 1048681382 /nfs/dbraw/zinc/68/13/82/1048681382.db2.gz WKRFXSPUJJCLAN-FUHWJXTLSA-N 1 0 314.473 4.039 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1ccccc1O ZINC000850530745 1048682781 /nfs/dbraw/zinc/68/27/81/1048682781.db2.gz BUYIHRIASUAKNN-LNLFQRSKSA-N 1 0 311.425 4.006 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(COC)cs1)c1ccc(N(C)C)cc1 ZINC000850532722 1048684830 /nfs/dbraw/zinc/68/48/30/1048684830.db2.gz OBGCTUALIRCJRD-GOSISDBHSA-N 1 0 318.486 4.201 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2cc3cc(C)ccc3o2)c1O ZINC000850531830 1048684965 /nfs/dbraw/zinc/68/49/65/1048684965.db2.gz OGOJNBLDQPDILS-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(N2CCCCC2)cc1 ZINC000850534452 1048685117 /nfs/dbraw/zinc/68/51/17/1048685117.db2.gz JVXMYQPURYKHNL-WMLDXEAASA-N 1 0 308.416 4.373 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)cc1 ZINC000850543628 1048687471 /nfs/dbraw/zinc/68/74/71/1048687471.db2.gz NJSDKLCSZQPXHB-VBKZILBWSA-N 1 0 310.441 4.186 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCC3(CC3(F)F)CC2)c1 ZINC000850551840 1048688980 /nfs/dbraw/zinc/68/89/80/1048688980.db2.gz VVDVGYVLJNROGF-OPGSHWCFSA-N 1 0 311.372 4.019 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H](O)C(C)C)c1 ZINC000850554789 1048689208 /nfs/dbraw/zinc/68/92/08/1048689208.db2.gz KZUYHNOFXGUAOL-BEVDRBHNSA-N 1 0 313.441 4.109 20 10 DICDRO CCCC[C@H](CCC)[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000850566141 1048694157 /nfs/dbraw/zinc/69/41/57/1048694157.db2.gz JXXNZNYFCLQUGT-SFHVURJKSA-N 1 0 318.505 4.096 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c1C ZINC000850579185 1048699465 /nfs/dbraw/zinc/69/94/65/1048699465.db2.gz TVCIQLUJGORVPF-IAQYHMDHSA-N 1 0 315.388 4.186 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCc3c(C)cccc32)c1O ZINC000850573784 1048699594 /nfs/dbraw/zinc/69/95/94/1048699594.db2.gz RATZUYIIMXFNBX-RDTXWAMCSA-N 1 0 311.425 4.437 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1C ZINC000850578567 1048699949 /nfs/dbraw/zinc/69/99/49/1048699949.db2.gz NIAKYNCBNVIXFQ-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@@H]([NH2+]Cc1cc2cc(F)ccc2o1)c1ccc(N(C)C)cc1 ZINC000775363894 1048704942 /nfs/dbraw/zinc/70/49/42/1048704942.db2.gz NGMNPWYPYPJWIQ-CYBMUJFWSA-N 1 0 312.388 4.489 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCc3ccccc32)c1 ZINC000775369906 1048713460 /nfs/dbraw/zinc/71/34/60/1048713460.db2.gz BYQPBCFBOSBHBM-GOEBONIOSA-N 1 0 311.425 4.172 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc3ccccc3c2)c1 ZINC000775370024 1048713727 /nfs/dbraw/zinc/71/37/27/1048713727.db2.gz KCRMBSAKYKKFEX-OAHLLOKOSA-N 1 0 321.420 4.447 20 10 DICDRO CO[C@@H](c1ccccc1F)[C@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000776497754 1048719152 /nfs/dbraw/zinc/71/91/52/1048719152.db2.gz FBWAQQBOGUIWCB-IFXJQAMLSA-N 1 0 317.404 4.014 20 10 DICDRO COCCC1(C[NH2+]Cc2cc(C)c(C)cc2O)CCCCC1 ZINC000775374569 1048719810 /nfs/dbraw/zinc/71/98/10/1048719810.db2.gz LZHKWWXKEWJJFF-UHFFFAOYSA-N 1 0 305.462 4.086 20 10 DICDRO CC[C@@H]([NH2+]CCCOCCc1ccccc1)c1ccccc1O ZINC000775412987 1048785150 /nfs/dbraw/zinc/78/51/50/1048785150.db2.gz SZCKLIRYSOLCNN-LJQANCHMSA-N 1 0 313.441 4.082 20 10 DICDRO CC[C@H]([NH2+]CCOc1ccc(Cl)cc1)c1ccccc1O ZINC000775413870 1048787925 /nfs/dbraw/zinc/78/79/25/1048787925.db2.gz DEJYRNXKKPEQLR-INIZCTEOSA-N 1 0 305.805 4.165 20 10 DICDRO C[C@H](c1ccccc1)[N@H+](CCOC(F)F)Cc1ccccc1O ZINC000851880282 1048807825 /nfs/dbraw/zinc/80/78/25/1048807825.db2.gz WGESXSNVQPXESX-CQSZACIVSA-N 1 0 321.367 4.195 20 10 DICDRO CCCOc1ccc(C[NH2+]CCc2cccc(F)c2)cc1C ZINC001177142296 1048837355 /nfs/dbraw/zinc/83/73/55/1048837355.db2.gz DTOYBTHGWMJOLA-UHFFFAOYSA-N 1 0 301.405 4.255 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@]2(C)CC2(F)F)cc1F ZINC001203169414 1048844019 /nfs/dbraw/zinc/84/40/19/1048844019.db2.gz ZIRABCKOFYCBIR-MRXNPFEDSA-N 1 0 314.395 4.197 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2c(F)cccc2F)cc1 ZINC001177328266 1048869278 /nfs/dbraw/zinc/86/92/78/1048869278.db2.gz KGBAKXBYDSQEBM-UHFFFAOYSA-N 1 0 318.411 4.143 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC(C)(C)CC(F)(F)F)cc1 ZINC000853095974 1048884293 /nfs/dbraw/zinc/88/42/93/1048884293.db2.gz HUPRZGIVJQNCPH-AATRIKPKSA-N 1 0 314.395 4.334 20 10 DICDRO CCc1cccc2cc(C[NH2+]Cc3ccc4c(c3)CCO4)oc21 ZINC001177586750 1048919348 /nfs/dbraw/zinc/91/93/48/1048919348.db2.gz JOFZWSGQQHKMMP-UHFFFAOYSA-N 1 0 307.393 4.220 20 10 DICDRO Fc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c2ccccc12 ZINC001177586950 1048919872 /nfs/dbraw/zinc/91/98/72/1048919872.db2.gz PJROPRKYDIUDBD-UHFFFAOYSA-N 1 0 307.368 4.204 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(Oc2cccc(Cl)c2)CC1 ZINC001203557027 1048927477 /nfs/dbraw/zinc/92/74/77/1048927477.db2.gz YVLROAWBBWSASZ-UHFFFAOYSA-N 1 0 317.816 4.089 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCC[C@]2(CCc3c2cccc3F)C1 ZINC001203562262 1048930385 /nfs/dbraw/zinc/93/03/85/1048930385.db2.gz GJEHJSSFYUVAGD-FQEVSTJZSA-N 1 0 311.400 4.011 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCc3ccccc3[C@H]2CC)c1O ZINC001203614098 1048940004 /nfs/dbraw/zinc/94/00/04/1048940004.db2.gz OPEGIRWMBZBMKA-GOSISDBHSA-N 1 0 311.425 4.300 20 10 DICDRO CCOc1cccc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c1O ZINC001203614985 1048941519 /nfs/dbraw/zinc/94/15/19/1048941519.db2.gz JMTAATWZPZSMQD-UHFFFAOYSA-N 1 0 311.425 4.084 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c(O)c1 ZINC001203628021 1048943186 /nfs/dbraw/zinc/94/31/86/1048943186.db2.gz VZSJOXOZCFGMHJ-KRWDZBQOSA-N 1 0 319.351 4.016 20 10 DICDRO COc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)c(O)c1 ZINC001203630330 1048944456 /nfs/dbraw/zinc/94/44/56/1048944456.db2.gz QFVHYIRFTMMNOF-GOSISDBHSA-N 1 0 315.388 4.267 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c(O)c1 ZINC001203634888 1048944505 /nfs/dbraw/zinc/94/45/05/1048944505.db2.gz ZYRWCJRWIZOBIQ-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c(O)c1 ZINC001203629350 1048945442 /nfs/dbraw/zinc/94/54/42/1048945442.db2.gz XNIDMGRXTXZZHH-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c(O)c1 ZINC001203635444 1048945477 /nfs/dbraw/zinc/94/54/77/1048945477.db2.gz VDTKDSGVAHEBLP-QGZVFWFLSA-N 1 0 319.351 4.016 20 10 DICDRO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001191474197 1048949815 /nfs/dbraw/zinc/94/98/15/1048949815.db2.gz HMJSSZYYTUUNQT-YLJYHZDGSA-N 1 0 308.469 4.206 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001203658528 1048950397 /nfs/dbraw/zinc/95/03/97/1048950397.db2.gz ZQRYXPXTRHNQTJ-INIZCTEOSA-N 1 0 319.857 4.336 20 10 DICDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)c1 ZINC001203663714 1048952912 /nfs/dbraw/zinc/95/29/12/1048952912.db2.gz FDEFWMAGCQAVAD-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(N)c1)c1ccc(C(F)(F)F)cc1O ZINC000854215485 1048954590 /nfs/dbraw/zinc/95/45/90/1048954590.db2.gz IHGJZUWWBXXGRX-OAHLLOKOSA-N 1 0 324.346 4.234 20 10 DICDRO CS[C@@H]1CCC[C@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC001177860139 1048955706 /nfs/dbraw/zinc/95/57/06/1048955706.db2.gz RTIQJDJSFUONFX-OZZQIWQLSA-N 1 0 304.503 4.030 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001203680234 1048958566 /nfs/dbraw/zinc/95/85/66/1048958566.db2.gz NHTXBSXFNGXZJK-KRWDZBQOSA-N 1 0 319.351 4.016 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)c1 ZINC001203679039 1048958639 /nfs/dbraw/zinc/95/86/39/1048958639.db2.gz YMZAPQHMFMPGKJ-CYBMUJFWSA-N 1 0 323.845 4.453 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](CO)CC(C)(C)C)cc1 ZINC001178237647 1049007036 /nfs/dbraw/zinc/00/70/36/1049007036.db2.gz GYXOKGHSNTYGBX-GOSISDBHSA-N 1 0 320.521 4.200 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(F)c1)c1cc(Cl)ccc1O ZINC000775488926 1049010209 /nfs/dbraw/zinc/01/02/09/1049010209.db2.gz XHCGTUAFDYMNCX-OAHLLOKOSA-N 1 0 323.795 4.434 20 10 DICDRO Oc1ccc(C[NH+]2CCC(c3cccc(Cl)c3)CC2)cc1O ZINC001203874982 1049020304 /nfs/dbraw/zinc/02/03/04/1049020304.db2.gz GMJQAVYMBCRTHE-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](c1ccc(C)cc1)N(C)C)c1ccccc1O ZINC000775497202 1049029451 /nfs/dbraw/zinc/02/94/51/1049029451.db2.gz OBPCEBKZPBQAIQ-RTBURBONSA-N 1 0 312.457 4.044 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](O)C1CCCCC1)c1cc(Cl)ccc1O ZINC000775497994 1049031252 /nfs/dbraw/zinc/03/12/52/1049031252.db2.gz FPRSLPONBYUFMO-WBVHZDCISA-N 1 0 311.853 4.028 20 10 DICDRO CC[C@H]([NH2+]C[C@H](O)C1CCCCC1)c1cc(Cl)ccc1O ZINC000775497774 1049033924 /nfs/dbraw/zinc/03/39/24/1049033924.db2.gz FPRSLPONBYUFMO-RDJZCZTQSA-N 1 0 311.853 4.028 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)cc1 ZINC001203939621 1049034673 /nfs/dbraw/zinc/03/46/73/1049034673.db2.gz RPMURBUKJOLJHB-OAQYLSRUSA-N 1 0 324.468 4.106 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)CCC(=O)c2ccccc2)cc1 ZINC001203942380 1049036639 /nfs/dbraw/zinc/03/66/39/1049036639.db2.gz NHZBILPHTJFLTK-UHFFFAOYSA-N 1 0 324.468 4.238 20 10 DICDRO CCN(CC)c1ccc(C[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)cc1 ZINC001203940678 1049037751 /nfs/dbraw/zinc/03/77/51/1049037751.db2.gz USVHMYTWBLFWDY-WBVHZDCISA-N 1 0 308.416 4.010 20 10 DICDRO FC(F)(F)[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC000776814169 1049038786 /nfs/dbraw/zinc/03/87/86/1049038786.db2.gz AFTWLEGXQSWDNA-INIZCTEOSA-N 1 0 321.342 4.057 20 10 DICDRO CC[C@H]([NH2+][C@H](C)Cc1ccc(O)cc1)c1cc(Cl)ccc1O ZINC000775498763 1049038878 /nfs/dbraw/zinc/03/88/78/1049038878.db2.gz NSTDNOYXLAITST-PXAZEXFGSA-N 1 0 319.832 4.423 20 10 DICDRO COc1ccc(N2CC[NH+](C[C@H](C)CC(C)(C)C)CC2)cc1F ZINC001192108556 1049041062 /nfs/dbraw/zinc/04/10/62/1049041062.db2.gz XRFTXHOOMOXTNQ-OAHLLOKOSA-N 1 0 322.468 4.029 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)Oc1cccc(F)c1)c1ccccc1O ZINC000775508628 1049043060 /nfs/dbraw/zinc/04/30/60/1049043060.db2.gz KZFGEGBIOONWHX-DYVFJYSZSA-N 1 0 303.377 4.040 20 10 DICDRO CC[C@@H]([NH2+][C@@H](Cn1cccn1)c1ccccc1)c1ccccc1O ZINC000775509966 1049044624 /nfs/dbraw/zinc/04/46/24/1049044624.db2.gz STGZUPAWCPEDSR-MOPGFXCFSA-N 1 0 321.424 4.071 20 10 DICDRO CC(C)=CC[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001178488051 1049045954 /nfs/dbraw/zinc/04/59/54/1049045954.db2.gz NEENWNMPLIQDMC-UHFFFAOYSA-N 1 0 306.453 4.305 20 10 DICDRO CC[C@H]([NH2+]C[C@H](OC)c1ccc(Cl)cc1)c1ccccc1O ZINC000775508018 1049047429 /nfs/dbraw/zinc/04/74/29/1049047429.db2.gz GTOGXABPZAPMEF-WMZOPIPTSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccncc1)c1cc(Cl)ccc1O ZINC000775513338 1049049179 /nfs/dbraw/zinc/04/91/79/1049049179.db2.gz XKRCSLWXSVIHMD-BLLLJJGKSA-N 1 0 304.821 4.113 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](CCO)CC(C)C)c1cc(Cl)ccc1O ZINC000775513594 1049050275 /nfs/dbraw/zinc/05/02/75/1049050275.db2.gz PZHLESWVJKRWQF-XJKSGUPXSA-N 1 0 313.869 4.131 20 10 DICDRO CC[C@H]([NH2+]Cc1sc(C)nc1C)c1cc(Cl)ccc1O ZINC000775509697 1049050927 /nfs/dbraw/zinc/05/09/27/1049050927.db2.gz UOJMBWITHUMMPB-ZDUSSCGKSA-N 1 0 310.850 4.360 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1cc(Cl)ccc1O ZINC000775509636 1049051871 /nfs/dbraw/zinc/05/18/71/1049051871.db2.gz NYZFMNFLOWMECA-IAGOWNOFSA-N 1 0 319.832 4.210 20 10 DICDRO CC[C@@H]([NH2+]Cc1sc(C)nc1C)c1cc(Cl)ccc1O ZINC000775509695 1049053058 /nfs/dbraw/zinc/05/30/58/1049053058.db2.gz UOJMBWITHUMMPB-CYBMUJFWSA-N 1 0 310.850 4.360 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)c1ccncc1)c1cc(Cl)ccc1O ZINC000775511818 1049055006 /nfs/dbraw/zinc/05/50/06/1049055006.db2.gz JYYNVBUCLISZMF-LRDDRELGSA-N 1 0 304.821 4.285 20 10 DICDRO CC[C@@H]([NH2+]CC(CC)(CC)CCO)c1cc(Cl)ccc1O ZINC000775511178 1049055616 /nfs/dbraw/zinc/05/56/16/1049055616.db2.gz CFOWTVVJSNSULJ-OAHLLOKOSA-N 1 0 313.869 4.275 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(OC)cc1Cl)c1ccccc1O ZINC000775513800 1049056944 /nfs/dbraw/zinc/05/69/44/1049056944.db2.gz NCHCWASIDOYOLU-QGZVFWFLSA-N 1 0 319.832 4.338 20 10 DICDRO CC[C@@H]([NH2+][C@H](CO)c1ccccc1C)c1cc(Cl)ccc1O ZINC000775511620 1049057043 /nfs/dbraw/zinc/05/70/43/1049057043.db2.gz FRZFPLOEPBVLDI-IAGOWNOFSA-N 1 0 319.832 4.128 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775514412 1049064200 /nfs/dbraw/zinc/06/42/00/1049064200.db2.gz ZXDJEJYMWNWMPT-AWEZNQCLSA-N 1 0 322.836 4.399 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccccc3OC)C2)cc1 ZINC000773753970 1049064173 /nfs/dbraw/zinc/06/41/73/1049064173.db2.gz ODCHKSFCJXKXRL-GOSISDBHSA-N 1 0 324.468 4.141 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](C(C)C)C1)c1cc(Cl)ccc1O ZINC000775518103 1049072895 /nfs/dbraw/zinc/07/28/95/1049072895.db2.gz CVEDSCZKSVZYOR-JLJPHGGASA-N 1 0 311.853 4.290 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCO[C@H](C(C)C)C1 ZINC001178758882 1049083877 /nfs/dbraw/zinc/08/38/77/1049083877.db2.gz LZLZECLRAWEGRI-UZLBHIALSA-N 1 0 314.473 4.028 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)[C@@H](O)C(C)C)c1cc(Cl)ccc1O ZINC000775524981 1049088446 /nfs/dbraw/zinc/08/84/46/1049088446.db2.gz XEPFMVKUQOPFFZ-HOCLYGCPSA-N 1 0 313.869 4.129 20 10 DICDRO CC[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccccc1O ZINC000775525148 1049088520 /nfs/dbraw/zinc/08/85/20/1049088520.db2.gz DNOKXPAITUNQIC-LSDHHAIUSA-N 1 0 303.789 4.220 20 10 DICDRO CC[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccccc1O ZINC000775525267 1049089320 /nfs/dbraw/zinc/08/93/20/1049089320.db2.gz FLTOXEWKYHZDIQ-ZDUSSCGKSA-N 1 0 313.294 4.190 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccccc1O ZINC000775525145 1049089458 /nfs/dbraw/zinc/08/94/58/1049089458.db2.gz DNOKXPAITUNQIC-HUUCEWRRSA-N 1 0 303.789 4.220 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)C1(C)CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000776882912 1049090547 /nfs/dbraw/zinc/09/05/47/1049090547.db2.gz KFBBQVICDXGECA-KGLIPLIRSA-N 1 0 322.880 4.016 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@H](OC)c1ccc(F)cc1)c1ccccc1O ZINC000775526698 1049093011 /nfs/dbraw/zinc/09/30/11/1049093011.db2.gz TXWIJGUYXOWQRZ-IXDGSTSKSA-N 1 0 317.404 4.348 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](c2ncccc2C)C(C)C)cc1 ZINC000773771998 1049093136 /nfs/dbraw/zinc/09/31/36/1049093136.db2.gz HXOPWCGNJXRLFA-IBGZPJMESA-N 1 0 311.473 4.333 20 10 DICDRO CC[C@@H]([NH2+]CC1(CO)CCCCC1)c1cc(Cl)ccc1O ZINC000775527855 1049097340 /nfs/dbraw/zinc/09/73/40/1049097340.db2.gz VFHVRIBYKUPFDL-OAHLLOKOSA-N 1 0 311.853 4.029 20 10 DICDRO C[C@@H]1CC[C@H](C)C[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001204163205 1049100565 /nfs/dbraw/zinc/10/05/65/1049100565.db2.gz QAOCLHKTOMJGJB-QWHCGFSZSA-N 1 0 314.395 4.392 20 10 DICDRO COCC(C)(C)CCC[NH2+]Cc1c(C)c2ccccc2n1C ZINC001178855512 1049101668 /nfs/dbraw/zinc/10/16/68/1049101668.db2.gz KSTRZSBKGFGDFL-UHFFFAOYSA-N 1 0 302.462 4.029 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@H]2CCC[C@H]2C(C)(C)C)cc1F ZINC001178931999 1049107792 /nfs/dbraw/zinc/10/77/92/1049107792.db2.gz VDJHGHMRXYDPFT-CJNGLKHVSA-N 1 0 310.432 4.335 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCC[C@@H]2C(C)(C)C)cc1F ZINC001178932001 1049107959 /nfs/dbraw/zinc/10/79/59/1049107959.db2.gz VDJHGHMRXYDPFT-XJKSGUPXSA-N 1 0 310.432 4.335 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1cc(Cl)ccc1O ZINC000775532160 1049112879 /nfs/dbraw/zinc/11/28/79/1049112879.db2.gz RXVDRQXTRKTZRN-CQSZACIVSA-N 1 0 311.212 4.335 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCC[C@@H](F)C2)c2ccccc21 ZINC001204233644 1049115510 /nfs/dbraw/zinc/11/55/10/1049115510.db2.gz TVLSJIUAPUBUCH-MRXNPFEDSA-N 1 0 300.421 4.230 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(C)(F)CC2)c2ccccc21 ZINC001204232368 1049115576 /nfs/dbraw/zinc/11/55/76/1049115576.db2.gz BKQHTFNZOXJPMU-UHFFFAOYSA-N 1 0 300.421 4.230 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@](C)(CF)C2)c2ccccc21 ZINC001204232634 1049116920 /nfs/dbraw/zinc/11/69/20/1049116920.db2.gz GWRJEDJTDBANRG-LJQANCHMSA-N 1 0 300.421 4.087 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](C(F)F)C2)c2ccccc21 ZINC001204241961 1049118430 /nfs/dbraw/zinc/11/84/30/1049118430.db2.gz LCXULJQVUBRHQL-OAHLLOKOSA-N 1 0 318.411 4.383 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(C(F)F)CC2)c2ccccc21 ZINC001204240552 1049118450 /nfs/dbraw/zinc/11/84/50/1049118450.db2.gz YAKYWMCMWGNZDE-UHFFFAOYSA-N 1 0 318.411 4.383 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)ccc1OC ZINC001178982788 1049119616 /nfs/dbraw/zinc/11/96/16/1049119616.db2.gz ZQCINMWBPKLVMB-PKOBYXMFSA-N 1 0 317.473 4.290 20 10 DICDRO CSC1CC[NH+](Cc2ccc(N(C)C)c3ccccc23)CC1 ZINC001204243271 1049121585 /nfs/dbraw/zinc/12/15/85/1049121585.db2.gz VBLYUPAWUURJLK-UHFFFAOYSA-N 1 0 314.498 4.233 20 10 DICDRO COc1c(C)cccc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC001179044515 1049122174 /nfs/dbraw/zinc/12/21/74/1049122174.db2.gz HAPQAYPGRUXFGE-UHFFFAOYSA-N 1 0 308.425 4.094 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C2CC2)[C@@H]2CCCCO2)cc1C ZINC001179044304 1049122611 /nfs/dbraw/zinc/12/26/11/1049122611.db2.gz AHXAONFMVIZKLV-VQTJNVASSA-N 1 0 317.473 4.221 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C2CC2)[C@H]2CCCCO2)cc1C ZINC001179044303 1049122680 /nfs/dbraw/zinc/12/26/80/1049122680.db2.gz AHXAONFMVIZKLV-UXHICEINSA-N 1 0 317.473 4.221 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000857081647 1049125482 /nfs/dbraw/zinc/12/54/82/1049125482.db2.gz PUGPXURVSZRDTF-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c(O)c1 ZINC001204275046 1049125774 /nfs/dbraw/zinc/12/57/74/1049125774.db2.gz MIHCFVNCVYQORS-MRXNPFEDSA-N 1 0 303.789 4.088 20 10 DICDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c(O)c1 ZINC001204275278 1049125939 /nfs/dbraw/zinc/12/59/39/1049125939.db2.gz NRQQXBWBBUYQHZ-MRXNPFEDSA-N 1 0 303.789 4.088 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(OC)ccc1F)c1ccc(C)cc1O ZINC000857082755 1049127696 /nfs/dbraw/zinc/12/76/96/1049127696.db2.gz XJHBMZUANFYQOO-QGZVFWFLSA-N 1 0 303.377 4.089 20 10 DICDRO Cc1ccc2oc(C[NH2+]Cc3c(O)cccc3Cl)cc2c1 ZINC001179159763 1049138341 /nfs/dbraw/zinc/13/83/41/1049138341.db2.gz QTGIYBLUNKNQGL-UHFFFAOYSA-N 1 0 301.773 4.390 20 10 DICDRO C[N@H+](CCc1cccc(F)c1)Cc1ccc(N2CCCC2)cc1 ZINC001204328089 1049142595 /nfs/dbraw/zinc/14/25/95/1049142595.db2.gz BSFZCWXVUUTLSW-UHFFFAOYSA-N 1 0 312.432 4.100 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)Cc2ccccc21 ZINC001204326288 1049142981 /nfs/dbraw/zinc/14/29/81/1049142981.db2.gz WSZZZDHQEOABGR-QGZVFWFLSA-N 1 0 306.453 4.406 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CC[C@H]2CCCC2(C)C)cc1F ZINC001179217066 1049143021 /nfs/dbraw/zinc/14/30/21/1049143021.db2.gz VSJQOYOEGKAWQN-CQSZACIVSA-N 1 0 310.432 4.337 20 10 DICDRO CC[C@H]([NH2+]C[C@@]1(C)CCO[C@H]1C1CC1)c1cc(Cl)ccc1O ZINC000775553394 1049148988 /nfs/dbraw/zinc/14/89/88/1049148988.db2.gz BKILLFFXJOXXIF-RYQLBKOJSA-N 1 0 323.864 4.292 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C2CCC2)[C@H]2CCOC2)cc1C ZINC001179390614 1049162972 /nfs/dbraw/zinc/16/29/72/1049162972.db2.gz KVNSFPSWKPMGRC-ICSRJNTNSA-N 1 0 317.473 4.079 20 10 DICDRO CC(C)Oc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC001204458097 1049165934 /nfs/dbraw/zinc/16/59/34/1049165934.db2.gz UAEPIFIQCHXLSD-UHFFFAOYSA-N 1 0 312.457 4.172 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)cc1 ZINC000773815127 1049170829 /nfs/dbraw/zinc/17/08/29/1049170829.db2.gz ZCOSJHUHSBEQSP-PZJWPPBQSA-N 1 0 324.468 4.010 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2cccc3ncccc23)cc1 ZINC001179524899 1049172243 /nfs/dbraw/zinc/17/22/43/1049172243.db2.gz CWJNIQLZAKYOSZ-XQRVVYSFSA-N 1 0 317.436 4.104 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](c2cccs2)C2CC2)cc1 ZINC000773816210 1049173235 /nfs/dbraw/zinc/17/32/35/1049173235.db2.gz DSFDZMOPCJJNHU-GOSISDBHSA-N 1 0 300.471 4.445 20 10 DICDRO Cc1c(F)cccc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001204512365 1049178604 /nfs/dbraw/zinc/17/86/04/1049178604.db2.gz GXHGODUTWFULMN-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c1 ZINC001204543699 1049187049 /nfs/dbraw/zinc/18/70/49/1049187049.db2.gz UUBABVKMYDZHCJ-FUHWJXTLSA-N 1 0 305.487 4.376 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(F)ccc1OC ZINC001179631237 1049190625 /nfs/dbraw/zinc/19/06/25/1049190625.db2.gz KXBFASWZTCFZEU-KRWDZBQOSA-N 1 0 315.388 4.010 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCCCC1 ZINC000775589582 1049195179 /nfs/dbraw/zinc/19/51/79/1049195179.db2.gz UNDHTWXWOOCYPR-MRXNPFEDSA-N 1 0 305.462 4.338 20 10 DICDRO Cc1ccc(Cl)cc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001179729394 1049200629 /nfs/dbraw/zinc/20/06/29/1049200629.db2.gz NOYFNSSBPFQQCU-UHFFFAOYSA-N 1 0 301.817 4.263 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC[C@@H]2CCC(F)(F)C2)cc1 ZINC001179758598 1049205324 /nfs/dbraw/zinc/20/53/24/1049205324.db2.gz KJJLGFHWTRAZSD-CWDCEQMOSA-N 1 0 308.416 4.181 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@H]2c2ccccc2C)c(O)c1 ZINC001204658903 1049213496 /nfs/dbraw/zinc/21/34/96/1049213496.db2.gz ZCDCYFLGIZJAFW-IBGZPJMESA-N 1 0 311.425 4.355 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccsc2C(F)(F)F)cc1 ZINC000858088882 1049216031 /nfs/dbraw/zinc/21/60/31/1049216031.db2.gz WGXWCXHBNLNHKE-UHFFFAOYSA-N 1 0 314.376 4.123 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001179845900 1049217217 /nfs/dbraw/zinc/21/72/17/1049217217.db2.gz ZREVAYUCZLURCA-UHFFFAOYSA-N 1 0 302.849 4.346 20 10 DICDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001204673695 1049217270 /nfs/dbraw/zinc/21/72/70/1049217270.db2.gz OGRDNERPXTXBKW-DYVFJYSZSA-N 1 0 310.432 4.431 20 10 DICDRO COc1ccc(C[NH2+]Cc2csc(C(F)(F)F)c2)cc1C ZINC000858120355 1049219591 /nfs/dbraw/zinc/21/95/91/1049219591.db2.gz CLZMVBBYOGRDLR-UHFFFAOYSA-N 1 0 315.360 4.374 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(SC(F)F)cc2)c1 ZINC000858239339 1049229161 /nfs/dbraw/zinc/22/91/61/1049229161.db2.gz MHPKEFZEKBLLPZ-UHFFFAOYSA-N 1 0 309.381 4.305 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000858237632 1049229912 /nfs/dbraw/zinc/22/99/12/1049229912.db2.gz OAQGCAMZHZUQRS-UHFFFAOYSA-N 1 0 314.385 4.022 20 10 DICDRO c1ccc([C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C2CCC2)nc1 ZINC000858237234 1049230099 /nfs/dbraw/zinc/23/00/99/1049230099.db2.gz HQUOFVDCIAOPGX-NRFANRHFSA-N 1 0 321.468 4.313 20 10 DICDRO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ccc2O)C1 ZINC001179936384 1049231375 /nfs/dbraw/zinc/23/13/75/1049231375.db2.gz GMTMWZHULQLNCP-YVEFUNNKSA-N 1 0 303.352 4.254 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]CC2(C(F)(F)F)CCCC2)c1 ZINC000858307824 1049239012 /nfs/dbraw/zinc/23/90/12/1049239012.db2.gz NJQQKLCBSZRALL-UHFFFAOYSA-N 1 0 317.351 4.003 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC2(C(F)(F)F)CCCC2)cc1C ZINC000858308195 1049239334 /nfs/dbraw/zinc/23/93/34/1049239334.db2.gz TYZSTOKEXXWVER-UHFFFAOYSA-N 1 0 301.352 4.221 20 10 DICDRO C[N@H+](CCCOc1ccc(Cl)cc1)Cc1cc(F)ccc1O ZINC001204720965 1049239741 /nfs/dbraw/zinc/23/97/41/1049239741.db2.gz GAPIBQKEAHBQAH-UHFFFAOYSA-N 1 0 323.795 4.086 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)c2ccns2)c(O)c(C(C)(C)C)c1 ZINC000858318280 1049242082 /nfs/dbraw/zinc/24/20/82/1049242082.db2.gz NDWGACPWWWPTIW-NSHDSACASA-N 1 0 320.458 4.006 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2(c3c(F)cccc3F)CCC2)c1 ZINC000858341625 1049245071 /nfs/dbraw/zinc/24/50/71/1049245071.db2.gz GESMFURGQLGRJX-UHFFFAOYSA-N 1 0 303.352 4.148 20 10 DICDRO C[C@@H]1C[NH+](Cc2ccc(OCc3ccccc3)cc2O)C[C@H]1C ZINC001204769830 1049258940 /nfs/dbraw/zinc/25/89/40/1049258940.db2.gz WXEUXFWIWNSALG-HZPDHXFCSA-N 1 0 311.425 4.059 20 10 DICDRO C[C@H]([NH2+]CC[C@@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000858445097 1049260178 /nfs/dbraw/zinc/26/01/78/1049260178.db2.gz AEROBPQBFPJCMP-ROUUACIJSA-N 1 0 316.489 4.144 20 10 DICDRO Cc1cc([C@@H](C)NCc2cc(C)n(-c3ccccc3)c2C)no1 ZINC000858542042 1049271744 /nfs/dbraw/zinc/27/17/44/1049271744.db2.gz HTUGOILUWNZDFA-OAHLLOKOSA-N 1 0 309.413 4.241 20 10 DICDRO CCn1ccnc1[C@@H](C)NCc1cc(C)n(-c2ccccc2)c1C ZINC000858543072 1049272978 /nfs/dbraw/zinc/27/29/78/1049272978.db2.gz PTLXRGBARVZHGX-MRXNPFEDSA-N 1 0 322.456 4.161 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c1 ZINC000858568675 1049276667 /nfs/dbraw/zinc/27/66/67/1049276667.db2.gz OWCYULHJVZMXKN-LLVKDONJSA-N 1 0 317.351 4.174 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c1O ZINC000858569046 1049277566 /nfs/dbraw/zinc/27/75/66/1049277566.db2.gz WSXITOLBSRMEEZ-NSHDSACASA-N 1 0 317.351 4.174 20 10 DICDRO CC(C)CC[C@@H]1CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180136834 1049278703 /nfs/dbraw/zinc/27/87/03/1049278703.db2.gz NUWURHCUCCRQSD-HNNXBMFYSA-N 1 0 310.432 4.431 20 10 DICDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001180125105 1049292747 /nfs/dbraw/zinc/29/27/47/1049292747.db2.gz RHVATTKPTJMFSV-JSGCOSHPSA-N 1 0 303.352 4.048 20 10 DICDRO COc1cc(C)cc(C[N@H+](C2CC2)C2CCC(C)CC2)c1O ZINC001204891458 1049300869 /nfs/dbraw/zinc/30/08/69/1049300869.db2.gz SBRZZFAXCGRFTF-UHFFFAOYSA-N 1 0 303.446 4.252 20 10 DICDRO CCC[N@H+](Cc1cc(OC)ccc1O)[C@@H]1CCc2ccccc21 ZINC001180225604 1049310522 /nfs/dbraw/zinc/31/05/22/1049310522.db2.gz UAKXXYBHYHOZJI-LJQANCHMSA-N 1 0 311.425 4.300 20 10 DICDRO C[N@H+](Cc1cc2ccnc(Cl)c2s1)Cc1ccccc1O ZINC001180240233 1049319767 /nfs/dbraw/zinc/31/97/67/1049319767.db2.gz UZJMFUGXROQEHG-UHFFFAOYSA-N 1 0 318.829 4.287 20 10 DICDRO CC1(C)CC[C@@H](C[N@H+](Cc2ccccc2O)C2CCCC2)O1 ZINC000775601726 1049320124 /nfs/dbraw/zinc/32/01/24/1049320124.db2.gz XQAPOWFSEBPVTJ-KRWDZBQOSA-N 1 0 303.446 4.094 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH+]2CCC(C(F)(F)F)CC2)cc1 ZINC001180249390 1049322480 /nfs/dbraw/zinc/32/24/80/1049322480.db2.gz KTRPZROPCTZMQQ-ARJAWSKDSA-N 1 0 312.379 4.040 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000773847996 1049327679 /nfs/dbraw/zinc/32/76/79/1049327679.db2.gz OWIFHHODQXTKFW-INIZCTEOSA-N 1 0 311.473 4.060 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2C)c1O ZINC001204974980 1049328649 /nfs/dbraw/zinc/32/86/49/1049328649.db2.gz FCRXKQIRLXQPJQ-IFXJQAMLSA-N 1 0 311.425 4.122 20 10 DICDRO CCCC[N@H+](C)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001205053459 1049355550 /nfs/dbraw/zinc/35/55/50/1049355550.db2.gz VGCZCEHXHLRZIG-UHFFFAOYSA-N 1 0 308.469 4.481 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1nccc2c1CCCC2 ZINC001180479040 1049363023 /nfs/dbraw/zinc/36/30/23/1049363023.db2.gz FVNUPNQDVFWRAF-UHFFFAOYSA-N 1 0 323.484 4.049 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCCc3ccccc3CC2)cc1 ZINC001194401523 1049369070 /nfs/dbraw/zinc/36/90/70/1049369070.db2.gz SHTXGGMMRYYCCV-UHFFFAOYSA-N 1 0 308.469 4.134 20 10 DICDRO COc1cc(C[NH+]2CCCCCCC2)c(O)c(C(C)(C)C)c1 ZINC001205108523 1049380949 /nfs/dbraw/zinc/38/09/49/1049380949.db2.gz QSVPDYGZUSTXKR-UHFFFAOYSA-N 1 0 305.462 4.464 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H](OC)C1CCCCC1 ZINC001205143810 1049392977 /nfs/dbraw/zinc/39/29/77/1049392977.db2.gz ZMVRIPYUCCSEHQ-FQEVSTJZSA-N 1 0 318.505 4.170 20 10 DICDRO COC1CCC(CC[NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC001180646985 1049394616 /nfs/dbraw/zinc/39/46/16/1049394616.db2.gz UYRVQIVYWRWJIS-UHFFFAOYSA-N 1 0 311.853 4.039 20 10 DICDRO COCC[N@H+](Cc1cccs1)Cc1cc(C(C)C)ccc1O ZINC001205162990 1049397608 /nfs/dbraw/zinc/39/76/08/1049397608.db2.gz VIGKRTGCANXUNK-UHFFFAOYSA-N 1 0 319.470 4.226 20 10 DICDRO CC[C@H]([NH2+]C1(c2cccc(OC)c2)CC1)c1ccc(N(C)C)cc1 ZINC000777155979 1049424116 /nfs/dbraw/zinc/42/41/16/1049424116.db2.gz QSZSLEBLNOYOOA-FQEVSTJZSA-N 1 0 324.468 4.491 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2CCC[C@H](C(C)C)CC2)c1O ZINC001181072395 1049440989 /nfs/dbraw/zinc/44/09/89/1049440989.db2.gz HGEGMPGQMJXHSQ-RDJZCZTQSA-N 1 0 305.462 4.404 20 10 DICDRO Cn1ccc2c1cc[nH+]c2-c1ccc(Oc2ccccc2)nc1 ZINC001205329655 1049441374 /nfs/dbraw/zinc/44/13/74/1049441374.db2.gz SXXBUVLGXATAFE-UHFFFAOYSA-N 1 0 301.349 4.428 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cc2ccccc2[nH]1 ZINC000775620655 1049445691 /nfs/dbraw/zinc/44/56/91/1049445691.db2.gz FEVBLUBCNKDPAX-OAHLLOKOSA-N 1 0 319.452 4.401 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cc2ccccc2[nH]1 ZINC000775620654 1049446181 /nfs/dbraw/zinc/44/61/81/1049446181.db2.gz FEVBLUBCNKDPAX-HNNXBMFYSA-N 1 0 319.452 4.401 20 10 DICDRO CCc1cccc(C[N@@H+]2CC[C@@](F)(c3ccccc3C)C2)c1O ZINC001181196055 1049451604 /nfs/dbraw/zinc/45/16/04/1049451604.db2.gz HUKBIBSNHUVDEN-FQEVSTJZSA-N 1 0 313.416 4.334 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)c(O)c1 ZINC001181196503 1049452012 /nfs/dbraw/zinc/45/20/12/1049452012.db2.gz PUPAOINTDOIBEQ-RTBURBONSA-N 1 0 311.425 4.217 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)c(O)c1 ZINC001181196502 1049452243 /nfs/dbraw/zinc/45/22/43/1049452243.db2.gz PUPAOINTDOIBEQ-RBUKOAKNSA-N 1 0 311.425 4.217 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)c(O)c1 ZINC001181196500 1049452255 /nfs/dbraw/zinc/45/22/55/1049452255.db2.gz PUPAOINTDOIBEQ-MOPGFXCFSA-N 1 0 311.425 4.217 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)C1CC1 ZINC001181223066 1049454742 /nfs/dbraw/zinc/45/47/42/1049454742.db2.gz MSZPSBOXWUAMNB-KGLIPLIRSA-N 1 0 306.881 4.464 20 10 DICDRO CCCCO[C@@H]1C[C@@H](N(CCC)c2ccc(C[NH3+])cc2)C1(C)C ZINC001181457072 1049478642 /nfs/dbraw/zinc/47/86/42/1049478642.db2.gz NRZJUKWOOIOQTR-RTBURBONSA-N 1 0 318.505 4.346 20 10 DICDRO Cc1ccc2c(c1)nc(C[NH2+]Cc1cc(C(C)C)ccc1O)n2C ZINC001205477663 1049480997 /nfs/dbraw/zinc/48/09/97/1049480997.db2.gz FTXRWCHHXVJBHB-UHFFFAOYSA-N 1 0 323.440 4.001 20 10 DICDRO COc1cccc(C[NH2+][C@H]2C[C@H](C)Sc3sccc32)c1O ZINC001181497301 1049484198 /nfs/dbraw/zinc/48/41/98/1049484198.db2.gz GJGJCXLPHJXAJE-GWCFXTLKSA-N 1 0 321.467 4.178 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)cc1 ZINC001205526553 1049490985 /nfs/dbraw/zinc/49/09/85/1049490985.db2.gz ACXGGOXQKZMYDU-NGXITPROSA-N 1 0 324.443 4.337 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2CC(c3cc(F)cc(F)c3)C2)c1 ZINC000862477103 1049496279 /nfs/dbraw/zinc/49/62/79/1049496279.db2.gz CCVDCEIWEWJXQJ-UHFFFAOYSA-N 1 0 303.352 4.015 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CC[C@H](OCCC(C)C)CC2)c1O ZINC000862489413 1049497079 /nfs/dbraw/zinc/49/70/79/1049497079.db2.gz KMCXMBJNFWZWCW-IYARVYRRSA-N 1 0 305.462 4.164 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccccc2CC(F)(F)F)c1O ZINC000862547507 1049502084 /nfs/dbraw/zinc/50/20/84/1049502084.db2.gz IBFYZCRBVHPRNO-UHFFFAOYSA-N 1 0 323.358 4.349 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc2[nH]ccc2c1 ZINC001205593692 1049505386 /nfs/dbraw/zinc/50/53/86/1049505386.db2.gz HMMKDHPXOVICIU-UHFFFAOYSA-N 1 0 319.452 4.400 20 10 DICDRO Cc1cc(C[N@H+]2C[C@H](C)[C@H](C)[C@@H]2C)ccc1N1CCCCC1 ZINC001195288709 1049510255 /nfs/dbraw/zinc/51/02/55/1049510255.db2.gz GSVHEMRGKCFJJB-BZSNNMDCSA-N 1 0 300.490 4.462 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@]1(C)CC1(Cl)Cl ZINC001181808557 1049520835 /nfs/dbraw/zinc/52/08/35/1049520835.db2.gz NWGRZUHPVITJGQ-HNNXBMFYSA-N 1 0 315.288 4.125 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@]1(C)CC1(Cl)Cl ZINC001181808558 1049521419 /nfs/dbraw/zinc/52/14/19/1049521419.db2.gz NWGRZUHPVITJGQ-OAHLLOKOSA-N 1 0 315.288 4.125 20 10 DICDRO CCc1cccc(C[NH2+]CC[C@]2(C)CC2(Cl)Cl)c1O ZINC001181809214 1049523616 /nfs/dbraw/zinc/52/36/16/1049523616.db2.gz XPWBXVLKNLVLGI-CQSZACIVSA-N 1 0 302.245 4.018 20 10 DICDRO CO[C@](C)(C[NH2+]Cc1ccc2ccccc2c1O)c1ccccc1 ZINC001181871096 1049534586 /nfs/dbraw/zinc/53/45/86/1049534586.db2.gz SLGALBOFZWKENW-OAQYLSRUSA-N 1 0 321.420 4.197 20 10 DICDRO [O-]c1c(Cl)cccc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000775663112 1049539987 /nfs/dbraw/zinc/53/99/87/1049539987.db2.gz YUYLDPRNIJTOKY-MRXNPFEDSA-N 1 0 303.789 4.088 20 10 DICDRO CSCc1ccc(C[NH2+]Cc2ccc(Cl)cc2O)cc1 ZINC001205736697 1049547566 /nfs/dbraw/zinc/54/75/66/1049547566.db2.gz XKFXDWBAHUKYTG-UHFFFAOYSA-N 1 0 307.846 4.198 20 10 DICDRO CN(C)c1cc(F)c(C[NH+]2CCC3(CCCC3)CC2)cc1F ZINC001181986817 1049556057 /nfs/dbraw/zinc/55/60/57/1049556057.db2.gz NYJDRKGXZJPMOS-UHFFFAOYSA-N 1 0 308.416 4.187 20 10 DICDRO CC(C)[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)[C@@H]1C(C)C ZINC001205788747 1049564365 /nfs/dbraw/zinc/56/43/65/1049564365.db2.gz GBQLCFKCKPFZHB-PXIXMTEYSA-N 1 0 300.490 4.378 20 10 DICDRO F[C@@H]1CCC2(C1)CC[NH+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001204320837 1049569949 /nfs/dbraw/zinc/56/99/49/1049569949.db2.gz BEMPTLHLEZHGKO-GOSISDBHSA-N 1 0 316.464 4.391 20 10 DICDRO COCC1(C[NH2+]Cc2cc(Cl)c(C)cc2O)CCCCC1 ZINC001182173915 1049576533 /nfs/dbraw/zinc/57/65/33/1049576533.db2.gz NMXGXHNHSPHJHA-UHFFFAOYSA-N 1 0 311.853 4.041 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CC(C)(CC(F)(F)F)C2)c1 ZINC001182225673 1049593472 /nfs/dbraw/zinc/59/34/72/1049593472.db2.gz BRILRXZFYFCAOX-UHFFFAOYSA-N 1 0 301.352 4.290 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c1O ZINC000775688410 1049619324 /nfs/dbraw/zinc/61/93/24/1049619324.db2.gz QXMUYEFUBOTASS-GFCCVEGCSA-N 1 0 305.805 4.253 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c1O ZINC000775688411 1049620513 /nfs/dbraw/zinc/62/05/13/1049620513.db2.gz QXMUYEFUBOTASS-LBPRGKRZSA-N 1 0 305.805 4.253 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)[C@H]1C ZINC001206016901 1049630847 /nfs/dbraw/zinc/63/08/47/1049630847.db2.gz SKNPLKBACQVPPE-SJORKVTESA-N 1 0 306.453 4.090 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)c1 ZINC000775706355 1049636579 /nfs/dbraw/zinc/63/65/79/1049636579.db2.gz OVCWAKCEDXWENZ-FZKQIMNGSA-N 1 0 315.388 4.123 20 10 DICDRO CC(C)[C@@H]1[N@H+](Cc2ccc(Br)cc2O)CC1(C)C ZINC001206040925 1049637857 /nfs/dbraw/zinc/63/78/57/1049637857.db2.gz QOSNZEIUHUEXIK-AWEZNQCLSA-N 1 0 312.251 4.021 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c1 ZINC001206062675 1049644076 /nfs/dbraw/zinc/64/40/76/1049644076.db2.gz COMFENSLABBBOW-RBUKOAKNSA-N 1 0 315.457 4.049 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@H]1CCc2ccccc21 ZINC001182424400 1049644737 /nfs/dbraw/zinc/64/47/37/1049644737.db2.gz SQUWSAMWNFWPHT-FXAWDEMLSA-N 1 0 322.496 4.312 20 10 DICDRO COc1cc(C[N@H+](C)Cc2ccccc2SC)c(O)cc1C ZINC000794662004 1049649779 /nfs/dbraw/zinc/64/97/79/1049649779.db2.gz OBIFTBTZFDOEKT-UHFFFAOYSA-N 1 0 317.454 4.063 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CC(C)(C)[C@@H]2C2CC2)c1O ZINC001206116361 1049657067 /nfs/dbraw/zinc/65/70/67/1049657067.db2.gz NSDSBKQUGNOCNE-HNNXBMFYSA-N 1 0 324.262 4.084 20 10 DICDRO Cc1cc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)ccc1N(C)C ZINC001196458087 1049662580 /nfs/dbraw/zinc/66/25/80/1049662580.db2.gz IDAVAWLASGHUDD-OAQYLSRUSA-N 1 0 308.469 4.476 20 10 DICDRO C[C@@H](CCc1ccccc1F)[NH2+]Cc1cc(Cl)ccc1O ZINC001206517103 1049675064 /nfs/dbraw/zinc/67/50/64/1049675064.db2.gz LXQQLIPTNVWMFQ-LBPRGKRZSA-N 1 0 307.796 4.296 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc(C)cc1)c1cc(Cl)ccc1O ZINC000774492234 1049675093 /nfs/dbraw/zinc/67/50/93/1049675093.db2.gz QDOVNCPJKLMTOS-FUHWJXTLSA-N 1 0 319.832 4.128 20 10 DICDRO COc1cccc(C=C2CC[NH+](Cc3cccc(C)c3O)CC2)c1 ZINC000775740688 1049687213 /nfs/dbraw/zinc/68/72/13/1049687213.db2.gz LZTWMBFVFZNYQG-UHFFFAOYSA-N 1 0 323.436 4.389 20 10 DICDRO CCc1cnc(CC[NH2+][C@@H](CC)c2ccc(C)cc2O)s1 ZINC000794802414 1049696245 /nfs/dbraw/zinc/69/62/45/1049696245.db2.gz NZQDQCISIXXJEY-HNNXBMFYSA-N 1 0 304.459 4.003 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccc(F)cc1)c1ccc(C)cc1O ZINC000794800667 1049697281 /nfs/dbraw/zinc/69/72/81/1049697281.db2.gz FQDZXOVEQBARIH-SOVGHPHASA-N 1 0 317.404 4.003 20 10 DICDRO CCc1ccc([C@H](COC)[NH2+][C@H](CC)c2ccc(C)cc2O)o1 ZINC000794802433 1049699150 /nfs/dbraw/zinc/69/91/50/1049699150.db2.gz ODMMYMWUDRXMHT-SJORKVTESA-N 1 0 317.429 4.284 20 10 DICDRO CC[C@@H]([NH2+]CCCSc1nccs1)c1ccc(C)cc1O ZINC000794802286 1049699163 /nfs/dbraw/zinc/69/91/63/1049699163.db2.gz NBERBOAPPQKRNX-CQSZACIVSA-N 1 0 322.499 4.380 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)CCc1ccco1 ZINC001206320835 1049711684 /nfs/dbraw/zinc/71/16/84/1049711684.db2.gz MJXUIJNWXNGXAA-IAGOWNOFSA-N 1 0 314.473 4.196 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)CCc1ccco1 ZINC001206320836 1049712281 /nfs/dbraw/zinc/71/22/81/1049712281.db2.gz MJXUIJNWXNGXAA-IRXDYDNUSA-N 1 0 314.473 4.196 20 10 DICDRO CCCCC[C@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206385528 1049724472 /nfs/dbraw/zinc/72/44/72/1049724472.db2.gz WFDIUSIBMNZGRZ-DLBZAZTESA-N 1 0 304.478 4.080 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2ccc3cc[nH]c3c2)ccc1N(C)C ZINC001197202236 1049726905 /nfs/dbraw/zinc/72/69/05/1049726905.db2.gz MONXTQIFCHEDBE-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1Cl ZINC001206429890 1049734355 /nfs/dbraw/zinc/73/43/55/1049734355.db2.gz LZTCCDPJLXTTGQ-HOCLYGCPSA-N 1 0 301.817 4.247 20 10 DICDRO Oc1cccc2sc(C[NH2+]Cc3cc(Cl)ccc3O)cc21 ZINC001206516809 1049748229 /nfs/dbraw/zinc/74/82/29/1049748229.db2.gz FMNJYGPZNXOAGL-UHFFFAOYSA-N 1 0 319.813 4.256 20 10 DICDRO C[C@H]([NH2+]CCc1ccccn1)c1ccc(N2CCCCCC2)cc1 ZINC000151429482 1049884248 /nfs/dbraw/zinc/88/42/48/1049884248.db2.gz NUGHLKPCVAVETL-SFHVURJKSA-N 1 0 323.484 4.355 20 10 DICDRO Cc1csc([C@@H]2CC[N@@H+](Cc3cc(C(C)C)ccc3O)C2)n1 ZINC001207447184 1049893847 /nfs/dbraw/zinc/89/38/47/1049893847.db2.gz AYOYJLDBCPQQTO-OAHLLOKOSA-N 1 0 316.470 4.270 20 10 DICDRO COc1cc(O)c(C[NH2+][C@]2(C)C[C@H](C)CC(C)(C)C2)cc1OC ZINC001207439742 1049894186 /nfs/dbraw/zinc/89/41/86/1049894186.db2.gz HWSYFKRCJVYVFY-BFUOFWGJSA-N 1 0 321.461 4.104 20 10 DICDRO Oc1cccc2c1C[N@H+](CCCc1ccc(Cl)cc1)CC2 ZINC001207598320 1049914831 /nfs/dbraw/zinc/91/48/31/1049914831.db2.gz ZSMUFMOABVPIPY-UHFFFAOYSA-N 1 0 301.817 4.037 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C[C@H]2CCC=CCCC2)c1O ZINC001207763077 1049936567 /nfs/dbraw/zinc/93/65/67/1049936567.db2.gz JUBSYWRHWXUHOD-ZDUSSCGKSA-N 1 0 309.837 4.280 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](CC)Cc1cc(C)cc(OC)c1O ZINC000164400054 1049936821 /nfs/dbraw/zinc/93/68/21/1049936821.db2.gz RFRILPJSCAADSQ-KRWDZBQOSA-N 1 0 314.429 4.077 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000760712186 1050005041 /nfs/dbraw/zinc/00/50/41/1050005041.db2.gz CSOMZRWJYWDDPG-SBHAEUEKSA-N 1 0 323.436 4.106 20 10 DICDRO CCOCCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000165085917 1050018492 /nfs/dbraw/zinc/01/84/92/1050018492.db2.gz VTVQPTNAXSOBND-MRXNPFEDSA-N 1 0 322.468 4.283 20 10 DICDRO CC[N@H+](CCc1ccc(F)cc1Cl)Cc1ccccc1O ZINC001209114314 1050037194 /nfs/dbraw/zinc/03/71/94/1050037194.db2.gz HEOILDKPDSVFTP-UHFFFAOYSA-N 1 0 307.796 4.249 20 10 DICDRO Cc1ccc(C)n1-c1ccc(CN(C)Cc2cncs2)cc1 ZINC001209520257 1050065699 /nfs/dbraw/zinc/06/56/99/1050065699.db2.gz SOGYXOHANRKBLZ-UHFFFAOYSA-N 1 0 311.454 4.183 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)cc1 ZINC001209518038 1050066351 /nfs/dbraw/zinc/06/63/51/1050066351.db2.gz LORUPLXLSUPXFS-SFHVURJKSA-N 1 0 316.395 4.325 20 10 DICDRO Cc1ccc(C)n1-c1ccc(CN2CCc3ncsc3C2)cc1 ZINC001209519669 1050066493 /nfs/dbraw/zinc/06/64/93/1050066493.db2.gz DLXHBLIMAPMPQT-UHFFFAOYSA-N 1 0 323.465 4.109 20 10 DICDRO COc1ccc(N(c2ccc(N)cc2)c2cnc(N)cc2C)cc1 ZINC001209969810 1050113409 /nfs/dbraw/zinc/11/34/09/1050113409.db2.gz QPGGUNWQIQTSGH-UHFFFAOYSA-N 1 0 320.396 4.033 20 10 DICDRO Cc1cc(N)[nH+]cc1Nc1ccc(CCc2ccc(N)cc2)cc1 ZINC001209966914 1050113727 /nfs/dbraw/zinc/11/37/27/1050113727.db2.gz JMTJBIJCXKXLNH-UHFFFAOYSA-N 1 0 318.424 4.083 20 10 DICDRO Oc1ccc(Cl)cc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000770303516 1050149665 /nfs/dbraw/zinc/14/96/65/1050149665.db2.gz JJLXQAHZDQELON-UHFFFAOYSA-N 1 0 307.743 4.210 20 10 DICDRO Cc1ccc(SC[C@@H](C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC000770666566 1050181931 /nfs/dbraw/zinc/18/19/31/1050181931.db2.gz PSUPIIVWBOJRAK-OAHLLOKOSA-N 1 0 301.455 4.279 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2cccc(F)c2F)CC1 ZINC000770664482 1050182358 /nfs/dbraw/zinc/18/23/58/1050182358.db2.gz PYVSGWOKBYZFFW-UHFFFAOYSA-N 1 0 303.352 4.050 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c1O ZINC000378873691 1050189954 /nfs/dbraw/zinc/18/99/54/1050189954.db2.gz UYXRRTKICLNFKQ-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO COc1cccc(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)c1O ZINC000378879472 1050192040 /nfs/dbraw/zinc/19/20/40/1050192040.db2.gz FDDJVNXDELOUHW-KRWDZBQOSA-N 1 0 303.377 4.027 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2ccccc2O)c2ccccc2)cc1 ZINC000378928497 1050193609 /nfs/dbraw/zinc/19/36/09/1050193609.db2.gz VXIXEHRNRHZORG-NRFANRHFSA-N 1 0 319.404 4.280 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)[C@H]2CCCCO2)c(C)n1-c1ccccc1 ZINC000379148801 1050196916 /nfs/dbraw/zinc/19/69/16/1050196916.db2.gz BENAOEYZKIMRRK-OXJNMPFZSA-N 1 0 312.457 4.141 20 10 DICDRO CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000760870912 1050197262 /nfs/dbraw/zinc/19/72/62/1050197262.db2.gz UCSDNFCSZSAKIA-LXIYXOSZSA-N 1 0 319.832 4.472 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000733992340 1050209016 /nfs/dbraw/zinc/20/90/16/1050209016.db2.gz PCOMOICTLOBGOI-HXUWFJFHSA-N 1 0 308.425 4.263 20 10 DICDRO Oc1ccccc1C[NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000824696214 1050234392 /nfs/dbraw/zinc/23/43/92/1050234392.db2.gz IJAWPZIPFHMLTH-QGZVFWFLSA-N 1 0 305.780 4.426 20 10 DICDRO COc1ccccc1C1(C[NH2+][C@@H](C)c2ccccc2O)CCC1 ZINC000760897545 1050236644 /nfs/dbraw/zinc/23/66/44/1050236644.db2.gz NFUMKZGGWZBELS-HNNXBMFYSA-N 1 0 311.425 4.173 20 10 DICDRO CC(C)[C@H]1C[C@H](C[NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000824798519 1050244916 /nfs/dbraw/zinc/24/49/16/1050244916.db2.gz DCPCMQFCVQGFTK-DNVCBOLYSA-N 1 0 313.441 4.086 20 10 DICDRO CCOCc1cc(C[NH2+]C23CCC(CC2)CC3)ccc1OC ZINC000824935266 1050258810 /nfs/dbraw/zinc/25/88/10/1050258810.db2.gz GJLYRVYIFKOBSY-UHFFFAOYSA-N 1 0 303.446 4.044 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)c2nccn21 ZINC000825017101 1050267970 /nfs/dbraw/zinc/26/79/70/1050267970.db2.gz LLXYNXKOMTUXQI-RDTXWAMCSA-N 1 0 319.408 4.051 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)cc1F ZINC000825063416 1050270761 /nfs/dbraw/zinc/27/07/61/1050270761.db2.gz DAGUNISMLDIEKP-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO COC1CCC([N@H+](C)Cc2cc(C)cc(C(C)(C)C)c2O)CC1 ZINC000734477570 1050276752 /nfs/dbraw/zinc/27/67/52/1050276752.db2.gz QODMDSUEKZIVHN-UHFFFAOYSA-N 1 0 319.489 4.388 20 10 DICDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000734476041 1050276821 /nfs/dbraw/zinc/27/68/21/1050276821.db2.gz BRVSOVLRPJSWPO-CRAIPNDOSA-N 1 0 318.420 4.318 20 10 DICDRO Cc1c(F)cccc1-c1ccc(C[NH2+]Cc2ccccc2O)o1 ZINC000734508733 1050279915 /nfs/dbraw/zinc/27/99/15/1050279915.db2.gz BAOOUGPDOJMYMW-UHFFFAOYSA-N 1 0 311.356 4.390 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCCOc3ccccc32)cc1Cl ZINC000825191121 1050286218 /nfs/dbraw/zinc/28/62/18/1050286218.db2.gz WTAXTLISDPMAGX-INIZCTEOSA-N 1 0 317.816 4.358 20 10 DICDRO CCOCCC1(C[NH2+]Cc2cc(Cl)c(C)cc2O)CCC1 ZINC000825366125 1050297736 /nfs/dbraw/zinc/29/77/36/1050297736.db2.gz SVFWUKOERYSRPA-UHFFFAOYSA-N 1 0 311.853 4.041 20 10 DICDRO C[N@H+](Cc1ccsc1)Cc1ccc(N2CCCCC2)cc1 ZINC000771935345 1050299253 /nfs/dbraw/zinc/29/92/53/1050299253.db2.gz OYNYHCGAITUIRF-UHFFFAOYSA-N 1 0 300.471 4.370 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1c(C)noc1C ZINC000825385077 1050302188 /nfs/dbraw/zinc/30/21/88/1050302188.db2.gz PQWMAGLNICQMDC-AWEZNQCLSA-N 1 0 308.809 4.200 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1Cl ZINC000825400491 1050302739 /nfs/dbraw/zinc/30/27/39/1050302739.db2.gz MCLHAHKIGRBAQI-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)cc1Cl ZINC000825412454 1050305868 /nfs/dbraw/zinc/30/58/68/1050305868.db2.gz KXDVSNVEHXNPEC-CABCVRRESA-N 1 0 311.853 4.037 20 10 DICDRO Cc1csc([C@@H](C)C[NH2+]Cc2cc(Cl)c(C)cc2O)n1 ZINC000825510303 1050313436 /nfs/dbraw/zinc/31/34/36/1050313436.db2.gz ZXWUZSNOUOLJOM-JTQLQIEISA-N 1 0 310.850 4.012 20 10 DICDRO CC[C@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccc(OC)cc1O ZINC000734849322 1050322441 /nfs/dbraw/zinc/32/24/41/1050322441.db2.gz AZCYCDSIHIUGCZ-MRXNPFEDSA-N 1 0 319.832 4.165 20 10 DICDRO CCOCc1cc(C[NH2+]C2(C)CCC(C)CC2)ccc1OC ZINC000734844271 1050324378 /nfs/dbraw/zinc/32/43/78/1050324378.db2.gz LNEQLGZFYNBOBI-UHFFFAOYSA-N 1 0 305.462 4.290 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@]2(C)CCCc3ccccc32)c1 ZINC000734845635 1050325217 /nfs/dbraw/zinc/32/52/17/1050325217.db2.gz XCJRGOWZMJRVCD-HXUWFJFHSA-N 1 0 311.425 4.132 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3cc(Cl)ccc3C2)cc1 ZINC001171103472 1050352416 /nfs/dbraw/zinc/35/24/16/1050352416.db2.gz CBWMUCVNWJDCLX-SFHVURJKSA-N 1 0 314.860 4.053 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccnc(SC)c2)cc1 ZINC000772467713 1050362229 /nfs/dbraw/zinc/36/22/29/1050362229.db2.gz BFYPRDQUGBUOGY-AWEZNQCLSA-N 1 0 315.486 4.110 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccnc(SC)c2)cc1 ZINC000772467714 1050362577 /nfs/dbraw/zinc/36/25/77/1050362577.db2.gz BFYPRDQUGBUOGY-CQSZACIVSA-N 1 0 315.486 4.110 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)CCCO)c1ccc(N2CCCCC2)cc1 ZINC000772479354 1050363681 /nfs/dbraw/zinc/36/36/81/1050363681.db2.gz AMFSTVZLZKYUSE-KRWDZBQOSA-N 1 0 318.505 4.126 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H]3CC(C)(C)C[C@H]3C)CC2)cc1 ZINC000766213642 1050371312 /nfs/dbraw/zinc/37/13/12/1050371312.db2.gz HVYKQQJASIARGN-BEFAXECRSA-N 1 0 316.489 4.078 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2cc3ccccc3o2)c(O)c1 ZINC000785557391 1050391314 /nfs/dbraw/zinc/39/13/14/1050391314.db2.gz NNRABBASHKVUAJ-CYBMUJFWSA-N 1 0 311.381 4.388 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccccc1O)c1ccc(C(F)(F)F)cc1 ZINC000785561602 1050393803 /nfs/dbraw/zinc/39/38/03/1050393803.db2.gz ZBLDMUMOJNFSRO-LBPRGKRZSA-N 1 0 309.331 4.304 20 10 DICDRO Cc1ccc(CC[C@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000766213314 1050394199 /nfs/dbraw/zinc/39/41/99/1050394199.db2.gz WYXZMWLBAZFNHD-GOEBONIOSA-N 1 0 300.446 4.326 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1ccnc(Oc2ccccc2F)c1 ZINC000785575400 1050397867 /nfs/dbraw/zinc/39/78/67/1050397867.db2.gz DPVYPXVSAJDCGY-UHFFFAOYSA-N 1 0 324.355 4.008 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(C)cccc1F)c1ccc(N(C)C)cc1 ZINC000766215085 1050448204 /nfs/dbraw/zinc/44/82/04/1050448204.db2.gz CCORJJHQUMEKAH-LJQANCHMSA-N 1 0 300.421 4.441 20 10 DICDRO CCc1cc(C[N@@H+](CC)Cc2ccccc2O)cc(CC)c1O ZINC001144151537 1050483597 /nfs/dbraw/zinc/48/35/97/1050483597.db2.gz WZCKAEFIWUWRBH-UHFFFAOYSA-N 1 0 313.441 4.245 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccncc1OC)c1cc(Cl)ccc1O ZINC000783328391 1050484771 /nfs/dbraw/zinc/48/47/71/1050484771.db2.gz AHWTWXBYEXWXDC-XHDPSFHLSA-N 1 0 320.820 4.251 20 10 DICDRO C[NH2+]Cc1ccc(N(Cc2ccccc2)c2ccc(N)cc2)cc1 ZINC001211131543 1050489986 /nfs/dbraw/zinc/48/99/86/1050489986.db2.gz YPKNRFWGBXIVFZ-UHFFFAOYSA-N 1 0 317.436 4.327 20 10 DICDRO CCOc1ccc(C[NH2+]C(C)(C)c2cccc(Cl)c2)c(O)c1 ZINC000738429950 1050534857 /nfs/dbraw/zinc/53/48/57/1050534857.db2.gz BAATXSHSVMDQAT-UHFFFAOYSA-N 1 0 319.832 4.469 20 10 DICDRO CCC(CC)[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766236501 1050546944 /nfs/dbraw/zinc/54/69/44/1050546944.db2.gz DXKWMSLSADLWLJ-CQSZACIVSA-N 1 0 312.404 4.035 20 10 DICDRO CCC[C@H](C)[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766238709 1050560425 /nfs/dbraw/zinc/56/04/25/1050560425.db2.gz XRUJCDVNUKSUGZ-UONOGXRCSA-N 1 0 312.404 4.035 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C/C=C\c2ccc(Cl)cc2)c1 ZINC000787278321 1050580281 /nfs/dbraw/zinc/58/02/81/1050580281.db2.gz DGLXDUDIAFHYCT-SCOBNMCVSA-N 1 0 317.816 4.418 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC1 ZINC000766238088 1050585624 /nfs/dbraw/zinc/58/56/24/1050585624.db2.gz PEVCUJHFELWZEQ-RHSMWYFYSA-N 1 0 324.415 4.035 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC1 ZINC000766238090 1050585944 /nfs/dbraw/zinc/58/59/44/1050585944.db2.gz PEVCUJHFELWZEQ-WMLDXEAASA-N 1 0 324.415 4.035 20 10 DICDRO C[C@H](c1cccc2ccccc21)[N@H+](C)Cc1c(O)cc(O)cc1O ZINC001144515426 1050606559 /nfs/dbraw/zinc/60/65/59/1050606559.db2.gz OGDIMABDVCDVLC-CYBMUJFWSA-N 1 0 323.392 4.150 20 10 DICDRO CCC[N@H+](Cc1cc(C)c(C)cc1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000740859934 1050631806 /nfs/dbraw/zinc/63/18/06/1050631806.db2.gz WENPKIDWWUMCGT-UHOSZYNNSA-N 1 0 317.473 4.035 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1 ZINC000845972168 1050638762 /nfs/dbraw/zinc/63/87/62/1050638762.db2.gz PGUQMCRZNNFBNF-NWDGAFQWSA-N 1 0 313.388 4.265 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3c(c2)CCCC3)c1 ZINC000845971232 1050639349 /nfs/dbraw/zinc/63/93/49/1050639349.db2.gz ISZHANBIGZIIHA-AWEZNQCLSA-N 1 0 311.425 4.130 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)s1)c1ccccc1O ZINC000845988931 1050641753 /nfs/dbraw/zinc/64/17/53/1050641753.db2.gz CJSUHEWXOLRRHP-VIFPVBQESA-N 1 0 301.333 4.323 20 10 DICDRO CC(C)CCC[C@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001170081977 1050649669 /nfs/dbraw/zinc/64/96/69/1050649669.db2.gz IDODKDCJGXIABS-SFHVURJKSA-N 1 0 318.505 4.170 20 10 DICDRO COc1cc(C[NH2+]Cc2cc(Cl)ccc2O)ccc1SC ZINC000846058702 1050649672 /nfs/dbraw/zinc/64/96/72/1050649672.db2.gz RVTABSAWRYOTIL-UHFFFAOYSA-N 1 0 323.845 4.066 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC[C@]2(C)C[C@@]2(F)Cl)cc1 ZINC000846028588 1050650907 /nfs/dbraw/zinc/65/09/07/1050650907.db2.gz CHDXQYDDPDLGKF-FDRQBBGKSA-N 1 0 310.844 4.060 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccccc1F ZINC000846044234 1050657242 /nfs/dbraw/zinc/65/72/42/1050657242.db2.gz GIDPOKDNGRMJFB-PXAZEXFGSA-N 1 0 303.377 4.342 20 10 DICDRO CC1(C)C[C@H]([NH2+]Cc2cc(F)ccc2O)c2cc(F)ccc2O1 ZINC000846053701 1050660047 /nfs/dbraw/zinc/66/00/47/1050660047.db2.gz WRXVNSISWPNGNQ-HNNXBMFYSA-N 1 0 319.351 4.062 20 10 DICDRO Cc1cccc(C[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)c1O ZINC000846052467 1050660586 /nfs/dbraw/zinc/66/05/86/1050660586.db2.gz ODFBJXSYOFMJLT-MRXNPFEDSA-N 1 0 315.388 4.232 20 10 DICDRO FC1(F)C[C@@]12CCC[N@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000846108792 1050665086 /nfs/dbraw/zinc/66/50/86/1050665086.db2.gz QIFRCDFLMAUVHH-GOSISDBHSA-N 1 0 320.427 4.298 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000793386241 1050668686 /nfs/dbraw/zinc/66/86/86/1050668686.db2.gz JHUIRRUNVFWJRV-CZIWCDLHSA-N 1 0 301.817 4.390 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)ccc2ccccc21 ZINC000846104489 1050670008 /nfs/dbraw/zinc/67/00/08/1050670008.db2.gz IEJLVRDSWNGTNF-KRWDZBQOSA-N 1 0 303.352 4.167 20 10 DICDRO Oc1ccccc1C[NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000846106769 1050671742 /nfs/dbraw/zinc/67/17/42/1050671742.db2.gz IRSFVLSCPUUUFU-UHFFFAOYSA-N 1 0 307.315 4.190 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(F)c2)c1O ZINC000846149819 1050672231 /nfs/dbraw/zinc/67/22/31/1050672231.db2.gz MOHZNCFCVMLWHP-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO CCS[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cccc(OC)c2O)C1 ZINC000846149881 1050672606 /nfs/dbraw/zinc/67/26/06/1050672606.db2.gz NMPOUNZOAALWSH-HZSPNIEDSA-N 1 0 309.475 4.116 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(Br)ccc2O)cc1 ZINC000227438345 1050673342 /nfs/dbraw/zinc/67/33/42/1050673342.db2.gz XOXKAOPBDKLUDS-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCc2ccc(F)cc2Cl)c1O ZINC000846151270 1050674411 /nfs/dbraw/zinc/67/44/11/1050674411.db2.gz YPQCNTZUQQWGOC-NSHDSACASA-N 1 0 323.795 4.087 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](CC(F)(F)F)C(C)C)c1O ZINC000846162497 1050676477 /nfs/dbraw/zinc/67/64/77/1050676477.db2.gz CCEWYOYXBBNRRI-JQWIXIFHSA-N 1 0 305.340 4.028 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(c3ccc(F)cc3)CCC2)c1O ZINC000846162595 1050676983 /nfs/dbraw/zinc/67/69/83/1050676983.db2.gz LLAPQVMAXPEGCB-CYBMUJFWSA-N 1 0 315.388 4.270 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCc3ccc(F)cc32)c1O ZINC000846167330 1050678812 /nfs/dbraw/zinc/67/88/12/1050678812.db2.gz IMZKQTQVKHUZIT-SJCJKPOMSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCc3ccc(F)cc32)c1O ZINC000846167334 1050678830 /nfs/dbraw/zinc/67/88/30/1050678830.db2.gz IMZKQTQVKHUZIT-YVEFUNNKSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C[C@H]2CCCCC(F)(F)C2)c1O ZINC000846168653 1050679938 /nfs/dbraw/zinc/67/99/38/1050679938.db2.gz BTTQLNIHGPHPML-STQMWFEESA-N 1 0 313.388 4.267 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C3CC3)cc2F)c1O ZINC000846171377 1050680625 /nfs/dbraw/zinc/68/06/25/1050680625.db2.gz RZFWIQTZXFBXAO-LBPRGKRZSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC[C@]2(C)CC2(Cl)Cl)c1O ZINC000846169719 1050680929 /nfs/dbraw/zinc/68/09/29/1050680929.db2.gz SENLMBPLIDRAMI-QMTHXVAHSA-N 1 0 318.244 4.025 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C3CC3)cc2F)c1O ZINC000846171375 1050681039 /nfs/dbraw/zinc/68/10/39/1050681039.db2.gz RZFWIQTZXFBXAO-GFCCVEGCSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2c(F)cccc2SC)c1O ZINC000846169435 1050681049 /nfs/dbraw/zinc/68/10/49/1050681049.db2.gz DOTUZYJBTNHLOQ-LLVKDONJSA-N 1 0 321.417 4.113 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc3[nH]c(C)cc3c2)c1O ZINC000846173605 1050682399 /nfs/dbraw/zinc/68/23/99/1050682399.db2.gz UEXGJUTZSHZDRV-CYBMUJFWSA-N 1 0 310.397 4.041 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc3[nH]c(C)cc3c2)c1O ZINC000846173608 1050682525 /nfs/dbraw/zinc/68/25/25/1050682525.db2.gz UEXGJUTZSHZDRV-ZDUSSCGKSA-N 1 0 310.397 4.041 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC2(c3ccccc3C)CC2)c1O ZINC000846144617 1050684181 /nfs/dbraw/zinc/68/41/81/1050684181.db2.gz JQHUVFPJHVFEPZ-OAHLLOKOSA-N 1 0 311.425 4.092 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+][C@H](C)c2cccc(OC)c2O)c1 ZINC000846141972 1050684476 /nfs/dbraw/zinc/68/44/76/1050684476.db2.gz PHFQCPFBVIGKIA-UONOGXRCSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC2(c3ccccc3C)CC2)c1O ZINC000846144612 1050684589 /nfs/dbraw/zinc/68/45/89/1050684589.db2.gz JQHUVFPJHVFEPZ-HNNXBMFYSA-N 1 0 311.425 4.092 20 10 DICDRO C[C@H]([NH2+]CC[C@@]1(C)C[C@@]1(F)Cl)c1cc(Cl)ccc1O ZINC000846185837 1050688778 /nfs/dbraw/zinc/68/87/78/1050688778.db2.gz SWQQVHGCORVARR-HERUPUMHSA-N 1 0 306.208 4.401 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1 ZINC000846214656 1050694995 /nfs/dbraw/zinc/69/49/95/1050694995.db2.gz LCAQDYOTYJYNKA-VXGBXAGGSA-N 1 0 302.245 4.325 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2c(F)cccc2F)c(O)c1 ZINC000788547753 1050700069 /nfs/dbraw/zinc/70/00/69/1050700069.db2.gz PBNGQLQTRQSOJE-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cn3ccccc3n2)cc1 ZINC000788546839 1050701875 /nfs/dbraw/zinc/70/18/75/1050701875.db2.gz MBGZRMYOWJBZAV-INIZCTEOSA-N 1 0 322.456 4.031 20 10 DICDRO CSC1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CCC1 ZINC000788524569 1050702964 /nfs/dbraw/zinc/70/29/64/1050702964.db2.gz SLAFBEZNCRDBEG-UHFFFAOYSA-N 1 0 313.466 4.435 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCN(c3ccccc3)C2)c(O)c1 ZINC000788527590 1050704193 /nfs/dbraw/zinc/70/41/93/1050704193.db2.gz WZLHNAYBDAZMLC-MSOLQXFVSA-N 1 0 324.468 4.186 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cc(F)cc(F)c2)c(O)c1 ZINC000788582589 1050708496 /nfs/dbraw/zinc/70/84/96/1050708496.db2.gz HRBMCABDCXHEQR-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO CSC1(C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)CC1 ZINC000788606032 1050712771 /nfs/dbraw/zinc/71/27/71/1050712771.db2.gz PGUZTKDOGJGHFB-CQSZACIVSA-N 1 0 322.493 4.362 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C(C)C)[C@@H](O)c2ccccc2)c(O)c1 ZINC000788618546 1050719159 /nfs/dbraw/zinc/71/91/59/1050719159.db2.gz AUBFYOGDWXXJNX-BEVDRBHNSA-N 1 0 313.441 4.109 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)c(Cl)cc2F)c(O)c1 ZINC000788620331 1050719275 /nfs/dbraw/zinc/71/92/75/1050719275.db2.gz OXRXOJMKFRBYPE-JTQLQIEISA-N 1 0 311.759 4.483 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(O)c1 ZINC000788774400 1050752983 /nfs/dbraw/zinc/75/29/83/1050752983.db2.gz DDVXZBGGXHKDTI-CQSZACIVSA-N 1 0 314.385 4.076 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)c(O)c1 ZINC000788821757 1050757996 /nfs/dbraw/zinc/75/79/96/1050757996.db2.gz GVWNYUAJXLUJSJ-ZDUSSCGKSA-N 1 0 304.821 4.217 20 10 DICDRO COc1c2ccccc2oc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000788979404 1050777866 /nfs/dbraw/zinc/77/78/66/1050777866.db2.gz FDXQXHJPKCAQLH-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c1O ZINC000761202381 1050778099 /nfs/dbraw/zinc/77/80/99/1050778099.db2.gz DOFPPIFGJRACQC-SJKOYZFVSA-N 1 0 317.816 4.247 20 10 DICDRO COc1c2ccccc2oc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000788978898 1050778109 /nfs/dbraw/zinc/77/81/09/1050778109.db2.gz BBWKCYIEJLZLLQ-LLVKDONJSA-N 1 0 315.344 4.137 20 10 DICDRO CN(c1ccc(N)cc1)c1ccc(N(C)C2CCCCC2)nc1 ZINC001212615096 1050780701 /nfs/dbraw/zinc/78/07/01/1050780701.db2.gz HCEFNFUJXGELNR-UHFFFAOYSA-N 1 0 310.445 4.201 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)c1O ZINC000761205607 1050783432 /nfs/dbraw/zinc/78/34/32/1050783432.db2.gz GWOLRSISBBUJFO-TYNCELHUSA-N 1 0 309.837 4.113 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@H]1C)c1ccc(N2CCOCC2)cc1Cl ZINC000772959497 1050807079 /nfs/dbraw/zinc/80/70/79/1050807079.db2.gz PXTHKWABGMWEBQ-GLJUWKHASA-N 1 0 322.880 4.016 20 10 DICDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)C1 ZINC000742367579 1050822781 /nfs/dbraw/zinc/82/27/81/1050822781.db2.gz ZBXPERFDWYFOAT-SJLPKXTDSA-N 1 0 318.530 4.298 20 10 DICDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)C1 ZINC000742367577 1050823076 /nfs/dbraw/zinc/82/30/76/1050823076.db2.gz ZBXPERFDWYFOAT-FUHWJXTLSA-N 1 0 318.530 4.298 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]C(C)(C)CCO)c(O)c(C(C)(C)C)c1 ZINC000742380405 1050826114 /nfs/dbraw/zinc/82/61/14/1050826114.db2.gz JIYWURXCNIRPQL-UHFFFAOYSA-N 1 0 321.505 4.238 20 10 DICDRO CCc1cnc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)s1 ZINC000742384545 1050827642 /nfs/dbraw/zinc/82/76/42/1050827642.db2.gz HOKJDBSWRUFXEI-UHFFFAOYSA-N 1 0 324.449 4.368 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cccc(-n3ccnc3)c2)cc1C ZINC000742392598 1050830623 /nfs/dbraw/zinc/83/06/23/1050830623.db2.gz ROUNNPLLPUELEI-INIZCTEOSA-N 1 0 321.424 4.040 20 10 DICDRO c1ccc(C[C@H]2C[C@@H]2[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000742375023 1050835158 /nfs/dbraw/zinc/83/51/58/1050835158.db2.gz KXZHAYWRFFTIKI-UNMCSNQZSA-N 1 0 320.480 4.398 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(CC)CC)c(F)c1)c1ccncc1 ZINC000742372454 1050835653 /nfs/dbraw/zinc/83/56/53/1050835653.db2.gz MXSSDWAYGGMHEN-GOSISDBHSA-N 1 0 315.436 4.308 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cc1C ZINC000789480331 1050835992 /nfs/dbraw/zinc/83/59/92/1050835992.db2.gz MFJOEWBKLVSHLP-CABCVRRESA-N 1 0 314.256 4.025 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)ccc1OC ZINC000742378213 1050837953 /nfs/dbraw/zinc/83/79/53/1050837953.db2.gz DTSSPTSBFNWVQU-ZIFCJYIRSA-N 1 0 317.473 4.290 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCOCC2(CCC2)C1 ZINC000761227266 1050880727 /nfs/dbraw/zinc/88/07/27/1050880727.db2.gz YKPBCGNLIDYZCQ-UHFFFAOYSA-N 1 0 323.436 4.062 20 10 DICDRO CC(C)[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C(C)(C)O ZINC000790703015 1050987364 /nfs/dbraw/zinc/98/73/64/1050987364.db2.gz VXDIFTUWAHYREV-LPHOPBHVSA-N 1 0 318.505 4.123 20 10 DICDRO C[N@H+](CCc1cccs1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000743382257 1051019752 /nfs/dbraw/zinc/01/97/52/1051019752.db2.gz NAFPSQRIKYKWJU-UHFFFAOYSA-N 1 0 319.470 4.131 20 10 DICDRO C[C@H]([NH2+]CCC1CCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000773035295 1051032108 /nfs/dbraw/zinc/03/21/08/1051032108.db2.gz LSNCHIKCMDNDCF-AWEZNQCLSA-N 1 0 322.880 4.017 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCCO[C@H]2C(C)C)cc1 ZINC000773048590 1051039339 /nfs/dbraw/zinc/03/93/39/1051039339.db2.gz RLGBJQLOJMSWFQ-QRFRQXIXSA-N 1 0 318.505 4.245 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)cc1C)c1ccc(N(C)C)cc1 ZINC000773050179 1051039402 /nfs/dbraw/zinc/03/94/02/1051039402.db2.gz FPHOPFQPQPMMLS-FQEVSTJZSA-N 1 0 312.457 4.311 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccc(N(C)C)cc1 ZINC000773082808 1051056028 /nfs/dbraw/zinc/05/60/28/1051056028.db2.gz WTGOVTNLLZLQND-HXUWFJFHSA-N 1 0 310.441 4.024 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)[C@@H]1CCCO1 ZINC000773102632 1051062835 /nfs/dbraw/zinc/06/28/35/1051062835.db2.gz HHIBRDSTNRHKEX-UXPWSPDFSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)c1cn[nH]c1 ZINC000773105518 1051063137 /nfs/dbraw/zinc/06/31/37/1051063137.db2.gz HQPLFOXYMFORKC-HOTGVXAUSA-N 1 0 312.461 4.202 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCSCC(F)(F)F)cc1 ZINC000773145061 1051079265 /nfs/dbraw/zinc/07/92/65/1051079265.db2.gz IFPFWWALHXGSKI-GFCCVEGCSA-N 1 0 320.424 4.089 20 10 DICDRO Cc1c[nH+]c(NCc2cc3ccccc3cc2O)c2[nH]ccc21 ZINC001171402276 1051091166 /nfs/dbraw/zinc/09/11/66/1051091166.db2.gz KUGDXZQJFSTBAH-UHFFFAOYSA-N 1 0 303.365 4.342 20 10 DICDRO Nc1cc[nH+]c2cc(NCc3cc4ccccc4cc3O)ccc12 ZINC001171407904 1051094938 /nfs/dbraw/zinc/09/49/38/1051094938.db2.gz YFONETRGEOFJLJ-UHFFFAOYSA-N 1 0 315.376 4.288 20 10 DICDRO Cn1ccc2c1[nH+]ccc2NCc1cc2ccccc2cc1O ZINC001171407672 1051095445 /nfs/dbraw/zinc/09/54/45/1051095445.db2.gz SNZNHSBUFGIUBH-UHFFFAOYSA-N 1 0 303.365 4.044 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000036961232 1051102969 /nfs/dbraw/zinc/10/29/69/1051102969.db2.gz KRAIKGONHVGVDJ-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000037142053 1051114087 /nfs/dbraw/zinc/11/40/87/1051114087.db2.gz GPWTYVPGBBZKIX-PWSUYJOCSA-N 1 0 307.743 4.256 20 10 DICDRO CC[C@@H](CSC)[N@H+](C)Cc1c(O)ccc2ccc(OC)cc21 ZINC000773255773 1051119777 /nfs/dbraw/zinc/11/97/77/1051119777.db2.gz PBHVGRNNUCFONU-AWEZNQCLSA-N 1 0 319.470 4.127 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCc3cc(Cl)ccc3C2)c1O ZINC000792178312 1051123206 /nfs/dbraw/zinc/12/32/06/1051123206.db2.gz BMNAABYNZNKHGC-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO C[C@H]1CCSCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000792194917 1051126987 /nfs/dbraw/zinc/12/69/87/1051126987.db2.gz AZJXXYXCRDWHLD-INIZCTEOSA-N 1 0 304.503 4.004 20 10 DICDRO Cc1cccc(Br)c1C[N@H+](C)Cc1ccccc1O ZINC001248618611 1051137857 /nfs/dbraw/zinc/13/78/57/1051137857.db2.gz AITCCTLDKYHDLR-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CSc1ccc(F)cc1C[NH2+]Cc1c(O)cccc1Cl ZINC000744447826 1051179048 /nfs/dbraw/zinc/17/90/48/1051179048.db2.gz CLBAZOSNNLCJLK-UHFFFAOYSA-N 1 0 311.809 4.196 20 10 DICDRO CC(C)n1nccc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000792820321 1051215782 /nfs/dbraw/zinc/21/57/82/1051215782.db2.gz MMEPTPCCKHKHCS-UHFFFAOYSA-N 1 0 313.445 4.114 20 10 DICDRO CSCC[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792991558 1051235426 /nfs/dbraw/zinc/23/54/26/1051235426.db2.gz JKQBLVXWXFWAQL-LLVKDONJSA-N 1 0 320.424 4.003 20 10 DICDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000747099752 1051242550 /nfs/dbraw/zinc/24/25/50/1051242550.db2.gz KMKNTTMFFDFDKX-HOTGVXAUSA-N 1 0 312.457 4.043 20 10 DICDRO COc1ccc2c(c1)CCC[C@H]2C[NH2+][C@H](C)c1ccccc1O ZINC000766331229 1051256110 /nfs/dbraw/zinc/25/61/10/1051256110.db2.gz NDBOHVUDXRKADV-ZBFHGGJFSA-N 1 0 311.425 4.172 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000793230023 1051263683 /nfs/dbraw/zinc/26/36/83/1051263683.db2.gz CLBWGRVCCGQXQX-JOYOIKCWSA-N 1 0 307.743 4.127 20 10 DICDRO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000793231278 1051264616 /nfs/dbraw/zinc/26/46/16/1051264616.db2.gz LYZJECGHGIAIOL-IAQYHMDHSA-N 1 0 309.331 4.318 20 10 DICDRO Cc1cccc(CNc2ccc(C[NH+](C)C)c(Cl)c2)c1O ZINC000793344342 1051280423 /nfs/dbraw/zinc/28/04/23/1051280423.db2.gz QTZPZNMXAJFAPN-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCC[C@@H]2c2ccc(C)cc2)c(O)c1 ZINC000793386084 1051294504 /nfs/dbraw/zinc/29/45/04/1051294504.db2.gz IVCYNKULQFLKRG-MOPGFXCFSA-N 1 0 311.425 4.135 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccccc2-c2ccccc2)c(O)c1 ZINC000793389413 1051296564 /nfs/dbraw/zinc/29/65/64/1051296564.db2.gz XZGVYWYOMHXLKE-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO CCC[N@H+](Cc1ccc(OC)cc1)Cc1cc(C)c(C)cc1O ZINC000746037664 1051309298 /nfs/dbraw/zinc/30/92/98/1051309298.db2.gz HZCJZNHLXDIMET-UHFFFAOYSA-N 1 0 313.441 4.430 20 10 DICDRO c1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CS2 ZINC001172190695 1051310690 /nfs/dbraw/zinc/31/06/90/1051310690.db2.gz LWIINLZOEHFZFS-GOSISDBHSA-N 1 0 324.493 4.093 20 10 DICDRO CN(c1ccc(N)cc1)c1ccc(C[NH+]2CCCCC2)c(F)c1 ZINC001215713179 1051318859 /nfs/dbraw/zinc/31/88/59/1051318859.db2.gz VZBXMCQYOKGYIS-UHFFFAOYSA-N 1 0 313.420 4.162 20 10 DICDRO Oc1cccc(Cl)c1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000793620945 1051330065 /nfs/dbraw/zinc/33/00/65/1051330065.db2.gz USBVGOMJGMOIDT-UHFFFAOYSA-N 1 0 307.743 4.210 20 10 DICDRO CC[C@H](C)OCC[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001172314256 1051338092 /nfs/dbraw/zinc/33/80/92/1051338092.db2.gz CENUNKFGCQOUDD-ROUUACIJSA-N 1 0 318.505 4.360 20 10 DICDRO CSC[C@@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000793798735 1051338386 /nfs/dbraw/zinc/33/83/86/1051338386.db2.gz ZCKCFJYHXWXBTB-CQSZACIVSA-N 1 0 301.455 4.120 20 10 DICDRO CC[C@H](C)OCC[C@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172340511 1051362100 /nfs/dbraw/zinc/36/21/00/1051362100.db2.gz KJGMQKGWTLWTRK-ROUUACIJSA-N 1 0 318.505 4.312 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H](C)CCOCC(C)C ZINC001172478546 1051402114 /nfs/dbraw/zinc/40/21/14/1051402114.db2.gz BBLZQWHUAHFAGO-QGZVFWFLSA-N 1 0 306.494 4.026 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000766365428 1051407969 /nfs/dbraw/zinc/40/79/69/1051407969.db2.gz FHMQOCACGNKIIR-CYBMUJFWSA-N 1 0 318.461 4.464 20 10 DICDRO CC[C@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccc(N(C)C)cc1 ZINC000766380395 1051409802 /nfs/dbraw/zinc/40/98/02/1051409802.db2.gz WDAFQRZYHGYCBI-KRWDZBQOSA-N 1 0 322.456 4.178 20 10 DICDRO CC(C)COCC[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001172456624 1051411233 /nfs/dbraw/zinc/41/12/33/1051411233.db2.gz GNBXFDAMTNKYSX-SFHVURJKSA-N 1 0 318.505 4.218 20 10 DICDRO Oc1cccc2c1C[N@@H+]([C@@H]1CCC[C@@H](c3ccccc3)C1)CC2 ZINC001172549236 1051433243 /nfs/dbraw/zinc/43/32/43/1051433243.db2.gz NODMFLYAYNZYMR-RTBURBONSA-N 1 0 307.437 4.477 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766558757 1051480614 /nfs/dbraw/zinc/48/06/14/1051480614.db2.gz HJXKKGTZTAELBT-HNAYVOBHSA-N 1 0 320.452 4.036 20 10 DICDRO CCOc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000766574602 1051509610 /nfs/dbraw/zinc/50/96/10/1051509610.db2.gz YWZNWRFJXSRVJW-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO C[C@@H](Cc1c(F)cccc1Cl)[NH2+][C@@H](C)c1ccccc1O ZINC001172839912 1051527853 /nfs/dbraw/zinc/52/78/53/1051527853.db2.gz ANOAAENNKLHIMM-RYUDHWBXSA-N 1 0 307.796 4.467 20 10 DICDRO C[C@H](Cc1c(F)cccc1Cl)[NH2+][C@H](C)c1ccccc1O ZINC001172839913 1051528187 /nfs/dbraw/zinc/52/81/87/1051528187.db2.gz ANOAAENNKLHIMM-VXGBXAGGSA-N 1 0 307.796 4.467 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2OC)c1ccc(N(C)C)cc1 ZINC000766593714 1051531101 /nfs/dbraw/zinc/53/11/01/1051531101.db2.gz WQNRKROPCQADBS-WOJBJXKFSA-N 1 0 324.468 4.489 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)cn1)c1ccc(N2CCCCC2)cc1 ZINC000766609387 1051542930 /nfs/dbraw/zinc/54/29/30/1051542930.db2.gz YTSSWTQAXLIRQY-OAHLLOKOSA-N 1 0 313.420 4.062 20 10 DICDRO C[C@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001172860334 1051547222 /nfs/dbraw/zinc/54/72/22/1051547222.db2.gz CJLHFBPSXHPBBI-GFCCVEGCSA-N 1 0 319.807 4.135 20 10 DICDRO C[C@H](Cc1ccc(F)cc1Cl)[N@@H+]1CCc2cccc(O)c2C1 ZINC001172871288 1051555740 /nfs/dbraw/zinc/55/57/40/1051555740.db2.gz JRRXJYVKQRUWDG-GFCCVEGCSA-N 1 0 319.807 4.174 20 10 DICDRO C[C@@H](Cc1ccc(F)cc1Cl)[N@@H+]1CCc2cccc(O)c2C1 ZINC001172871293 1051556304 /nfs/dbraw/zinc/55/63/04/1051556304.db2.gz JRRXJYVKQRUWDG-LBPRGKRZSA-N 1 0 319.807 4.174 20 10 DICDRO C[C@@H](CSc1ccc(Cl)cc1)[NH2+]Cc1ccc(O)c(O)c1 ZINC001172884366 1051567322 /nfs/dbraw/zinc/56/73/22/1051567322.db2.gz XTJQHTQHMSUSRM-NSHDSACASA-N 1 0 323.845 4.022 20 10 DICDRO C[N@H+](Cc1ccccc1O)C1CCC(Oc2ccccc2)CC1 ZINC001173206320 1051645025 /nfs/dbraw/zinc/64/50/25/1051645025.db2.gz RGERSEYOPFVLGB-UHFFFAOYSA-N 1 0 311.425 4.214 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(OC)c(C)c2)C1(CC)CC ZINC001169582007 1051655435 /nfs/dbraw/zinc/65/54/35/1051655435.db2.gz NPIUVJHMFPDFJY-ZWKOTPCHSA-N 1 0 305.462 4.077 20 10 DICDRO c1cc(N2CCCCC2)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403675995 1051666521 /nfs/dbraw/zinc/66/65/21/1051666521.db2.gz GUOUFPOTLQZASY-JLYLLQBASA-N 1 0 316.514 4.193 20 10 DICDRO CC[C@@H]1CC[C@@H]([N@@H+]2CCc3c(c4cc(OC)ccc4n3C)C2)C1 ZINC001173286017 1051690446 /nfs/dbraw/zinc/69/04/46/1051690446.db2.gz CEXLQWUSVGNPSE-HUUCEWRRSA-N 1 0 312.457 4.124 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cc(Cl)cc(Cl)c1[O-] ZINC000806135033 1051736012 /nfs/dbraw/zinc/73/60/12/1051736012.db2.gz FFFHEGDSWHGFGD-IINYFYTJSA-N 1 0 319.276 4.080 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC1(C)C)c1ccc(N2CCOCC2)cc1Cl ZINC000806169366 1051746738 /nfs/dbraw/zinc/74/67/38/1051746738.db2.gz KQJOCWJTOBVOKD-SUMWQHHRSA-N 1 0 322.880 4.016 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2CCCc3sccc32)c(O)c1 ZINC000767190437 1051772020 /nfs/dbraw/zinc/77/20/20/1051772020.db2.gz MWGAIDUVDGNLLQ-HNNXBMFYSA-N 1 0 303.427 4.020 20 10 DICDRO Oc1ccccc1C[NH2+]C1CCC2(CCc3ccccc32)CC1 ZINC001173688161 1051780729 /nfs/dbraw/zinc/78/07/29/1051780729.db2.gz XPLYMWWZGOYUDY-UHFFFAOYSA-N 1 0 307.437 4.309 20 10 DICDRO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000768161422 1051889925 /nfs/dbraw/zinc/88/99/25/1051889925.db2.gz MKDPYYFKKICQMJ-KRWDZBQOSA-N 1 0 309.457 4.055 20 10 DICDRO CCOc1cccc(C[N@H+](C)Cc2ccc(Cl)cc2)c1O ZINC000768170116 1051892258 /nfs/dbraw/zinc/89/22/58/1051892258.db2.gz KVSKEDXMNJBUDU-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO C[N@H+](Cc1ccc(Cl)s1)Cc1cc(Cl)ccc1O ZINC000768194029 1051902007 /nfs/dbraw/zinc/90/20/07/1051902007.db2.gz YCFDAQHJINTOGA-UHFFFAOYSA-N 1 0 302.226 4.393 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccc(F)cc2)c1 ZINC000768216246 1051903318 /nfs/dbraw/zinc/90/33/18/1051903318.db2.gz UHJDLAPIEAHWLB-CYBMUJFWSA-N 1 0 303.377 4.123 20 10 DICDRO C[C@@H](c1ccccc1)[N@H+](C)Cc1cc(Br)ccc1O ZINC000768197544 1051904784 /nfs/dbraw/zinc/90/47/84/1051904784.db2.gz JVCJJSVBFNICFK-LBPRGKRZSA-N 1 0 320.230 4.348 20 10 DICDRO Cc1ccc(O)c(C[N@H+](C)Cc2cccc(Br)c2)c1 ZINC000768252731 1051908938 /nfs/dbraw/zinc/90/89/38/1051908938.db2.gz NQKLRKBOVOZJPN-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1ccc([C@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000768263603 1051911347 /nfs/dbraw/zinc/91/13/47/1051911347.db2.gz VPLCAGVTJPWJIA-SFHVURJKSA-N 1 0 324.468 4.025 20 10 DICDRO CCOc1ccc(C[N@H+](Cc2ccco2)C2CCCC2)c(O)c1 ZINC000768269716 1051911960 /nfs/dbraw/zinc/91/19/60/1051911960.db2.gz LPGDNKUFFAVMNU-UHFFFAOYSA-N 1 0 315.413 4.329 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CCC(C(F)(F)F)CC2)cc1 ZINC000768244513 1051913780 /nfs/dbraw/zinc/91/37/80/1051913780.db2.gz QEXFAEQXCUCZDW-UHFFFAOYSA-N 1 0 314.395 4.307 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(O)c1 ZINC000768329458 1051918492 /nfs/dbraw/zinc/91/84/92/1051918492.db2.gz FIXGOGBNGDQACT-GOSISDBHSA-N 1 0 315.388 4.267 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)c(O)c1 ZINC000768329897 1051918545 /nfs/dbraw/zinc/91/85/45/1051918545.db2.gz KAKMJVOFCNXALN-MRXNPFEDSA-N 1 0 303.427 4.190 20 10 DICDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1cccc(OC)c1O ZINC000768340845 1051922070 /nfs/dbraw/zinc/92/20/70/1051922070.db2.gz GHVFZYYIAHKNQJ-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)c1 ZINC000768425374 1051928720 /nfs/dbraw/zinc/92/87/20/1051928720.db2.gz WMPJLRMSQHBKQQ-OAQYLSRUSA-N 1 0 318.420 4.107 20 10 DICDRO COc1cccc(C[N@H+](C2CC2)[C@H]2CCCc3ccccc32)c1O ZINC000768526359 1051937844 /nfs/dbraw/zinc/93/78/44/1051937844.db2.gz FHUIKIJXOOVFEK-IBGZPJMESA-N 1 0 323.436 4.443 20 10 DICDRO Cc1cc(Br)ccc1C[N@@H+](C)Cc1ccccc1O ZINC000768872876 1051974246 /nfs/dbraw/zinc/97/42/46/1051974246.db2.gz LHJOTVRAZZUDKN-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO C[N@H+](Cc1cccc(OC2CCCC2)c1)Cc1ccccc1O ZINC000768873600 1051974773 /nfs/dbraw/zinc/97/47/73/1051974773.db2.gz QSZQXMFOHQHMTD-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO COc1ccc2cc(C[N@H+](C)Cc3ccccc3O)ccc2c1 ZINC000768872206 1051975676 /nfs/dbraw/zinc/97/56/76/1051975676.db2.gz FRWIJURIRCEDLI-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccccn1 ZINC000768925964 1051981678 /nfs/dbraw/zinc/98/16/78/1051981678.db2.gz KBSBXXNXFUXMNW-UHFFFAOYSA-N 1 0 323.484 4.483 20 10 DICDRO CCOc1cccc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)c1O ZINC000768935596 1051983135 /nfs/dbraw/zinc/98/31/35/1051983135.db2.gz CZVXMCYNBXLBRZ-LJQANCHMSA-N 1 0 323.436 4.443 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)CCOCc2ccccc2)cc1C ZINC000808434229 1052032697 /nfs/dbraw/zinc/03/26/97/1052032697.db2.gz YXPZCHKYIHQKMC-KRWDZBQOSA-N 1 0 313.441 4.094 20 10 DICDRO c1coc([C@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)c1 ZINC000769389709 1052036791 /nfs/dbraw/zinc/03/67/91/1052036791.db2.gz NWYDHJZOKWJRHW-SFHVURJKSA-N 1 0 310.441 4.259 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCSC(F)(F)F)c1O ZINC000808678938 1052067380 /nfs/dbraw/zinc/06/73/80/1052067380.db2.gz YVEDCEOJBQOLPY-MRVPVSSYSA-N 1 0 313.772 4.258 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000769425102 1052043909 /nfs/dbraw/zinc/04/39/09/1052043909.db2.gz CUCBTFWZAWGZFE-QGZVFWFLSA-N 1 0 319.857 4.336 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000769428702 1052048245 /nfs/dbraw/zinc/04/82/45/1052048245.db2.gz REMYOSHEKOATQU-INIZCTEOSA-N 1 0 319.351 4.016 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c1O ZINC000808681203 1052058594 /nfs/dbraw/zinc/05/85/94/1052058594.db2.gz WTYWSBIORZFCOO-OLZOCXBDSA-N 1 0 319.832 4.258 20 10 DICDRO C[N@H+](CCCSCc1ccccc1)Cc1ccccc1O ZINC000761681844 1052060666 /nfs/dbraw/zinc/06/06/66/1052060666.db2.gz XZDFPWRCQXBJGR-UHFFFAOYSA-N 1 0 301.455 4.148 20 10 DICDRO CCn1nc(C)c(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c1C ZINC000808690206 1052060900 /nfs/dbraw/zinc/06/09/00/1052060900.db2.gz JZHYUUAKUZSGQN-NSHDSACASA-N 1 0 321.852 4.038 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)c2ccccc21 ZINC000808687379 1052060882 /nfs/dbraw/zinc/06/08/82/1052060882.db2.gz QKYCEMIQLIIIPV-QRWLVFNGSA-N 1 0 306.453 4.407 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cccc(N(C)C)c2)c1O ZINC000808692638 1052061676 /nfs/dbraw/zinc/06/16/76/1052061676.db2.gz SIJNQPDYVLAZDD-CYBMUJFWSA-N 1 0 318.848 4.271 20 10 DICDRO CCC[N@H+](Cc1c(O)cccc1Cl)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000769469719 1052064101 /nfs/dbraw/zinc/06/41/01/1052064101.db2.gz DDBJILIKSXJJPM-JCURWCKSSA-N 1 0 323.864 4.071 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccc(C)c(C)c2)C2CC2)c1O ZINC000769470737 1052064193 /nfs/dbraw/zinc/06/41/93/1052064193.db2.gz OLMDBNYLSUWZMO-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO COCc1ccccc1C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808674456 1052065113 /nfs/dbraw/zinc/06/51/13/1052065113.db2.gz SQQIUUZQKVGCNY-CYBMUJFWSA-N 1 0 319.832 4.351 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCSC(F)(F)F)c1O ZINC000808678939 1052067308 /nfs/dbraw/zinc/06/73/08/1052067308.db2.gz YVEDCEOJBQOLPY-QMMMGPOBSA-N 1 0 313.772 4.258 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCSC3(CCCCC3)C2)c1O ZINC000769501313 1052068072 /nfs/dbraw/zinc/06/80/72/1052068072.db2.gz ACPACSQMMUSVOQ-UHFFFAOYSA-N 1 0 321.486 4.043 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2cc3ccccc3o2)c(O)c1 ZINC000769497465 1052068479 /nfs/dbraw/zinc/06/84/79/1052068479.db2.gz FCKCZYWCQSOANF-UHFFFAOYSA-N 1 0 311.381 4.169 20 10 DICDRO Cc1cccc([C@H](O)C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808706201 1052068640 /nfs/dbraw/zinc/06/86/40/1052068640.db2.gz FDWQZQXLCXMFGV-CXAGYDPISA-N 1 0 319.832 4.047 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1O ZINC000769500418 1052069484 /nfs/dbraw/zinc/06/94/84/1052069484.db2.gz ZLBJVOUQTARION-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)c1O ZINC000808710285 1052070259 /nfs/dbraw/zinc/07/02/59/1052070259.db2.gz OTCKQUDQTWSONW-SNVBAGLBSA-N 1 0 311.212 4.253 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCc2ccccn2)c1O ZINC000808707879 1052071052 /nfs/dbraw/zinc/07/10/52/1052071052.db2.gz BOIDFZMGSCLNAH-CYBMUJFWSA-N 1 0 304.821 4.032 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)c1ccco1 ZINC000808713449 1052073156 /nfs/dbraw/zinc/07/31/56/1052073156.db2.gz NCXOEFAFDNRAIT-DOMZBBRYSA-N 1 0 323.820 4.375 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)c2cncc(F)c2)c1O ZINC000808712848 1052073897 /nfs/dbraw/zinc/07/38/97/1052073897.db2.gz IKMLUFSZOAQNCV-QWRGUYRKSA-N 1 0 308.784 4.300 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)c1ccco1 ZINC000808713451 1052074449 /nfs/dbraw/zinc/07/44/49/1052074449.db2.gz NCXOEFAFDNRAIT-IUODEOHRSA-N 1 0 323.820 4.375 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCOCC12CCCC2 ZINC000769531481 1052074874 /nfs/dbraw/zinc/07/48/74/1052074874.db2.gz BQBHCZMZORPOMO-UHFFFAOYSA-N 1 0 323.436 4.204 20 10 DICDRO COc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808714736 1052075905 /nfs/dbraw/zinc/07/59/05/1052075905.db2.gz BLIQTMJDAZZQBB-NEPJUHHUSA-N 1 0 320.820 4.169 20 10 DICDRO CCOC1CC(CC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000808716574 1052076424 /nfs/dbraw/zinc/07/64/24/1052076424.db2.gz ZMEFIJXGPDYBOM-OPFPJEHXSA-N 1 0 311.853 4.210 20 10 DICDRO Cc1cccc(CCC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)n1 ZINC000808717773 1052077795 /nfs/dbraw/zinc/07/77/95/1052077795.db2.gz HLGBMNRQNDLIGO-CQSZACIVSA-N 1 0 318.848 4.341 20 10 DICDRO CCOCC(C)(C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000808725468 1052081532 /nfs/dbraw/zinc/08/15/32/1052081532.db2.gz SNJIOFSSDWPIDV-QGZVFWFLSA-N 1 0 318.505 4.390 20 10 DICDRO C/C=C\C[C@H](CO)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000769992822 1052138811 /nfs/dbraw/zinc/13/88/11/1052138811.db2.gz DHOZSEWZONVOFE-VOSNQSNISA-N 1 0 316.489 4.045 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CCC[NH2+]CC1 ZINC001217996012 1052182465 /nfs/dbraw/zinc/18/24/65/1052182465.db2.gz UKWCZTFHECHOOD-YYZBOFOMSA-N 1 0 311.385 4.329 20 10 DICDRO C[C@@H]1CC[NH2+]C[C@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218043130 1052188071 /nfs/dbraw/zinc/18/80/71/1052188071.db2.gz FLQOHMNUFYSHHG-QCRUOMNUSA-N 1 0 311.385 4.184 20 10 DICDRO c1csc(/N=N/c2c(O[C@@H]3CC[NH2+]C3)ccc3ccccc32)n1 ZINC001218038153 1052188233 /nfs/dbraw/zinc/18/82/33/1052188233.db2.gz FWLMXINSBKERIH-NOFRPNMFSA-N 1 0 324.409 4.452 20 10 DICDRO C[C@H]1C[C@H](OC2=CC(=O)C=CC2=NNc2ccccc2)CC[NH2+]1 ZINC001218052304 1052190154 /nfs/dbraw/zinc/19/01/54/1052190154.db2.gz APTMYXYVSAJGFL-XJEBNATLSA-N 1 0 311.385 4.327 20 10 DICDRO C[C@H]1C[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)CC[NH2+]1 ZINC001218056837 1052190823 /nfs/dbraw/zinc/19/08/23/1052190823.db2.gz POUMOZZZJMVQGI-NBDPHERISA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CC[C@@]12CC[NH2+]C2 ZINC001218117428 1052199329 /nfs/dbraw/zinc/19/93/29/1052199329.db2.gz MYCPAJOPFIKPSG-NJOYMBDGSA-N 1 0 323.396 4.329 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@@H]3CCO[C@@]34CC[NH2+]C4)cc2)cc1 ZINC001218139552 1052200842 /nfs/dbraw/zinc/20/08/42/1052200842.db2.gz WFOGVDFTQWTBQZ-QSDHIIRHSA-N 1 0 323.396 4.002 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@H]3CCC4(C[NH2+]C4)C3)cc2)C=C1 ZINC001218237753 1052209548 /nfs/dbraw/zinc/20/95/48/1052209548.db2.gz KNQCJRNWRCZVDS-SFHVURJKSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1CCC2(C[NH2+]C2)C1 ZINC001218234813 1052210492 /nfs/dbraw/zinc/21/04/92/1052210492.db2.gz KYDOHRLFEZBFPX-OXBTWTFQSA-N 1 0 323.396 4.329 20 10 DICDRO Cc1ccc(O[C@@H]2C[C@@H]3C[NH2+]C[C@H]23)c(/N=N/c2ccccc2)c1 ZINC001218329828 1052226036 /nfs/dbraw/zinc/22/60/36/1052226036.db2.gz GUVSPKFBELMPNM-LUAKQJLXSA-N 1 0 307.397 4.397 20 10 DICDRO C[C@@H]1CC[C@H](Oc2ccccc2NN=C2C=CC=CC2=O)C[NH2+]1 ZINC001218404567 1052234922 /nfs/dbraw/zinc/23/49/22/1052234922.db2.gz JQJVPPBEHXOETG-XZQSZFKWSA-N 1 0 311.385 4.327 20 10 DICDRO C[C@H]1CC[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)C[NH2+]1 ZINC001218404562 1052234960 /nfs/dbraw/zinc/23/49/60/1052234960.db2.gz JQJVPPBEHXOETG-KYATVUERSA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1C[NH2+]CCC12CC2 ZINC001218405165 1052235066 /nfs/dbraw/zinc/23/50/66/1052235066.db2.gz NUJJULKRUAXXKA-VEGAHXMMSA-N 1 0 323.396 4.329 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2ccccc2Cl)c1 ZINC000315376572 1052336162 /nfs/dbraw/zinc/33/61/62/1052336162.db2.gz FYCCKABTLDTARV-STQMWFEESA-N 1 0 319.832 4.336 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@@H]3CCCc4sccc43)ccc21 ZINC000315716898 1052347816 /nfs/dbraw/zinc/34/78/16/1052347816.db2.gz MRRVXTNPZITNBP-QGZVFWFLSA-N 1 0 312.482 4.298 20 10 DICDRO COc1ccc(C[NH2+]CCC2CC(OC(C)(C)C)C2)cc1C ZINC000762456135 1052386198 /nfs/dbraw/zinc/38/61/98/1052386198.db2.gz LWDKPGBWMICXLL-UHFFFAOYSA-N 1 0 305.462 4.077 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(OC(F)F)c1)c1ccc(N(C)C)cc1 ZINC000089520334 1052393102 /nfs/dbraw/zinc/39/31/02/1052393102.db2.gz AKKZRXNWSNMEHY-ZDUSSCGKSA-N 1 0 320.383 4.205 20 10 DICDRO Cc1noc(C)c1[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000317676677 1052393779 /nfs/dbraw/zinc/39/37/79/1052393779.db2.gz PDHVYZXMDQRDDJ-UHIISALHSA-N 1 0 300.402 4.205 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C)cc(C)c2O)cc1 ZINC000915836417 1052501464 /nfs/dbraw/zinc/50/14/64/1052501464.db2.gz LOZKTLVRYSOABU-IBGZPJMESA-N 1 0 311.425 4.355 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc3c(cc2O)CCC3)cc1 ZINC000915836637 1052501542 /nfs/dbraw/zinc/50/15/42/1052501542.db2.gz QGSGTOAXKAYDQK-HXUWFJFHSA-N 1 0 323.436 4.227 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2ccc(Cl)cc2)c1 ZINC000915876449 1052525408 /nfs/dbraw/zinc/52/54/08/1052525408.db2.gz WEPWOHPLUSCZDJ-OLZOCXBDSA-N 1 0 319.832 4.336 20 10 DICDRO C[C@H]([NH2+]C[C@H](O)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000153873022 1052593179 /nfs/dbraw/zinc/59/31/79/1052593179.db2.gz ANBGMKBOKTXYRW-UWJYYQICSA-N 1 0 324.468 4.061 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000763388938 1052622192 /nfs/dbraw/zinc/62/21/92/1052622192.db2.gz CLTOQIWOBGJFBF-SFHVURJKSA-N 1 0 300.833 4.183 20 10 DICDRO CCC1CCC([NH2+]Cc2ccc(N3CCSCC3)cc2)CC1 ZINC000916835432 1052658022 /nfs/dbraw/zinc/65/80/22/1052658022.db2.gz CXCDUMSCBRCLTC-UHFFFAOYSA-N 1 0 318.530 4.298 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1F ZINC000917074760 1052691393 /nfs/dbraw/zinc/69/13/93/1052691393.db2.gz FUMBHZPRRBKRCN-UHFFFAOYSA-N 1 0 300.421 4.302 20 10 DICDRO c1ccc2c(c1)cccc2CC[NH2+]Cc1ccc2c(c1)CCO2 ZINC000917395014 1052723575 /nfs/dbraw/zinc/72/35/75/1052723575.db2.gz ZCCGUHQPABHPIZ-UHFFFAOYSA-N 1 0 303.405 4.107 20 10 DICDRO CC[N@H+](CCc1ccccc1)Cc1c(O)ccc2ccncc21 ZINC000917469509 1052730520 /nfs/dbraw/zinc/73/05/20/1052730520.db2.gz VGTCQMQAGRYBII-UHFFFAOYSA-N 1 0 306.409 4.005 20 10 DICDRO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)o1 ZINC000237668773 1053018534 /nfs/dbraw/zinc/01/85/34/1053018534.db2.gz OIUYJSHVWHPCEU-KBXCAEBGSA-N 1 0 310.441 4.075 20 10 DICDRO Cc1ccc2c(CC[NH2+]Cc3cc(C)c(C)cc3O)c[nH]c2c1 ZINC000237884537 1053035361 /nfs/dbraw/zinc/03/53/61/1053035361.db2.gz ASJNILWTEVETHW-UHFFFAOYSA-N 1 0 308.425 4.131 20 10 DICDRO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(F)ccc1O)CCC2 ZINC000180223005 1053049694 /nfs/dbraw/zinc/04/96/94/1053049694.db2.gz ICLVCMAPMLKHSL-AWEZNQCLSA-N 1 0 320.433 4.060 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000238108032 1053052094 /nfs/dbraw/zinc/05/20/94/1053052094.db2.gz JQDSEEQSLFAJTH-UHFFFAOYSA-N 1 0 319.404 4.261 20 10 DICDRO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2cccc(C)c2O)s1 ZINC000180406722 1053055317 /nfs/dbraw/zinc/05/53/17/1053055317.db2.gz ZITPJADUKRLUOS-ZDUSSCGKSA-N 1 0 304.459 4.221 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCCC3(CCCC3)CC2)c(O)c1 ZINC001474626495 1053067745 /nfs/dbraw/zinc/06/77/45/1053067745.db2.gz MYEZTGBRMFCUHW-UHFFFAOYSA-N 1 0 303.446 4.256 20 10 DICDRO C[NH+]1CCC(Oc2ccccc2NN=C2C=CC=CC2=O)CC1 ZINC001228418151 1053098161 /nfs/dbraw/zinc/09/81/61/1053098161.db2.gz FKXZAMDNRJMAEA-FMQUCBEESA-N 1 0 311.385 4.281 20 10 DICDRO COc1ccc(C2([NH2+]Cc3ccc(N4CCCC4)cc3)CC2)cc1 ZINC001318358604 1053163674 /nfs/dbraw/zinc/16/36/74/1053163674.db2.gz CWUIXNQEGSWOQC-UHFFFAOYSA-N 1 0 322.452 4.074 20 10 DICDRO CC(C)([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccc(F)c1 ZINC001319831063 1053277987 /nfs/dbraw/zinc/27/79/87/1053277987.db2.gz FQJBYKZRVURCPQ-UHFFFAOYSA-N 1 0 312.432 4.451 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1cccc(Cl)c1F ZINC001319952185 1053288914 /nfs/dbraw/zinc/28/89/14/1053288914.db2.gz YXGJBMOGUXRWJU-UHFFFAOYSA-N 1 0 300.160 4.128 20 10 DICDRO CSc1cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)ccn1 ZINC001320119060 1053308849 /nfs/dbraw/zinc/30/88/49/1053308849.db2.gz VWTUZBWRUKURHT-GXTWGEPZSA-N 1 0 314.454 4.156 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](CCO)C1CCCCC1 ZINC001320124816 1053308970 /nfs/dbraw/zinc/30/89/70/1053308970.db2.gz MOSRYFVXIFNIAF-PVAVHDDUSA-N 1 0 317.473 4.170 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CN(C)Cc2ccccc21 ZINC001320132224 1053310246 /nfs/dbraw/zinc/31/02/46/1053310246.db2.gz IUOHLIXNPARITI-ZTFGCOKTSA-N 1 0 322.452 4.025 20 10 DICDRO CCOCCC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC001320253756 1053320294 /nfs/dbraw/zinc/32/02/94/1053320294.db2.gz ZUAFNXKFAWOIMP-HOTGVXAUSA-N 1 0 317.473 4.435 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)C12CCC2 ZINC001320410467 1053330855 /nfs/dbraw/zinc/33/08/55/1053330855.db2.gz BSJWTMMZHSXVKV-HDEZJCGLSA-N 1 0 315.457 4.186 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC001320425063 1053333782 /nfs/dbraw/zinc/33/37/82/1053333782.db2.gz SLSKXWGGSSOUON-SCRDCRAPSA-N 1 0 316.470 4.407 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@]1(C)CCO[C@@H]1C1CC1 ZINC001320570298 1053346289 /nfs/dbraw/zinc/34/62/89/1053346289.db2.gz SDQDUSOKTVTVOP-CTNSEHHHSA-N 1 0 315.457 4.044 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCOc1ccccc1F ZINC001321024777 1053382836 /nfs/dbraw/zinc/38/28/36/1053382836.db2.gz VNKJLUDMNZMBLI-ZFWWWQNUSA-N 1 0 315.388 4.057 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCc1nc(C(C)(C)C)co1 ZINC001352774083 1053402871 /nfs/dbraw/zinc/40/28/71/1053402871.db2.gz GUEJERODKQVXOM-OLZOCXBDSA-N 1 0 314.429 4.324 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](C)c1c(F)cncc1F ZINC001322453019 1053507049 /nfs/dbraw/zinc/50/70/49/1053507049.db2.gz USQPVSRMPNGRCW-GYSYKLTISA-N 1 0 318.367 4.273 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCc1ccc(Cl)nc1 ZINC001323832258 1053604988 /nfs/dbraw/zinc/60/49/88/1053604988.db2.gz UZELXZVCLBBJMW-JSGCOSHPSA-N 1 0 316.832 4.130 20 10 DICDRO C[C@@H]([NH2+]CCc1csc(-c2ccccc2)n1)c1ccccc1O ZINC000183388694 1053649638 /nfs/dbraw/zinc/64/96/38/1053649638.db2.gz RTYTUJIUNZCMJD-CQSZACIVSA-N 1 0 324.449 4.409 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1nc(C(C)(C)C)cs1 ZINC001324543385 1053661639 /nfs/dbraw/zinc/66/16/39/1053661639.db2.gz SVGIMROBCSKFHV-WCQYABFASA-N 1 0 316.470 4.484 20 10 DICDRO C[C@H]([NH2+]C[C@H](O)c1ccc(C(C)(C)C)cc1)c1ccccc1O ZINC000183516892 1053670936 /nfs/dbraw/zinc/67/09/36/1053670936.db2.gz RICRNRKSLIBEGX-LIRRHRJNSA-N 1 0 313.441 4.074 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H](Cc2ccccc2)C2CC2)cc1 ZINC001200473124 1053687471 /nfs/dbraw/zinc/68/74/71/1053687471.db2.gz ZYOPBTVZTQESMA-AZYNXAEESA-N 1 0 320.480 4.377 20 10 DICDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCSC2(CCC2)CC1 ZINC001325243321 1053708123 /nfs/dbraw/zinc/70/81/23/1053708123.db2.gz YIZAOBYFUCCJGZ-UHFFFAOYSA-N 1 0 316.514 4.148 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2Cc3ccccc3C2)cc1C ZINC001200500866 1053709930 /nfs/dbraw/zinc/70/99/30/1053709930.db2.gz QXNPCBSARDGJKY-UHFFFAOYSA-N 1 0 309.453 4.288 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1CCOC(C)(C)C1 ZINC001325315732 1053713644 /nfs/dbraw/zinc/71/36/44/1053713644.db2.gz PDDHIUSBUDVIOS-RBSFLKMASA-N 1 0 303.446 4.044 20 10 DICDRO Cc1noc(C)c1CCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001325341673 1053715420 /nfs/dbraw/zinc/71/54/20/1053715420.db2.gz XXMADCUHIBCMBH-LRDDRELGSA-N 1 0 314.429 4.076 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CCCO[C@H]1C(C)C ZINC001325357589 1053716062 /nfs/dbraw/zinc/71/60/62/1053716062.db2.gz VHOPUGVLZPFXPX-DICRZQGBSA-N 1 0 317.473 4.290 20 10 DICDRO COc1ccc(Cl)cc1CC[NH2+][C@H](C)c1cc(C)ccc1O ZINC001325357560 1053717279 /nfs/dbraw/zinc/71/72/79/1053717279.db2.gz UKXHZJLEEJOGKT-CYBMUJFWSA-N 1 0 319.832 4.256 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CC(C)(C)c1cccnc1 ZINC001325582626 1053722880 /nfs/dbraw/zinc/72/28/80/1053722880.db2.gz RNHIMZXYSNKGAD-HOCLYGCPSA-N 1 0 310.441 4.211 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@H]3C[NH+]4CCC3CC4)cc2)C=C1 ZINC001231318733 1053725438 /nfs/dbraw/zinc/72/54/38/1053725438.db2.gz CKIOKCPLGOWRIP-IBGZPJMESA-N 1 0 323.396 4.281 20 10 DICDRO CC1CC[NH+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC001231466206 1053758101 /nfs/dbraw/zinc/75/81/01/1053758101.db2.gz OUYDYTYJHKMOMA-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C2(CC2)C1 ZINC001231470145 1053759324 /nfs/dbraw/zinc/75/93/24/1053759324.db2.gz PCXWFGDWIVVPFX-MRXNPFEDSA-N 1 0 323.436 4.346 20 10 DICDRO C[C@H]1CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001231466761 1053759391 /nfs/dbraw/zinc/75/93/91/1053759391.db2.gz VHBCVTZTIUTTRZ-INIZCTEOSA-N 1 0 311.425 4.203 20 10 DICDRO COc1cccc([C@H]2CCCC[N@@H+]2Cc2cccc(C)c2O)c1 ZINC001231593409 1053790897 /nfs/dbraw/zinc/79/08/97/1053790897.db2.gz WIMOMNUECPFVME-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCc2c(F)cccc2C1 ZINC001231591172 1053791767 /nfs/dbraw/zinc/79/17/67/1053791767.db2.gz WUJGABGMIIMXPA-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO COc1cccc([C@@H]2CCC[N@H+](Cc3cccc(C)c3O)C2)c1 ZINC001231594354 1053793558 /nfs/dbraw/zinc/79/35/58/1053793558.db2.gz FROCAVJUDYTGJD-QGZVFWFLSA-N 1 0 311.425 4.089 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H](F)C(F)(F)CC1 ZINC001231588801 1053794146 /nfs/dbraw/zinc/79/41/46/1053794146.db2.gz UQHDRHPEUVJFPK-INIZCTEOSA-N 1 0 309.331 4.115 20 10 DICDRO CCCC[N@H+](Cc1cccc2c[nH]nc21)Cc1ccccc1O ZINC001327191736 1053839943 /nfs/dbraw/zinc/83/99/43/1053839943.db2.gz WQODZMCHUPWJAR-UHFFFAOYSA-N 1 0 309.413 4.071 20 10 DICDRO CC[C@@H]([NH2+]C1CC2(CC2(F)F)C1)c1cc(Cl)ccc1O ZINC001327227827 1053843569 /nfs/dbraw/zinc/84/35/69/1053843569.db2.gz KCXZWYIFXMVIBL-KSGYAGIASA-N 1 0 301.764 4.274 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(Cl)c(O)c1 ZINC001231735657 1053844929 /nfs/dbraw/zinc/84/49/29/1053844929.db2.gz SKZMGGFTOJEATA-UHFFFAOYSA-N 1 0 318.848 4.134 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1ccc2ccccc2c1O ZINC000273392976 1053847100 /nfs/dbraw/zinc/84/71/00/1053847100.db2.gz LBXAQLVTQVPMDY-SCLBCKFNSA-N 1 0 321.424 4.007 20 10 DICDRO CSCC1(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001327269681 1053847543 /nfs/dbraw/zinc/84/75/43/1053847543.db2.gz ZTUAHHBPJQUHHI-KBPBESRZSA-N 1 0 305.487 4.372 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)c1ccc2ccccc2c1O ZINC000273392965 1053847868 /nfs/dbraw/zinc/84/78/68/1053847868.db2.gz LBXAQLVTQVPMDY-ACJLOTCBSA-N 1 0 321.424 4.007 20 10 DICDRO CC[C@H]([NH2+][C@H]1CC[C@H](OC)C1)c1ccc(C(F)(F)F)cc1O ZINC001327534004 1053862460 /nfs/dbraw/zinc/86/24/60/1053862460.db2.gz VHDXCCMCJNPPIM-OBJOEFQTSA-N 1 0 317.351 4.019 20 10 DICDRO CC(C)(C)Oc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)cc1 ZINC001231806017 1053863948 /nfs/dbraw/zinc/86/39/48/1053863948.db2.gz XJSCJDYVUJIEOM-UHFFFAOYSA-N 1 0 311.425 4.128 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@H+](C)Cc1ccc(C)c(C)c1 ZINC001231854251 1053889651 /nfs/dbraw/zinc/88/96/51/1053889651.db2.gz BRGARGUUUUSABF-UHFFFAOYSA-N 1 0 312.457 4.010 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccncc1 ZINC001200702987 1053907153 /nfs/dbraw/zinc/90/71/53/1053907153.db2.gz JRFZUEQDNWOMTH-FQEVSTJZSA-N 1 0 309.457 4.313 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(F)F)c1O ZINC001328102383 1053908067 /nfs/dbraw/zinc/90/80/67/1053908067.db2.gz DIZJDNDGSJJAGZ-ZDAZMGEQSA-N 1 0 301.764 4.048 20 10 DICDRO Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001232006005 1053936560 /nfs/dbraw/zinc/93/65/60/1053936560.db2.gz UYPXMNJHIQTIBE-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cncc(C)c2)cc1F ZINC000184351468 1053998771 /nfs/dbraw/zinc/99/87/71/1053998771.db2.gz LTJCPSLXNJMOJP-OAHLLOKOSA-N 1 0 315.436 4.226 20 10 DICDRO CCC(CC)(C[NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC001200819449 1054005121 /nfs/dbraw/zinc/00/51/21/1054005121.db2.gz BBCVACHARDLCGT-UHFFFAOYSA-N 1 0 309.453 4.469 20 10 DICDRO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(Cl)c(OC)cc1O ZINC001232269081 1054009700 /nfs/dbraw/zinc/00/97/00/1054009700.db2.gz QNVOOGHTGPKJNK-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1Cl ZINC001232269919 1054009981 /nfs/dbraw/zinc/00/99/81/1054009981.db2.gz NNVARGNOBHNLLC-OAHLLOKOSA-N 1 0 303.789 4.001 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1Cl ZINC001232269130 1054010305 /nfs/dbraw/zinc/01/03/05/1054010305.db2.gz WLZLBARDBPGKFV-HNNXBMFYSA-N 1 0 321.779 4.227 20 10 DICDRO C[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001200854735 1054043178 /nfs/dbraw/zinc/04/31/78/1054043178.db2.gz SNTYWKFUFBFZNN-GJZGRUSLSA-N 1 0 300.421 4.174 20 10 DICDRO C[C@]1(CC[NH2+]Cc2ccc(N3CCCC3)cc2)C[C@@]1(F)Cl ZINC001332612113 1054123958 /nfs/dbraw/zinc/12/39/58/1054123958.db2.gz XBHPKEOQYIUJLG-IRXDYDNUSA-N 1 0 310.844 4.081 20 10 DICDRO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(N(C)C)cc1O ZINC001232840531 1054127697 /nfs/dbraw/zinc/12/76/97/1054127697.db2.gz ZDLYSOURNAZSRQ-CYBMUJFWSA-N 1 0 318.848 4.305 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+][C@H]1CCCc2cccnc21 ZINC001332912658 1054131492 /nfs/dbraw/zinc/13/14/92/1054131492.db2.gz JWSMHBLCYRXXJE-CWRNSKLLSA-N 1 0 308.425 4.311 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000848561195 1054151641 /nfs/dbraw/zinc/15/16/41/1054151641.db2.gz WFRRABXZQMULMO-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC3(CCCC3)O2)c(O)c1C ZINC000848569560 1054156130 /nfs/dbraw/zinc/15/61/30/1054156130.db2.gz BHJOCQODCBLTIF-JKSUJKDBSA-N 1 0 303.446 4.151 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCC3(CCCC3)O2)c(O)c1 ZINC000848571104 1054156206 /nfs/dbraw/zinc/15/62/06/1054156206.db2.gz PNXJYSAJOMNXFY-HZPDHXFCSA-N 1 0 303.446 4.151 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC3(CCCC3)O2)c(O)c1 ZINC000848571105 1054156224 /nfs/dbraw/zinc/15/62/24/1054156224.db2.gz PNXJYSAJOMNXFY-JKSUJKDBSA-N 1 0 303.446 4.151 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1 ZINC000848575247 1054156328 /nfs/dbraw/zinc/15/63/28/1054156328.db2.gz MZUWWAYYCQJLSJ-LBPRGKRZSA-N 1 0 313.388 4.095 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2noc3ccccc32)c2c1c(F)ccc2O ZINC000848574208 1054157380 /nfs/dbraw/zinc/15/73/80/1054157380.db2.gz BYNHTOZWUOVBHZ-MFKMUULPSA-N 1 0 312.344 4.011 20 10 DICDRO C[C@H]([NH2+]Cc1noc2ccccc12)c1cc2c(cc1O)CCCC2 ZINC000848574781 1054158114 /nfs/dbraw/zinc/15/81/14/1054158114.db2.gz ICXJJRZVUKBVLK-ZDUSSCGKSA-N 1 0 322.408 4.263 20 10 DICDRO Oc1cc(C[NH+](C2CCCCC2)C2CCCCC2)cc(O)c1O ZINC001233010018 1054171536 /nfs/dbraw/zinc/17/15/36/1054171536.db2.gz HNRHIZQYBMEIGQ-UHFFFAOYSA-N 1 0 319.445 4.271 20 10 DICDRO C[C@H](c1cccc2ccccc21)[N@H+](C)Cc1cc(O)c(O)c(O)c1 ZINC001233014784 1054173891 /nfs/dbraw/zinc/17/38/91/1054173891.db2.gz BXKPISVEYPIZJQ-CYBMUJFWSA-N 1 0 323.392 4.150 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C1CC2(C1)COC(C)(C)C2 ZINC001334729880 1054195335 /nfs/dbraw/zinc/19/53/35/1054195335.db2.gz HKXGWGUJDVZRJX-MGVZARIASA-N 1 0 315.457 4.186 20 10 DICDRO COc1cccc(F)c1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC001334734288 1054197727 /nfs/dbraw/zinc/19/77/27/1054197727.db2.gz VUEQKGREJPQYSB-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO CC1(C)C[NH+](Cc2c(O)ccc3cc(Br)ccc32)C1 ZINC001233194437 1054198056 /nfs/dbraw/zinc/19/80/56/1054198056.db2.gz TYERDHUCWFIKDA-UHFFFAOYSA-N 1 0 320.230 4.150 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC001335523237 1054219177 /nfs/dbraw/zinc/21/91/77/1054219177.db2.gz UGXPBVAVJAVFCS-MDZLAQPJSA-N 1 0 302.443 4.365 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c1 ZINC001233283908 1054221033 /nfs/dbraw/zinc/22/10/33/1054221033.db2.gz AMMLGAWSMVKFKU-OAHLLOKOSA-N 1 0 315.379 4.259 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC(C(F)(F)F)CC2)c1 ZINC001233284267 1054222333 /nfs/dbraw/zinc/22/23/33/1054222333.db2.gz OAPMPSYRZAPNQA-UHFFFAOYSA-N 1 0 315.379 4.464 20 10 DICDRO COCC[C@@H]1CCCC[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233286363 1054225117 /nfs/dbraw/zinc/22/51/17/1054225117.db2.gz QKWAWALZCUBECP-KRWDZBQOSA-N 1 0 305.462 4.081 20 10 DICDRO CC[N@H+](Cc1ccc(C)cc1)Cc1cc(Cl)cc(OC)c1O ZINC001233290540 1054225639 /nfs/dbraw/zinc/22/56/39/1054225639.db2.gz IPZDRJUMXFLAEW-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO COc1cc(Cl)cc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1O ZINC001233287587 1054226469 /nfs/dbraw/zinc/22/64/69/1054226469.db2.gz YIUPQBXWFWBTTH-GFCCVEGCSA-N 1 0 317.816 4.174 20 10 DICDRO [O-]c1ccc(F)c(F)c1C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC001233334370 1054235804 /nfs/dbraw/zinc/23/58/04/1054235804.db2.gz DARLDDBOJNPKBH-AWEZNQCLSA-N 1 0 303.352 4.050 20 10 DICDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c([O-])ccc(F)c2F)cc1 ZINC001233334297 1054236411 /nfs/dbraw/zinc/23/64/11/1054236411.db2.gz AWWBBTTZADIJDF-MRXNPFEDSA-N 1 0 303.352 4.316 20 10 DICDRO [O-]c1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001233334590 1054236639 /nfs/dbraw/zinc/23/66/39/1054236639.db2.gz MOYSTQPVKYSEJF-OAHLLOKOSA-N 1 0 307.315 4.147 20 10 DICDRO CCSCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001337042066 1054255154 /nfs/dbraw/zinc/25/51/54/1054255154.db2.gz GRPBGAWQSADKRS-MRXNPFEDSA-N 1 0 306.519 4.250 20 10 DICDRO Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1ccc(N)cc1 ZINC001356083710 1054274045 /nfs/dbraw/zinc/27/40/45/1054274045.db2.gz YQVKVFMVINEDKH-CYBMUJFWSA-N 1 0 303.475 4.350 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001233454791 1054276497 /nfs/dbraw/zinc/27/64/97/1054276497.db2.gz KGQSQIGEILSWOL-OAHLLOKOSA-N 1 0 307.315 4.358 20 10 DICDRO C[N@H+](Cc1cccs1)Cc1ccc(C(F)(F)F)cc1O ZINC001233454066 1054276665 /nfs/dbraw/zinc/27/66/65/1054276665.db2.gz FSNMLVWKWBXZRD-UHFFFAOYSA-N 1 0 301.333 4.105 20 10 DICDRO C[N@H+](Cc1ccc2nc(Cl)ccc2c1)Cc1ccccc1O ZINC001233445361 1054277344 /nfs/dbraw/zinc/27/73/44/1054277344.db2.gz CAZXUONDEBRPGY-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO C[N@H+](Cc1ccsc1)Cc1ccc(C(F)(F)F)cc1O ZINC001233454171 1054277456 /nfs/dbraw/zinc/27/74/56/1054277456.db2.gz JIXSQTVWXZOUTD-UHFFFAOYSA-N 1 0 301.333 4.105 20 10 DICDRO C[C@H](c1cccc2ccccc21)[N@H+](C)Cc1cc(O)c(O)cc1O ZINC001233486991 1054279530 /nfs/dbraw/zinc/27/95/30/1054279530.db2.gz KQUFFGWNNVYCFZ-CYBMUJFWSA-N 1 0 323.392 4.150 20 10 DICDRO CCc1cccc(C[N@H+](CCC(F)(F)F)CC2CC2)c1O ZINC000848889524 1054285903 /nfs/dbraw/zinc/28/59/03/1054285903.db2.gz KMJOGILJXDJWQU-UHFFFAOYSA-N 1 0 301.352 4.119 20 10 DICDRO COc1cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)ccc1C ZINC001337786056 1054286241 /nfs/dbraw/zinc/28/62/41/1054286241.db2.gz UVAAHAARNJYYBN-GDBMZVCRSA-N 1 0 311.425 4.356 20 10 DICDRO CCC(CC)(CCO)C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001337785391 1054286399 /nfs/dbraw/zinc/28/63/99/1054286399.db2.gz LNJUXAOTVPVOJT-LSDHHAIUSA-N 1 0 305.462 4.027 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCOc3c(Cl)cccc32)c1O ZINC000848894577 1054288041 /nfs/dbraw/zinc/28/80/41/1054288041.db2.gz NKYAYPLNXVHSPN-INIZCTEOSA-N 1 0 317.816 4.221 20 10 DICDRO COc1cccc(F)c1C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC001337821435 1054288051 /nfs/dbraw/zinc/28/80/51/1054288051.db2.gz NKUQCQYCDKCKTA-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc(Cl)cn1 ZINC001337801420 1054288497 /nfs/dbraw/zinc/28/84/97/1054288497.db2.gz STPWLCCEEMBMGA-BXUZGUMPSA-N 1 0 302.805 4.087 20 10 DICDRO CCc1cccc(C[NH2+]Cc2cc(C)ccc2OC(F)F)c1O ZINC000848897068 1054290067 /nfs/dbraw/zinc/29/00/67/1054290067.db2.gz DLFZYVPBQRBRAO-UHFFFAOYSA-N 1 0 321.367 4.154 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCCOc3c(F)cccc32)c1O ZINC000848901229 1054290823 /nfs/dbraw/zinc/29/08/23/1054290823.db2.gz PXLWQGJARCBLJJ-KRWDZBQOSA-N 1 0 315.388 4.097 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCO[C@@H](C(CC)CC)C2)c1O ZINC000848901087 1054291896 /nfs/dbraw/zinc/29/18/96/1054291896.db2.gz OQRWDWZVCQUQHF-ZWKOTPCHSA-N 1 0 305.462 4.028 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](C)c2ccc3ncsc3c2)c1O ZINC000848903998 1054292466 /nfs/dbraw/zinc/29/24/66/1054292466.db2.gz IELLUXSOMNTGHB-LBPRGKRZSA-N 1 0 312.438 4.415 20 10 DICDRO CCc1cccc(C[N@@H+](Cc2ccc(C)nc2)CC2CC2)c1O ZINC000848919260 1054298971 /nfs/dbraw/zinc/29/89/71/1054298971.db2.gz INZFZPIUPWEDML-UHFFFAOYSA-N 1 0 310.441 4.070 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(Cl)c(F)c2)c1O ZINC001338250864 1054301015 /nfs/dbraw/zinc/30/10/15/1054301015.db2.gz VHTGOKDVUQAOCY-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2cccc(C(F)F)c2)cc1F ZINC001338641200 1054312764 /nfs/dbraw/zinc/31/27/64/1054312764.db2.gz GSIWGHUILMTTEP-UHFFFAOYSA-N 1 0 308.347 4.119 20 10 DICDRO Cc1cc(Br)cc([C@@H](C)[NH2+]CCCC(F)F)c1O ZINC001339193505 1054329719 /nfs/dbraw/zinc/32/97/19/1054329719.db2.gz JGXBTEBUMWRFFX-SECBINFHSA-N 1 0 322.193 4.159 20 10 DICDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)o1 ZINC001339510362 1054340296 /nfs/dbraw/zinc/34/02/96/1054340296.db2.gz UBVAGHONCCLCMN-MRXNPFEDSA-N 1 0 312.457 4.299 20 10 DICDRO CC[N@H+](Cc1cccc(OC(F)(F)F)c1O)C1CCCCC1 ZINC001233728160 1054345583 /nfs/dbraw/zinc/34/55/83/1054345583.db2.gz UASSCNHNBRUNIP-UHFFFAOYSA-N 1 0 317.351 4.445 20 10 DICDRO COc1cccc(C[NH2+][C@H]2c3ccccc3CCC[C@H]2C)c1O ZINC000185084723 1054352860 /nfs/dbraw/zinc/35/28/60/1054352860.db2.gz YZGAITMOWBCPNH-AUUYWEPGSA-N 1 0 311.425 4.204 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CCN(c3ccccc3)CC2)c(O)c1 ZINC000185104505 1054362152 /nfs/dbraw/zinc/36/21/52/1054362152.db2.gz CAMLENCNAKYGCC-INIZCTEOSA-N 1 0 310.441 4.020 20 10 DICDRO Cc1ccc([C@H](O)C[NH2+][C@H](C)c2ccc3ccccc3c2O)cc1 ZINC000185098984 1054366071 /nfs/dbraw/zinc/36/60/71/1054366071.db2.gz JIUBVHDXXLGHSI-FOIQADDNSA-N 1 0 321.420 4.238 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC1(c2ccccn2)CCC1 ZINC001340993251 1054373668 /nfs/dbraw/zinc/37/36/68/1054373668.db2.gz ZDQFNQAEPZDOAX-CVEARBPZSA-N 1 0 322.452 4.355 20 10 DICDRO CCc1cccc(NC(=[NH2+])NCc2ccc(N(CC)CC)cc2)c1 ZINC000849072511 1054374691 /nfs/dbraw/zinc/37/46/91/1054374691.db2.gz QUECSEQFRPIBIR-UHFFFAOYSA-N 1 0 324.472 4.232 20 10 DICDRO CCc1ccc(NC(=[NH2+])NCc2ccc(N(CC)CC)cc2)cc1 ZINC000849072504 1054375080 /nfs/dbraw/zinc/37/50/80/1054375080.db2.gz PDXJKFCXJDIVMJ-UHFFFAOYSA-N 1 0 324.472 4.232 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCCOCc2ccccc2)c(O)c1 ZINC001343917371 1054457389 /nfs/dbraw/zinc/45/73/89/1054457389.db2.gz UPTACVLRYQIFGT-KRWDZBQOSA-N 1 0 313.441 4.267 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1OC)c1ccccc1O ZINC000185213146 1054465972 /nfs/dbraw/zinc/46/59/72/1054465972.db2.gz NDWLTOOREGZBOV-WFASDCNBSA-N 1 0 303.377 4.342 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1OC)c1ccccc1O ZINC000185213160 1054466684 /nfs/dbraw/zinc/46/66/84/1054466684.db2.gz NDWLTOOREGZBOV-SWLSCSKDSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1nccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185346605 1054528649 /nfs/dbraw/zinc/52/86/49/1054528649.db2.gz JUFGAHDENBKBQO-LSDHHAIUSA-N 1 0 323.440 4.037 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2nc(C(C)(C)C)cs2)c1 ZINC000185373778 1054530642 /nfs/dbraw/zinc/53/06/42/1054530642.db2.gz LLRWFGCWLNGJAY-ZDUSSCGKSA-N 1 0 318.486 4.348 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3Cc4cccc(C)c4C3)c2c1 ZINC001234526078 1054542357 /nfs/dbraw/zinc/54/23/57/1054542357.db2.gz PZEIPKHSTFUTBE-UHFFFAOYSA-N 1 0 319.404 4.378 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CC[C@@H]4CCC[C@@H]4C3)c2c1 ZINC001234525451 1054543929 /nfs/dbraw/zinc/54/39/29/1054543929.db2.gz HZMIQYWCENPMIB-GOEBONIOSA-N 1 0 311.425 4.176 20 10 DICDRO CC[NH+]1CCN(c2ccc(O[C@@H](C)c3cccs3)cc2)CC1 ZINC001234657089 1054569110 /nfs/dbraw/zinc/56/91/10/1054569110.db2.gz AWVBAIWRFLLGOK-HNNXBMFYSA-N 1 0 316.470 4.030 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)c1 ZINC000185571228 1054582005 /nfs/dbraw/zinc/58/20/05/1054582005.db2.gz YSDDGTQUGZZDIS-CQSZACIVSA-N 1 0 308.381 4.206 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185566894 1054582397 /nfs/dbraw/zinc/58/23/97/1054582397.db2.gz IONOFHRGRCSGPR-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)Sc2ccccc2)c1 ZINC000185580603 1054586785 /nfs/dbraw/zinc/58/67/85/1054586785.db2.gz CTBPCYLYGXTKPW-ZIAGYGMSSA-N 1 0 317.454 4.232 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC000073052970 1054628361 /nfs/dbraw/zinc/62/83/61/1054628361.db2.gz VYHRYRLJRFHIEQ-FQEVSTJZSA-N 1 0 310.441 4.002 20 10 DICDRO C[N@H+](CCc1cccnc1)Cc1cccc(-c2ccccc2)c1O ZINC001234996619 1054637543 /nfs/dbraw/zinc/63/75/43/1054637543.db2.gz JRRNKLBQQYMKJS-UHFFFAOYSA-N 1 0 318.420 4.129 20 10 DICDRO C[N@@H+](Cc1cccc(-c2ccccc2)c1O)C[C@@H]1CCCCO1 ZINC001234993921 1054637953 /nfs/dbraw/zinc/63/79/53/1054637953.db2.gz CQAJUQVDDRQKPP-SFHVURJKSA-N 1 0 311.425 4.060 20 10 DICDRO Oc1c(C[NH+]2CCC(F)(F)CC2)cccc1-c1ccccc1 ZINC001234992444 1054638725 /nfs/dbraw/zinc/63/87/25/1054638725.db2.gz PALIOYHJINVWPB-UHFFFAOYSA-N 1 0 303.352 4.290 20 10 DICDRO C[N@H+](Cc1ccccn1)Cc1cccc(-c2ccccc2)c1O ZINC001234993195 1054638932 /nfs/dbraw/zinc/63/89/32/1054638932.db2.gz WLFIDRATHIQYOH-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO CO[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)[C@H](C)C1 ZINC001235000853 1054641213 /nfs/dbraw/zinc/64/12/13/1054641213.db2.gz QVMRIDZKQQUCEO-CRAIPNDOSA-N 1 0 311.425 4.059 20 10 DICDRO CC1(C)C[N@H+](Cc2cccc(-c3ccccc3)c2O)CCCO1 ZINC001234997461 1054641234 /nfs/dbraw/zinc/64/12/34/1054641234.db2.gz ZSMXNLFPGQHEIO-UHFFFAOYSA-N 1 0 311.425 4.060 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc2c(c1)CCCN2 ZINC001348855575 1054689228 /nfs/dbraw/zinc/68/92/28/1054689228.db2.gz GVCXZCTVFNMJDC-KBXCAEBGSA-N 1 0 322.452 4.397 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cc1F ZINC000921505261 1054726672 /nfs/dbraw/zinc/72/66/72/1054726672.db2.gz CWKXQLKZGPFGHK-ZDUSSCGKSA-N 1 0 315.388 4.010 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@H](O)c2ccc(F)cc2)c(O)c1 ZINC000185838661 1054734467 /nfs/dbraw/zinc/73/44/67/1054734467.db2.gz KJBPZMNJVAYOCC-GLJUWKHASA-N 1 0 317.404 4.003 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H]2c2nccs2)c(O)c1 ZINC001235677442 1054770168 /nfs/dbraw/zinc/77/01/68/1054770168.db2.gz DWRNLJIYNINKQX-HNNXBMFYSA-N 1 0 316.470 4.483 20 10 DICDRO C[N@H+](Cc1cccc(F)c1)Cc1ccc(C(C)(C)C)cc1O ZINC001235676788 1054771314 /nfs/dbraw/zinc/77/13/14/1054771314.db2.gz UXUBXWAOPCXEHG-UHFFFAOYSA-N 1 0 301.405 4.461 20 10 DICDRO CC(C)(C)c1ccc(C[NH+]2CCC(c3cccnc3)CC2)c(O)c1 ZINC001235679380 1054774666 /nfs/dbraw/zinc/77/46/66/1054774666.db2.gz OIARJLDQBVQJMV-UHFFFAOYSA-N 1 0 324.468 4.464 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)c(O)c1 ZINC001235683496 1054775698 /nfs/dbraw/zinc/77/56/98/1054775698.db2.gz GOFPGUUUOZDPJB-SFHVURJKSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccncc3)C2)c(O)c1 ZINC001235685969 1054776904 /nfs/dbraw/zinc/77/69/04/1054776904.db2.gz WEHPTDMUAFWKIC-MRXNPFEDSA-N 1 0 310.441 4.074 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc(C)cc(Cl)n1 ZINC001474123459 1054787077 /nfs/dbraw/zinc/78/70/77/1054787077.db2.gz XZMZANSFAFBDGH-UHFFFAOYSA-N 1 0 313.832 4.133 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3cnccc3c2)cc1 ZINC000785425010 1054863236 /nfs/dbraw/zinc/86/32/36/1054863236.db2.gz BOSXZSOGTHFCDG-UHFFFAOYSA-N 1 0 319.452 4.371 20 10 DICDRO Cc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccc3ccccc3c2O)c1 ZINC000186124669 1054956695 /nfs/dbraw/zinc/95/66/95/1054956695.db2.gz UQAUXJJXZDBCFQ-MGPUTAFESA-N 1 0 321.420 4.238 20 10 DICDRO Nc1ccc(C[N@H+](Cc2ccccc2)C2CCSCC2)cc1 ZINC001236268837 1055046218 /nfs/dbraw/zinc/04/62/18/1055046218.db2.gz HZZILHIMNUSONX-UHFFFAOYSA-N 1 0 312.482 4.167 20 10 DICDRO Nc1ccc(C2CC[NH+](Cc3c(O)cccc3Cl)CC2)cc1 ZINC001236335283 1055063349 /nfs/dbraw/zinc/06/33/49/1055063349.db2.gz NAKQRJGFUIGGMS-UHFFFAOYSA-N 1 0 316.832 4.007 20 10 DICDRO CC(C)OCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000764574439 1055212087 /nfs/dbraw/zinc/21/20/87/1055212087.db2.gz RVFHQJVTQCFBIM-MRXNPFEDSA-N 1 0 322.468 4.282 20 10 DICDRO Oc1c(CN([C@H]2CC[NH2+]C2)C2CCCCC2)ccc2ccccc21 ZINC001236652452 1055212232 /nfs/dbraw/zinc/21/22/32/1055212232.db2.gz HXXNZVNRAGNGJT-IBGZPJMESA-N 1 0 324.468 4.042 20 10 DICDRO COc1cc2ccccc2cc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001236679682 1055224370 /nfs/dbraw/zinc/22/43/70/1055224370.db2.gz LUEWPJJZCAGVLE-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(C)c(F)c1)c1ccc(N(C)C)cc1 ZINC000764739374 1055244302 /nfs/dbraw/zinc/24/43/02/1055244302.db2.gz UJZZSWVOOVGXBT-IBGZPJMESA-N 1 0 300.421 4.441 20 10 DICDRO CCC(CC)[N@H+](Cc1c([O-])cccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782077 1055255763 /nfs/dbraw/zinc/25/57/63/1055255763.db2.gz LTDXDKLTMATZSD-CTYIDZIISA-N 1 0 324.896 4.306 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2nc3ccccc3s2)c(O)c1 ZINC001236783269 1055258748 /nfs/dbraw/zinc/25/87/48/1055258748.db2.gz JMUTXOWMSIRIFU-UHFFFAOYSA-N 1 0 312.438 4.196 20 10 DICDRO CCc1ccc(C[N@H+](C)[C@H](C)Cc2ccccc2OC)c(O)c1 ZINC001236791243 1055261511 /nfs/dbraw/zinc/26/15/11/1055261511.db2.gz FNBUKIQBWSXZDH-OAHLLOKOSA-N 1 0 313.441 4.026 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC001236799642 1055266883 /nfs/dbraw/zinc/26/68/83/1055266883.db2.gz UJMNMYMOXPWSSA-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO COc1ccc(C[N@H+](C)C/C=C/c2ccccc2)c([O-])c1Cl ZINC001236807115 1055267259 /nfs/dbraw/zinc/26/72/59/1055267259.db2.gz MVMFDMZFTWHFNM-RMKNXTFCSA-N 1 0 317.816 4.199 20 10 DICDRO CC[N@H+](Cc1ccccc1F)Cc1ccc(OC)c(Cl)c1[O-] ZINC001236806840 1055268396 /nfs/dbraw/zinc/26/83/96/1055268396.db2.gz JTIWTKQOHOZNEE-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO COc1ccc(C[N@H+](C)CCc2cccc(C)c2)c([O-])c1Cl ZINC001236812117 1055270570 /nfs/dbraw/zinc/27/05/70/1055270570.db2.gz RQKFTSQGCIKTCS-UHFFFAOYSA-N 1 0 319.832 4.037 20 10 DICDRO COc1cc(O)c(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c(Cl)c1 ZINC001236809132 1055270666 /nfs/dbraw/zinc/27/06/66/1055270666.db2.gz SULIUYLKPOEJMY-LBPRGKRZSA-N 1 0 317.816 4.001 20 10 DICDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc3ccccc3cc2O)no1 ZINC001236827631 1055279346 /nfs/dbraw/zinc/27/93/46/1055279346.db2.gz VJQXKPSBRJKFKT-SFHVURJKSA-N 1 0 308.381 4.179 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CC[C@H](F)C(F)(F)CC1 ZINC001236825703 1055279785 /nfs/dbraw/zinc/27/97/85/1055279785.db2.gz CPVJHRRRMYXLMI-INIZCTEOSA-N 1 0 309.331 4.115 20 10 DICDRO CC1(C)C[N@H+](Cc2cc3ccccc3cc2O)CCC1(F)F ZINC001236826852 1055279910 /nfs/dbraw/zinc/27/99/10/1055279910.db2.gz OOASVDYFSJFLEI-UHFFFAOYSA-N 1 0 305.368 4.413 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCCc2ccccc2C1 ZINC001236830617 1055280786 /nfs/dbraw/zinc/28/07/86/1055280786.db2.gz BYFSBBJIOZRBJP-UHFFFAOYSA-N 1 0 303.405 4.494 20 10 DICDRO Oc1cc2ccccc2cc1C[NH+]1CCC(c2ccccn2)CC1 ZINC001236839422 1055287001 /nfs/dbraw/zinc/28/70/01/1055287001.db2.gz GAGNPOXMSSHMIU-UHFFFAOYSA-N 1 0 318.420 4.320 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@H]1Cc1ccccn1 ZINC001236842057 1055289256 /nfs/dbraw/zinc/28/92/56/1055289256.db2.gz SSVLEKWQPNHIFM-FQEVSTJZSA-N 1 0 318.420 4.148 20 10 DICDRO C[C@H](CSC(C)(C)C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000764903519 1055290388 /nfs/dbraw/zinc/29/03/88/1055290388.db2.gz VAQYZSWQMXDYAL-OAHLLOKOSA-N 1 0 306.519 4.297 20 10 DICDRO CC[C@H](Cc1cccs1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000764902750 1055290463 /nfs/dbraw/zinc/29/04/63/1055290463.db2.gz QCKDFNQTLGQOCN-QGZVFWFLSA-N 1 0 314.498 4.459 20 10 DICDRO CCC[N@H+](Cc1ccc(N2CCOCC2)cc1Cl)[C@@H](C)CC ZINC001236928465 1055319326 /nfs/dbraw/zinc/31/93/26/1055319326.db2.gz LUQSFSXJCLVRQL-HNNXBMFYSA-N 1 0 324.896 4.187 20 10 DICDRO C[N@H+](Cc1cncc(-c2ccc(F)cc2)c1)Cc1ccccc1O ZINC001237003240 1055335457 /nfs/dbraw/zinc/33/54/57/1055335457.db2.gz ZJOFFNXMLAYEIU-UHFFFAOYSA-N 1 0 322.383 4.225 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c(O)c1 ZINC001237040356 1055346112 /nfs/dbraw/zinc/34/61/12/1055346112.db2.gz BXRJBEQRHKVUMI-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO COc1cccc2c1C[N@H+](Cc1ccc(C(C)C)cc1O)CC2 ZINC001237044161 1055348442 /nfs/dbraw/zinc/34/84/42/1055348442.db2.gz BAXZUHAJUFUMOR-UHFFFAOYSA-N 1 0 311.425 4.083 20 10 DICDRO CCC[N@H+](CCc1ccccn1)Cc1ccc(C(C)C)cc1O ZINC001237048450 1055351756 /nfs/dbraw/zinc/35/17/56/1055351756.db2.gz GIBPQICDUDZRTO-UHFFFAOYSA-N 1 0 312.457 4.365 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)CCc2ccccc2F)c(O)c1 ZINC001237054965 1055352734 /nfs/dbraw/zinc/35/27/34/1055352734.db2.gz JVNFBJSSQKYLDY-UHFFFAOYSA-N 1 0 301.405 4.329 20 10 DICDRO CCCC[N@H+](CCC)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237056903 1055355439 /nfs/dbraw/zinc/35/54/39/1055355439.db2.gz POKQJPBNGAWRCT-UHFFFAOYSA-N 1 0 319.367 4.345 20 10 DICDRO CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765281042 1055355991 /nfs/dbraw/zinc/35/59/91/1055355991.db2.gz NBHWBCOHSQARCR-INIZCTEOSA-N 1 0 312.457 4.392 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)Cc2cccc(F)c2F)c(O)c1 ZINC001237054925 1055356238 /nfs/dbraw/zinc/35/62/38/1055356238.db2.gz ICCKLXJWFLGLBT-UHFFFAOYSA-N 1 0 305.368 4.426 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 ZINC000765301260 1055357989 /nfs/dbraw/zinc/35/79/89/1055357989.db2.gz TYXLQULYQXRTFX-KZNAEPCWSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 ZINC000765301261 1055358859 /nfs/dbraw/zinc/35/88/59/1055358859.db2.gz TYXLQULYQXRTFX-SQNIBIBYSA-N 1 0 316.489 4.000 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2COc3ccccc3C2)cc1 ZINC000765334665 1055364274 /nfs/dbraw/zinc/36/42/74/1055364274.db2.gz QQTAAZLQYGSNDQ-IAGOWNOFSA-N 1 0 324.468 4.045 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2COc3ccccc3C2)cc1 ZINC000765334666 1055364404 /nfs/dbraw/zinc/36/44/04/1055364404.db2.gz QQTAAZLQYGSNDQ-IRXDYDNUSA-N 1 0 324.468 4.045 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(O)cc1)c1ccc(N2CCCCC2)cc1 ZINC000765350502 1055372916 /nfs/dbraw/zinc/37/29/16/1055372916.db2.gz OXUKCMQTWAOXEM-KRWDZBQOSA-N 1 0 324.468 4.276 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[NH+]1C2CCCC1CCC2 ZINC001237114963 1055376882 /nfs/dbraw/zinc/37/68/82/1055376882.db2.gz QCUXUDRRJGNUGW-UHFFFAOYSA-N 1 0 315.335 4.198 20 10 DICDRO C[N@H+](Cc1cccc(F)c1)Cc1cc(C(F)(F)F)ccc1O ZINC001237138875 1055380215 /nfs/dbraw/zinc/38/02/15/1055380215.db2.gz ZPKOTTFURHTXML-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC001237140002 1055384046 /nfs/dbraw/zinc/38/40/46/1055384046.db2.gz SXPPPWIMZBMPOZ-HNNXBMFYSA-N 1 0 322.330 4.143 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1ccnc2c(Cl)cccc12 ZINC001237152432 1055386463 /nfs/dbraw/zinc/38/64/63/1055386463.db2.gz OQUGQVYIHCCVLI-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765480419 1055400860 /nfs/dbraw/zinc/40/08/60/1055400860.db2.gz MGFHRLVKEJZTIO-INIZCTEOSA-N 1 0 324.468 4.237 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccc(OC)c1 ZINC000765485695 1055403974 /nfs/dbraw/zinc/40/39/74/1055403974.db2.gz NGGOEPIYIZSNNF-HXUWFJFHSA-N 1 0 324.468 4.319 20 10 DICDRO Cc1cccc(C[NH+]2CCC3(CCNc4ccccc43)CC2)c1O ZINC001237321400 1055426148 /nfs/dbraw/zinc/42/61/48/1055426148.db2.gz WUPLKFGLJDTPHN-UHFFFAOYSA-N 1 0 322.452 4.050 20 10 DICDRO C[C@@H]([NH2+]C1(c2ccccc2F)CCC1)c1cc(F)ccc1O ZINC000842906404 1055434792 /nfs/dbraw/zinc/43/47/92/1055434792.db2.gz UGDXENZOVBXBTH-GFCCVEGCSA-N 1 0 303.352 4.400 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cnc(-c3ccccc3)o2)cc1 ZINC001237367262 1055441598 /nfs/dbraw/zinc/44/15/98/1055441598.db2.gz BYBPMTMNWHCURM-UHFFFAOYSA-N 1 0 321.424 4.040 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001237487673 1055458104 /nfs/dbraw/zinc/45/81/04/1055458104.db2.gz KCJISRQLTRZBIM-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cccc(O)c1C[N@H+](C)Cc1ccc(Br)cc1 ZINC001237489574 1055459401 /nfs/dbraw/zinc/45/94/01/1055459401.db2.gz IULYFFJVRVYRKD-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001237489421 1055459823 /nfs/dbraw/zinc/45/98/23/1055459823.db2.gz HJAAEHZTDGGFCV-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1c(C)cccc1O ZINC001237494789 1055461810 /nfs/dbraw/zinc/46/18/10/1055461810.db2.gz LLJBRSVMTRJSEI-GOSISDBHSA-N 1 0 311.425 4.184 20 10 DICDRO C[N@H+](Cc1ccccn1)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237641088 1055490925 /nfs/dbraw/zinc/49/09/25/1055490925.db2.gz LLTZLAUVCZWSLQ-UHFFFAOYSA-N 1 0 322.383 4.225 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[NH+]1CCC(F)(F)CC1 ZINC001237640443 1055491329 /nfs/dbraw/zinc/49/13/29/1055491329.db2.gz BNKBHNWFFLTDAB-UHFFFAOYSA-N 1 0 321.342 4.429 20 10 DICDRO Cc1ccnc2cccc(C[N@@H+](C)Cc3ccc(N(C)C)cc3)c12 ZINC001237635995 1055491697 /nfs/dbraw/zinc/49/16/97/1055491697.db2.gz LCZLYTSVEDXHFO-UHFFFAOYSA-N 1 0 319.452 4.241 20 10 DICDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1c(O)cccc1Cl)CCC2 ZINC001620867643 1055493917 /nfs/dbraw/zinc/49/39/17/1055493917.db2.gz VKHZNGYQFVFRFT-KRWDZBQOSA-N 1 0 317.816 4.221 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCC[C@@H](CF)C1 ZINC001237647281 1055495158 /nfs/dbraw/zinc/49/51/58/1055495158.db2.gz SWZZAKRPUSYXGW-AWEZNQCLSA-N 1 0 317.379 4.380 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)C2CCCCC2)cc1Br ZINC001237677863 1055503716 /nfs/dbraw/zinc/50/37/16/1055503716.db2.gz QRSISTVRDKZHKV-UHFFFAOYSA-N 1 0 312.251 4.228 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(OC)ccc1C ZINC001237716381 1055512185 /nfs/dbraw/zinc/51/21/85/1055512185.db2.gz URRBSWSDFZLECK-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)CCCO2 ZINC000765609985 1055512592 /nfs/dbraw/zinc/51/25/92/1055512592.db2.gz SVYSHMGQXDBOFO-IBGZPJMESA-N 1 0 323.436 4.242 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCc1ccc(F)c(F)c1 ZINC001620904907 1055529056 /nfs/dbraw/zinc/52/90/56/1055529056.db2.gz UZPHODPTHQREJB-UHFFFAOYSA-N 1 0 314.379 4.097 20 10 DICDRO CCCCC[C@@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000765637256 1055531570 /nfs/dbraw/zinc/53/15/70/1055531570.db2.gz ANFCHOVLHDHCLN-MRXNPFEDSA-N 1 0 304.478 4.222 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CSC2(C)C)cc1 ZINC001620911427 1055536010 /nfs/dbraw/zinc/53/60/10/1055536010.db2.gz JFWXYZDVUAMPFW-QGZVFWFLSA-N 1 0 306.519 4.297 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CSC2(C)C)cc1 ZINC001620911426 1055536077 /nfs/dbraw/zinc/53/60/77/1055536077.db2.gz JFWXYZDVUAMPFW-KRWDZBQOSA-N 1 0 306.519 4.297 20 10 DICDRO C[N@H+](Cc1ccccc1Cl)Cc1cc(F)cc(Cl)c1[O-] ZINC001237815358 1055536569 /nfs/dbraw/zinc/53/65/69/1055536569.db2.gz XERQCJRUNQQSHJ-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001237950623 1055563851 /nfs/dbraw/zinc/56/38/51/1055563851.db2.gz YNJKZQRQYJYHSB-GFCCVEGCSA-N 1 0 323.770 4.313 20 10 DICDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001237941611 1055564953 /nfs/dbraw/zinc/56/49/53/1055564953.db2.gz ZFQPLXSUBNWIIE-TXEJJXNPSA-N 1 0 317.791 4.271 20 10 DICDRO Cc1sccc1C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001237970086 1055568233 /nfs/dbraw/zinc/56/82/33/1055568233.db2.gz GGGVGLJBGPQLLG-UHFFFAOYSA-N 1 0 300.471 4.289 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c1O ZINC001238060417 1055597040 /nfs/dbraw/zinc/59/70/40/1055597040.db2.gz APSUHIYRUHEDQM-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1O ZINC001238065773 1055597962 /nfs/dbraw/zinc/59/79/62/1055597962.db2.gz FEHVNXMPJMHXHN-QGZVFWFLSA-N 1 0 321.342 4.455 20 10 DICDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(F)cc(C)c1O ZINC001238071136 1055601745 /nfs/dbraw/zinc/60/17/45/1055601745.db2.gz SSZQSJAIXGMSOH-CYBMUJFWSA-N 1 0 303.377 4.041 20 10 DICDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(F)cc(C)c2O)c1 ZINC001238071404 1055601946 /nfs/dbraw/zinc/60/19/46/1055601946.db2.gz WTKCTAPSFWJFGT-SFHVURJKSA-N 1 0 315.388 4.185 20 10 DICDRO C[N@H+](Cc1cccc(-c2cccs2)n1)Cc1ccccc1O ZINC001238214080 1055623505 /nfs/dbraw/zinc/62/35/05/1055623505.db2.gz TYERKMSNPJWHGH-UHFFFAOYSA-N 1 0 310.422 4.148 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2ccccc2O)c(Cl)c1 ZINC001238403430 1055653445 /nfs/dbraw/zinc/65/34/45/1055653445.db2.gz OURRZIFXTKRVDF-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Cc1cc(F)cc(CN2CCc3cccc(O)c3C2)c1Cl ZINC001238784395 1055749858 /nfs/dbraw/zinc/74/98/58/1055749858.db2.gz PGSNFJIMGSRSQH-UHFFFAOYSA-N 1 0 305.780 4.051 20 10 DICDRO CC[C@H]([NH2+][C@H](C)Cc1ccc(O)cc1)c1ccc(N(C)C)cc1 ZINC000765770043 1055915027 /nfs/dbraw/zinc/91/50/27/1055915027.db2.gz VMMDBUJKNZTSTF-QRWLVFNGSA-N 1 0 312.457 4.130 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C(C)(C)c1ccccc1 ZINC001620765433 1055935105 /nfs/dbraw/zinc/93/51/05/1055935105.db2.gz DQUPHVVXGUVSBQ-HNNXBMFYSA-N 1 0 314.448 4.348 20 10 DICDRO CCCOc1ccc(C[NH2+]CCc2ncc(C)cc2C)cc1C ZINC001620987463 1055960734 /nfs/dbraw/zinc/96/07/34/1055960734.db2.gz WOLJIAPDPJEFDD-UHFFFAOYSA-N 1 0 312.457 4.128 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H]3CCC[C@H](C(C)C)C3)C2)cc1 ZINC001621001526 1055968739 /nfs/dbraw/zinc/96/87/39/1055968739.db2.gz PLQFXAFAZMYXCX-BZSNNMDCSA-N 1 0 316.489 4.078 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H]3CCC[C@@H](C(C)C)C3)C2)cc1 ZINC001621001529 1055969471 /nfs/dbraw/zinc/96/94/71/1055969471.db2.gz PLQFXAFAZMYXCX-SQNIBIBYSA-N 1 0 316.489 4.078 20 10 DICDRO CCc1cccc2c(CC[NH2+]Cc3ccc(OC)c(C)c3)c[nH]c21 ZINC001620795854 1055975194 /nfs/dbraw/zinc/97/51/94/1055975194.db2.gz RHYAABZKGBGIHH-UHFFFAOYSA-N 1 0 322.452 4.380 20 10 DICDRO C[C@H]1CCCC[C@@H]1CC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001620796534 1055975234 /nfs/dbraw/zinc/97/52/34/1055975234.db2.gz MZMWXNHXOJKJDX-UONOGXRCSA-N 1 0 310.432 4.337 20 10 DICDRO CCCOc1ccc(C[NH2+]CC[C@@H]2CC2(Cl)Cl)cc1C ZINC001621015320 1055981000 /nfs/dbraw/zinc/98/10/00/1055981000.db2.gz VBTGUHLDFKRPKA-CQSZACIVSA-N 1 0 316.272 4.457 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCCC23CC3)cc1F ZINC001621025136 1055991469 /nfs/dbraw/zinc/99/14/69/1055991469.db2.gz BGPJTBUWNYPAHL-MRXNPFEDSA-N 1 0 304.453 4.342 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H](C)Oc1ccc(C)cc1 ZINC001620815195 1056009463 /nfs/dbraw/zinc/00/94/63/1056009463.db2.gz PBDIFQFKLXIGHM-INIZCTEOSA-N 1 0 322.452 4.352 20 10 DICDRO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)CCC2 ZINC000765817534 1056178521 /nfs/dbraw/zinc/17/85/21/1056178521.db2.gz LWJKUBQABYKNFI-WBMJQRKESA-N 1 0 317.408 4.037 20 10 DICDRO C[C@@H]([NH2+]CCOCC1CC1)c1ccc(N2CCCCCC2)cc1 ZINC000765864624 1056346778 /nfs/dbraw/zinc/34/67/78/1056346778.db2.gz AXOUQFIVLSFICR-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO CN(C)c1ccc(C[N@H+](C[C@@H]2CCC(F)(F)C2)C2CC2)cc1 ZINC001615219671 1056478142 /nfs/dbraw/zinc/47/81/42/1056478142.db2.gz PHFYKYLAWOQPIT-OAHLLOKOSA-N 1 0 308.416 4.152 20 10 DICDRO CCC[C@](C)(O)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765939338 1056525406 /nfs/dbraw/zinc/52/54/06/1056525406.db2.gz AGUGSRAKOGMSHC-PXNSSMCTSA-N 1 0 318.505 4.269 20 10 DICDRO CCC[C@@](C)(O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765941266 1056531597 /nfs/dbraw/zinc/53/15/97/1056531597.db2.gz GHOWDWMDOGTXKW-HNAYVOBHSA-N 1 0 322.468 4.018 20 10 DICDRO C[C@@H]([NH2+]CCc1ccsc1)c1cc2c(cc1O)CCCC2 ZINC000756379106 1056613305 /nfs/dbraw/zinc/61/33/05/1056613305.db2.gz LJUVGTIZLNNWBU-CYBMUJFWSA-N 1 0 301.455 4.226 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@@H](C)C[C@H]3C)CC2)cc1 ZINC000765959842 1056651615 /nfs/dbraw/zinc/65/16/15/1056651615.db2.gz SIDVQZWANYQQOQ-JXXFODFXSA-N 1 0 316.489 4.078 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(OC(C)(C)C)nc2)c(O)c1 ZINC000186507698 1056763974 /nfs/dbraw/zinc/76/39/74/1056763974.db2.gz DAMXISLNFSTXPQ-AWEZNQCLSA-N 1 0 314.429 4.124 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c(OCC2CC2)c1 ZINC001620833618 1056766254 /nfs/dbraw/zinc/76/62/54/1056766254.db2.gz AFWREKFPKFMZLI-UHFFFAOYSA-N 1 0 323.436 4.009 20 10 DICDRO CCCC[N@H+](CCOCC1CCCC1)Cc1ccccc1O ZINC001617538888 1056846461 /nfs/dbraw/zinc/84/64/61/1056846461.db2.gz OQSSVHQNSRUCNE-UHFFFAOYSA-N 1 0 305.462 4.201 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1cc2cnccc2o1 ZINC000922320584 1057006186 /nfs/dbraw/zinc/00/61/86/1057006186.db2.gz LXOOKLWYERWMFK-ZDUSSCGKSA-N 1 0 308.381 4.004 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCC[C@H](C2CCOCC2)C1)c1ccccc1O ZINC000922330516 1057010087 /nfs/dbraw/zinc/01/00/87/1057010087.db2.gz YLBSKYABIULNGF-HYVNUMGLSA-N 1 0 303.446 4.028 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@@H](C2CCOCC2)C1)c1ccccc1O ZINC000922330519 1057010098 /nfs/dbraw/zinc/01/00/98/1057010098.db2.gz YLBSKYABIULNGF-UAGQMJEPSA-N 1 0 303.446 4.028 20 10 DICDRO CC(C)OCCCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000186530037 1057024824 /nfs/dbraw/zinc/02/48/24/1057024824.db2.gz DDRAHDVJXXKVNX-HNNXBMFYSA-N 1 0 305.462 4.127 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](c2ccccn2)C2CC2)cc1C ZINC000922583613 1057034894 /nfs/dbraw/zinc/03/48/94/1057034894.db2.gz ZBGSROMUPYHZQC-FQEVSTJZSA-N 1 0 310.441 4.420 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)c2nc(C)cs2)cc1 ZINC000186575580 1057057810 /nfs/dbraw/zinc/05/78/10/1057057810.db2.gz GUGLUIUNYMPCGO-HIFRSBDPSA-N 1 0 317.502 4.362 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2)c1nccs1 ZINC000186740332 1057106762 /nfs/dbraw/zinc/10/67/62/1057106762.db2.gz IRYSMMLKDQLZFZ-CHWSQXEVSA-N 1 0 316.470 4.182 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1ncc(C)s1)c1ccc(N(C)C)cc1 ZINC000186772612 1057121797 /nfs/dbraw/zinc/12/17/97/1057121797.db2.gz PWIRPYQLBUVAJH-DYVFJYSZSA-N 1 0 317.502 4.362 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1cc2c(s1)CCC2 ZINC000766028359 1057127449 /nfs/dbraw/zinc/12/74/49/1057127449.db2.gz DROGMKYHJWFHHK-AWEZNQCLSA-N 1 0 314.498 4.462 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccc(OC)cc1 ZINC000766028813 1057127546 /nfs/dbraw/zinc/12/75/46/1057127546.db2.gz GTBOAMIYHVLEDW-HXUWFJFHSA-N 1 0 312.457 4.311 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccc(OC)cc1 ZINC000766028811 1057127665 /nfs/dbraw/zinc/12/76/65/1057127665.db2.gz GTBOAMIYHVLEDW-FQEVSTJZSA-N 1 0 312.457 4.311 20 10 DICDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)CCC2 ZINC000766030695 1057131748 /nfs/dbraw/zinc/13/17/48/1057131748.db2.gz WGMQRXVIINMRJQ-OAQYLSRUSA-N 1 0 324.468 4.237 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC(C)(C)Cc2occc21 ZINC000766031002 1057135067 /nfs/dbraw/zinc/13/50/67/1057135067.db2.gz YOJNKRPTOZTCIG-GOSISDBHSA-N 1 0 312.457 4.457 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CCCCC1 ZINC000186883959 1057143593 /nfs/dbraw/zinc/14/35/93/1057143593.db2.gz ONYCFZRUCUVWDF-AWEZNQCLSA-N 1 0 309.425 4.169 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+]CCCSc2nccs2)cc1 ZINC000766071745 1057284996 /nfs/dbraw/zinc/28/49/96/1057284996.db2.gz NROCPHUAEMSPHG-CYBMUJFWSA-N 1 0 322.499 4.375 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766073624 1057286000 /nfs/dbraw/zinc/28/60/00/1057286000.db2.gz RSADJHJFIIMMFH-IEZWGBDMSA-N 1 0 318.505 4.245 20 10 DICDRO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCCSc1nccs1 ZINC000766072754 1057286161 /nfs/dbraw/zinc/28/61/61/1057286161.db2.gz MPISEVWQFJDBBV-DOMZBBRYSA-N 1 0 304.484 4.148 20 10 DICDRO CC[C@@H](COC)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766093065 1057323104 /nfs/dbraw/zinc/32/31/04/1057323104.db2.gz GZRJJXFXPLSYJH-WMZOPIPTSA-N 1 0 304.478 4.143 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1)CCCC2 ZINC000766119621 1057352023 /nfs/dbraw/zinc/35/20/23/1057352023.db2.gz QJNQRHKAFWSIRQ-GFCCVEGCSA-N 1 0 313.363 4.045 20 10 DICDRO CC(C)([NH2+]Cc1c(O)cccc1Br)c1ccccc1 ZINC000706828424 1057481464 /nfs/dbraw/zinc/48/14/64/1057481464.db2.gz CSPULQSTAWNYFU-UHFFFAOYSA-N 1 0 320.230 4.180 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccc(Br)cc2)c1O ZINC000709510395 1057502219 /nfs/dbraw/zinc/50/22/19/1057502219.db2.gz ZRAYRRIFNQPWMW-UHFFFAOYSA-N 1 0 320.230 4.007 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)C ZINC000766164015 1057529780 /nfs/dbraw/zinc/52/97/80/1057529780.db2.gz WPQSWFDGXDLJFE-QAPCUYQASA-N 1 0 322.468 4.138 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000074230516 1057553562 /nfs/dbraw/zinc/55/35/62/1057553562.db2.gz BFPKWVBPPMJCSE-CYBMUJFWSA-N 1 0 320.383 4.205 20 10 DICDRO C[C@H](C[N@H+](C)Cc1c(O)ccc2ccncc21)c1ccccc1 ZINC000727427284 1057654250 /nfs/dbraw/zinc/65/42/50/1057654250.db2.gz GGLHMUDREYFRSR-OAHLLOKOSA-N 1 0 306.409 4.176 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCCC[C@H]2C)ccc1OC ZINC000727468591 1057655730 /nfs/dbraw/zinc/65/57/30/1057655730.db2.gz TWEQFSQLKFOZSK-WBVHZDCISA-N 1 0 305.462 4.148 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CCCC[C@H]2C)ccc1OC ZINC000727468589 1057655838 /nfs/dbraw/zinc/65/58/38/1057655838.db2.gz TWEQFSQLKFOZSK-NVXWUHKLSA-N 1 0 305.462 4.148 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000727825930 1057675727 /nfs/dbraw/zinc/67/57/27/1057675727.db2.gz CUCPATVBIJVHIF-LJQANCHMSA-N 1 0 323.436 4.227 20 10 DICDRO Oc1ccc2ccncc2c1C[N@H+](CC1CC1)C1CCCCC1 ZINC000727824494 1057677382 /nfs/dbraw/zinc/67/73/82/1057677382.db2.gz QNBUKCWMLCHCRQ-UHFFFAOYSA-N 1 0 310.441 4.485 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CC[C@H](c4ccco4)C3)c2c1 ZINC000732181091 1057769490 /nfs/dbraw/zinc/76/94/90/1057769490.db2.gz GOJOBTWRRCFCKJ-HNNXBMFYSA-N 1 0 323.392 4.137 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC000732204492 1057770893 /nfs/dbraw/zinc/77/08/93/1057770893.db2.gz LIIGFVBZANNDKT-UHFFFAOYSA-N 1 0 323.436 4.272 20 10 DICDRO Cc1ccc(SCC[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000733322901 1057812308 /nfs/dbraw/zinc/81/23/08/1057812308.db2.gz WZXUCYGCRHRFQE-UHFFFAOYSA-N 1 0 307.846 4.236 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1 ZINC000733325997 1057812733 /nfs/dbraw/zinc/81/27/33/1057812733.db2.gz CIYUQKMRPQQILW-KRWDZBQOSA-N 1 0 304.384 4.272 20 10 DICDRO CC[C@](C)([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1 ZINC000733327656 1057813557 /nfs/dbraw/zinc/81/35/57/1057813557.db2.gz ANQWYBSEIYYTGL-IBGZPJMESA-N 1 0 300.421 4.307 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC1(Sc2ccccc2)CC1 ZINC000733328616 1057813574 /nfs/dbraw/zinc/81/35/74/1057813574.db2.gz WODFBBQMQJEICO-UHFFFAOYSA-N 1 0 319.857 4.460 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(-c3ccccc3F)o2)c1 ZINC000733327274 1057813617 /nfs/dbraw/zinc/81/36/17/1057813617.db2.gz OYIXWFOLNBXGKH-UHFFFAOYSA-N 1 0 311.356 4.390 20 10 DICDRO Cc1cccc2[nH]cc(CC[NH2+]Cc3c(O)cccc3Cl)c21 ZINC000733327374 1057814009 /nfs/dbraw/zinc/81/40/09/1057814009.db2.gz UJYAYBATAAQKIW-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)ccc1OC ZINC000733327968 1057814051 /nfs/dbraw/zinc/81/40/51/1057814051.db2.gz NSSPBKXGLSHGTJ-IIDMSEBBSA-N 1 0 305.462 4.146 20 10 DICDRO CCOc1cccc(C[NH2+]C2CC(C)(c3ccccc3)C2)c1O ZINC000733326517 1057814061 /nfs/dbraw/zinc/81/40/61/1057814061.db2.gz HXJUHBUMDVBGHA-UHFFFAOYSA-N 1 0 311.425 4.001 20 10 DICDRO Nc1ccc(C[NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)cc1 ZINC001246168018 1058711734 /nfs/dbraw/zinc/71/17/34/1058711734.db2.gz CHSBDOWVJZYQIN-OAHLLOKOSA-N 1 0 321.251 4.223 20 10 DICDRO COc1ccc(N2CCC[N@H+](CCC3=CCCCC3)CC2)cc1 ZINC001559492277 1059268981 /nfs/dbraw/zinc/26/89/81/1059268981.db2.gz KVFQKLPVGBSSKW-UHFFFAOYSA-N 1 0 314.473 4.098 20 10 DICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCC2(CCC2)O1 ZINC001559492582 1059271021 /nfs/dbraw/zinc/27/10/21/1059271021.db2.gz VQPZLZZPZMBRTR-LJQANCHMSA-N 1 0 316.489 4.065 20 10 DICDRO Cc1cc(C[N@H+](C)CCC(F)(F)F)ccc1N1CCCCC1 ZINC001559512013 1059307489 /nfs/dbraw/zinc/30/74/89/1059307489.db2.gz LJFOIYDWRDKFNW-UHFFFAOYSA-N 1 0 314.395 4.370 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)CC[C@H]1c1ccccc1 ZINC001559565164 1059392241 /nfs/dbraw/zinc/39/22/41/1059392241.db2.gz GFNTWWQOYUUEJG-LAUBAEHRSA-N 1 0 308.469 4.378 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)CC[C@H]1c1ccccc1 ZINC001559565163 1059394539 /nfs/dbraw/zinc/39/45/39/1059394539.db2.gz GFNTWWQOYUUEJG-DYESRHJHSA-N 1 0 308.469 4.378 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H]2CCC(C)(C)C[C@H]2C)c1O ZINC001559775338 1059613170 /nfs/dbraw/zinc/61/31/70/1059613170.db2.gz JSLKWZXBGQPQQI-BZNIZROVSA-N 1 0 307.409 4.038 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2c(F)cccc2Cl)cc1 ZINC001560297388 1060081585 /nfs/dbraw/zinc/08/15/85/1060081585.db2.gz BNUWWPRPKAAXHU-SNAWJCMRSA-N 1 0 318.823 4.348 20 10 DICDRO CC(C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC001560296890 1060081705 /nfs/dbraw/zinc/08/17/05/1060081705.db2.gz NAXCTZJPAYZWFU-PKOBYXMFSA-N 1 0 300.490 4.373 20 10 DICDRO CCOc1ccccc1CC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001560322642 1060109371 /nfs/dbraw/zinc/10/93/71/1060109371.db2.gz NPAFRLVPIOFJOD-UHFFFAOYSA-N 1 0 319.832 4.085 20 10 DICDRO Cc1nc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)sc1C ZINC001560353925 1060139944 /nfs/dbraw/zinc/13/99/44/1060139944.db2.gz AITLNBZREYXIGU-UHFFFAOYSA-N 1 0 315.486 4.040 20 10 DICDRO CC[C@@H](C[NH2+]Cc1c(O)cccc1Cl)Oc1ccccc1C ZINC001560357066 1060141980 /nfs/dbraw/zinc/14/19/80/1060141980.db2.gz DNKQOBYKCJBTBY-AWEZNQCLSA-N 1 0 319.832 4.301 20 10 DICDRO C[N@H+](CCc1ccccc1)Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249224421 1060193984 /nfs/dbraw/zinc/19/39/84/1060193984.db2.gz YXIGKGSOBPVCRY-UHFFFAOYSA-N 1 0 323.436 4.251 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC23CCC(CC2)C3)cc1F ZINC001560425073 1060208914 /nfs/dbraw/zinc/20/89/14/1060208914.db2.gz QTUQITMRJIOQCQ-UHFFFAOYSA-N 1 0 304.453 4.342 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H](C)c2ccccc2)ccc1OC ZINC001560434518 1060222991 /nfs/dbraw/zinc/22/29/91/1060222991.db2.gz YRRXTMZRPXVAGE-INIZCTEOSA-N 1 0 313.441 4.125 20 10 DICDRO CS[C@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)C(C)(C)C ZINC001560437313 1060227110 /nfs/dbraw/zinc/22/71/10/1060227110.db2.gz LEQRQBNHZZPLFJ-CQSZACIVSA-N 1 0 301.883 4.221 20 10 DICDRO COc1cccc(C2([NH2+]C/C=C/c3ccc(N(C)C)cc3)CC2)c1 ZINC001560470566 1060262241 /nfs/dbraw/zinc/26/22/41/1060262241.db2.gz ZPXOZKRXADQDAO-AATRIKPKSA-N 1 0 322.452 4.053 20 10 DICDRO c1cc(NCc2ccc(N3CCCCC3)cc2)[nH+]c2c1CCC2 ZINC001560476224 1060266210 /nfs/dbraw/zinc/26/62/10/1060266210.db2.gz CGHWXBRJTUTJPF-UHFFFAOYSA-N 1 0 307.441 4.173 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1cc(F)ccc1F ZINC001560508331 1060306940 /nfs/dbraw/zinc/30/69/40/1060306940.db2.gz RSHORGWSBNFADY-AWEZNQCLSA-N 1 0 318.411 4.060 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+]C[C@H]3CCCC(C)(C)C3)C2)cc1 ZINC001560529173 1060330416 /nfs/dbraw/zinc/33/04/16/1060330416.db2.gz UKLUKIIMEJBABJ-IRXDYDNUSA-N 1 0 316.489 4.080 20 10 DICDRO Cc1cc(C[NH2+]Cc2cnc(F)c(C)c2)c(C)n1-c1ccccc1 ZINC001560555954 1060363971 /nfs/dbraw/zinc/36/39/71/1060363971.db2.gz KEWJICOVBLEPPC-UHFFFAOYSA-N 1 0 323.415 4.226 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C2CC2)[C@@H]2CCCOC2)cc1C ZINC001560607598 1060421123 /nfs/dbraw/zinc/42/11/23/1060421123.db2.gz JRPSMWNXXDVBOV-UYAOXDASSA-N 1 0 317.473 4.079 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C2CC2)[C@H]2CCCOC2)cc1C ZINC001560607596 1060422278 /nfs/dbraw/zinc/42/22/78/1060422278.db2.gz JRPSMWNXXDVBOV-ICSRJNTNSA-N 1 0 317.473 4.079 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCCC(C)(C)O2)cc1F ZINC001560610442 1060424175 /nfs/dbraw/zinc/42/41/75/1060424175.db2.gz WDSDJMNXSLVHRR-INIZCTEOSA-N 1 0 322.468 4.109 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCCC(C)(C)O2)cc1F ZINC001560610443 1060424946 /nfs/dbraw/zinc/42/49/46/1060424946.db2.gz WDSDJMNXSLVHRR-MRXNPFEDSA-N 1 0 322.468 4.109 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCc3ccccc3[C@@H]2C)cc1Cl ZINC001560628680 1060441001 /nfs/dbraw/zinc/44/10/01/1060441001.db2.gz YUFKDVUJOQCSAG-ZDUSSCGKSA-N 1 0 301.817 4.473 20 10 DICDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(C)cc(OC)c1O ZINC001560640289 1060457796 /nfs/dbraw/zinc/45/77/96/1060457796.db2.gz OETVKEZPLHLEIB-SFHVURJKSA-N 1 0 311.425 4.219 20 10 DICDRO CO[C@H](CC(C)C)C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC001560664803 1060493322 /nfs/dbraw/zinc/49/33/22/1060493322.db2.gz GVINGPLVMYWLHE-LJQANCHMSA-N 1 0 306.494 4.024 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)CC1(CCCOC)CCC1 ZINC001560685451 1060531970 /nfs/dbraw/zinc/53/19/70/1060531970.db2.gz BYGJBZNOXFOUHO-UHFFFAOYSA-N 1 0 305.462 4.201 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1O)[C@H](C)c1cccc(O)c1 ZINC001560692835 1060541375 /nfs/dbraw/zinc/54/13/75/1060541375.db2.gz PMLDWUJLZIBXAE-GFCCVEGCSA-N 1 0 305.805 4.334 20 10 DICDRO C[N@H+](CCCOc1ccccc1)Cc1ccc2ccccc2c1O ZINC001560697805 1060552678 /nfs/dbraw/zinc/55/26/78/1060552678.db2.gz PCARNJOVWQLSRN-UHFFFAOYSA-N 1 0 321.420 4.446 20 10 DICDRO C[C@@H]1C[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@H]2CCCC[C@H]12 ZINC001560705679 1060560617 /nfs/dbraw/zinc/56/06/17/1060560617.db2.gz ORUCOUQPMSMLPZ-MRRJBJDNSA-N 1 0 308.416 4.041 20 10 DICDRO C[N@H+](Cc1cc(Cl)cc(F)c1[O-])CC1(c2ccccc2)CC1 ZINC001560757370 1060622802 /nfs/dbraw/zinc/62/28/02/1060622802.db2.gz MELMOBJOXBDZLT-UHFFFAOYSA-N 1 0 319.807 4.348 20 10 DICDRO CCC[C@@]1(COC)CCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC001560789225 1060649205 /nfs/dbraw/zinc/64/92/05/1060649205.db2.gz QYELCDHKDBOLPB-KRWDZBQOSA-N 1 0 311.853 4.135 20 10 DICDRO CCC[C@]1(COC)CCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC001560789226 1060649447 /nfs/dbraw/zinc/64/94/47/1060649447.db2.gz QYELCDHKDBOLPB-QGZVFWFLSA-N 1 0 311.853 4.135 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(C)C[C@@H]2c2ccccc2)c1 ZINC001560814641 1060674832 /nfs/dbraw/zinc/67/48/32/1060674832.db2.gz DFFJSJUAZBPAOH-LXGCGDOSSA-N 1 0 311.425 4.245 20 10 DICDRO CC[C@H](C[NH2+]Cc1ccc(N(C)C)cc1C)CC(F)(F)F ZINC001560889134 1060750384 /nfs/dbraw/zinc/75/03/84/1060750384.db2.gz NKNMUKQQIHQCEE-ZDUSSCGKSA-N 1 0 302.384 4.129 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@@]2(F)c2ccccc2)cc1Cl ZINC001560897938 1060760179 /nfs/dbraw/zinc/76/01/79/1060760179.db2.gz RSLONDWBHLFPSA-DLBZAZTESA-N 1 0 305.780 4.081 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC[C@@H]2CCCC2(C)C)c1O ZINC001560941944 1060805596 /nfs/dbraw/zinc/80/55/96/1060805596.db2.gz BORWVFLMFHPQAM-ZDUSSCGKSA-N 1 0 311.853 4.360 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC2CCC3(CC3)CC2)c1O ZINC001560952558 1060819593 /nfs/dbraw/zinc/81/95/93/1060819593.db2.gz NSLYCTQLPROMOC-UHFFFAOYSA-N 1 0 309.837 4.114 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CCSCCC(F)(F)F)c1 ZINC001560971959 1060834210 /nfs/dbraw/zinc/83/42/10/1060834210.db2.gz YGFMPFNMWLQYMW-UHFFFAOYSA-N 1 0 321.408 4.291 20 10 DICDRO COc1cccc2c(C[N@@H+]3Cc4cccc(O)c4C3)cccc12 ZINC001560978902 1060842466 /nfs/dbraw/zinc/84/24/66/1060842466.db2.gz VCEXICWPQNRCHX-UHFFFAOYSA-N 1 0 305.377 4.070 20 10 DICDRO COc1cc(O)c(C[NH2+][C@H]2CCC[C@H](C(C)C)CC2)cc1OC ZINC001462125136 1060947836 /nfs/dbraw/zinc/94/78/36/1060947836.db2.gz ICCMFOZYYJLUAU-HOCLYGCPSA-N 1 0 321.461 4.104 20 10 DICDRO CC1=C(Br)C[N@H+](Cc2cc(C(C)C)ccc2O)CC1 ZINC001462152469 1060974280 /nfs/dbraw/zinc/97/42/80/1060974280.db2.gz BAWOYCLWIYMMCI-UHFFFAOYSA-N 1 0 324.262 4.390 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001462186238 1061008839 /nfs/dbraw/zinc/00/88/39/1061008839.db2.gz ZQVZPUIJHFSVDC-MRXNPFEDSA-N 1 0 305.780 4.352 20 10 DICDRO CC[C@@H](CCc1ccccc1)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC001462211085 1061029913 /nfs/dbraw/zinc/02/99/13/1061029913.db2.gz UFURFUJTUQEHMO-RDJZCZTQSA-N 1 0 313.441 4.463 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)ccc1N(C)C ZINC001473308223 1061072682 /nfs/dbraw/zinc/07/26/82/1061072682.db2.gz RJBYDFSWFIXYKL-UHFFFAOYSA-N 1 0 322.374 4.110 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC001462355540 1061126240 /nfs/dbraw/zinc/12/62/40/1061126240.db2.gz KZBYEEWXQUSRIN-IIHSZXCVSA-N 1 0 302.506 4.406 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+][C@H](C)CC3CCCC3)C2)cc1 ZINC001462374735 1061136740 /nfs/dbraw/zinc/13/67/40/1061136740.db2.gz NTHAWJFFMODNRM-SJLPKXTDSA-N 1 0 316.489 4.080 20 10 DICDRO C[C@H]([NH2+]CCSCc1ccccc1)c1ccc(N(C)C)cc1 ZINC001473400140 1061137193 /nfs/dbraw/zinc/13/71/93/1061137193.db2.gz KZAICVFWWBYTOG-INIZCTEOSA-N 1 0 314.498 4.337 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCSC[C@H]2C2CCC2)c1 ZINC001462380536 1061138467 /nfs/dbraw/zinc/13/84/67/1061138467.db2.gz ADJXBSIAYPMXAX-KRWDZBQOSA-N 1 0 305.487 4.233 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCCCN1C(C)C ZINC001473424276 1061152317 /nfs/dbraw/zinc/15/23/17/1061152317.db2.gz JSBQDEPIXHDTHM-LJQANCHMSA-N 1 0 318.505 4.257 20 10 DICDRO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1cc(F)ccc1O ZINC001462415169 1061160492 /nfs/dbraw/zinc/16/04/92/1061160492.db2.gz OOCWUPDHHAKLRD-ZDUSSCGKSA-N 1 0 305.418 4.144 20 10 DICDRO CCc1cccc(C[NH2+][C@H](CC)Cc2ccc(F)cc2)c1O ZINC001462423074 1061164478 /nfs/dbraw/zinc/16/44/78/1061164478.db2.gz ZHDCWOWTJMKECU-GOSISDBHSA-N 1 0 301.405 4.205 20 10 DICDRO CC[C@@](C)([NH2+]Cc1cc(Br)cc(C)c1O)C1CC1 ZINC001462433959 1061172676 /nfs/dbraw/zinc/17/26/76/1061172676.db2.gz BDNXMZJNJNSJKE-OAHLLOKOSA-N 1 0 312.251 4.131 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CCc2cn(C)c3ccccc23)c1 ZINC001462444811 1061177747 /nfs/dbraw/zinc/17/77/47/1061177747.db2.gz RVAWEGVKFUAOER-UHFFFAOYSA-N 1 0 322.452 4.340 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(Oc3ccccn3)c2)c1 ZINC001462449740 1061180922 /nfs/dbraw/zinc/18/09/22/1061180922.db2.gz UGBZUBFVRYCSMZ-UHFFFAOYSA-N 1 0 320.392 4.178 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCOc2cccc(F)c2)cc1Cl ZINC001462643308 1061315595 /nfs/dbraw/zinc/31/55/95/1061315595.db2.gz VGTXHVAPVCSBRD-UHFFFAOYSA-N 1 0 323.795 4.052 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@@H]2C[C@@H]2Cc2ccccc2)c1 ZINC001462660216 1061323972 /nfs/dbraw/zinc/32/39/72/1061323972.db2.gz IZDLZACAYFMPKP-OALUTQOASA-N 1 0 309.453 4.484 20 10 DICDRO CCc1ccc2c(c1)CC[N@@H+](Cc1c(O)cc(C)cc1Cl)C2 ZINC001462672750 1061332161 /nfs/dbraw/zinc/33/21/61/1061332161.db2.gz VRKWJIBELKZGHK-UHFFFAOYSA-N 1 0 315.844 4.475 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(F)ccc1OC ZINC001473813441 1061420744 /nfs/dbraw/zinc/42/07/44/1061420744.db2.gz KMOJCTJWDCBAGJ-SFHVURJKSA-N 1 0 316.420 4.141 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]Cc2cccnc2)cc1 ZINC001473913874 1061460525 /nfs/dbraw/zinc/46/05/25/1061460525.db2.gz NLCJPXQGSDEBGX-UHFFFAOYSA-N 1 0 323.465 4.069 20 10 DICDRO c1ccc(C2([NH2+]Cc3ccc(N4CCCC4)cc3)CCC2)cc1 ZINC001251730434 1061462249 /nfs/dbraw/zinc/46/22/49/1061462249.db2.gz ODFQDESBOGKOJU-UHFFFAOYSA-N 1 0 306.453 4.456 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCc2ccc(Cl)cc2)cc1 ZINC001473914641 1061462852 /nfs/dbraw/zinc/46/28/52/1061462852.db2.gz XCICYPGHDVPEDT-ARJAWSKDSA-N 1 0 314.860 4.252 20 10 DICDRO c1ccc2c(c1)SCC[C@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001473915372 1061463381 /nfs/dbraw/zinc/46/33/81/1061463381.db2.gz UZNWNPLCEUVVRF-QGZVFWFLSA-N 1 0 311.450 4.338 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H](C)c2ccc(F)cc2)c(Cl)c1 ZINC001473988500 1061532053 /nfs/dbraw/zinc/53/20/53/1061532053.db2.gz NFTKNDRXLCASQC-LBPRGKRZSA-N 1 0 307.796 4.386 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC(C)(C)c2cccs2)cc1 ZINC001474003185 1061544520 /nfs/dbraw/zinc/54/45/20/1061544520.db2.gz XMNWTPZBRNVGFG-ALCCZGGFSA-N 1 0 314.498 4.395 20 10 DICDRO Clc1ccc(C[NH2+]CCCSc2nccs2)s1 ZINC001474018609 1061559336 /nfs/dbraw/zinc/55/93/36/1061559336.db2.gz XGYSXBSJSZFTNJ-UHFFFAOYSA-N 1 0 304.893 4.130 20 10 DICDRO CCS[C@@H]1CCC[C@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC001474038397 1061582992 /nfs/dbraw/zinc/58/29/92/1061582992.db2.gz PVTQFZHTZUHCFR-BUPXIBQPSA-N 1 0 318.530 4.420 20 10 DICDRO CC[C@H](C[NH2+]Cc1ccc(OC)c(C)c1)Oc1ccccc1F ZINC001474040307 1061585221 /nfs/dbraw/zinc/58/52/21/1061585221.db2.gz XSFQYUHFJBRULN-MRXNPFEDSA-N 1 0 317.404 4.090 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H](c2cccnc2)C(C)C)c(Cl)c1 ZINC001474040083 1061586482 /nfs/dbraw/zinc/58/64/82/1061586482.db2.gz QIPAWXGHVBUJRE-OAHLLOKOSA-N 1 0 318.848 4.278 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2COCc3ccccc32)cc1C ZINC001474184109 1061733171 /nfs/dbraw/zinc/73/31/71/1061733171.db2.gz PHJWEMOVWYALTD-LJQANCHMSA-N 1 0 311.425 4.145 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@H]1CCCC[C@H]1C ZINC001474184581 1061733599 /nfs/dbraw/zinc/73/35/99/1061733599.db2.gz GNZYSNRSUMUPCD-HHXXYDBFSA-N 1 0 302.506 4.408 20 10 DICDRO Cc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001474220359 1061778798 /nfs/dbraw/zinc/77/87/98/1061778798.db2.gz DYUFWPWVFZELDB-HXUWFJFHSA-N 1 0 307.437 4.487 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC2C[C@H]3CC[C@@H](C2)S3)c(Cl)c1 ZINC001474266902 1061833716 /nfs/dbraw/zinc/83/37/16/1061833716.db2.gz BDHNRZZAASODDQ-YHWZYXNKSA-N 1 0 311.878 4.118 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCC2(c3ccccc3)CC2)cc1 ZINC001474271896 1061839386 /nfs/dbraw/zinc/83/93/86/1061839386.db2.gz JKLHIOJMYUCEGY-SREVYHEPSA-N 1 0 320.480 4.477 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@@H]1CCC(F)(F)C1 ZINC001474293103 1061862294 /nfs/dbraw/zinc/86/22/94/1061862294.db2.gz XFJNBCZOOQJUCQ-AWEZNQCLSA-N 1 0 306.400 4.402 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCN(C)C[C@H]2c2ccccc2)c1 ZINC001474308053 1061878784 /nfs/dbraw/zinc/87/87/84/1061878784.db2.gz ZSMJRSFRKIFWBV-FQEVSTJZSA-N 1 0 324.468 4.004 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2C2CC2)c(C(F)(F)F)c1 ZINC001474334867 1061927240 /nfs/dbraw/zinc/92/72/40/1061927240.db2.gz CNKMLNLDDCCSOX-INIZCTEOSA-N 1 0 312.379 4.146 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2C2CC2)c(C(F)(F)F)c1 ZINC001474334868 1061928743 /nfs/dbraw/zinc/92/87/43/1061928743.db2.gz CNKMLNLDDCCSOX-MRXNPFEDSA-N 1 0 312.379 4.146 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@@H](C)CC2)c(O)c(C(C)(C)C)c1 ZINC001474338849 1061933172 /nfs/dbraw/zinc/93/31/72/1061933172.db2.gz GMVLRMQVPYGYQR-CQSZACIVSA-N 1 0 305.462 4.320 20 10 DICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)CC1Cc2ccccc2C1 ZINC001474347028 1061950552 /nfs/dbraw/zinc/95/05/52/1061950552.db2.gz JKUMCHKVWOLVEJ-UHFFFAOYSA-N 1 0 322.496 4.378 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@H]2Cc2ccc(C)cc2)c1O ZINC001474347739 1061953540 /nfs/dbraw/zinc/95/35/40/1061953540.db2.gz VWRNRXSYGKDHTF-FQEVSTJZSA-N 1 0 309.453 4.470 20 10 DICDRO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1ccc(Cl)cc1O ZINC001474352117 1061963501 /nfs/dbraw/zinc/96/35/01/1061963501.db2.gz UFEFBNAYLHLZGC-UHFFFAOYSA-N 1 0 300.789 4.159 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](C)Cc1cc2ccccc2[nH]1 ZINC001474351015 1061965168 /nfs/dbraw/zinc/96/51/68/1061965168.db2.gz FYODPZSFVBFKNJ-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)Cc2cccc(N(C)C)c2)c1 ZINC001474357513 1061973718 /nfs/dbraw/zinc/97/37/18/1061973718.db2.gz AJRYYLGCOLHNBL-UHFFFAOYSA-N 1 0 312.457 4.214 20 10 DICDRO Cc1cccc(OCC[N@@H+](C)Cc2cc(Cl)c(C)cc2O)c1 ZINC001474361706 1061984907 /nfs/dbraw/zinc/98/49/07/1061984907.db2.gz ALYWHYQLNWSIRQ-UHFFFAOYSA-N 1 0 319.832 4.173 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c(O)c1 ZINC001474376110 1062021052 /nfs/dbraw/zinc/02/10/52/1062021052.db2.gz ITQGEXXUZQLBAA-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO CC(C)[N@H+](Cc1ccco1)Cc1ccc(Br)cc1O ZINC001474402201 1062057414 /nfs/dbraw/zinc/05/74/14/1062057414.db2.gz NPBVIDQFVRQMIH-UHFFFAOYSA-N 1 0 324.218 4.158 20 10 DICDRO CN(Cc1ccc2occc2c1)c1ccc(OCC[NH+](C)C)cc1 ZINC001474422012 1062094064 /nfs/dbraw/zinc/09/40/64/1062094064.db2.gz PUVWQDFELPNXPZ-UHFFFAOYSA-N 1 0 324.424 4.010 20 10 DICDRO COc1ccc(N2CCC[N@@H+]([C@H](C)c3ccccc3C)CC2)cc1 ZINC001459350423 1062105013 /nfs/dbraw/zinc/10/50/13/1062105013.db2.gz OLOPFKAXMNYCPR-GOSISDBHSA-N 1 0 324.468 4.277 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@H+](C)CC2(c3ccccc3)CC2)cc1 ZINC001474444895 1062123403 /nfs/dbraw/zinc/12/34/03/1062123403.db2.gz RHOYLUGGBREVKF-BQYQJAHWSA-N 1 0 320.480 4.429 20 10 DICDRO COc1cc(C[N@@H+]2CCCCC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001474458566 1062137584 /nfs/dbraw/zinc/13/75/84/1062137584.db2.gz YNWPHQYNSGQNGP-CQSZACIVSA-N 1 0 305.462 4.463 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001474477837 1062158187 /nfs/dbraw/zinc/15/81/87/1062158187.db2.gz ZPWIOAGGAJVCCQ-GOSISDBHSA-N 1 0 312.432 4.190 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c1 ZINC001474486435 1062163372 /nfs/dbraw/zinc/16/33/72/1062163372.db2.gz MCUWTWGMSYTHIR-FZMZJTMJSA-N 1 0 301.352 4.288 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1C[C@@H](OC(C)(C)C)C1(C)C ZINC001474494972 1062175656 /nfs/dbraw/zinc/17/56/56/1062175656.db2.gz HEEUNYMRLKFMDJ-ZWKOTPCHSA-N 1 0 318.505 4.344 20 10 DICDRO Cc1ccccc1C[C@H]1CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001459513946 1062176571 /nfs/dbraw/zinc/17/65/71/1062176571.db2.gz IWPHXCYTVOEFFL-OAQYLSRUSA-N 1 0 308.469 4.268 20 10 DICDRO CCCN(Cc1c(O)cc(C)cc1Cl)c1ccc(C[NH3+])cc1 ZINC001474497094 1062176790 /nfs/dbraw/zinc/17/67/90/1062176790.db2.gz XYRHPTJQCKZUJL-UHFFFAOYSA-N 1 0 318.848 4.229 20 10 DICDRO CO[C@H](C)C[N@H+](Cc1ccc(N2CCCCC2)c(C)c1)C(C)C ZINC001459527127 1062185567 /nfs/dbraw/zinc/18/55/67/1062185567.db2.gz RSTDYAVUBDISQX-GOSISDBHSA-N 1 0 318.505 4.231 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](OC(C)(C)C)C2(C)C)c1 ZINC001474505054 1062188900 /nfs/dbraw/zinc/18/89/00/1062188900.db2.gz NAGQRFJGOOHKNH-ZLIFDBKOSA-N 1 0 321.461 4.034 20 10 DICDRO CC[N@@H+](Cc1cc(Br)ccc1O)CC1CC(C)C1 ZINC001459581920 1062225098 /nfs/dbraw/zinc/22/50/98/1062225098.db2.gz WZWUFOQPIHUBBM-UHFFFAOYSA-N 1 0 312.251 4.023 20 10 DICDRO COc1ccc(O)c(C[NH2+]C[C@@H]2CCC[C@H]2c2ccccc2)c1 ZINC001474544546 1062238193 /nfs/dbraw/zinc/23/81/93/1062238193.db2.gz RCEWCKLMQHHDHR-LPHOPBHVSA-N 1 0 311.425 4.074 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)c1 ZINC001474544436 1062240289 /nfs/dbraw/zinc/24/02/89/1062240289.db2.gz HFUMBQDQKNTDDG-SPYBWZPUSA-N 1 0 311.425 4.167 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)cc1 ZINC001459629112 1062265267 /nfs/dbraw/zinc/26/52/67/1062265267.db2.gz GFFXAGVJZSNWOF-HXUWFJFHSA-N 1 0 311.473 4.208 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)C1CCSCC1 ZINC001474585384 1062292045 /nfs/dbraw/zinc/29/20/45/1062292045.db2.gz RRKSLHHGLHYXIU-JKSUJKDBSA-N 1 0 320.546 4.113 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(Br)cc1O)[C@H]1CC1(C)C ZINC001474587266 1062296364 /nfs/dbraw/zinc/29/63/64/1062296364.db2.gz PSJRGQQQKZDJHZ-OLZOCXBDSA-N 1 0 312.251 4.069 20 10 DICDRO COc1cc(C)cc(C[NH2+]C2(c3ccccc3C)CCC2)c1O ZINC001474609381 1062321760 /nfs/dbraw/zinc/32/17/60/1062321760.db2.gz GHHLPTQLSGYGCY-UHFFFAOYSA-N 1 0 311.425 4.187 20 10 DICDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)[C@@H]1C[C@H]1c1cccs1 ZINC001474609186 1062322563 /nfs/dbraw/zinc/32/25/63/1062322563.db2.gz OSCIQHREJZOSFC-LEWSCRJBSA-N 1 0 307.846 4.389 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1CC(c2cc(F)cc(F)c2)C1 ZINC001474609959 1062326798 /nfs/dbraw/zinc/32/67/98/1062326798.db2.gz ZQINJKPUMIGAPY-UHFFFAOYSA-N 1 0 323.770 4.360 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H](C)C[C@@H](C)CC(C)C)C2)cc1 ZINC001474624441 1062347391 /nfs/dbraw/zinc/34/73/91/1062347391.db2.gz UBPGRIQFMBGRGY-KSZLIROESA-N 1 0 318.505 4.324 20 10 DICDRO Cc1cccc(CC2C[NH+](Cc3cc(C(C)C)ccc3O)C2)c1 ZINC001474640552 1062365322 /nfs/dbraw/zinc/36/53/22/1062365322.db2.gz CMPHJCUVFQTDFH-UHFFFAOYSA-N 1 0 309.453 4.499 20 10 DICDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1(CC)CC ZINC001459756253 1062365872 /nfs/dbraw/zinc/36/58/72/1062365872.db2.gz VKDYPLXKCPFWCN-RTBURBONSA-N 1 0 318.505 4.168 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@@H](c3ccc(F)c(F)c3)C2)c(O)c1 ZINC001474642102 1062366852 /nfs/dbraw/zinc/36/68/52/1062366852.db2.gz LKIBMZVERCDWAG-OAHLLOKOSA-N 1 0 317.379 4.358 20 10 DICDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1(CC)CC ZINC001459756242 1062366699 /nfs/dbraw/zinc/36/66/99/1062366699.db2.gz VKDYPLXKCPFWCN-MOPGFXCFSA-N 1 0 318.505 4.168 20 10 DICDRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC001474670039 1062400808 /nfs/dbraw/zinc/40/08/08/1062400808.db2.gz WCDAUHSELDRGJV-YXUGBTPSSA-N 1 0 311.425 4.244 20 10 DICDRO CCOc1ccc(N2CC[NH+](CCC3=CCCCC3)CC2)cc1 ZINC001459797769 1062408577 /nfs/dbraw/zinc/40/85/77/1062408577.db2.gz QPOSZFFGZZFCMQ-UHFFFAOYSA-N 1 0 314.473 4.098 20 10 DICDRO Oc1c(C[NH2+]CC[C@H]2CCCC2(F)F)ccc2ccccc21 ZINC001474683065 1062413667 /nfs/dbraw/zinc/41/36/67/1062413667.db2.gz FLKVWNYSRJGKSR-OAHLLOKOSA-N 1 0 305.368 4.461 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)c1O ZINC001474687257 1062419534 /nfs/dbraw/zinc/41/95/34/1062419534.db2.gz NMLJVXJEAQNTLR-TUKIKUTGSA-N 1 0 324.262 4.131 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]Cc2nccc3c2CCCC3)c1 ZINC001474706808 1062432083 /nfs/dbraw/zinc/43/20/83/1062432083.db2.gz STRBWVCBBVKDQN-UHFFFAOYSA-N 1 0 310.441 4.079 20 10 DICDRO CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC001459865707 1062457180 /nfs/dbraw/zinc/45/71/80/1062457180.db2.gz BVPZCHGBMJWOCN-HXUWFJFHSA-N 1 0 314.448 4.249 20 10 DICDRO Oc1c(C[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)ccc2ccccc21 ZINC001474745715 1062460497 /nfs/dbraw/zinc/46/04/97/1062460497.db2.gz ZMAAXIYNRRADAG-GOSISDBHSA-N 1 0 323.823 4.456 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001255719027 1062536419 /nfs/dbraw/zinc/53/64/19/1062536419.db2.gz BDDSKPUQXPUYJQ-ZIAGYGMSSA-N 1 0 301.352 4.335 20 10 DICDRO Cc1ccc(SC[C@@H](C)[N@H+](C)Cc2ccccc2O)cc1 ZINC001255772337 1062597552 /nfs/dbraw/zinc/59/75/52/1062597552.db2.gz ZBPJILPOZGWMBR-OAHLLOKOSA-N 1 0 301.455 4.313 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H](C)Cc1ccccn1 ZINC001256410532 1062810256 /nfs/dbraw/zinc/81/02/56/1062810256.db2.gz VDJYVSITNSLWPU-YWZLYKJASA-N 1 0 324.468 4.248 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H]2CCO[C@@H](c3ccccc3)C2)c(O)c1 ZINC001256798242 1062984577 /nfs/dbraw/zinc/98/45/77/1062984577.db2.gz OJLWBVXMNIIXCB-YLJYHZDGSA-N 1 0 311.425 4.019 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC001256798241 1062986034 /nfs/dbraw/zinc/98/60/34/1062986034.db2.gz OJLWBVXMNIIXCB-XLIONFOSSA-N 1 0 311.425 4.019 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC001256819611 1062998493 /nfs/dbraw/zinc/99/84/93/1062998493.db2.gz DOKLIQCILTYKCC-AZUAARDMSA-N 1 0 311.425 4.134 20 10 DICDRO C[C@H](CCc1ccccc1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001460998581 1063174084 /nfs/dbraw/zinc/17/40/84/1063174084.db2.gz AHKQELQROUZBFB-RUJXFNLJSA-N 1 0 308.469 4.377 20 10 DICDRO COc1cc(C[NH2+][C@H]2CCCC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001461002118 1063177720 /nfs/dbraw/zinc/17/77/20/1063177720.db2.gz QQSDHYVXZFBKER-DYVFJYSZSA-N 1 0 305.462 4.367 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)Cc1ccccc1F ZINC001461092071 1063248403 /nfs/dbraw/zinc/24/84/03/1063248403.db2.gz AWZULOOBEJEMBH-CQSZACIVSA-N 1 0 310.416 4.347 20 10 DICDRO COc1ccc(C[NH2+][C@@H](c2ccccc2)[C@H]2CCCO2)cc1C ZINC001461118248 1063268858 /nfs/dbraw/zinc/26/88/58/1063268858.db2.gz ZRGANVWIMPXYAZ-UXHICEINSA-N 1 0 311.425 4.014 20 10 DICDRO CCCCOc1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001461126520 1063275968 /nfs/dbraw/zinc/27/59/68/1063275968.db2.gz CSSJDYOSAIMFBQ-UHFFFAOYSA-N 1 0 311.425 4.090 20 10 DICDRO COc1ccc(C2([NH2+]Cc3c(C)c4ccccc4n3C)CC2)cc1 ZINC001461143962 1063291043 /nfs/dbraw/zinc/29/10/43/1063291043.db2.gz AMVXABPAMRIQBT-UHFFFAOYSA-N 1 0 320.436 4.274 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C/C=C/c1ccc(F)c(F)c1 ZINC001461195381 1063324220 /nfs/dbraw/zinc/32/42/20/1063324220.db2.gz NXIICEPHMOWNTB-SNAWJCMRSA-N 1 0 316.395 4.142 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@H]2Cc2ccccc2)c(Cl)c1 ZINC001461219791 1063343081 /nfs/dbraw/zinc/34/30/81/1063343081.db2.gz CBKYUWOBAPUMAF-PBHICJAKSA-N 1 0 301.817 4.075 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1CCCSC1 ZINC001257669011 1063364451 /nfs/dbraw/zinc/36/44/51/1063364451.db2.gz YSWYYSWPMAFSDI-GUYCJALGSA-N 1 0 305.487 4.118 20 10 DICDRO Cc1cc(C)nc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC001473114910 1063416510 /nfs/dbraw/zinc/41/65/10/1063416510.db2.gz FVEUQDDWAJKFRU-UHFFFAOYSA-N 1 0 311.473 4.175 20 10 DICDRO CCOc1cc(Cl)ccc1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC001461374800 1063457678 /nfs/dbraw/zinc/45/76/78/1063457678.db2.gz QTFVCEHSMBCCCY-UHFFFAOYSA-N 1 0 319.832 4.346 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCc3ccccc3C2)c(Cl)c1 ZINC001461393273 1063469928 /nfs/dbraw/zinc/46/99/28/1063469928.db2.gz QXLXNSQQWAPBHL-AWEZNQCLSA-N 1 0 315.844 4.249 20 10 DICDRO Cc1ccccc1[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@@H](C)CO1 ZINC001473174190 1063479703 /nfs/dbraw/zinc/47/97/03/1063479703.db2.gz VHKLOAHHVLFPBZ-LAUBAEHRSA-N 1 0 324.468 4.023 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2scnc2c1)c1ccc(N(C)C)cc1 ZINC001461443956 1063510237 /nfs/dbraw/zinc/51/02/37/1063510237.db2.gz ZMEPAJHECGFEQM-ZDUSSCGKSA-N 1 0 311.454 4.213 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](CO)CC2CCCC2)cc1C ZINC001461462226 1063524167 /nfs/dbraw/zinc/52/41/67/1063524167.db2.gz KXMGGNBFPOCBTQ-IBGZPJMESA-N 1 0 319.489 4.062 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H](C)Cc1ccco1 ZINC001258186058 1063550714 /nfs/dbraw/zinc/55/07/14/1063550714.db2.gz VMTCDSRJKQUODB-AUUYWEPGSA-N 1 0 313.441 4.446 20 10 DICDRO C=Cc1ccc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001461523479 1063558257 /nfs/dbraw/zinc/55/82/57/1063558257.db2.gz UXFNVGBIYCVILH-UHFFFAOYSA-N 1 0 306.453 4.262 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)c(C(F)(F)F)c1 ZINC001461622185 1063618656 /nfs/dbraw/zinc/61/86/56/1063618656.db2.gz WTGVKDMEBRGAJN-MRVWCRGKSA-N 1 0 312.379 4.050 20 10 DICDRO CC(C)(C)O[C@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)C12CCC2 ZINC001461643904 1063630856 /nfs/dbraw/zinc/63/08/56/1063630856.db2.gz HSTZWCBDGBQJAJ-HOTGVXAUSA-N 1 0 323.864 4.262 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H](C)CCc1ccc(OC)cc1 ZINC001258406872 1063642372 /nfs/dbraw/zinc/64/23/72/1063642372.db2.gz UTILILPQFIUDEM-MRXNPFEDSA-N 1 0 313.441 4.244 20 10 DICDRO CCCCC[C@H](CC)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258434744 1063651564 /nfs/dbraw/zinc/65/15/64/1063651564.db2.gz PTRRRVIYBBTGRR-SFHVURJKSA-N 1 0 318.505 4.305 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCc2cc(Cl)ccc21 ZINC001461686362 1063658946 /nfs/dbraw/zinc/65/89/46/1063658946.db2.gz QDLSXILAKUUEEA-HNNXBMFYSA-N 1 0 308.208 4.476 20 10 DICDRO COCc1ccccc1/C=C(\C)C[NH2+][C@@H](C)c1ccccc1O ZINC001461732861 1063686066 /nfs/dbraw/zinc/68/60/66/1063686066.db2.gz YTWXYUXWBRDKPQ-STTHAQSSSA-N 1 0 311.425 4.293 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](c1ccncc1)C1CC1 ZINC001461808907 1063728842 /nfs/dbraw/zinc/72/88/42/1063728842.db2.gz BYHPKTOQBADQFD-FQEVSTJZSA-N 1 0 305.425 4.123 20 10 DICDRO Oc1cccc(Br)c1C[NH2+]C[C@H]1C[C@@H]1C1CCCC1 ZINC001461830791 1063740614 /nfs/dbraw/zinc/74/06/14/1063740614.db2.gz PEUDBZLWOWAVEA-CHWSQXEVSA-N 1 0 324.262 4.071 20 10 DICDRO Oc1cccc(Br)c1C[NH2+]C[C@H]1C[C@H]1C1CCCC1 ZINC001461830792 1063740723 /nfs/dbraw/zinc/74/07/23/1063740723.db2.gz PEUDBZLWOWAVEA-OLZOCXBDSA-N 1 0 324.262 4.071 20 10 DICDRO Cc1c(Cl)cccc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001461838572 1063742945 /nfs/dbraw/zinc/74/29/45/1063742945.db2.gz OCFWSDZNUVRDBV-UHFFFAOYSA-N 1 0 302.849 4.346 20 10 DICDRO C[C@@H]1C[C@H]([N@@H+]2CCCc3cc(O)c(O)cc3C2)CC(C)(C)C1 ZINC001258704785 1063761662 /nfs/dbraw/zinc/76/16/62/1063761662.db2.gz UEPBIXIBSPFPEC-CJNGLKHVSA-N 1 0 303.446 4.061 20 10 DICDRO C[C@@H]1C[C@@H]([N@@H+]2CCCc3cc(O)c(O)cc3C2)CC(C)(C)C1 ZINC001258704786 1063762172 /nfs/dbraw/zinc/76/21/72/1063762172.db2.gz UEPBIXIBSPFPEC-CZUORRHYSA-N 1 0 303.446 4.061 20 10 DICDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)Cc1ccccc1F ZINC001461876548 1063767830 /nfs/dbraw/zinc/76/78/30/1063767830.db2.gz WRAZBLCECFMVNE-FPLPWBNLSA-N 1 0 312.432 4.427 20 10 DICDRO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1cc(F)ccc1O ZINC001461897927 1063786087 /nfs/dbraw/zinc/78/60/87/1063786087.db2.gz GQRXPPGWBAGNCR-OCCSQVGLSA-N 1 0 303.352 4.048 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)Cc1cccc(Cl)c1 ZINC001258751131 1063798186 /nfs/dbraw/zinc/79/81/86/1063798186.db2.gz IFZKEBBEDKOMGO-AWEZNQCLSA-N 1 0 303.833 4.499 20 10 DICDRO CCc1cccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c1O ZINC001461930018 1063816444 /nfs/dbraw/zinc/81/64/44/1063816444.db2.gz QYBMBHBZYQVRDI-GFCCVEGCSA-N 1 0 317.379 4.352 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCOc2ccccc2[C@H]1C ZINC001461934313 1063819432 /nfs/dbraw/zinc/81/94/32/1063819432.db2.gz IXUZQZNJTGDIFJ-MRXNPFEDSA-N 1 0 310.441 4.017 20 10 DICDRO CC[C@H](C[C@@H](C)CC)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258785678 1063823443 /nfs/dbraw/zinc/82/34/43/1063823443.db2.gz WIRDGFUUHXLPKF-FUHWJXTLSA-N 1 0 318.505 4.161 20 10 DICDRO CC[C@@H](C)C[C@H](CC)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258795494 1063832748 /nfs/dbraw/zinc/83/27/48/1063832748.db2.gz RSFCWHKWFITGLS-MJGOQNOKSA-N 1 0 318.505 4.170 20 10 DICDRO C[N@H+](Cc1ccc(CC(F)(F)F)cc1)Cc1ccccc1O ZINC001461964580 1063846795 /nfs/dbraw/zinc/84/67/95/1063846795.db2.gz IOZCDPNAGAQPGY-UHFFFAOYSA-N 1 0 309.331 4.129 20 10 DICDRO CC(C)CC(CC(C)C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001258835798 1063858900 /nfs/dbraw/zinc/85/89/00/1063858900.db2.gz CALAOBSWHHEUBN-UHFFFAOYSA-N 1 0 305.462 4.307 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1O ZINC001461988000 1063861227 /nfs/dbraw/zinc/86/12/27/1063861227.db2.gz LCVAQAUEOVKUKR-JMSVASOKSA-N 1 0 309.837 4.207 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1O ZINC001461988006 1063862348 /nfs/dbraw/zinc/86/23/48/1063862348.db2.gz LCVAQAUEOVKUKR-XUJVJEKNSA-N 1 0 309.837 4.207 20 10 DICDRO CC(C)c1ccc(O)c(CN(CCC[NH3+])c2cccc(F)c2)c1 ZINC001461991481 1063863198 /nfs/dbraw/zinc/86/31/98/1063863198.db2.gz RJTLMILZKZLUGW-UHFFFAOYSA-N 1 0 316.420 4.010 20 10 DICDRO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001462005777 1063873606 /nfs/dbraw/zinc/87/36/06/1063873606.db2.gz BSDISAGLJFJOCO-BETUJISGSA-N 1 0 314.395 4.249 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccccc2NC)cc1 ZINC001462007668 1063875878 /nfs/dbraw/zinc/87/58/78/1063875878.db2.gz HQNAFDQFCSEYSJ-UHFFFAOYSA-N 1 0 311.473 4.207 20 10 DICDRO CCc1cccc(C[N@H+](Cc2ccc(OC)cc2)C2CC2)c1O ZINC001462050550 1063901209 /nfs/dbraw/zinc/90/12/09/1063901209.db2.gz YRPJYKNMYIHDSU-UHFFFAOYSA-N 1 0 311.425 4.128 20 10 DICDRO Cc1csc(CCC[NH2+]Cc2ccc3ccccc3c2O)n1 ZINC001261245374 1063914324 /nfs/dbraw/zinc/91/43/24/1063914324.db2.gz ZGDSQDJKRSVKLQ-UHFFFAOYSA-N 1 0 312.438 4.033 20 10 DICDRO CCc1cccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)c1O ZINC001462088424 1063923214 /nfs/dbraw/zinc/92/32/14/1063923214.db2.gz ABISPUPXUMTPRR-ZDUSSCGKSA-N 1 0 301.352 4.117 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1(C)C ZINC001462095590 1063925832 /nfs/dbraw/zinc/92/58/32/1063925832.db2.gz SGWHHLHYFACXTQ-OAHLLOKOSA-N 1 0 314.395 4.224 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C1CCC1)[C@H]1CCOC1 ZINC001261852405 1063949965 /nfs/dbraw/zinc/94/99/65/1063949965.db2.gz BLFKIHBDCKLKBL-XXLXZOJFSA-N 1 0 315.457 4.044 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000393892077 1064308359 /nfs/dbraw/zinc/30/83/59/1064308359.db2.gz UBPNWOFJQMLIKT-PKOBYXMFSA-N 1 0 324.468 4.016 20 10 DICDRO CCOc1ccc2c(c1)C[N@@H+](Cc1ccc(N(C)C)c(C)c1)CC2 ZINC001307434019 1065392743 /nfs/dbraw/zinc/39/27/43/1065392743.db2.gz QKATXGLDWYPEDL-UHFFFAOYSA-N 1 0 324.468 4.018 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)CC1([C@@H]2CCCCO2)CCC1 ZINC001307502405 1065446106 /nfs/dbraw/zinc/44/61/06/1065446106.db2.gz WBAYCYSPEWXAAY-IBGZPJMESA-N 1 0 317.473 4.344 20 10 DICDRO COc1ccc2c(c1)C[C@H](C(C)C)CN2C[C@H]1CCO[C@@H](C)C1 ZINC001307864136 1065658172 /nfs/dbraw/zinc/65/81/72/1065658172.db2.gz PHKLZGCEPDBODL-BQFCYCMXSA-N 1 0 317.473 4.145 20 10 DICDRO COc1ccc2c(c1)C[C@H](C(C)C)CN2C[C@@H]1CCO[C@H](C)C1 ZINC001307864138 1065658590 /nfs/dbraw/zinc/65/85/90/1065658590.db2.gz PHKLZGCEPDBODL-NUJGCVRESA-N 1 0 317.473 4.145 20 10 DICDRO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC001308206735 1065814326 /nfs/dbraw/zinc/81/43/26/1065814326.db2.gz TUCZYXDXAGRMNG-YJBOKZPZSA-N 1 0 318.530 4.154 20 10 DICDRO Cc1cc(C)cc(OCC[NH2+]Cc2c(O)cc(C)cc2Cl)c1 ZINC001308220996 1065828596 /nfs/dbraw/zinc/82/85/96/1065828596.db2.gz MBJPVYRQRNSUCY-UHFFFAOYSA-N 1 0 319.832 4.139 20 10 DICDRO Fc1ccc(-c2ccc(C[NH2+]Cc3ccc4c(c3)CCO4)o2)cc1 ZINC001308235617 1065842294 /nfs/dbraw/zinc/84/22/94/1065842294.db2.gz FRFBTXFIUYNVTM-UHFFFAOYSA-N 1 0 323.367 4.310 20 10 DICDRO CCC1CCC(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC001308253408 1065856427 /nfs/dbraw/zinc/85/64/27/1065856427.db2.gz TXGACPXDCFNGRS-UHFFFAOYSA-N 1 0 310.432 4.337 20 10 DICDRO Cc1cccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c1C ZINC001308259954 1065860585 /nfs/dbraw/zinc/86/05/85/1065860585.db2.gz CPRIBTBGAGQWGZ-HNNXBMFYSA-N 1 0 300.421 4.359 20 10 DICDRO CCCC[C@H](CCC)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC001308299484 1065895344 /nfs/dbraw/zinc/89/53/44/1065895344.db2.gz BIUJBPUAQJRNKF-KRWDZBQOSA-N 1 0 322.468 4.111 20 10 DICDRO CCC1(CC)[C@H]([NH2+]Cc2c(O)cc(C)cc2Cl)C[C@H]1OC ZINC001308341243 1065926823 /nfs/dbraw/zinc/92/68/23/1065926823.db2.gz GIBAXDOMFBMTBC-HZPDHXFCSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc3ncccc3c2)c(Cl)c1 ZINC001308396083 1065962077 /nfs/dbraw/zinc/96/20/77/1065962077.db2.gz JYNFRBPOQZIFBV-UHFFFAOYSA-N 1 0 312.800 4.192 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C2(Cc3ccc(F)cc3)CC2)cc1 ZINC001308403421 1065965248 /nfs/dbraw/zinc/96/52/48/1065965248.db2.gz DGXGLCFLRNWHPD-ONEGZZNKSA-N 1 0 324.443 4.270 20 10 DICDRO CC1(C)[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)[C@@H]1c1ccccc1 ZINC001308432372 1065983366 /nfs/dbraw/zinc/98/33/66/1065983366.db2.gz HXXQANTVWAAWTH-ICSRJNTNSA-N 1 0 307.437 4.151 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001308440818 1065988583 /nfs/dbraw/zinc/98/85/83/1065988583.db2.gz WWUNPXGAZOGBFU-KRWDZBQOSA-N 1 0 322.496 4.271 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)cc1 ZINC001308447189 1065993424 /nfs/dbraw/zinc/99/34/24/1065993424.db2.gz KSSMRMRMXNUUPG-TZIWHRDSSA-N 1 0 308.469 4.426 20 10 DICDRO CC[N@H+](CCCNCc1c(O)cccc1Cl)C1CCCCC1 ZINC001308455727 1066000038 /nfs/dbraw/zinc/00/00/38/1066000038.db2.gz OETFHUMKGXVHGK-UHFFFAOYSA-N 1 0 324.896 4.180 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCS[C@@H]2C)cc1 ZINC001308458439 1066002135 /nfs/dbraw/zinc/00/21/35/1066002135.db2.gz WSSMXEQCFBJMAO-CRAIPNDOSA-N 1 0 306.519 4.297 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCS[C@H]2C)cc1 ZINC001308458442 1066002360 /nfs/dbraw/zinc/00/23/60/1066002360.db2.gz WSSMXEQCFBJMAO-YJBOKZPZSA-N 1 0 306.519 4.297 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc2c(c1)CCCO2 ZINC001308471394 1066010809 /nfs/dbraw/zinc/01/08/09/1066010809.db2.gz LCKWJOPNKNBRMO-OAHLLOKOSA-N 1 0 323.436 4.187 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CC2CCC3(CC3)CC2)cc1F ZINC001308482184 1066019974 /nfs/dbraw/zinc/01/99/74/1066019974.db2.gz JEJWKUZBUWPZEZ-UHFFFAOYSA-N 1 0 308.416 4.091 20 10 DICDRO Cc1ccc(CCC[NH2+]Cc2c(O)cccc2Cl)c(C)c1 ZINC001308488725 1066022784 /nfs/dbraw/zinc/02/27/84/1066022784.db2.gz GBTWTVHNVRYBQQ-UHFFFAOYSA-N 1 0 303.833 4.385 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCO[C@H]1c1ccccc1 ZINC001308490470 1066024069 /nfs/dbraw/zinc/02/40/69/1066024069.db2.gz NNTKFDOKXYKRLY-NQIIRXRSSA-N 1 0 320.436 4.107 20 10 DICDRO COc1cc(C[NH2+]C[C@@H]2C[C@@H]2[C@H]2C[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308521369 1066041655 /nfs/dbraw/zinc/04/16/55/1066041655.db2.gz BQEYUHVGPHVFLL-PYTWLRIVSA-N 1 0 317.473 4.080 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c(O)c1 ZINC001308573693 1066088403 /nfs/dbraw/zinc/08/84/03/1066088403.db2.gz REMVJHXMLBRBPG-IBGZPJMESA-N 1 0 301.430 4.032 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)c1 ZINC001308629109 1066126011 /nfs/dbraw/zinc/12/60/11/1066126011.db2.gz JFOCTFHIFXDZSS-HNNXBMFYSA-N 1 0 313.441 4.284 20 10 DICDRO COc1cc(O)c(C[NH2+]C2CC(C)(C)CC(C)(C)C2)cc1OC ZINC001308645230 1066135519 /nfs/dbraw/zinc/13/55/19/1066135519.db2.gz JWNGNTCRLYKFKY-UHFFFAOYSA-N 1 0 321.461 4.104 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](C)Cc1ccc(Cl)s1 ZINC001308651094 1066137779 /nfs/dbraw/zinc/13/77/79/1066137779.db2.gz PNDGFVNLGCWQFH-UHFFFAOYSA-N 1 0 308.878 4.408 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC001308659136 1066141951 /nfs/dbraw/zinc/14/19/51/1066141951.db2.gz KDAMUXPKSBEGRT-KRWDZBQOSA-N 1 0 301.817 4.253 20 10 DICDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1(C)C ZINC001308667537 1066146130 /nfs/dbraw/zinc/14/61/30/1066146130.db2.gz DHVDLXHEPRNTBE-MSOLQXFVSA-N 1 0 313.441 4.227 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC001308675091 1066149643 /nfs/dbraw/zinc/14/96/43/1066149643.db2.gz SXVIMIKEOMWJHB-UHFFFAOYSA-N 1 0 317.379 4.486 20 10 DICDRO C[C@@H]1COc2ccccc2C[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001308686056 1066154710 /nfs/dbraw/zinc/15/47/10/1066154710.db2.gz XWOKAMZAFZKAEI-JTGQJZMRSA-N 1 0 322.452 4.049 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCC3(CCCCC3)O2)cc1Cl ZINC001308686453 1066155111 /nfs/dbraw/zinc/15/51/11/1066155111.db2.gz PNIPWBDWOMTRRA-OAHLLOKOSA-N 1 0 323.864 4.326 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCCO[C@H]2CC(C)C)cc1Cl ZINC001308710195 1066191975 /nfs/dbraw/zinc/19/19/75/1066191975.db2.gz DAXVVWSOMPRWKT-RDJZCZTQSA-N 1 0 311.853 4.037 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC001308717162 1066195052 /nfs/dbraw/zinc/19/50/52/1066195052.db2.gz CDANKBSILXMGLN-QGZVFWFLSA-N 1 0 305.780 4.116 20 10 DICDRO CCO[C@@H](C[NH2+]Cc1cc(C(C)C)ccc1O)c1ccccc1 ZINC001308727761 1066202704 /nfs/dbraw/zinc/20/27/04/1066202704.db2.gz XJNNUARIHCGSIB-FQEVSTJZSA-N 1 0 313.441 4.383 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@]2(C)CC2(Cl)Cl)cc1Cl ZINC001308766635 1066240620 /nfs/dbraw/zinc/24/06/20/1066240620.db2.gz NJNWSXWONXTJOF-CYBMUJFWSA-N 1 0 322.663 4.418 20 10 DICDRO Cc1ccc2c(c1)CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)C2 ZINC001308823590 1066299747 /nfs/dbraw/zinc/29/97/47/1066299747.db2.gz ALOOKGQGLWVKIT-SNAWJCMRSA-N 1 0 306.453 4.133 20 10 DICDRO CCCCCC[C@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001308830134 1066306775 /nfs/dbraw/zinc/30/67/75/1066306775.db2.gz HYZBRFJFTLVXPS-ZWKOTPCHSA-N 1 0 318.505 4.470 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)c1 ZINC001308848426 1066326571 /nfs/dbraw/zinc/32/65/71/1066326571.db2.gz SAPVAYVFCVTOLO-HXUWFJFHSA-N 1 0 321.420 4.294 20 10 DICDRO CCC(O)(CC)C(C)(C)C[NH2+]Cc1ccc2ccccc2c1O ZINC001308862160 1066340553 /nfs/dbraw/zinc/34/05/53/1066340553.db2.gz SLDQLEIYCHKXHD-UHFFFAOYSA-N 1 0 315.457 4.212 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@H]3CCCCO3)C2)cc1Cl ZINC001308863012 1066341938 /nfs/dbraw/zinc/34/19/38/1066341938.db2.gz CYSHPIYFKQKFOQ-KBXCAEBGSA-N 1 0 323.864 4.135 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@@H]3CC(C)(C)CC[C@H]3C)C2)cc1 ZINC001308861490 1066342434 /nfs/dbraw/zinc/34/24/34/1066342434.db2.gz YKGFZWRNOIYMPD-JTDSTZFVSA-N 1 0 316.489 4.078 20 10 DICDRO CC(C)([NH2+]Cc1cc(F)ccc1O)c1nc2ccccc2s1 ZINC001308884152 1066361752 /nfs/dbraw/zinc/36/17/52/1066361752.db2.gz MZKSFMVNAIITDR-UHFFFAOYSA-N 1 0 316.401 4.166 20 10 DICDRO CSc1ccccc1C[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC001308902016 1066380831 /nfs/dbraw/zinc/38/08/31/1066380831.db2.gz NIDVNZDUNREKRN-KBPBESRZSA-N 1 0 301.455 4.396 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC001308908662 1066385603 /nfs/dbraw/zinc/38/56/03/1066385603.db2.gz IBKXGNJSLJNVDB-KRWDZBQOSA-N 1 0 305.368 4.455 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](Cc2cccnc2)C2CCCC2)c1O ZINC001308910600 1066387073 /nfs/dbraw/zinc/38/70/73/1066387073.db2.gz HNKFUFXAQQKPFC-FQEVSTJZSA-N 1 0 324.468 4.241 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCCC[C@H]([C@H]3CCOC3)C2)c1 ZINC001308974640 1066427364 /nfs/dbraw/zinc/42/73/64/1066427364.db2.gz JYDGBJIOUJHDMZ-ROUUACIJSA-N 1 0 317.473 4.154 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)C[C@H](C)O)c1ccc(N2CCCCC2)cc1 ZINC000090085980 185281366 /nfs/dbraw/zinc/28/13/66/185281366.db2.gz UQOJBBXKMITMFC-DLBZAZTESA-N 1 0 318.505 4.125 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](CC)c2ccc(OC)cc2)c1O ZINC000236957602 202094179 /nfs/dbraw/zinc/09/41/79/202094179.db2.gz IASXWLYTDNGKFF-KRWDZBQOSA-N 1 0 315.413 4.040 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)c1nccs1)c1ccc2ccccc2c1O ZINC000186740158 200001188 /nfs/dbraw/zinc/00/11/88/200001188.db2.gz FBPNUEYFRLTPOG-QWHCGFSZSA-N 1 0 312.438 4.456 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c1 ZINC000021011902 182260234 /nfs/dbraw/zinc/26/02/34/182260234.db2.gz UJHLLIQRNRAUTN-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c1 ZINC000021502070 182275197 /nfs/dbraw/zinc/27/51/97/182275197.db2.gz GPGBAIAGNSQSPX-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO COCC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1O)c1ccc(C)o1 ZINC000272632994 130047943 /nfs/dbraw/zinc/04/79/43/130047943.db2.gz NLMYJKJZNCICIW-HNNXBMFYSA-N 1 0 323.820 4.123 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccc1OC(F)F ZINC000272816449 130065751 /nfs/dbraw/zinc/06/57/51/130065751.db2.gz DZZCQYSENHABMJ-NWDGAFQWSA-N 1 0 307.340 4.405 20 10 DICDRO CC(C)Oc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000273362601 130111159 /nfs/dbraw/zinc/11/11/59/130111159.db2.gz DGLZVTYKKDHOBV-CYBMUJFWSA-N 1 0 303.377 4.169 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c(O)c1C ZINC000273379252 130114423 /nfs/dbraw/zinc/11/44/23/130114423.db2.gz HUQBHBVFQYBDTR-QGZVFWFLSA-N 1 0 324.468 4.460 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(O)c1C ZINC000273431222 130120428 /nfs/dbraw/zinc/12/04/28/130120428.db2.gz VTLQWTKMLFBGKH-KGLIPLIRSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000273446656 130121567 /nfs/dbraw/zinc/12/15/67/130121567.db2.gz FFVBWSAJWUWJBW-OLZOCXBDSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1cnc([C@@H](C)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273492606 130128012 /nfs/dbraw/zinc/12/80/12/130128012.db2.gz XBWXVZPLXJYGJD-SMDDNHRTSA-N 1 0 304.459 4.228 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCOC3(CCCCC3)C2)c1 ZINC000273489327 130128144 /nfs/dbraw/zinc/12/81/44/130128144.db2.gz NWXIOGZVJYTUQL-HZPDHXFCSA-N 1 0 303.446 4.233 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1ccc(C)o1 ZINC000273507681 130130623 /nfs/dbraw/zinc/13/06/23/130130623.db2.gz ZWMFGYTUJURBNQ-RDJZCZTQSA-N 1 0 317.429 4.339 20 10 DICDRO Cc1csc(C2([NH2+][C@@H](C)c3cc(F)ccc3O)CCC2)n1 ZINC000273520466 130132329 /nfs/dbraw/zinc/13/23/29/130132329.db2.gz UBJDYNHRMCQSBC-NSHDSACASA-N 1 0 306.406 4.026 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](CCCO)c2ccccc2)c(O)c1C ZINC000273598148 130142400 /nfs/dbraw/zinc/14/24/00/130142400.db2.gz REMBIKQXNKTZEH-APWZRJJASA-N 1 0 313.441 4.173 20 10 DICDRO C[C@@H]([NH2+]CC1(CCO)CCCC1)c1ccc2ccccc2c1O ZINC000273620032 130145548 /nfs/dbraw/zinc/14/55/48/130145548.db2.gz YTEQFEZUUFFZHL-OAHLLOKOSA-N 1 0 313.441 4.139 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)c(O)c1C ZINC000274756782 130259600 /nfs/dbraw/zinc/25/96/00/130259600.db2.gz JBJHQXAXBRTSKK-OAHLLOKOSA-N 1 0 313.441 4.087 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c(O)c1C ZINC000282904376 130946357 /nfs/dbraw/zinc/94/63/57/130946357.db2.gz WYOXEDDSFZJUSQ-DOTOQJQBSA-N 1 0 303.446 4.009 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000284966659 131127599 /nfs/dbraw/zinc/12/75/99/131127599.db2.gz FQWGCYMFKLQGSI-QWHCGFSZSA-N 1 0 302.418 4.068 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3[nH]c(C)cc3c2)c1 ZINC000285523704 131176793 /nfs/dbraw/zinc/17/67/93/131176793.db2.gz CCIFZSOMXDOFKH-CYBMUJFWSA-N 1 0 310.397 4.041 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3[nH]c(C)cc3c2)c1 ZINC000285523710 131176941 /nfs/dbraw/zinc/17/69/41/131176941.db2.gz CCIFZSOMXDOFKH-ZDUSSCGKSA-N 1 0 310.397 4.041 20 10 DICDRO CSCc1ccc(C[NH2+][C@H](C)c2ccc(F)c(F)c2[O-])cc1 ZINC000285728878 131197341 /nfs/dbraw/zinc/19/73/41/131197341.db2.gz QQILSALXIMPDIL-LLVKDONJSA-N 1 0 323.408 4.384 20 10 DICDRO C[C@H]([NH2+]CC1=CCCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000286986482 131259130 /nfs/dbraw/zinc/25/91/30/131259130.db2.gz JJSHNXPXGAINOR-KRWDZBQOSA-N 1 0 314.473 4.064 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)c1ccccc1O ZINC000287936560 131306617 /nfs/dbraw/zinc/30/66/17/131306617.db2.gz XEZIALFELZJTBV-YJBOKZPZSA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1nccn1-c1ccccc1)c1ccccc1O ZINC000287936557 131306730 /nfs/dbraw/zinc/30/67/30/131306730.db2.gz XEZIALFELZJTBV-QAPCUYQASA-N 1 0 321.424 4.380 20 10 DICDRO Cc1cc(Br)cc([C@@H](C)[NH2+]CCC(C)(F)F)c1O ZINC000297278129 132006906 /nfs/dbraw/zinc/00/69/06/132006906.db2.gz LDTMTYWBEOVOQB-SECBINFHSA-N 1 0 322.193 4.159 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cccc(OC(F)F)c2)cc1C ZINC000079080841 331681003 /nfs/dbraw/zinc/68/10/03/331681003.db2.gz QJJLWXGDRNHNCS-CYBMUJFWSA-N 1 0 321.367 4.456 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000176984771 332966813 /nfs/dbraw/zinc/96/68/13/332966813.db2.gz KOWIOKZIHQWSDE-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO C[C@H](c1ccncc1)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000172365379 333062147 /nfs/dbraw/zinc/06/21/47/333062147.db2.gz NNFCILLJICSMQV-QGZVFWFLSA-N 1 0 309.457 4.265 20 10 DICDRO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000172365375 333062178 /nfs/dbraw/zinc/06/21/78/333062178.db2.gz NNFCILLJICSMQV-KRWDZBQOSA-N 1 0 309.457 4.265 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOc2c(Cl)cccc21)c1cc(F)ccc1O ZINC000185185500 333205359 /nfs/dbraw/zinc/20/53/59/333205359.db2.gz VXDHWYBDCHVKMZ-BONVTDFDSA-N 1 0 321.779 4.359 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1ccc(N(C)C)cc1 ZINC000191859316 333283171 /nfs/dbraw/zinc/28/31/71/333283171.db2.gz WCIXCQJYOQCQFC-PBEJRMEISA-N 1 0 324.468 4.181 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1O ZINC000191860238 333283189 /nfs/dbraw/zinc/28/31/89/333283189.db2.gz SCLKIGBNVYESGA-HQRMLTQVSA-N 1 0 311.425 4.211 20 10 DICDRO C[C@H]([NH2+]CCCc1nccs1)c1cc2c(cc1O)CCCC2 ZINC000273467709 334047407 /nfs/dbraw/zinc/04/74/07/334047407.db2.gz JBKVKHGFHTZPAJ-ZDUSSCGKSA-N 1 0 316.470 4.011 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(Cl)cn1 ZINC000274943834 334067886 /nfs/dbraw/zinc/06/78/86/334067886.db2.gz UAJPVXYCNUNSQP-AWEZNQCLSA-N 1 0 315.848 4.186 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000192839141 336265480 /nfs/dbraw/zinc/26/54/80/336265480.db2.gz WZJAVWVQRAJWFF-SRVKXCTJSA-N 1 0 317.351 4.173 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc(NC(C)=O)c1)c1ccccc1O ZINC000192947224 336285589 /nfs/dbraw/zinc/28/55/89/336285589.db2.gz JEITXJTUXYNAIB-UGSOOPFHSA-N 1 0 312.413 4.153 20 10 DICDRO Fc1ccc2c(NCCCSc3nccs3)cc[nH+]c2c1 ZINC000301805163 336331367 /nfs/dbraw/zinc/33/13/67/336331367.db2.gz XNSGRZJGAIAZFU-UHFFFAOYSA-N 1 0 319.430 4.425 20 10 DICDRO COc1cccc(CNc2c(C)c(C)[nH+]c3ccccc32)c1O ZINC000302071388 336346934 /nfs/dbraw/zinc/34/69/34/336346934.db2.gz GWICBXHPEYWCMB-UHFFFAOYSA-N 1 0 308.381 4.178 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCC12CCOCC2)c1ccc(C)cc1O ZINC000370185439 336879255 /nfs/dbraw/zinc/87/92/55/336879255.db2.gz QPBPTFPJGROIIN-AEFFLSMTSA-N 1 0 303.446 4.091 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(-c2cccnc2)c1)c1ccccc1O ZINC000372096280 336921904 /nfs/dbraw/zinc/92/19/04/336921904.db2.gz ROTUBWYACJHXNV-HNNXBMFYSA-N 1 0 304.393 4.305 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccc(C)cc1O ZINC000377092204 337046665 /nfs/dbraw/zinc/04/66/65/337046665.db2.gz GWFGGRXEWFSNFK-DLBZAZTESA-N 1 0 315.388 4.404 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccc(C)cc1O ZINC000377092212 337046677 /nfs/dbraw/zinc/04/66/77/337046677.db2.gz GWFGGRXEWFSNFK-IAGOWNOFSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(O)c1 ZINC000193903029 337080025 /nfs/dbraw/zinc/08/00/25/337080025.db2.gz HWBQQVPKURBHOF-OLZOCXBDSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1cccc(C[NH+]2CCC(c3nc4ccccc4o3)CC2)c1O ZINC000179573514 337170328 /nfs/dbraw/zinc/17/03/28/337170328.db2.gz HUQKVCJPTVTMAX-UHFFFAOYSA-N 1 0 322.408 4.221 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2-n2cccn2)c(O)c1 ZINC000185742241 337250979 /nfs/dbraw/zinc/25/09/79/337250979.db2.gz GNVWEBGBMVDKGS-CVEARBPZSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1cccc2nc(C3CC[NH+](Cc4ccccc4O)CC3)oc21 ZINC000188885889 337275958 /nfs/dbraw/zinc/27/59/58/337275958.db2.gz ZXIRECBRDZZRGL-UHFFFAOYSA-N 1 0 322.408 4.221 20 10 DICDRO Fc1cc2c(cc1Cl)[C@H]([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC000527858378 337769615 /nfs/dbraw/zinc/76/96/15/337769615.db2.gz QUECRZBPROZWJH-QGZVFWFLSA-N 1 0 317.791 4.191 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C1CCC(C(F)F)CC1 ZINC000442857963 338435306 /nfs/dbraw/zinc/43/53/06/338435306.db2.gz RDRCZAZPHHXFRU-UHFFFAOYSA-N 1 0 306.400 4.400 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000475201666 339441431 /nfs/dbraw/zinc/44/14/31/339441431.db2.gz JJAMHTYYYGDLQV-CXAGYDPISA-N 1 0 308.425 4.493 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000551277208 341336872 /nfs/dbraw/zinc/33/68/72/341336872.db2.gz ARTWUICAPYQDJV-GOSISDBHSA-N 1 0 320.436 4.360 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1OC(F)F)c1ccccc1O ZINC000272816453 341630504 /nfs/dbraw/zinc/63/05/04/341630504.db2.gz DZZCQYSENHABMJ-RYUDHWBXSA-N 1 0 307.340 4.405 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](CC)c2ccccc2O)cc1F ZINC000155726291 521008532 /nfs/dbraw/zinc/00/85/32/521008532.db2.gz HEPCWBCSHUKZQD-MRXNPFEDSA-N 1 0 303.377 4.171 20 10 DICDRO CC[C@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1ccc(N(C)C)cc1 ZINC000156447436 522708678 /nfs/dbraw/zinc/70/86/78/522708678.db2.gz FXBPAFLISDMQES-ROUUACIJSA-N 1 0 316.445 4.082 20 10 DICDRO CC[C@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccc(N(C)C)cc1 ZINC000156447684 522748512 /nfs/dbraw/zinc/74/85/12/522748512.db2.gz FXBPAFLISDMQES-ZWKOTPCHSA-N 1 0 316.445 4.082 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(Cl)c1)c1ccccc1O ZINC000121094025 522878055 /nfs/dbraw/zinc/87/80/55/522878055.db2.gz XDIKPZMNINKNDW-OAHLLOKOSA-N 1 0 305.805 4.295 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1ccccc1O ZINC000157899733 522947871 /nfs/dbraw/zinc/94/78/71/522947871.db2.gz URFFMCYJHUXOLV-SJORKVTESA-N 1 0 315.388 4.486 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccccc1O ZINC000188039210 522950947 /nfs/dbraw/zinc/95/09/47/522950947.db2.gz ROOIOHGLZDVDHO-CVEARBPZSA-N 1 0 301.361 4.096 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3ccc(F)cc32)c1 ZINC000182381188 524774227 /nfs/dbraw/zinc/77/42/27/524774227.db2.gz BWXDMOAIWPFLHC-SGTLLEGYSA-N 1 0 315.388 4.268 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1N1CCCCC1)c1ccccc1O ZINC000183715204 525538113 /nfs/dbraw/zinc/53/81/13/525538113.db2.gz MRBFNVIGXQTMRB-MRXNPFEDSA-N 1 0 310.441 4.233 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@H](C2CC2)C1)c1ccc2ccccc2c1O ZINC000157634769 525574515 /nfs/dbraw/zinc/57/45/15/525574515.db2.gz ZWVVJKVWGMBIFS-CRFBAAHOSA-N 1 0 311.425 4.154 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)C1CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC000126089671 525594131 /nfs/dbraw/zinc/59/41/31/525594131.db2.gz DMGRXDMGRPOCLH-SJORKVTESA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccc(N(C)C)cc1 ZINC000180716306 525688832 /nfs/dbraw/zinc/68/88/32/525688832.db2.gz ZUWHVLUJTOLMSE-ACJLOTCBSA-N 1 0 314.404 4.066 20 10 DICDRO CSCc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000188719376 525740100 /nfs/dbraw/zinc/74/01/00/525740100.db2.gz UKJYIJBCQOHDIE-LBPRGKRZSA-N 1 0 305.418 4.245 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c(O)c1 ZINC000186010080 525743806 /nfs/dbraw/zinc/74/38/06/525743806.db2.gz PIFMLGSSTXIVLK-MLGOLLRUSA-N 1 0 301.361 4.014 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)c(O)c1 ZINC000188060594 525750146 /nfs/dbraw/zinc/75/01/46/525750146.db2.gz HNCJMPGWGAVHPV-WBMJQRKESA-N 1 0 301.361 4.014 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)CCC2 ZINC000364962687 527113593 /nfs/dbraw/zinc/11/35/93/527113593.db2.gz OPRQYGUWDHECDV-TVQRCGJNSA-N 1 0 306.406 4.024 20 10 DICDRO CCSc1cc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)ccn1 ZINC000275145673 535731521 /nfs/dbraw/zinc/73/15/21/535731521.db2.gz UIUIYXIJJDDENI-CQSZACIVSA-N 1 0 316.470 4.367 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](CCOC)c2ccco2)cc1 ZINC000272485726 535765421 /nfs/dbraw/zinc/76/54/21/535765421.db2.gz BPXNCJMGIKXYGV-MAUKXSAKSA-N 1 0 316.445 4.164 20 10 DICDRO CC[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(Cl)c1[O-] ZINC000287662846 535802741 /nfs/dbraw/zinc/80/27/41/535802741.db2.gz LTGKKGSJCGZSLF-MRXNPFEDSA-N 1 0 324.896 4.349 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCOC)c1ccc(C)o1)c1ccccc1O ZINC000274807680 535931635 /nfs/dbraw/zinc/93/16/35/535931635.db2.gz XDJZLLKXUBLYQX-HOTGVXAUSA-N 1 0 303.402 4.112 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(C)cc1O ZINC000280001497 535939414 /nfs/dbraw/zinc/93/94/14/535939414.db2.gz FXZQSHUFJCBDBD-WBVHZDCISA-N 1 0 303.446 4.233 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(OC)c(OC)c1 ZINC000287539953 535943470 /nfs/dbraw/zinc/94/34/70/535943470.db2.gz PFNIVAKUNSNXRR-CJNGLKHVSA-N 1 0 315.413 4.211 20 10 DICDRO COC1CCN(c2ccc(C[NH2+][C@@H](C)c3ccccc3)cc2)CC1 ZINC000294915249 536758339 /nfs/dbraw/zinc/75/83/39/536758339.db2.gz GAWORMSGKRYDDI-KRWDZBQOSA-N 1 0 324.468 4.153 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1ccco1 ZINC000273470211 536807931 /nfs/dbraw/zinc/80/79/31/536807931.db2.gz RWOJHZBNWMKERK-GOEBONIOSA-N 1 0 303.402 4.030 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1ccco1 ZINC000273470219 536817827 /nfs/dbraw/zinc/81/78/27/536817827.db2.gz RWOJHZBNWMKERK-ZBFHGGJFSA-N 1 0 303.402 4.030 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)c(C)c1OC ZINC000287190804 536903194 /nfs/dbraw/zinc/90/31/94/536903194.db2.gz VUUSNFDBSGKRBD-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000728198396 1035726684 /nfs/dbraw/zinc/72/66/84/1035726684.db2.gz CYNQUWPWBYHHLX-MRXNPFEDSA-N 1 0 303.446 4.160 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](CC)c2ccccc2O)cc1OC ZINC000155115063 1036134021 /nfs/dbraw/zinc/13/40/21/1036134021.db2.gz FNANDENAHMQTEP-INIZCTEOSA-N 1 0 315.413 4.040 20 10 DICDRO CC[C@H](c1ccncc1)[N@H+](CC)Cc1cc(OC)c(C)cc1O ZINC000160282256 1036355456 /nfs/dbraw/zinc/35/54/56/1036355456.db2.gz AUAXFIMKGGSIPA-QGZVFWFLSA-N 1 0 314.429 4.077 20 10 DICDRO Cc1csc([C@H](C)[NH2+]Cc2ccc(N3CCCCC3)cc2)n1 ZINC000069168576 1036574177 /nfs/dbraw/zinc/57/41/77/1036574177.db2.gz VLVXTSUYBUBUMQ-HNNXBMFYSA-N 1 0 315.486 4.293 20 10 DICDRO C[C@H](Cc1ccccc1Cl)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001648816863 1036576882 /nfs/dbraw/zinc/57/68/82/1036576882.db2.gz KKOXAQCEZWVAGM-CQSZACIVSA-N 1 0 315.844 4.386 20 10 DICDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccc(OC)c(C)c2)cc1 ZINC001167321774 1036703060 /nfs/dbraw/zinc/70/30/60/1036703060.db2.gz KKMJODKMEPCSLP-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCCc3cc(OC)ccc3C2)cc1 ZINC001167325953 1036735832 /nfs/dbraw/zinc/73/58/32/1036735832.db2.gz HSORNEUPLOARQR-UHFFFAOYSA-N 1 0 324.468 4.100 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000083551624 1036894995 /nfs/dbraw/zinc/89/49/95/1036894995.db2.gz DSQXTDFJRWANMF-UHFFFAOYSA-N 1 0 315.722 4.354 20 10 DICDRO Cc1csc(CCCC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)n1 ZINC000160658300 1037323976 /nfs/dbraw/zinc/32/39/76/1037323976.db2.gz TZMIBQKGXNERCL-HNNXBMFYSA-N 1 0 317.502 4.191 20 10 DICDRO Oc1cccc(Cl)c1C[NH+]1CCC2(CC(F)(F)C2)CC1 ZINC001140338190 1037471679 /nfs/dbraw/zinc/47/16/79/1037471679.db2.gz ZJDYFJKYYVKINR-UHFFFAOYSA-N 1 0 301.764 4.057 20 10 DICDRO CC[C@@H]([NH2+]CCc1scnc1C)c1cc(Cl)ccc1O ZINC000834881575 1037695697 /nfs/dbraw/zinc/69/56/97/1037695697.db2.gz UNTIWIMEUKTLDX-CYBMUJFWSA-N 1 0 310.850 4.094 20 10 DICDRO Oc1cccc(Br)c1C[NH+]1C2CCCC1CCC2 ZINC000707128658 1037808155 /nfs/dbraw/zinc/80/81/55/1037808155.db2.gz ZCJOSBBABVOIJZ-UHFFFAOYSA-N 1 0 310.235 4.062 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)c2ccc(C)s2)c1O ZINC000228672078 1038016544 /nfs/dbraw/zinc/01/65/44/1038016544.db2.gz OZYDYNXHKXLKDQ-JTQLQIEISA-N 1 0 311.834 4.275 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)c2ccc(C)s2)c1O ZINC000228672089 1038017729 /nfs/dbraw/zinc/01/77/29/1038017729.db2.gz OZYDYNXHKXLKDQ-SNVBAGLBSA-N 1 0 311.834 4.275 20 10 DICDRO Oc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000276641380 1038060512 /nfs/dbraw/zinc/06/05/12/1038060512.db2.gz QQGFFSKKYLEJKF-FQEVSTJZSA-N 1 0 322.452 4.160 20 10 DICDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(Cl)cc1O ZINC001140466058 1038145582 /nfs/dbraw/zinc/14/55/82/1038145582.db2.gz VRDXCDFUPNZRFT-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO CCN(C)c1ccc(C[N@H+](CC)[C@@H](C)c2cccc(O)c2)cc1 ZINC001167525791 1038547708 /nfs/dbraw/zinc/54/77/08/1038547708.db2.gz KLXFQSQXMAMJLI-INIZCTEOSA-N 1 0 312.457 4.431 20 10 DICDRO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+](C)Cc1ccccc1O ZINC000152295499 1038606052 /nfs/dbraw/zinc/60/60/52/1038606052.db2.gz OPVGXOSDYHTKKW-CQSZACIVSA-N 1 0 308.381 4.240 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)s1 ZINC000050286851 1038772103 /nfs/dbraw/zinc/77/21/03/1038772103.db2.gz DPIWUCFYGRXHPH-CQSZACIVSA-N 1 0 300.471 4.290 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccs1 ZINC000050286873 1038773172 /nfs/dbraw/zinc/77/31/72/1038773172.db2.gz RKYMOIXQMRSJMJ-MRXNPFEDSA-N 1 0 300.471 4.371 20 10 DICDRO Cc1cc(C[N@@H+]2CCSC3(CCCCC3)C2)ccc1N(C)C ZINC001167619580 1038942889 /nfs/dbraw/zinc/94/28/89/1038942889.db2.gz MKZJGFKJJUJWCP-UHFFFAOYSA-N 1 0 318.530 4.313 20 10 DICDRO C[C@@]1(F)CCC[N@H+](Cc2cccc(C(F)(F)F)c2[O-])CC1 ZINC001233416131 1039414026 /nfs/dbraw/zinc/41/40/26/1039414026.db2.gz WYJKJMYPCTUGSW-CQSZACIVSA-N 1 0 305.315 4.125 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOC[C@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000278568624 1039558099 /nfs/dbraw/zinc/55/80/99/1039558099.db2.gz PJTWOPXJVWBSIG-FUHIMQAGSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@H]1CC1(Cl)Cl ZINC001203223763 1039650586 /nfs/dbraw/zinc/65/05/86/1039650586.db2.gz ZYEDEHAHHIFFBS-LBPRGKRZSA-N 1 0 311.256 4.160 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3cccc(O)c3C2)cc(C(F)(F)F)c1 ZINC001143458693 1040118155 /nfs/dbraw/zinc/11/81/55/1040118155.db2.gz QVVBWXZVLSDYJF-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(SC)cc2)c1O ZINC000282362116 1040917340 /nfs/dbraw/zinc/91/73/40/1040917340.db2.gz WHAZIZRYWYKQLU-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)CCO)c1ccc(N2CCCCCC2)cc1 ZINC000178164705 1040978781 /nfs/dbraw/zinc/97/87/81/1040978781.db2.gz RZNUZDXYZDEZAT-KRWDZBQOSA-N 1 0 318.505 4.126 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)c1ccc(C)o1 ZINC000808699917 1041007218 /nfs/dbraw/zinc/00/72/18/1041007218.db2.gz DTBRZXFYURXZQF-DOMZBBRYSA-N 1 0 323.820 4.294 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)C1CCOCC1 ZINC000808700178 1041008671 /nfs/dbraw/zinc/00/86/71/1041008671.db2.gz IQDGJQHJVYNMMU-LRDDRELGSA-N 1 0 311.853 4.210 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](CCO)CC(C)C)c1O ZINC000808700284 1041009400 /nfs/dbraw/zinc/00/94/00/1041009400.db2.gz KAAROGOCTDCMMR-KGLIPLIRSA-N 1 0 313.869 4.049 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](CO)c2ccccc2C)c1O ZINC000808700731 1041012376 /nfs/dbraw/zinc/01/23/76/1041012376.db2.gz PKIIVTMIALSFKJ-CXAGYDPISA-N 1 0 319.832 4.047 20 10 DICDRO CC(C)OCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178193480 1041035718 /nfs/dbraw/zinc/03/57/18/1041035718.db2.gz QSSJXQKGKPMBOU-KRWDZBQOSA-N 1 0 304.478 4.143 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccsc1 ZINC000178204886 1041085290 /nfs/dbraw/zinc/08/52/90/1041085290.db2.gz GWGQDXAOMLGUJR-CQSZACIVSA-N 1 0 318.511 4.152 20 10 DICDRO c1cc([C@@H]2CCCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)n[nH]1 ZINC000809693147 1041214178 /nfs/dbraw/zinc/21/41/78/1041214178.db2.gz ORQYEFVVWHAYDT-FQEVSTJZSA-N 1 0 324.472 4.127 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)c(Cl)c2)c1 ZINC000053150101 1041221255 /nfs/dbraw/zinc/22/12/55/1041221255.db2.gz MIVZGDWUYHVRBA-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1 ZINC000809728660 1041225543 /nfs/dbraw/zinc/22/55/43/1041225543.db2.gz DYPMUPNQYXTZOY-HXUWFJFHSA-N 1 0 309.457 4.265 20 10 DICDRO CCSCC[N@H+](Cc1ccco1)Cc1ccc(N(C)C)cc1 ZINC000809731591 1041226316 /nfs/dbraw/zinc/22/63/16/1041226316.db2.gz KPIGKMKMFWRGSV-UHFFFAOYSA-N 1 0 318.486 4.101 20 10 DICDRO c1cc([C@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)ccn1 ZINC000809728922 1041227084 /nfs/dbraw/zinc/22/70/84/1041227084.db2.gz LLCYWTKJVMXZNG-OAQYLSRUSA-N 1 0 321.468 4.409 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCC[C@H]2c2ccc(C)cc2)c1O ZINC000809740259 1041239375 /nfs/dbraw/zinc/23/93/75/1041239375.db2.gz RHWKUYDNGMRHHJ-ZWKOTPCHSA-N 1 0 311.425 4.135 20 10 DICDRO COc1cccc(C[NH2+]Cc2ccc(-c3ccccc3)cc2)c1O ZINC000809740302 1041240089 /nfs/dbraw/zinc/24/00/89/1041240089.db2.gz SXDBWEVNYVMVRQ-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1cc(F)ccc1O ZINC000809780773 1041255232 /nfs/dbraw/zinc/25/52/32/1041255232.db2.gz JBRAUHWFWHRJHS-MRXNPFEDSA-N 1 0 303.377 4.123 20 10 DICDRO CCOc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c(O)c1 ZINC000809782933 1041255388 /nfs/dbraw/zinc/25/53/88/1041255388.db2.gz LHZLNWPTAOMIKW-QGZVFWFLSA-N 1 0 317.454 4.436 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(C)n1)c1ccc(C(F)(F)F)cc1O ZINC000810211551 1041337262 /nfs/dbraw/zinc/33/72/62/1041337262.db2.gz SXQYJFMPKNRJCM-OAHLLOKOSA-N 1 0 324.346 4.355 20 10 DICDRO CC[C@H]([NH2+]CCc1ccncc1)c1ccc(C(F)(F)F)cc1O ZINC000810223407 1041341928 /nfs/dbraw/zinc/34/19/28/1041341928.db2.gz LFAZNFFIZQWIDZ-HNNXBMFYSA-N 1 0 324.346 4.089 20 10 DICDRO CC[C@H]([NH2+]Cc1cncc(C)c1)c1ccc(C(F)(F)F)cc1O ZINC000810229224 1041343335 /nfs/dbraw/zinc/34/33/35/1041343335.db2.gz UWBVBUHJQRPMTF-HNNXBMFYSA-N 1 0 324.346 4.355 20 10 DICDRO CO[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000810257724 1041349211 /nfs/dbraw/zinc/34/92/11/1041349211.db2.gz UVNVINYQIHGRHP-IXDOHACOSA-N 1 0 304.478 4.141 20 10 DICDRO CC(C)N(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000810245139 1041356479 /nfs/dbraw/zinc/35/64/79/1041356479.db2.gz SIXHGAJQQZUZIT-ROUUACIJSA-N 1 0 317.521 4.056 20 10 DICDRO CC(C)CCn1cccc1C[NH2+]CCCSc1nccs1 ZINC000236635927 1041392939 /nfs/dbraw/zinc/39/29/39/1041392939.db2.gz HJOYHJCKWADKGQ-UHFFFAOYSA-N 1 0 323.531 4.263 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)CCc2ccco2)cc1 ZINC000314082272 1041428573 /nfs/dbraw/zinc/42/85/73/1041428573.db2.gz VXPFGJHYEJSOAR-INIZCTEOSA-N 1 0 300.446 4.237 20 10 DICDRO Cc1nc2ccccc2n1CCC[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000184869998 1041600240 /nfs/dbraw/zinc/60/02/40/1041600240.db2.gz UPMWMGZHXRZUPW-HNNXBMFYSA-N 1 0 323.440 4.100 20 10 DICDRO CCCCOc1ncccc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185143692 1041607494 /nfs/dbraw/zinc/60/74/94/1041607494.db2.gz PMGJPSWAABRURA-HNNXBMFYSA-N 1 0 314.429 4.125 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCCCC(=O)OC(C)(C)C)c1 ZINC000185597300 1041617974 /nfs/dbraw/zinc/61/79/74/1041617974.db2.gz ZRMBOUHHSYVPLH-HNNXBMFYSA-N 1 0 321.461 4.253 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C)cs2)cc1 ZINC000162325733 1041617978 /nfs/dbraw/zinc/61/79/78/1041617978.db2.gz CBYWZVPCEITVFM-KGLIPLIRSA-N 1 0 303.475 4.319 20 10 DICDRO CCO[C@@H](CC[NH2+][C@@H](C)c1cc(OC)ccc1O)C1CCCC1 ZINC000185634973 1041619285 /nfs/dbraw/zinc/61/92/85/1041619285.db2.gz GFCKZFPVDYTUBQ-LIRRHRJNSA-N 1 0 321.461 4.037 20 10 DICDRO CO[C@@](C)(C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C1CC1 ZINC000812733882 1041642278 /nfs/dbraw/zinc/64/22/78/1041642278.db2.gz DCMPISWNFNNANZ-JXFKEZNVSA-N 1 0 316.489 4.143 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)cc1 ZINC000812781238 1041647175 /nfs/dbraw/zinc/64/71/75/1041647175.db2.gz MIWXDRJUYSMWEC-CVEARBPZSA-N 1 0 314.395 4.306 20 10 DICDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756534354 1041691124 /nfs/dbraw/zinc/69/11/24/1041691124.db2.gz KHJCSEUNHQWUCA-CHWSQXEVSA-N 1 0 319.832 4.423 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccn2CCC(C)C)c1 ZINC000813331486 1041698722 /nfs/dbraw/zinc/69/87/22/1041698722.db2.gz PONQKLXVQKYMKW-OAHLLOKOSA-N 1 0 316.445 4.099 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCCC[C@@H]2CC)ccc1OC ZINC000747854623 1041702866 /nfs/dbraw/zinc/70/28/66/1041702866.db2.gz UADFFOKHVOXROV-FUHWJXTLSA-N 1 0 305.462 4.290 20 10 DICDRO Cc1cc(Br)c([O-])c(C[N@@H+](C)[C@@H](C)c2ccco2)c1 ZINC000781898559 1041705817 /nfs/dbraw/zinc/70/58/17/1041705817.db2.gz ZMIFBROXNJWSHQ-NSHDSACASA-N 1 0 324.218 4.249 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2cccc(SCC)c2)c(O)c1 ZINC000813790838 1041732846 /nfs/dbraw/zinc/73/28/46/1041732846.db2.gz FVQNPRGJJVNEPW-UHFFFAOYSA-N 1 0 317.454 4.193 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1 ZINC000813872481 1041740271 /nfs/dbraw/zinc/74/02/71/1041740271.db2.gz HCEABOOPYZKIGM-QWHCGFSZSA-N 1 0 313.388 4.267 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)c1cc(F)ccc1O ZINC000813872997 1041740352 /nfs/dbraw/zinc/74/03/52/1041740352.db2.gz MVGUDXAXTXLQGO-NWDGAFQWSA-N 1 0 301.352 4.398 20 10 DICDRO CCSc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000813885532 1041742410 /nfs/dbraw/zinc/74/24/10/1041742410.db2.gz UWMYXOQQBCUBAC-GFCCVEGCSA-N 1 0 305.418 4.494 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2cccs2)c1O ZINC000162696847 1041771339 /nfs/dbraw/zinc/77/13/39/1041771339.db2.gz SHTFLOZKTYNNJR-AWEZNQCLSA-N 1 0 303.427 4.190 20 10 DICDRO CSC1(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000193816307 1041776756 /nfs/dbraw/zinc/77/67/56/1041776756.db2.gz AZYCHEQQNNUUAP-HNNXBMFYSA-N 1 0 304.503 4.223 20 10 DICDRO Oc1ccccc1C[N@@H+]1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000814178955 1041780128 /nfs/dbraw/zinc/78/01/28/1041780128.db2.gz KNAFPYIZTVQEAR-MRXNPFEDSA-N 1 0 319.857 4.412 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(Cl)cc1 ZINC000756608461 1041787881 /nfs/dbraw/zinc/78/78/81/1041787881.db2.gz CDJUZOMADLSEHS-FZKQIMNGSA-N 1 0 319.832 4.392 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000814301623 1041808624 /nfs/dbraw/zinc/80/86/24/1041808624.db2.gz YXPABKXFNFJYSC-MQMHXKEQSA-N 1 0 305.780 4.221 20 10 DICDRO C[C@@H]([NH2+][C@@H](CCO)C1CCCCC1)c1cc(Cl)ccc1O ZINC000756661750 1041851586 /nfs/dbraw/zinc/85/15/86/1041851586.db2.gz VEZYNWWXTIUZGO-WBMJQRKESA-N 1 0 311.853 4.028 20 10 DICDRO Cc1cc(C[N@H+](CCC(F)(F)F)CC2CC2)ccc1N(C)C ZINC000815060125 1041909942 /nfs/dbraw/zinc/90/99/42/1041909942.db2.gz OKMFBTCUHZYBMN-UHFFFAOYSA-N 1 0 314.395 4.225 20 10 DICDRO Cc1cc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)ccc1N(C)C ZINC000815082638 1041912277 /nfs/dbraw/zinc/91/22/77/1041912277.db2.gz AMWMEARONXTQTK-UHFFFAOYSA-N 1 0 318.411 4.364 20 10 DICDRO Cc1cc(C[NH+]2CCC(CC(F)(F)F)CC2)ccc1N(C)C ZINC000815112801 1041913500 /nfs/dbraw/zinc/91/35/00/1041913500.db2.gz CLZIYWDUHFVGGX-UHFFFAOYSA-N 1 0 314.395 4.225 20 10 DICDRO Cc1cc(C[NH2+]C(C)(C)c2ccccc2F)ccc1N(C)C ZINC000815121865 1041914600 /nfs/dbraw/zinc/91/46/00/1041914600.db2.gz ZDZCQJGYSBLSBD-UHFFFAOYSA-N 1 0 300.421 4.225 20 10 DICDRO CCOCc1cc(C[NH2+]C2CC(C(C)(C)C)C2)ccc1OC ZINC000815146331 1041926298 /nfs/dbraw/zinc/92/62/98/1041926298.db2.gz FCGPRAWZNBORQN-UHFFFAOYSA-N 1 0 305.462 4.146 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1cccc(Cl)c1 ZINC000756734650 1041952263 /nfs/dbraw/zinc/95/22/63/1041952263.db2.gz XZRJEMBGSHOTFI-APPDUMDISA-N 1 0 323.795 4.223 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCc1ccco1 ZINC000815553815 1041961661 /nfs/dbraw/zinc/96/16/61/1041961661.db2.gz KWEULSWKVYLYLX-FQEVSTJZSA-N 1 0 321.420 4.491 20 10 DICDRO CCOCc1ccc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000815558440 1041962771 /nfs/dbraw/zinc/96/27/71/1041962771.db2.gz CYOXZCHXSIURBR-INIZCTEOSA-N 1 0 313.441 4.396 20 10 DICDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000815571326 1041972126 /nfs/dbraw/zinc/97/21/26/1041972126.db2.gz APCQUTLPFRTEJN-CYBMUJFWSA-N 1 0 304.384 4.190 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CCC=CO1 ZINC000815618997 1041975396 /nfs/dbraw/zinc/97/53/96/1041975396.db2.gz ZMQNIDVLENALMC-ICSRJNTNSA-N 1 0 323.436 4.348 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](c2ccccc2)C2CC2)c1 ZINC000815630576 1041978245 /nfs/dbraw/zinc/97/82/45/1041978245.db2.gz OHYLLYKMWBPGHM-AUUYWEPGSA-N 1 0 311.425 4.245 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H](c2ccccc2)C2CC2)c1 ZINC000815630579 1041978370 /nfs/dbraw/zinc/97/83/70/1041978370.db2.gz OHYLLYKMWBPGHM-LIRRHRJNSA-N 1 0 311.425 4.245 20 10 DICDRO CC[C@@H](C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O)OC ZINC000815628318 1041978549 /nfs/dbraw/zinc/97/85/49/1041978549.db2.gz XPQCNHCTOWJBTO-HKUYNNGSSA-N 1 0 313.441 4.081 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c1 ZINC000815632314 1041978602 /nfs/dbraw/zinc/97/86/02/1041978602.db2.gz JVBPVNIQOFTEQK-XNRPHZJLSA-N 1 0 315.388 4.137 20 10 DICDRO COCC1(CC[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CCC1 ZINC000815641633 1041983290 /nfs/dbraw/zinc/98/32/90/1041983290.db2.gz DHIIBMAHGXQSOF-OAHLLOKOSA-N 1 0 317.473 4.128 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)C(C)(C)O ZINC000815652348 1041985102 /nfs/dbraw/zinc/98/51/02/1041985102.db2.gz YXPSXWICKPBEGI-APWZRJJASA-N 1 0 318.505 4.267 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CC)C(C)(C)O)c1ccc(C(F)(F)F)cc1O ZINC000815651953 1041986967 /nfs/dbraw/zinc/98/69/67/1041986967.db2.gz JWRGPRXMCFMIJF-OCCSQVGLSA-N 1 0 319.367 4.001 20 10 DICDRO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1c(O)cccc1Cl)CCC2 ZINC000125583900 1042014614 /nfs/dbraw/zinc/01/46/14/1042014614.db2.gz VPKBKVPEHNRXEL-AWEZNQCLSA-N 1 0 322.861 4.320 20 10 DICDRO Cc1nc(C)c([C@H](C)[NH2+]CCCSc2nccs2)s1 ZINC000178462998 1042025609 /nfs/dbraw/zinc/02/56/09/1042025609.db2.gz PFJUOTLHEKGORF-VIFPVBQESA-N 1 0 313.517 4.049 20 10 DICDRO Oc1c(C[NH+]2CCC(C(F)(F)F)CC2)ccc2ccccc21 ZINC000816484290 1042055663 /nfs/dbraw/zinc/05/56/63/1042055663.db2.gz WVNVYGYQVWZUML-UHFFFAOYSA-N 1 0 309.331 4.320 20 10 DICDRO CC(C)(C)OC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000816496769 1042057643 /nfs/dbraw/zinc/05/76/43/1042057643.db2.gz WNWHLYPECDQFLF-UHFFFAOYSA-N 1 0 313.441 4.325 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@H]2c2ccccn2)ccc2ccccc21 ZINC000816487094 1042057711 /nfs/dbraw/zinc/05/77/11/1042057711.db2.gz CUOWBJVJDWKTML-IBGZPJMESA-N 1 0 304.393 4.278 20 10 DICDRO CS[C@@H]1CCCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816520944 1042060050 /nfs/dbraw/zinc/06/00/50/1042060050.db2.gz BTJHMDIHCPSUOY-MRXNPFEDSA-N 1 0 301.455 4.263 20 10 DICDRO Oc1c(C[NH2+]CCSc2ccccc2)ccc2ccccc21 ZINC000816530102 1042061974 /nfs/dbraw/zinc/06/19/74/1042061974.db2.gz UDGKOAFJJMLHFF-UHFFFAOYSA-N 1 0 309.434 4.427 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC000816535410 1042062832 /nfs/dbraw/zinc/06/28/32/1042062832.db2.gz NTZMEVNDIUMVAR-UHFFFAOYSA-N 1 0 307.393 4.234 20 10 DICDRO Oc1c(C[NH2+]CC2(c3ccccc3)CC2)ccc2ccccc21 ZINC000816532910 1042063372 /nfs/dbraw/zinc/06/33/72/1042063372.db2.gz ASZFGOVOVZUSDJ-UHFFFAOYSA-N 1 0 303.405 4.367 20 10 DICDRO CCN(C)c1ccccc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816548213 1042065296 /nfs/dbraw/zinc/06/52/96/1042065296.db2.gz ZTSCKLUICOXQAE-UHFFFAOYSA-N 1 0 320.436 4.291 20 10 DICDRO COc1cc(C)ccc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816557296 1042067666 /nfs/dbraw/zinc/06/76/66/1042067666.db2.gz LFGNZDVVILNBFZ-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO Oc1c(C[NH2+]Cc2cccc3cccnc32)ccc2ccccc21 ZINC000816562160 1042068769 /nfs/dbraw/zinc/06/87/69/1042068769.db2.gz AWMFYUZEQVWWCB-UHFFFAOYSA-N 1 0 314.388 4.383 20 10 DICDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816559626 1042068838 /nfs/dbraw/zinc/06/88/38/1042068838.db2.gz PSHSQNGKIKDQLM-FUHWJXTLSA-N 1 0 313.441 4.229 20 10 DICDRO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816560679 1042069241 /nfs/dbraw/zinc/06/92/41/1042069241.db2.gz XGBZDIWYSFZPIJ-ZWKOTPCHSA-N 1 0 313.441 4.229 20 10 DICDRO [O-]c1cc(F)c(Cl)cc1C[NH2+]Cc1ccc2ncccc2c1 ZINC000816595126 1042070110 /nfs/dbraw/zinc/07/01/10/1042070110.db2.gz AMKVMRIGKSTTQD-UHFFFAOYSA-N 1 0 316.763 4.023 20 10 DICDRO C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc3ccccc3c2O)C[C@H](C)O1 ZINC000816601020 1042071238 /nfs/dbraw/zinc/07/12/38/1042071238.db2.gz ORAIEUIJSPVSSG-MUJYYYPQSA-N 1 0 313.441 4.229 20 10 DICDRO Oc1c(C[NH2+]C[C@H]2CCCC(F)(F)C2)ccc2ccccc21 ZINC000816599270 1042071436 /nfs/dbraw/zinc/07/14/36/1042071436.db2.gz HQXHNKASLWBZIG-ZDUSSCGKSA-N 1 0 305.368 4.461 20 10 DICDRO Oc1c(C[N@@H+]2CCC=C(c3ccco3)C2)ccc2ccccc21 ZINC000816608224 1042071569 /nfs/dbraw/zinc/07/15/69/1042071569.db2.gz SJILFDZECYPYJY-UHFFFAOYSA-N 1 0 305.377 4.428 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c1O ZINC000816619398 1042072625 /nfs/dbraw/zinc/07/26/25/1042072625.db2.gz FAPJQYCQEKGSAH-KRWDZBQOSA-N 1 0 311.425 4.171 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000817408885 1042107277 /nfs/dbraw/zinc/10/72/77/1042107277.db2.gz RKGULWXKSQOSTB-HNNXBMFYSA-N 1 0 321.779 4.188 20 10 DICDRO COc1cccc(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)c1O ZINC000817416097 1042108579 /nfs/dbraw/zinc/10/85/79/1042108579.db2.gz IKYAXZJSUPMQIJ-ZDUSSCGKSA-N 1 0 305.443 4.434 20 10 DICDRO COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000817574491 1042115062 /nfs/dbraw/zinc/11/50/62/1042115062.db2.gz OVPIRDDSLXWVGP-LBPRGKRZSA-N 1 0 317.816 4.134 20 10 DICDRO C[C@H]([NH2+]CCCC1(O)CCC1)c1ccc(N2CCCCC2)cc1 ZINC000817587193 1042118933 /nfs/dbraw/zinc/11/89/33/1042118933.db2.gz VYLIVKHOMIOGCN-KRWDZBQOSA-N 1 0 316.489 4.023 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CC12CCSCC2)c1cc(Cl)ccc1O ZINC000817588071 1042119543 /nfs/dbraw/zinc/11/95/43/1042119543.db2.gz BRXNSOBWQCQDFQ-RYUDHWBXSA-N 1 0 311.878 4.230 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cc(C)n1 ZINC000817590434 1042120081 /nfs/dbraw/zinc/12/00/81/1042120081.db2.gz WVGCDAIASZODEB-CYBMUJFWSA-N 1 0 304.821 4.217 20 10 DICDRO Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]CCc2ccc(N)cc2)c1 ZINC000817956354 1042131278 /nfs/dbraw/zinc/13/12/78/1042131278.db2.gz XDCVNAMLZNYJIB-CYBMUJFWSA-N 1 0 320.383 4.072 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](N)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000817955313 1042131666 /nfs/dbraw/zinc/13/16/66/1042131666.db2.gz VOFSAURISWUSDN-DYESRHJHSA-N 1 0 323.484 4.028 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(OC(F)F)cc1 ZINC000817955821 1042131714 /nfs/dbraw/zinc/13/17/14/1042131714.db2.gz IOAGTSLXBBCIDB-KRWDZBQOSA-N 1 0 320.383 4.154 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(C(F)(F)F)cc1 ZINC000817956019 1042131755 /nfs/dbraw/zinc/13/17/55/1042131755.db2.gz NTKQVXAIZLWVLL-LBPRGKRZSA-N 1 0 308.347 4.181 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000817957648 1042132469 /nfs/dbraw/zinc/13/24/69/1042132469.db2.gz NSIGDZZTRSIGSA-TUKIKUTGSA-N 1 0 320.889 4.308 20 10 DICDRO COc1c(C)cc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1Cl ZINC000817958549 1042132697 /nfs/dbraw/zinc/13/26/97/1042132697.db2.gz XEHACQIOVZVLBG-CYBMUJFWSA-N 1 0 318.848 4.133 20 10 DICDRO Cc1cc2c(cc1C)[C@@H]([NH2+]CCc1ccc(N)cc1)CCS2 ZINC000817957920 1042132777 /nfs/dbraw/zinc/13/27/77/1042132777.db2.gz QTDDFQDGASLAFE-SFHVURJKSA-N 1 0 312.482 4.255 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)c(O)c1 ZINC000817977821 1042134568 /nfs/dbraw/zinc/13/45/68/1042134568.db2.gz PVJFSKRKDFHWNO-OAHLLOKOSA-N 1 0 310.441 4.218 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000817976709 1042134884 /nfs/dbraw/zinc/13/48/84/1042134884.db2.gz RZOKANNIIWOFNS-GXFFZTMASA-N 1 0 319.276 4.257 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1cc(Cl)ccc1O ZINC000817968094 1042135267 /nfs/dbraw/zinc/13/52/67/1042135267.db2.gz PAHCCBYFZLFPSY-APPDUMDISA-N 1 0 316.832 4.356 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccc(N(C)C)cc1 ZINC000817978066 1042135650 /nfs/dbraw/zinc/13/56/50/1042135650.db2.gz UZDSWTRHZJTUBQ-HXUWFJFHSA-N 1 0 323.484 4.352 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c(Cl)c1 ZINC000818329890 1042147710 /nfs/dbraw/zinc/14/77/10/1042147710.db2.gz HQRBAXGGGCGDLG-GFCCVEGCSA-N 1 0 317.816 4.134 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cccc(Cl)c2C1)c1ccccc1O ZINC001170901224 1042148840 /nfs/dbraw/zinc/14/88/40/1042148840.db2.gz CDPRSNDJKAUPPM-JSGCOSHPSA-N 1 0 301.817 4.254 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3cccc(Cl)c3C2)cc1 ZINC001170907703 1042154061 /nfs/dbraw/zinc/15/40/61/1042154061.db2.gz KDXRCXIWJAUQHY-INIZCTEOSA-N 1 0 314.860 4.053 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(Cl)nc1)c1ccc(N(C)C)cc1 ZINC000165494694 1042157650 /nfs/dbraw/zinc/15/76/50/1042157650.db2.gz NDEJZFSYLUEUCB-INIZCTEOSA-N 1 0 303.837 4.042 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 ZINC000165885177 1042189678 /nfs/dbraw/zinc/18/96/78/1042189678.db2.gz AOVWEWXXBDGPGF-MSOLQXFVSA-N 1 0 324.468 4.243 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 ZINC000165885298 1042190057 /nfs/dbraw/zinc/19/00/57/1042190057.db2.gz AOVWEWXXBDGPGF-ROUUACIJSA-N 1 0 324.468 4.243 20 10 DICDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001204673700 1042298389 /nfs/dbraw/zinc/29/83/89/1042298389.db2.gz OGRDNERPXTXBKW-SUMWQHHRSA-N 1 0 310.432 4.431 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2CCCc3ccc(F)cc32)c1O ZINC000279895059 1042349045 /nfs/dbraw/zinc/34/90/45/1042349045.db2.gz VMPHPIQMXZRLBJ-KRWDZBQOSA-N 1 0 315.388 4.097 20 10 DICDRO Cc1ccc([C@@H]([NH2+]Cc2cc(F)ccc2O)c2ccccn2)cc1 ZINC000366249424 1042365524 /nfs/dbraw/zinc/36/55/24/1042365524.db2.gz KADNQQCCLAMGBV-HXUWFJFHSA-N 1 0 322.383 4.114 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccc(C)cc1O ZINC000279930478 1042385694 /nfs/dbraw/zinc/38/56/94/1042385694.db2.gz AQMPFBPNAVBSBY-KCQAQPDRSA-N 1 0 316.449 4.134 20 10 DICDRO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000236990371 1042447017 /nfs/dbraw/zinc/44/70/17/1042447017.db2.gz CHAPORMHRTYJBZ-LJQANCHMSA-N 1 0 312.457 4.392 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C(C)(C)c2ccc(CC)cc2)c1 ZINC000237032702 1042466877 /nfs/dbraw/zinc/46/68/77/1042466877.db2.gz TWSBHHUDADOSPP-UHFFFAOYSA-N 1 0 313.441 4.378 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2cc(C)sc2C)c1O ZINC000894165290 1042480812 /nfs/dbraw/zinc/48/08/12/1042480812.db2.gz OOWPZYBWMCUDFV-LBPRGKRZSA-N 1 0 305.443 4.238 20 10 DICDRO Cc1cc(C)c(O)c(C[NH+]2CCC(OCCC(C)C)CC2)c1 ZINC000178859682 1042518932 /nfs/dbraw/zinc/51/89/32/1042518932.db2.gz GIOCRXDEDTZVBA-UHFFFAOYSA-N 1 0 305.462 4.036 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3ncccc3c2)c(O)c1C ZINC000280130172 1042565379 /nfs/dbraw/zinc/56/53/79/1042565379.db2.gz OUTFATBSECPRPZ-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccc(C)cc1O ZINC000280156267 1042566551 /nfs/dbraw/zinc/56/65/51/1042566551.db2.gz QLDYBWQHZROMOQ-DLBZAZTESA-N 1 0 315.388 4.404 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccc(C)cc1O ZINC000280272598 1042568832 /nfs/dbraw/zinc/56/88/32/1042568832.db2.gz YAKYTMNENCXERN-MLGOLLRUSA-N 1 0 302.418 4.150 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCc2ccccc2F)c(Cl)c1 ZINC001204736091 1042615123 /nfs/dbraw/zinc/61/51/23/1042615123.db2.gz HQEHWZYRNIMOAO-UHFFFAOYSA-N 1 0 307.796 4.168 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(OC)ccc2O)cc1 ZINC000319705776 1042681295 /nfs/dbraw/zinc/68/12/95/1042681295.db2.gz NHFQYYUSRTVYRA-ZIAGYGMSSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2ccc(C)cc2SC)c1O ZINC000894333014 1042855381 /nfs/dbraw/zinc/85/53/81/1042855381.db2.gz SUYBMFLOXGTWPS-UHFFFAOYSA-N 1 0 317.454 4.029 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](CC)c2ccc(C)cc2O)C12CCC2 ZINC000794803695 1043051561 /nfs/dbraw/zinc/05/15/61/1043051561.db2.gz RVOPETLYQMYWJF-RYQLBKOJSA-N 1 0 303.446 4.089 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(Cl)nc1)c1ccc(C)cc1O ZINC000794811643 1043057364 /nfs/dbraw/zinc/05/73/64/1043057364.db2.gz SWBSGQIQGXOIJF-OAHLLOKOSA-N 1 0 304.821 4.032 20 10 DICDRO CC[C@@H]([NH2+]CCc1sc(C)nc1C)c1ccc(C)cc1O ZINC000794811269 1043057794 /nfs/dbraw/zinc/05/77/94/1043057794.db2.gz WLGGLMVXSBWHBI-OAHLLOKOSA-N 1 0 304.459 4.057 20 10 DICDRO CC[C@@H]([NH2+]CC[C@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000794814579 1043058568 /nfs/dbraw/zinc/05/85/68/1043058568.db2.gz LVOWCAXMXMMPCD-QUCCMNQESA-N 1 0 313.441 4.039 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12)c1ccc(C)cc1O ZINC000794813983 1043058786 /nfs/dbraw/zinc/05/87/86/1043058786.db2.gz GENNDULHCLYJDK-WERVVEIQSA-N 1 0 307.437 4.327 20 10 DICDRO CC[C@H]([NH2+]CCC[C@@H]1CCCC[C@@H]1O)c1ccc(C)cc1O ZINC000794815352 1043059765 /nfs/dbraw/zinc/05/97/65/1043059765.db2.gz KCJJRHCCCOQTEZ-SZMVWBNQSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccc(C)cc1O ZINC000794812420 1043061050 /nfs/dbraw/zinc/06/10/50/1043061050.db2.gz WQOYGJQWJDQEPK-AZUAARDMSA-N 1 0 311.425 4.055 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCO)C1CCCCC1)c1ccc(C)cc1O ZINC000794811628 1043062376 /nfs/dbraw/zinc/06/23/76/1043062376.db2.gz SQHKKFSJIPPBQI-MSOLQXFVSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@H](C(C)(C)C)C1)c1ccc(C)cc1O ZINC000794817091 1043063273 /nfs/dbraw/zinc/06/32/73/1043063273.db2.gz OVPNXYCDRRMGKP-ZVZYQTTQSA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@@H]([NH2+]CCC1CCC(OC)CC1)c1ccc(C)cc1O ZINC000794820046 1043064087 /nfs/dbraw/zinc/06/40/87/1043064087.db2.gz ZZYDTBLZLLVCGU-LEOMRAHMSA-N 1 0 305.462 4.337 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2ccc(F)cc21)c1cc(F)ccc1O ZINC000794832191 1043069092 /nfs/dbraw/zinc/06/90/92/1043069092.db2.gz HDRMCJWNNBRXGD-GTNSWQLSSA-N 1 0 303.352 4.399 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccc(N(C)C)cc1 ZINC000178550321 1043133296 /nfs/dbraw/zinc/13/32/96/1043133296.db2.gz LSVRFZBCFQGNBM-MGPUTAFESA-N 1 0 312.457 4.047 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2cc3ccccc3o2)c1O ZINC000189096177 1043136375 /nfs/dbraw/zinc/13/63/75/1043136375.db2.gz CKNFNLGYQNEDCW-ZDUSSCGKSA-N 1 0 311.381 4.388 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(Cl)nc2)cc1 ZINC000179108472 1043140786 /nfs/dbraw/zinc/14/07/86/1043140786.db2.gz CEVHBTMXUAZHJS-CQSZACIVSA-N 1 0 317.864 4.432 20 10 DICDRO C[C@H](c1cccnc1)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000179194907 1043142258 /nfs/dbraw/zinc/14/22/58/1043142258.db2.gz VBSQPERPZCPYQP-QGZVFWFLSA-N 1 0 309.457 4.265 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c1O ZINC000120783156 1043144225 /nfs/dbraw/zinc/14/42/25/1043144225.db2.gz YVZZYVHPEQORKZ-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOc2c(Cl)cccc21)c1ccccc1O ZINC000183459045 1043164856 /nfs/dbraw/zinc/16/48/56/1043164856.db2.gz NQZQSYHVDZBABZ-IAQYHMDHSA-N 1 0 303.789 4.220 20 10 DICDRO Cc1ccc(-c2nc(CC[NH2+][C@@H](C)c3ccccc3O)co2)cc1 ZINC000183481364 1043164948 /nfs/dbraw/zinc/16/49/48/1043164948.db2.gz DSGYIQUJSFSQRD-HNNXBMFYSA-N 1 0 322.408 4.249 20 10 DICDRO Cc1ccccc1CN1CCC([NH2+][C@H](C)c2ccccc2O)CC1 ZINC000183427817 1043165053 /nfs/dbraw/zinc/16/50/53/1043165053.db2.gz PAHCPAUTDSFEPT-QGZVFWFLSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1[N+](=O)[O-] ZINC000183614529 1043168376 /nfs/dbraw/zinc/16/83/76/1043168376.db2.gz FKGOCHKLXAUFSX-STQMWFEESA-N 1 0 300.358 4.021 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1N1CCCCC1)c1ccccc1O ZINC000183715184 1043170131 /nfs/dbraw/zinc/17/01/31/1043170131.db2.gz MRBFNVIGXQTMRB-INIZCTEOSA-N 1 0 310.441 4.233 20 10 DICDRO COc1ccc([C@H]([NH2+][C@@H](C)c2cc(F)ccc2O)C2CC2)cc1 ZINC000184910975 1043190216 /nfs/dbraw/zinc/19/02/16/1043190216.db2.gz WBVDAUVOJHJZSG-HXPMCKFVSA-N 1 0 315.388 4.342 20 10 DICDRO CCCOCc1ccccc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185062837 1043195088 /nfs/dbraw/zinc/19/50/88/1043195088.db2.gz QKUPFNGKLNERDD-INIZCTEOSA-N 1 0 313.441 4.478 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H]2CCCO2)c1 ZINC000185225081 1043197604 /nfs/dbraw/zinc/19/76/04/1043197604.db2.gz YIXOXGJQDNUQJK-RYGJVYDSSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@@H]([NH2+]Cc1ccsc1C(F)(F)F)c1cc(F)ccc1O ZINC000866406015 1043198941 /nfs/dbraw/zinc/19/89/41/1043198941.db2.gz PXBWEPWOHWPZIF-MRVPVSSYSA-N 1 0 319.323 4.462 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOc2ccccc21)c1cc(F)ccc1O ZINC000185271344 1043198903 /nfs/dbraw/zinc/19/89/03/1043198903.db2.gz HESHTFKMZYGRFN-LRDDRELGSA-N 1 0 301.361 4.096 20 10 DICDRO CC(C)COC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccco1 ZINC000185289445 1043199235 /nfs/dbraw/zinc/19/92/35/1043199235.db2.gz WDGHPQQIMQDJNJ-XJKSGUPXSA-N 1 0 321.392 4.189 20 10 DICDRO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cs1 ZINC000185425136 1043199811 /nfs/dbraw/zinc/19/98/11/1043199811.db2.gz XSSRGAVMKKQRNB-VHSXEESVSA-N 1 0 310.850 4.476 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(O)c1 ZINC000185374341 1043200359 /nfs/dbraw/zinc/20/03/59/1043200359.db2.gz ZPYVMUWEBZVSOO-LBPRGKRZSA-N 1 0 304.459 4.305 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1F ZINC000185383161 1043201596 /nfs/dbraw/zinc/20/15/96/1043201596.db2.gz ZREFPFJGPZOUSR-ZDUSSCGKSA-N 1 0 303.377 4.089 20 10 DICDRO C[C@@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccc2ccccc2c1O ZINC000185534637 1043202906 /nfs/dbraw/zinc/20/29/06/1043202906.db2.gz OZOCHSPZXRTBGP-RNHZPVLASA-N 1 0 311.425 4.010 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](c2ncccc2C)C(C)C)c1 ZINC000185457834 1043203332 /nfs/dbraw/zinc/20/33/32/1043203332.db2.gz HIOQMSRVRUXVDN-KSSFIOAISA-N 1 0 314.429 4.152 20 10 DICDRO C[C@@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccc2ccccc2c1O ZINC000185534605 1043203362 /nfs/dbraw/zinc/20/33/62/1043203362.db2.gz OZOCHSPZXRTBGP-QUSXHRHCSA-N 1 0 311.425 4.010 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000185611276 1043203950 /nfs/dbraw/zinc/20/39/50/1043203950.db2.gz FUUNHISLTIUMRX-JKSUJKDBSA-N 1 0 321.424 4.298 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2cnc(C)s2)cc1 ZINC000866454566 1043204645 /nfs/dbraw/zinc/20/46/45/1043204645.db2.gz CWQYIUVPQXONQU-CHWSQXEVSA-N 1 0 303.475 4.319 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cnc(C)s1)c1ccc(N(C)C)cc1 ZINC000866454368 1043204987 /nfs/dbraw/zinc/20/49/87/1043204987.db2.gz ACJKKDSIHRBUPS-BLLLJJGKSA-N 1 0 303.475 4.319 20 10 DICDRO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000866455240 1043205170 /nfs/dbraw/zinc/20/51/70/1043205170.db2.gz KHBBRJLBFAWEMD-VXGBXAGGSA-N 1 0 316.470 4.448 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)s1 ZINC000866454616 1043205453 /nfs/dbraw/zinc/20/54/53/1043205453.db2.gz FILBYDIEJHEEOH-HOTUBEGUSA-N 1 0 306.406 4.195 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000185678390 1043206449 /nfs/dbraw/zinc/20/64/49/1043206449.db2.gz SKEPSGDIDHNIAJ-JTQLQIEISA-N 1 0 308.809 4.009 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc2c1CCOC2)c1ccc(C)cc1O ZINC000866477825 1043206763 /nfs/dbraw/zinc/20/67/63/1043206763.db2.gz CBHCTJQVNFGGRK-IBGZPJMESA-N 1 0 311.425 4.014 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc2c1CCOC2)c1ccc(N(C)C)cc1 ZINC000866479644 1043207475 /nfs/dbraw/zinc/20/74/75/1043207475.db2.gz WSLZOOUGAVBKBQ-OAQYLSRUSA-N 1 0 324.468 4.066 20 10 DICDRO CC[C@@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866480600 1043209391 /nfs/dbraw/zinc/20/93/91/1043209391.db2.gz FVZMEAHXDBMEIC-SJLPKXTDSA-N 1 0 303.446 4.172 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1cc(F)ccc1F ZINC000186071081 1043212178 /nfs/dbraw/zinc/21/21/78/1043212178.db2.gz CXNFUOFTDHQJSX-APPDUMDISA-N 1 0 321.367 4.481 20 10 DICDRO CCC(CC)(C[NH2+][C@H](C)c1cccc(OC)c1O)C(F)(F)F ZINC000866506172 1043212361 /nfs/dbraw/zinc/21/23/61/1043212361.db2.gz DXKCULCTSMVWIL-LLVKDONJSA-N 1 0 319.367 4.420 20 10 DICDRO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000186057953 1043213023 /nfs/dbraw/zinc/21/30/23/1043213023.db2.gz PAILAOQCHPHXRE-LSDHHAIUSA-N 1 0 323.440 4.482 20 10 DICDRO CCC(CC)[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(OC)ccc2O)CCO1 ZINC000186502428 1043225476 /nfs/dbraw/zinc/22/54/76/1043225476.db2.gz WXZLKIUCLBTDCI-ZBQZNYHESA-N 1 0 321.461 4.035 20 10 DICDRO Cc1nc([C@H]2CCC[N@@H+]2Cc2cc(C)c(C)cc2O)cs1 ZINC000186864638 1043237798 /nfs/dbraw/zinc/23/77/98/1043237798.db2.gz XZJADJWGGIJUFY-MRXNPFEDSA-N 1 0 302.443 4.111 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCn2nccc21)c1ccc(N2CCCCC2)cc1 ZINC000866632698 1043239231 /nfs/dbraw/zinc/23/92/31/1043239231.db2.gz OCDFDUYKHGFTFN-LPHOPBHVSA-N 1 0 324.472 4.059 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2cccc3[nH]ccc32)c2c1c(F)ccc2O ZINC000866632249 1043240462 /nfs/dbraw/zinc/24/04/62/1043240462.db2.gz WDFIDOPZOIGGER-BDJLRTHQSA-N 1 0 310.372 4.351 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000187586195 1043247161 /nfs/dbraw/zinc/24/71/61/1043247161.db2.gz YNXBMSVPJYVWSH-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO c1ccc2c(c1)NCCC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000192661805 1043272000 /nfs/dbraw/zinc/27/20/00/1043272000.db2.gz HTTVHNZGTNTEPQ-NRFANRHFSA-N 1 0 321.468 4.323 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000194257093 1043289925 /nfs/dbraw/zinc/28/99/25/1043289925.db2.gz XJPOKOZLBGRYAJ-MLGOLLRUSA-N 1 0 305.805 4.084 20 10 DICDRO COc1cccc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)c1O ZINC000237237358 1043293360 /nfs/dbraw/zinc/29/33/60/1043293360.db2.gz IMQFGNPPPYTYBE-GOSISDBHSA-N 1 0 317.404 4.417 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c(F)c2)cc1 ZINC000122325039 1043296064 /nfs/dbraw/zinc/29/60/64/1043296064.db2.gz JHSJDTFBSXAWAA-CQSZACIVSA-N 1 0 316.420 4.141 20 10 DICDRO COCCCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000122639477 1043319267 /nfs/dbraw/zinc/31/92/67/1043319267.db2.gz ACGUCHGHCDACBV-INIZCTEOSA-N 1 0 322.468 4.283 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCOc2ccccc21 ZINC000122755985 1043324981 /nfs/dbraw/zinc/32/49/81/1043324981.db2.gz ZJSBJRQHTZBLMG-IBGZPJMESA-N 1 0 310.441 4.065 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000122755794 1043325480 /nfs/dbraw/zinc/32/54/80/1043325480.db2.gz ZJSBJRQHTZBLMG-LJQANCHMSA-N 1 0 310.441 4.065 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCc2sccc21 ZINC000122763570 1043326754 /nfs/dbraw/zinc/32/67/54/1043326754.db2.gz CWYZKKIMYJKWQD-QGZVFWFLSA-N 1 0 300.471 4.290 20 10 DICDRO C[C@H]([NH2+][C@@H](C)[C@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000268939437 1043345549 /nfs/dbraw/zinc/34/55/49/1043345549.db2.gz ZRCUCOBPIYVFGK-LNLFQRSKSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cc2c(cc1O)CCCC2 ZINC000872117017 1043465223 /nfs/dbraw/zinc/46/52/23/1043465223.db2.gz WWNCPADGIWVSFA-SNVBAGLBSA-N 1 0 322.861 4.232 20 10 DICDRO CC[C@H]([NH2+]Cc1ncc(Cl)s1)c1cc(Cl)ccc1O ZINC000872116988 1043465389 /nfs/dbraw/zinc/46/53/89/1043465389.db2.gz WJYALRXHKGZZJA-JTQLQIEISA-N 1 0 317.241 4.396 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2cccc3ncccc23)c2c1c(F)ccc2O ZINC000872124302 1043469681 /nfs/dbraw/zinc/46/96/81/1043469681.db2.gz JDFPVAPJTHZGOY-SJKOYZFVSA-N 1 0 322.383 4.418 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1O ZINC000872130433 1043473041 /nfs/dbraw/zinc/47/30/41/1043473041.db2.gz HTIRKNRFIXTSRT-WDEREUQCSA-N 1 0 310.319 4.218 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc(C(F)(F)F)nc1 ZINC000872131460 1043473447 /nfs/dbraw/zinc/47/34/47/1043473447.db2.gz UVESAKOODOCKSS-GWCFXTLKSA-N 1 0 322.330 4.144 20 10 DICDRO Cc1cc(O)c(CNc2ccccc2CC[NH+](C)C)cc1Cl ZINC000825635256 1043510642 /nfs/dbraw/zinc/51/06/42/1043510642.db2.gz YKQYYBPWKVFWLL-UHFFFAOYSA-N 1 0 318.848 4.070 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc([C@H](C)O)cc2)cc1C ZINC000873021375 1043514486 /nfs/dbraw/zinc/51/44/86/1043514486.db2.gz MHEPLCBMHIDSDS-INIZCTEOSA-N 1 0 313.441 4.127 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCn2ccc3ccccc32)c(O)c1 ZINC000320159008 1043518428 /nfs/dbraw/zinc/51/84/28/1043518428.db2.gz KQIBCYJVMSSMJJ-MRXNPFEDSA-N 1 0 308.425 4.396 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2cnc(C)s2)cc1C ZINC000873150874 1043518886 /nfs/dbraw/zinc/51/88/86/1043518886.db2.gz RIXVSQWYLVKDBW-ZDUSSCGKSA-N 1 0 304.459 4.400 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccc(N(C)C)cc1 ZINC000124408544 1043521907 /nfs/dbraw/zinc/52/19/07/1043521907.db2.gz RDJVBSXIWNCJKI-OLZOCXBDSA-N 1 0 304.384 4.443 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OC3CCCCC3)CC2)cc1C ZINC000124740199 1043565179 /nfs/dbraw/zinc/56/51/79/1043565179.db2.gz YCIGXVVTIYDNCM-UHFFFAOYSA-N 1 0 317.473 4.323 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1F ZINC000124819112 1043570097 /nfs/dbraw/zinc/57/00/97/1043570097.db2.gz VTGXUNSORFCAIP-ZIAGYGMSSA-N 1 0 316.420 4.312 20 10 DICDRO COc1ccc(N2CCC([NH2+]C3CCC(C)(C)CC3)CC2)cc1 ZINC000237259525 1043652019 /nfs/dbraw/zinc/65/20/19/1043652019.db2.gz PTRPWYNNKKHEBN-UHFFFAOYSA-N 1 0 316.489 4.222 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc(OC)c(C)c2)c1 ZINC000926903433 1043652931 /nfs/dbraw/zinc/65/29/31/1043652931.db2.gz VOGLBQHYJYMMMZ-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO Cc1nc2c(cccc2CC[NH2+][C@H](C)c2cc(C)ccc2O)o1 ZINC000926974492 1043665772 /nfs/dbraw/zinc/66/57/72/1043665772.db2.gz LWTLYJGKBUIOJE-CYBMUJFWSA-N 1 0 310.397 4.044 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1ccc(N(C)C)cc1 ZINC000927060866 1043675722 /nfs/dbraw/zinc/67/57/22/1043675722.db2.gz DPRCVFHKODGDTK-MOPGFXCFSA-N 1 0 309.457 4.266 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3cccnc32)c2c1c(F)ccc2O ZINC000927064070 1043677418 /nfs/dbraw/zinc/67/74/18/1043677418.db2.gz OAUCJDLOWKJBHR-UGFHNGPFSA-N 1 0 312.388 4.142 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cc(Cl)cc2c1OCC2 ZINC000927142680 1043699926 /nfs/dbraw/zinc/69/99/26/1043699926.db2.gz VLENRTNOTPAQTG-NWDGAFQWSA-N 1 0 317.816 4.392 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000021804203 1043704636 /nfs/dbraw/zinc/70/46/36/1043704636.db2.gz TVKLAMGLMYHRCR-UHFFFAOYSA-N 1 0 309.240 4.349 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3cccnc3)CC2)cc1Cl ZINC000825910070 1043716173 /nfs/dbraw/zinc/71/61/73/1043716173.db2.gz BQFHVRSLSZJMIJ-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO C[C@@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccc(N(C)C)cc1 ZINC000777702785 1043766837 /nfs/dbraw/zinc/76/68/37/1043766837.db2.gz TWDUXEQXLZGZQX-CQSZACIVSA-N 1 0 315.436 4.126 20 10 DICDRO Cc1cccc(O)c1C[NH2+]Cc1ccsc1C(F)(F)F ZINC000877663552 1043785908 /nfs/dbraw/zinc/78/59/08/1043785908.db2.gz UHNGQTXSMPXGLL-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO Cc1cccnc1[C@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccccc2O)C1 ZINC000877757997 1043791583 /nfs/dbraw/zinc/79/15/83/1043791583.db2.gz CEJKFMLRQJVIGA-YESZJQIVSA-N 1 0 310.441 4.473 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccc1O ZINC000877756329 1043792041 /nfs/dbraw/zinc/79/20/41/1043792041.db2.gz HTTKMJHTTSAVOM-INIZCTEOSA-N 1 0 310.441 4.233 20 10 DICDRO CCCCn1nc(C)c(C[NH2+][C@H](C)c2ccccc2O)c1Cl ZINC000877756445 1043792487 /nfs/dbraw/zinc/79/24/87/1043792487.db2.gz IZJHEPMRTBSSNZ-GFCCVEGCSA-N 1 0 321.852 4.201 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@H](C)C1)c1ccccc1O ZINC000877756519 1043793512 /nfs/dbraw/zinc/79/35/12/1043793512.db2.gz OZMYUQNMJHWPLF-LMMKCTJWSA-N 1 0 324.468 4.096 20 10 DICDRO CCCCn1nc(C)c(C[NH2+][C@@H](C)c2ccccc2O)c1Cl ZINC000877757143 1043793683 /nfs/dbraw/zinc/79/36/83/1043793683.db2.gz IZJHEPMRTBSSNZ-LBPRGKRZSA-N 1 0 321.852 4.201 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1OC(C)C ZINC000877756475 1043793833 /nfs/dbraw/zinc/79/38/33/1043793833.db2.gz KTXYXTRUOMDDAD-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO C[C@@H]([NH2+]Cc1sccc1Br)c1ccccc1O ZINC000147921337 1043903671 /nfs/dbraw/zinc/90/36/71/1043903671.db2.gz RYVJGBQAFCWGAB-SECBINFHSA-N 1 0 312.232 4.067 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(Cl)c1 ZINC000290209563 1043928022 /nfs/dbraw/zinc/92/80/22/1043928022.db2.gz HGCHSVPTDVAKCQ-LRDDRELGSA-N 1 0 305.805 4.084 20 10 DICDRO CC[C@@H]([NH2+]CCc1nc(C)c(C)s1)c1ccc(N(C)C)cc1 ZINC000127747649 1043964824 /nfs/dbraw/zinc/96/48/24/1043964824.db2.gz IEADEFPMLFSYOZ-QGZVFWFLSA-N 1 0 317.502 4.109 20 10 DICDRO CCCC[C@H](CC)[NH2+]Cc1cc(Br)ccc1O ZINC001257413020 1043966094 /nfs/dbraw/zinc/96/60/94/1043966094.db2.gz QSPBSJCCZKVARB-ZDUSSCGKSA-N 1 0 300.240 4.213 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c1 ZINC000127851382 1043973756 /nfs/dbraw/zinc/97/37/56/1043973756.db2.gz OADISBSURGEUGX-OAHLLOKOSA-N 1 0 322.408 4.221 20 10 DICDRO CCCc1nc(C)c(C[NH2+]Cc2ccc(N(CC)CC)cc2)o1 ZINC000291767950 1044101587 /nfs/dbraw/zinc/10/15/87/1044101587.db2.gz SIJBCMWPOURKMQ-UHFFFAOYSA-N 1 0 315.461 4.072 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@H]2OCCc3sccc32)c1 ZINC000291945169 1044116858 /nfs/dbraw/zinc/11/68/58/1044116858.db2.gz QEKHYEFUFIXRHO-ZJNRKIDTSA-N 1 0 317.454 4.115 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@H]1OCCc2sccc21)c1ccccc1O ZINC000291974896 1044121450 /nfs/dbraw/zinc/12/14/50/1044121450.db2.gz UMQAPURIGBHPCK-QITLCBANSA-N 1 0 317.454 4.197 20 10 DICDRO CCC(CC)[C@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000778119710 1044157489 /nfs/dbraw/zinc/15/74/89/1044157489.db2.gz XWBGVTRLWVCJIU-CXAGYDPISA-N 1 0 311.853 4.119 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)c1O ZINC000292837242 1044216220 /nfs/dbraw/zinc/21/62/20/1044216220.db2.gz AXBCLCONZRATAT-UHFFFAOYSA-N 1 0 321.367 4.192 20 10 DICDRO COCc1c(C)cc(C)c(C[NH2+][C@H](C)c2ccccc2O)c1C ZINC000883224227 1044240122 /nfs/dbraw/zinc/24/01/22/1044240122.db2.gz IBKLFKKFARSEGG-MRXNPFEDSA-N 1 0 313.441 4.315 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(C)nc1Cl)c1ccc(N(C)C)cc1 ZINC000883301803 1044262428 /nfs/dbraw/zinc/26/24/28/1044262428.db2.gz IMSLYIQGZAUQRP-KRWDZBQOSA-N 1 0 317.864 4.350 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2c3ccccc3CC[C@H]2F)c1 ZINC000883376477 1044290694 /nfs/dbraw/zinc/29/06/94/1044290694.db2.gz LRVPTQSJTSIQQA-OEPMTFCVSA-N 1 0 315.388 4.077 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(F)cc1[O-] ZINC000293669458 1044309332 /nfs/dbraw/zinc/30/93/32/1044309332.db2.gz JIOZEKKKEBYVLA-LLVKDONJSA-N 1 0 309.331 4.494 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccc(N(C)C)cc1 ZINC000132193201 1044317700 /nfs/dbraw/zinc/31/77/00/1044317700.db2.gz NRYNCJGAGFPNCO-ZDUSSCGKSA-N 1 0 321.515 4.042 20 10 DICDRO Fc1ccc2c(c1)[C@H]([NH2+]CCCSc1nccs1)CC2 ZINC000132237679 1044320306 /nfs/dbraw/zinc/32/03/06/1044320306.db2.gz JJSCXXNKQSGTLS-CQSZACIVSA-N 1 0 308.447 4.042 20 10 DICDRO Fc1ccc([C@H]2C[C@H]([NH2+]Cc3ccc4c(c3)CCCO4)C2)cc1 ZINC001202602736 1044367245 /nfs/dbraw/zinc/36/72/45/1044367245.db2.gz MHBUQQAUIJOTNH-UAPYVXQJSA-N 1 0 311.400 4.187 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)c(O)c1 ZINC000192936223 1044404291 /nfs/dbraw/zinc/40/42/91/1044404291.db2.gz ANVVSVWTAYMUBR-GFCCVEGCSA-N 1 0 307.340 4.153 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOc2ccccc21)c1ccc(N(C)C)cc1 ZINC000133513873 1044406014 /nfs/dbraw/zinc/40/60/14/1044406014.db2.gz QKHGYINYZPMNQX-BEFAXECRSA-N 1 0 310.441 4.317 20 10 DICDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000192948139 1044407308 /nfs/dbraw/zinc/40/73/08/1044407308.db2.gz KBLBDGYHHUSZTA-KBPBESRZSA-N 1 0 312.413 4.071 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C2CC2)C2CCC2)cc1F ZINC001202676803 1044462616 /nfs/dbraw/zinc/46/26/16/1044462616.db2.gz QQIGGFDVIBGVJC-LJQANCHMSA-N 1 0 304.453 4.340 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)c2nc(C)cs2)cc1 ZINC000116381367 1044470519 /nfs/dbraw/zinc/47/05/19/1044470519.db2.gz LPRQUCCYJKMNQD-UHFFFAOYSA-N 1 0 317.502 4.323 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)c2ccccc2O1 ZINC000295101399 1044489637 /nfs/dbraw/zinc/48/96/37/1044489637.db2.gz SULSTUOMVQQQSP-IAQYHMDHSA-N 1 0 303.789 4.048 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+]Cc2c(O)cc(C)cc2Cl)s1 ZINC000840939839 1044542497 /nfs/dbraw/zinc/54/24/97/1044542497.db2.gz RPOHYOZHOKLETJ-SNVBAGLBSA-N 1 0 310.850 4.012 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCCOc3c(F)cccc31)CC2 ZINC000296335782 1044610670 /nfs/dbraw/zinc/61/06/70/1044610670.db2.gz GPVSQYSLKJIGQT-HOTGVXAUSA-N 1 0 313.372 4.022 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1cc(C)ccc1O)CC3 ZINC000778640211 1044621410 /nfs/dbraw/zinc/62/14/10/1044621410.db2.gz JJOVTAQPCMNGQX-INIZCTEOSA-N 1 0 320.436 4.137 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2ccccc2c1O)c1cccnc1 ZINC000840975147 1044656479 /nfs/dbraw/zinc/65/64/79/1044656479.db2.gz LUHGXJQWESHPJL-UHFFFAOYSA-N 1 0 306.409 4.008 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)c1c(O)cccc1F ZINC000886586019 1044664128 /nfs/dbraw/zinc/66/41/28/1044664128.db2.gz JDJYLZPZJKDKRN-ZDUSSCGKSA-N 1 0 302.393 4.074 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C2CC2)no1)c1cc(Cl)ccc1O ZINC000886684801 1044679515 /nfs/dbraw/zinc/67/95/15/1044679515.db2.gz SRDCSSIMGLMGHX-AWEZNQCLSA-N 1 0 306.793 4.152 20 10 DICDRO Cc1ccc([C@H]([NH2+]Cc2cc(F)ccc2O)c2ccccn2)cc1 ZINC000366249423 1044715854 /nfs/dbraw/zinc/71/58/54/1044715854.db2.gz KADNQQCCLAMGBV-FQEVSTJZSA-N 1 0 322.383 4.114 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000090763045 1044749721 /nfs/dbraw/zinc/74/97/21/1044749721.db2.gz FCBXTJWNYGELOC-UGSOOPFHSA-N 1 0 315.461 4.202 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)c2c(C)noc2C)cc1 ZINC000090764632 1044750470 /nfs/dbraw/zinc/75/04/70/1044750470.db2.gz VRYLZTYISZUDDA-KGLIPLIRSA-N 1 0 315.461 4.202 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)Oc1ccccc1F)c1ccccc1O ZINC000156069030 1044760758 /nfs/dbraw/zinc/76/07/58/1044760758.db2.gz BSGLUKVWSAXHCH-XJKSGUPXSA-N 1 0 303.377 4.040 20 10 DICDRO C[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000222909376 1044816535 /nfs/dbraw/zinc/81/65/35/1044816535.db2.gz LZTHMRKLZSCQOR-ZDUSSCGKSA-N 1 0 300.368 4.107 20 10 DICDRO Oc1ccc2ccncc2c1C[NH+]1CCC(c2ccccc2)CC1 ZINC000887559245 1044853309 /nfs/dbraw/zinc/85/33/09/1044853309.db2.gz GPIKNLMYJXINHJ-UHFFFAOYSA-N 1 0 318.420 4.320 20 10 DICDRO COc1cccc(C[NH2+]Cc2cc(C)cc3c(C)c(C)[nH]c32)c1O ZINC000264392274 1044874865 /nfs/dbraw/zinc/87/48/65/1044874865.db2.gz SDXXKXQCBJYZRZ-UHFFFAOYSA-N 1 0 324.424 4.097 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC000371488610 1044882063 /nfs/dbraw/zinc/88/20/63/1044882063.db2.gz SFSSELZLRLLADJ-INIZCTEOSA-N 1 0 310.422 4.339 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCc2cnn(C(C)C)c21)c1ccccc1O ZINC000373456153 1044978236 /nfs/dbraw/zinc/97/82/36/1044978236.db2.gz YNLVAAKTKRBVTP-IAGOWNOFSA-N 1 0 313.445 4.288 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@](C)(CC)c2nccs2)c(O)c1 ZINC000152655144 1045046455 /nfs/dbraw/zinc/04/64/55/1045046455.db2.gz SMWQGWKWCMIDBD-KRWDZBQOSA-N 1 0 320.458 4.053 20 10 DICDRO Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000153166283 1045052363 /nfs/dbraw/zinc/05/23/63/1045052363.db2.gz KCUYSCAJOGVVGZ-MSOLQXFVSA-N 1 0 324.468 4.243 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000779021760 1045147156 /nfs/dbraw/zinc/14/71/56/1045147156.db2.gz YKKBGQVETTWVIC-INIZCTEOSA-N 1 0 307.315 4.147 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1F ZINC000779044215 1045198667 /nfs/dbraw/zinc/19/86/67/1045198667.db2.gz LNOPAMKHAFYSPK-LJQANCHMSA-N 1 0 312.432 4.449 20 10 DICDRO c1csc(SCCC[NH2+][C@@H](c2ccccn2)C2CCC2)n1 ZINC000925104010 1045227047 /nfs/dbraw/zinc/22/70/47/1045227047.db2.gz UTTZLWRFPCENJL-OAHLLOKOSA-N 1 0 319.499 4.151 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1ccc(N2CCCCC2)cc1 ZINC000779079025 1045254700 /nfs/dbraw/zinc/25/47/00/1045254700.db2.gz JVHQVOXCSOSPJA-QFBILLFUSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCC[C@@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000779084112 1045261063 /nfs/dbraw/zinc/26/10/63/1045261063.db2.gz TYDKFVLYLRAFEP-UXPWSPDFSA-N 1 0 316.489 4.021 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCN1C1CCCC1)c1ccc2ccccc2c1O ZINC000528005420 1045293365 /nfs/dbraw/zinc/29/33/65/1045293365.db2.gz ZXFRWXJLEAEZKK-YJBOKZPZSA-N 1 0 324.468 4.213 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCN1C1CCCC1)c1ccc2ccccc2c1O ZINC000528005416 1045293497 /nfs/dbraw/zinc/29/34/97/1045293497.db2.gz ZXFRWXJLEAEZKK-QAPCUYQASA-N 1 0 324.468 4.213 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1cccc(C)c1O)CC3 ZINC000779168068 1045347530 /nfs/dbraw/zinc/34/75/30/1045347530.db2.gz VBWWUWUMDIZJGE-MRXNPFEDSA-N 1 0 320.436 4.137 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000779178507 1045349537 /nfs/dbraw/zinc/34/95/37/1045349537.db2.gz QRLQUZAIYKWTMZ-BPAFIMBUSA-N 1 0 318.505 4.387 20 10 DICDRO CSc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1F ZINC000160537584 1045460556 /nfs/dbraw/zinc/46/05/56/1045460556.db2.gz IVVKEMWCJXJXQH-CYBMUJFWSA-N 1 0 318.461 4.464 20 10 DICDRO CC(C)Oc1ccccc1C[NH2+]Cc1c(O)cccc1Cl ZINC000113325789 1045561208 /nfs/dbraw/zinc/56/12/08/1045561208.db2.gz LCLOEGRTOUHFHP-UHFFFAOYSA-N 1 0 305.805 4.123 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCC[C@H]2OCC)cc1 ZINC001202789659 1045572774 /nfs/dbraw/zinc/57/27/74/1045572774.db2.gz RQRQDQWEJKXCMW-WOJBJXKFSA-N 1 0 318.505 4.360 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)c(Cl)c1 ZINC000021010707 1045583779 /nfs/dbraw/zinc/58/37/79/1045583779.db2.gz JWJQOEPCWYMOPX-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c1O ZINC000800526380 1045639385 /nfs/dbraw/zinc/63/93/85/1045639385.db2.gz HYTVTFNANSWYQF-LLVKDONJSA-N 1 0 303.780 4.269 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC23CCOCC3)c2c1c(F)ccc2O ZINC000800498444 1045635148 /nfs/dbraw/zinc/63/51/48/1045635148.db2.gz KJCMPHRVWNGOFH-XNRPHZJLSA-N 1 0 319.420 4.019 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CC2CCC(F)(F)CC2)c2c1c(F)ccc2O ZINC000800499870 1045635380 /nfs/dbraw/zinc/63/53/80/1045635380.db2.gz NTQVYPAVRDXGCN-MFKMUULPSA-N 1 0 313.363 4.495 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccc3[nH]ccc32)c(O)c1C ZINC000800501829 1045637069 /nfs/dbraw/zinc/63/70/69/1045637069.db2.gz ZVWIQQKRKWZQNY-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCCC(F)(F)C2)c1O ZINC000800526384 1045639114 /nfs/dbraw/zinc/63/91/14/1045639114.db2.gz HYTVTFNANSWYQF-NSHDSACASA-N 1 0 303.780 4.269 20 10 DICDRO Cc1cccc(C[NH2+]CCCc2c[nH]c3ccc(F)cc23)c1O ZINC000800537417 1045639679 /nfs/dbraw/zinc/63/96/79/1045639679.db2.gz XYDJCVOMIGAWRM-UHFFFAOYSA-N 1 0 312.388 4.043 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](C)c2ccsc2)ccc1OC ZINC000800888876 1045662528 /nfs/dbraw/zinc/66/25/28/1045662528.db2.gz FEQVZDLUFNLJRM-CYBMUJFWSA-N 1 0 305.443 4.144 20 10 DICDRO FC(F)(F)[C@H]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000752265668 1045669082 /nfs/dbraw/zinc/66/90/82/1045669082.db2.gz LDHLLZCNZKPEBF-WFASDCNBSA-N 1 0 313.363 4.080 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000752264315 1045669335 /nfs/dbraw/zinc/66/93/35/1045669335.db2.gz BGNNUZITVHGSIN-HUUCEWRRSA-N 1 0 314.395 4.211 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000752264316 1045669873 /nfs/dbraw/zinc/66/98/73/1045669873.db2.gz BGNNUZITVHGSIN-LSDHHAIUSA-N 1 0 314.395 4.211 20 10 DICDRO FCCC[C@H]1CCC[C@H]1[NH2+]CCCSc1nccs1 ZINC000800971241 1045671383 /nfs/dbraw/zinc/67/13/83/1045671383.db2.gz HVMDUFDHEJFMKK-CHWSQXEVSA-N 1 0 302.484 4.133 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2ccccc2OC1)c1cc(Cl)ccc1O ZINC000800987429 1045678187 /nfs/dbraw/zinc/67/81/87/1045678187.db2.gz XSRVYGACWORHHP-WFASDCNBSA-N 1 0 317.816 4.090 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)c(O)c1C ZINC000800987443 1045678464 /nfs/dbraw/zinc/67/84/64/1045678464.db2.gz XVQCBLHWTWSDQJ-DOTOQJQBSA-N 1 0 311.425 4.053 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)c1O ZINC000779432082 1045711561 /nfs/dbraw/zinc/71/15/61/1045711561.db2.gz JXEPOIDLEMAMHP-INIZCTEOSA-N 1 0 317.816 4.358 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccccc2Cl)c(O)c1 ZINC000752940020 1045717144 /nfs/dbraw/zinc/71/71/44/1045717144.db2.gz LKVLJDWIAFJWJT-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)c1O ZINC000752986659 1045718969 /nfs/dbraw/zinc/71/89/69/1045718969.db2.gz LXNHBEXASHSDCM-SJLPKXTDSA-N 1 0 311.425 4.217 20 10 DICDRO CCCC[N@H+](Cc1c(C)onc1CC)Cc1ccccc1O ZINC000801595739 1045749663 /nfs/dbraw/zinc/74/96/63/1045749663.db2.gz IVXSOIFSZBIVSY-UHFFFAOYSA-N 1 0 302.418 4.053 20 10 DICDRO CCCC[N@H+](Cc1c(C)nc2ccccn21)Cc1ccccc1O ZINC000801597826 1045752436 /nfs/dbraw/zinc/75/24/36/1045752436.db2.gz PGUOALNZQBCSNF-UHFFFAOYSA-N 1 0 323.440 4.151 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@H](c3ccc(C)cc3)C2)c1O ZINC000753591635 1045770207 /nfs/dbraw/zinc/77/02/07/1045770207.db2.gz RADOYKKIIFRHQD-KRWDZBQOSA-N 1 0 311.425 4.089 20 10 DICDRO COc1cc(C)c([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1C ZINC000753660200 1045784729 /nfs/dbraw/zinc/78/47/29/1045784729.db2.gz YZRLFYHCKWMELA-HNNXBMFYSA-N 1 0 311.425 4.098 20 10 DICDRO C[C@@H]([NH2+]CCCNc1ccccc1F)c1ccc(N(C)C)cc1 ZINC000753765305 1045801382 /nfs/dbraw/zinc/80/13/82/1045801382.db2.gz BCDHQPZXFDPIRX-OAHLLOKOSA-N 1 0 315.436 4.045 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1O ZINC000192536746 1045861497 /nfs/dbraw/zinc/86/14/97/1045861497.db2.gz IXOLRGBLKHLWNS-CQSZACIVSA-N 1 0 303.427 4.108 20 10 DICDRO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000079249389 1045872923 /nfs/dbraw/zinc/87/29/23/1045872923.db2.gz VIMJRBLSASAABT-HNNXBMFYSA-N 1 0 311.425 4.260 20 10 DICDRO COc1cc(C)cc(C[N@H+](Cc2ccc(F)cc2)C(C)C)c1O ZINC000754719848 1045919250 /nfs/dbraw/zinc/91/92/50/1045919250.db2.gz IZPWNEWRXYVJDW-UHFFFAOYSA-N 1 0 317.404 4.259 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cccc(OC(F)F)c1 ZINC000192720866 1045927246 /nfs/dbraw/zinc/92/72/46/1045927246.db2.gz KCWHINAKCDVXMI-VXGBXAGGSA-N 1 0 307.340 4.405 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(OC)c(F)c1)c1ccccc1O ZINC000192795838 1045934782 /nfs/dbraw/zinc/93/47/82/1045934782.db2.gz QTGBGSXPFSQDFO-LRDDRELGSA-N 1 0 303.377 4.342 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(OC)c(F)c1)c1ccccc1O ZINC000192795848 1045935801 /nfs/dbraw/zinc/93/58/01/1045935801.db2.gz QTGBGSXPFSQDFO-BLLLJJGKSA-N 1 0 303.377 4.342 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)[C@@H]1C[C@H]1c1ccccc1 ZINC000802303204 1045945845 /nfs/dbraw/zinc/94/58/45/1045945845.db2.gz ZVBOLBOZABLURV-BPUTZDHNSA-N 1 0 318.511 4.407 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1OC1CC1)c1ccc(N(C)C)cc1 ZINC000828960052 1045946399 /nfs/dbraw/zinc/94/63/99/1045946399.db2.gz SVOBKUJLQSNVTG-HNNXBMFYSA-N 1 0 310.441 4.145 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C)c(F)c2)cc1 ZINC000755072188 1045951198 /nfs/dbraw/zinc/95/11/98/1045951198.db2.gz XMDINRRIAFOEKQ-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000802308600 1045951668 /nfs/dbraw/zinc/95/16/68/1045951668.db2.gz FSOHFWOGOXUAQG-ZACQAIPSSA-N 1 0 318.505 4.387 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000802308597 1045951862 /nfs/dbraw/zinc/95/18/62/1045951862.db2.gz FSOHFWOGOXUAQG-ULQDDVLXSA-N 1 0 318.505 4.387 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)c(O)c1C ZINC000802310310 1045952217 /nfs/dbraw/zinc/95/22/17/1045952217.db2.gz ZKLJXBGZTRFSRE-DZKIICNBSA-N 1 0 305.462 4.253 20 10 DICDRO Cc1cc(C[N@H+](C)CCc2cccnc2)c(C)n1-c1ccccc1 ZINC001137858160 1045987255 /nfs/dbraw/zinc/98/72/55/1045987255.db2.gz YOQJONNBLGAEBD-UHFFFAOYSA-N 1 0 319.452 4.164 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c(C)n1-c1ccccc1 ZINC001137857418 1045988510 /nfs/dbraw/zinc/98/85/10/1045988510.db2.gz GVRMRBWXQAXTCA-GOSISDBHSA-N 1 0 316.395 4.325 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCO[C@@H](CC)C1 ZINC000802657328 1046026749 /nfs/dbraw/zinc/02/67/49/1046026749.db2.gz AZWFZXSEPHCROZ-AEFFLSMTSA-N 1 0 305.462 4.200 20 10 DICDRO COc1ccc(O)c(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c1 ZINC000802658283 1046027821 /nfs/dbraw/zinc/02/78/21/1046027821.db2.gz RONJQKPXVKJBIJ-GGPHIMKMSA-N 1 0 323.436 4.311 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000802657558 1046028711 /nfs/dbraw/zinc/02/87/11/1046028711.db2.gz IVTTUTVXEITTOF-CQSZACIVSA-N 1 0 317.326 4.086 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)c1O ZINC000802659117 1046030123 /nfs/dbraw/zinc/03/01/23/1046030123.db2.gz DTVVPVGYVYZYSR-CHWSQXEVSA-N 1 0 311.853 4.037 20 10 DICDRO CCCC[N@H+](Cc1cnc2ccc(C)cn12)Cc1ccccc1O ZINC000802657769 1046030914 /nfs/dbraw/zinc/03/09/14/1046030914.db2.gz RPAMSMVOOPQFEC-UHFFFAOYSA-N 1 0 323.440 4.151 20 10 DICDRO CCCC[N@H+](Cc1ncc(CC)s1)Cc1ccccc1O ZINC000802657808 1046031191 /nfs/dbraw/zinc/03/11/91/1046031191.db2.gz UIGNKEGRCMHDDY-UHFFFAOYSA-N 1 0 304.459 4.213 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCCC(F)(F)F)c1 ZINC000756079539 1046050163 /nfs/dbraw/zinc/05/01/63/1046050163.db2.gz QJZMKDXYZJEQQI-MNOVXSKESA-N 1 0 305.340 4.173 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2c1O ZINC000193701135 1046061092 /nfs/dbraw/zinc/06/10/92/1046061092.db2.gz YEZODUSXYTUKPO-CYBMUJFWSA-N 1 0 322.364 4.304 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](c2cccs2)C2CC2)c1 ZINC000756362726 1046068620 /nfs/dbraw/zinc/06/86/20/1046068620.db2.gz CGGLALDXXWVFAV-APPDUMDISA-N 1 0 303.427 4.264 20 10 DICDRO C[C@@H]([NH2+]CCSCc1ccccc1)c1cc(F)ccc1O ZINC000756356096 1046069569 /nfs/dbraw/zinc/06/95/69/1046069569.db2.gz XPBLCBCGXBCUEA-CYBMUJFWSA-N 1 0 305.418 4.115 20 10 DICDRO C[C@H]([NH2+]Cc1cn2ccccc2n1)c1ccc2ccccc2c1O ZINC000756364731 1046072711 /nfs/dbraw/zinc/07/27/11/1046072711.db2.gz VBBORYQNBYLYGC-AWEZNQCLSA-N 1 0 317.392 4.044 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccsc2)N(C)C)c(O)c1C ZINC000756371870 1046073165 /nfs/dbraw/zinc/07/31/65/1046073165.db2.gz OUJDFDOARQHXTR-PBHICJAKSA-N 1 0 318.486 4.024 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3occc32)c2c1c(F)ccc2O ZINC000756402545 1046075941 /nfs/dbraw/zinc/07/59/41/1046075941.db2.gz UVOROPHXCPRZBO-LERXQTSPSA-N 1 0 301.361 4.340 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCCOc2ccc(F)cc2)c(O)c1 ZINC000756400405 1046076389 /nfs/dbraw/zinc/07/63/89/1046076389.db2.gz KGUFLJMZNCWLOI-HNNXBMFYSA-N 1 0 317.404 4.350 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000756420031 1046079865 /nfs/dbraw/zinc/07/98/65/1046079865.db2.gz VPXYFFDMYNEURS-CYBMUJFWSA-N 1 0 301.455 4.492 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCOCCc2ccccc2)c(O)c1 ZINC000756434782 1046080960 /nfs/dbraw/zinc/08/09/60/1046080960.db2.gz PTSPHXZDBJWONB-QGZVFWFLSA-N 1 0 313.441 4.001 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756434887 1046082180 /nfs/dbraw/zinc/08/21/80/1046082180.db2.gz VEPXYHWVCWUVTM-LRDDRELGSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)COc2ccc(F)cc2F)c1 ZINC000756454754 1046085707 /nfs/dbraw/zinc/08/57/07/1046085707.db2.gz NUCJUWAOSWGXIX-CHWSQXEVSA-N 1 0 321.367 4.097 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc3c(s2)CCCC3)c1 ZINC000756482453 1046086877 /nfs/dbraw/zinc/08/68/77/1046086877.db2.gz IOFNIWKGYIHFER-CYBMUJFWSA-N 1 0 301.455 4.492 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)c(O)c1 ZINC000756481089 1046087149 /nfs/dbraw/zinc/08/71/49/1046087149.db2.gz BMQHHJVVGRQECA-SUMWQHHRSA-N 1 0 315.388 4.404 20 10 DICDRO CCOc1cccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001138100508 1046089138 /nfs/dbraw/zinc/08/91/38/1046089138.db2.gz UKPQKISHMSZRMH-UHFFFAOYSA-N 1 0 324.468 4.318 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CSCc3ccccc32)c1 ZINC000756491316 1046089973 /nfs/dbraw/zinc/08/99/73/1046089973.db2.gz ZNXIJSDDFVVXOG-SJKOYZFVSA-N 1 0 315.438 4.040 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc3ccccc3n2)c(O)c1 ZINC000756497344 1046091450 /nfs/dbraw/zinc/09/14/50/1046091450.db2.gz TXFPYELQKDGRJV-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)COc1ccccc1)c1cc(Cl)ccc1O ZINC000756494880 1046092475 /nfs/dbraw/zinc/09/24/75/1046092475.db2.gz OXIAGLCNMOPXDN-QWHCGFSZSA-N 1 0 305.805 4.164 20 10 DICDRO COc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756503079 1046092608 /nfs/dbraw/zinc/09/26/08/1046092608.db2.gz JJKIJIFVAXNGCK-ZIAGYGMSSA-N 1 0 317.404 4.212 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCCOC2CCCC2)c2c1c(F)ccc2O ZINC000756501133 1046092658 /nfs/dbraw/zinc/09/26/58/1046092658.db2.gz BEHIIPRTZQBEDJ-SWLSCSKDSA-N 1 0 307.409 4.019 20 10 DICDRO COc1ccccc1C1(C[NH2+][C@H](C)c2cc(C)ccc2O)CC1 ZINC000756516028 1046093624 /nfs/dbraw/zinc/09/36/24/1046093624.db2.gz HMJSMBFLTFEWAS-OAHLLOKOSA-N 1 0 311.425 4.092 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@@H](C)c3cc(C)ccc3O)c[nH]c2c1 ZINC000756517239 1046094232 /nfs/dbraw/zinc/09/42/32/1046094232.db2.gz OMUGFNOGYRXRBG-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO C[C@@H]([NH2+]CCc1cc(F)cc(F)c1)c1cc(Cl)ccc1O ZINC000756510126 1046094437 /nfs/dbraw/zinc/09/44/37/1046094437.db2.gz HFXIBOQVEJAKBX-SNVBAGLBSA-N 1 0 311.759 4.217 20 10 DICDRO CCn1nc(C)c(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)c1C ZINC000756534889 1046095817 /nfs/dbraw/zinc/09/58/17/1046095817.db2.gz LKJWNZDORICGMD-ZDUSSCGKSA-N 1 0 323.440 4.229 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000756531865 1046096361 /nfs/dbraw/zinc/09/63/61/1046096361.db2.gz AKGQDEBHRWPCKQ-YQVWRLOYSA-N 1 0 324.468 4.187 20 10 DICDRO C[C@@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1ccc(F)cc1[O-] ZINC000756536467 1046096895 /nfs/dbraw/zinc/09/68/95/1046096895.db2.gz VZHYFDLJULKHHL-MRXNPFEDSA-N 1 0 322.468 4.228 20 10 DICDRO COc1ccc(CC[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1F ZINC000756539358 1046097125 /nfs/dbraw/zinc/09/71/25/1046097125.db2.gz MLQVHRVUGZCARO-LLVKDONJSA-N 1 0 323.795 4.087 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756555051 1046097749 /nfs/dbraw/zinc/09/77/49/1046097749.db2.gz RMGNLTQDQZOERN-CYBMUJFWSA-N 1 0 318.848 4.353 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCOc3ccccc32)c(O)c1C ZINC000756549269 1046098666 /nfs/dbraw/zinc/09/86/66/1046098666.db2.gz DRMZHRBPVIRFMT-JKSUJKDBSA-N 1 0 311.425 4.226 20 10 DICDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1F ZINC000756539553 1046099077 /nfs/dbraw/zinc/09/90/77/1046099077.db2.gz QIIVOAVXIIUAOU-AWEZNQCLSA-N 1 0 317.404 4.050 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1F ZINC000756557218 1046099682 /nfs/dbraw/zinc/09/96/82/1046099682.db2.gz RFKPYKKLGXRKPD-CQSZACIVSA-N 1 0 317.404 4.398 20 10 DICDRO C[C@H]([NH2+]CC1CCSCC1)c1cc2c(cc1O)CCCC2 ZINC000756571806 1046103023 /nfs/dbraw/zinc/10/30/23/1046103023.db2.gz FTIGENIMNFBYNR-ZDUSSCGKSA-N 1 0 305.487 4.065 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCN(c3ccccc3)C2)c(O)c1C ZINC000756582375 1046104720 /nfs/dbraw/zinc/10/47/20/1046104720.db2.gz HYMJWGBKEHZDKW-MSOLQXFVSA-N 1 0 324.468 4.329 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2c[nH]c3c2cccc3C)c1 ZINC000756598262 1046106167 /nfs/dbraw/zinc/10/61/67/1046106167.db2.gz QULBXHSYWSWOMU-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(Cl)cc1 ZINC000756608459 1046107444 /nfs/dbraw/zinc/10/74/44/1046107444.db2.gz CDJUZOMADLSEHS-ACJLOTCBSA-N 1 0 319.832 4.392 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)c1ccncc1 ZINC000756608670 1046107511 /nfs/dbraw/zinc/10/75/11/1046107511.db2.gz QOQHYGDHNWEKRF-TUKIKUTGSA-N 1 0 300.377 4.216 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Sc1ccccc1 ZINC000756611397 1046110003 /nfs/dbraw/zinc/11/00/03/1046110003.db2.gz SKYFFPLAOUPVOU-OLZOCXBDSA-N 1 0 305.418 4.363 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(Cl)ccc2O)C12CCC2 ZINC000756613498 1046110209 /nfs/dbraw/zinc/11/02/09/1046110209.db2.gz PSDNCXLINMSJHP-XFBWCDHKSA-N 1 0 309.837 4.044 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2O)C12CCC2 ZINC000756613724 1046110266 /nfs/dbraw/zinc/11/02/66/1046110266.db2.gz QKRAGFLAXAYNCU-BHYGNILZSA-N 1 0 303.446 4.007 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1c(C)nn(C)c1C ZINC000756617920 1046110309 /nfs/dbraw/zinc/11/03/09/1046110309.db2.gz QRJHNCLRNTVTCQ-DYVFJYSZSA-N 1 0 315.461 4.161 20 10 DICDRO CCCN(Cc1cccc2cnccc21)c1ccc(C[NH3+])cc1 ZINC000194980796 1046110455 /nfs/dbraw/zinc/11/04/55/1046110455.db2.gz BGZVLXBTOUZZPH-UHFFFAOYSA-N 1 0 305.425 4.110 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(C)c(C)c2O)C12CCC2 ZINC000756613726 1046110844 /nfs/dbraw/zinc/11/08/44/1046110844.db2.gz QKRAGFLAXAYNCU-DJIMGWMZSA-N 1 0 303.446 4.007 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccc(F)cc2F)c(O)c1 ZINC000756620515 1046112861 /nfs/dbraw/zinc/11/28/61/1046112861.db2.gz KKUHETDAJUZHQR-QWHCGFSZSA-N 1 0 305.368 4.433 20 10 DICDRO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc3ccccc3c2O)CCO1 ZINC000756663505 1046117713 /nfs/dbraw/zinc/11/77/13/1046117713.db2.gz JWHFBAJKMUNNDO-URLQWDBASA-N 1 0 313.441 4.400 20 10 DICDRO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc3ccccc3c2O)CCO1 ZINC000756663503 1046118225 /nfs/dbraw/zinc/11/82/25/1046118225.db2.gz JWHFBAJKMUNNDO-GMBSWORKSA-N 1 0 313.441 4.400 20 10 DICDRO CSc1cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)ccn1 ZINC000756664722 1046118278 /nfs/dbraw/zinc/11/82/78/1046118278.db2.gz PGBOFXHYBMOSNI-JTQLQIEISA-N 1 0 308.834 4.013 20 10 DICDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756684659 1046119513 /nfs/dbraw/zinc/11/95/13/1046119513.db2.gz PESBLSZQVLZACI-BLLLJJGKSA-N 1 0 317.816 4.447 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(C)cc1O ZINC000756684155 1046119825 /nfs/dbraw/zinc/11/98/25/1046119825.db2.gz LAFSQAGNDQJNIV-RDTXWAMCSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000756681440 1046119902 /nfs/dbraw/zinc/11/99/02/1046119902.db2.gz BPVOLNWWUFUZTL-MAUKXSAKSA-N 1 0 311.425 4.410 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756675982 1046120032 /nfs/dbraw/zinc/12/00/32/1046120032.db2.gz KDKFKYYZPAORPO-XUJVJEKNSA-N 1 0 300.377 4.134 20 10 DICDRO COc1ccc(C(C)(C)C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000756683582 1046120427 /nfs/dbraw/zinc/12/04/27/1046120427.db2.gz SHDKDEIXMAWCCB-OAHLLOKOSA-N 1 0 313.441 4.338 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756678362 1046120523 /nfs/dbraw/zinc/12/05/23/1046120523.db2.gz WBIAKZDLOMGHBG-GJZGRUSLSA-N 1 0 310.441 4.386 20 10 DICDRO Fc1cccc2c1CN(Cc1ccc(N3CCCCC3)cc1)C2 ZINC001138219701 1046120657 /nfs/dbraw/zinc/12/06/57/1046120657.db2.gz LXYQOCCONGMTGX-UHFFFAOYSA-N 1 0 310.416 4.332 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Oc1ccccc1Cl ZINC000756734713 1046124153 /nfs/dbraw/zinc/12/41/53/1046124153.db2.gz YUQGVOGNNAQGGO-NEPJUHHUSA-N 1 0 323.795 4.303 20 10 DICDRO CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756737621 1046125320 /nfs/dbraw/zinc/12/53/20/1046125320.db2.gz WPYDPHRRXGMPMP-AHIWAGSCSA-N 1 0 311.853 4.147 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2COc3c2cccc3Cl)c(O)c1C ZINC000756756198 1046126370 /nfs/dbraw/zinc/12/63/70/1046126370.db2.gz FYNVYTACZADZOT-WBMJQRKESA-N 1 0 317.816 4.447 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](c3ccccc3)[C@@H]2C)c1 ZINC000756758629 1046127398 /nfs/dbraw/zinc/12/73/98/1046127398.db2.gz HEHTUSQOCTYBCO-AGGDQXJMSA-N 1 0 311.425 4.244 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c(F)c1 ZINC000756759743 1046127500 /nfs/dbraw/zinc/12/75/00/1046127500.db2.gz XXEWNPGFHNTOBI-MEBBXXQBSA-N 1 0 319.351 4.017 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)[C@H]2CCCCO2)c(O)c1C ZINC000756758165 1046127557 /nfs/dbraw/zinc/12/75/57/1046127557.db2.gz SNAZEVUBLFSEPT-DOTOQJQBSA-N 1 0 305.462 4.255 20 10 DICDRO CCOCCC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CCC1 ZINC000756762033 1046128034 /nfs/dbraw/zinc/12/80/34/1046128034.db2.gz VZYBMMZPPZLQAK-UKRRQHHQSA-N 1 0 321.436 4.266 20 10 DICDRO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cc(Cl)ccc1O ZINC000756757741 1046128230 /nfs/dbraw/zinc/12/82/30/1046128230.db2.gz BJCXBNQDCDMTEO-LKFCYVNXSA-N 1 0 324.207 4.483 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1Cl ZINC000756760156 1046128323 /nfs/dbraw/zinc/12/83/23/1046128323.db2.gz LZZQGTZKOXBIBW-UGSOOPFHSA-N 1 0 319.832 4.392 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c(C)c1 ZINC000756757703 1046128340 /nfs/dbraw/zinc/12/83/40/1046128340.db2.gz APRUYFMZOAPSOL-MLGOLLRUSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ccccc2Cl)c(O)c1 ZINC000756768824 1046129812 /nfs/dbraw/zinc/12/98/12/1046129812.db2.gz NPUITYPCIOLSMJ-CYBMUJFWSA-N 1 0 305.805 4.084 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOCc2ccc(Cl)cc2)c1 ZINC000756768923 1046130447 /nfs/dbraw/zinc/13/04/47/1046130447.db2.gz AUVVRWGGWQJTES-CQSZACIVSA-N 1 0 319.832 4.221 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCOc2ccccc2Cl)c1 ZINC000756767318 1046130563 /nfs/dbraw/zinc/13/05/63/1046130563.db2.gz GAUXTDQERWPNLY-ZDUSSCGKSA-N 1 0 305.805 4.084 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC2(c3ccc(F)cc3F)CC2)c(O)c1 ZINC000756777798 1046131609 /nfs/dbraw/zinc/13/16/09/1046131609.db2.gz LCJZFIJLWOGTKI-ZDUSSCGKSA-N 1 0 317.379 4.361 20 10 DICDRO Cc1c(C[NH+]2CCC3(CCC(=O)CC3)CC2)c2ccccc2n1C ZINC001138260122 1046131909 /nfs/dbraw/zinc/13/19/09/1046131909.db2.gz VOUQJWXWEXGGMT-UHFFFAOYSA-N 1 0 324.468 4.212 20 10 DICDRO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1cc(Cl)ccc1O ZINC000756785070 1046133521 /nfs/dbraw/zinc/13/35/21/1046133521.db2.gz RWEBTLXDNGDBKW-GTNSWQLSSA-N 1 0 302.805 4.243 20 10 DICDRO C[N@H+](CCCOC(C)(C)C)Cc1ccc(N2CCCCC2)cc1 ZINC000756784153 1046133788 /nfs/dbraw/zinc/13/37/88/1046133788.db2.gz RNZAUDBKONWQED-UHFFFAOYSA-N 1 0 318.505 4.314 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCCc2cccs2)c2c1c(F)ccc2O ZINC000756780965 1046133870 /nfs/dbraw/zinc/13/38/70/1046133870.db2.gz ZLFGMMPZXHDGCG-BXUZGUMPSA-N 1 0 305.418 4.364 20 10 DICDRO COc1ccc(C[C@@H](C)C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756785031 1046134141 /nfs/dbraw/zinc/13/41/41/1046134141.db2.gz RRBBQKOINSTQRS-ZIAGYGMSSA-N 1 0 317.404 4.069 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000083552352 1046137420 /nfs/dbraw/zinc/13/74/20/1046137420.db2.gz MMSGRUZCZPTEGG-UHFFFAOYSA-N 1 0 300.160 4.128 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccccc1C(F)(F)F ZINC000083552300 1046137537 /nfs/dbraw/zinc/13/75/37/1046137537.db2.gz FROWFXYHROFSNM-UHFFFAOYSA-N 1 0 315.722 4.354 20 10 DICDRO C[C@H]([NH2+]C1(c2ccc(F)cc2)CCC1)c1cc(F)ccc1O ZINC000756818484 1046138608 /nfs/dbraw/zinc/13/86/08/1046138608.db2.gz NWCYBSDCHGUGFR-LBPRGKRZSA-N 1 0 303.352 4.400 20 10 DICDRO Cc1csc(C2([NH2+][C@@H](C)c3ccc(C)cc3O)CCC2)n1 ZINC000756820650 1046140198 /nfs/dbraw/zinc/14/01/98/1046140198.db2.gz JTPRQTHAHSQERY-ZDUSSCGKSA-N 1 0 302.443 4.196 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]C2(c3cccc(F)c3)CC2)c2c1c(F)ccc2O ZINC000756831990 1046140370 /nfs/dbraw/zinc/14/03/70/1046140370.db2.gz CPOIJBBASBOIJJ-XHDPSFHLSA-N 1 0 315.363 4.498 20 10 DICDRO Cc1csc(C2([NH2+][C@H](C)c3ccc(C)cc3O)CCC2)n1 ZINC000756820648 1046140559 /nfs/dbraw/zinc/14/05/59/1046140559.db2.gz JTPRQTHAHSQERY-CYBMUJFWSA-N 1 0 302.443 4.196 20 10 DICDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)CCO1 ZINC000756873750 1046147251 /nfs/dbraw/zinc/14/72/51/1046147251.db2.gz JKKBQHWYWLTMFZ-NWANDNLSSA-N 1 0 311.853 4.290 20 10 DICDRO CN1CCCc2cc(C[N@@H+]3CCC[C@@H]3c3cccs3)ccc21 ZINC001138358689 1046155544 /nfs/dbraw/zinc/15/55/44/1046155544.db2.gz XRHJDUDBSDLEJF-GOSISDBHSA-N 1 0 312.482 4.468 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(C)c1 ZINC001138436901 1046182072 /nfs/dbraw/zinc/18/20/72/1046182072.db2.gz PJKGXIPSZKABHK-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO C[C@H]([NH2+]Cc1nccc2c1CCCC2)c1ccc(Cl)cc1O ZINC000903183065 1046185729 /nfs/dbraw/zinc/18/57/29/1046185729.db2.gz ZMYPOJFAQHEJAC-LBPRGKRZSA-N 1 0 316.832 4.170 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@H](C)c1cc(F)cc(F)c1O ZINC000757615842 1046193023 /nfs/dbraw/zinc/19/30/23/1046193023.db2.gz ZKPHQHBTSCKACM-GFCCVEGCSA-N 1 0 320.383 4.214 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cc(F)c(F)c(F)c2)c(O)c1 ZINC000757639286 1046195138 /nfs/dbraw/zinc/19/51/38/1046195138.db2.gz QJLMWWBQYOUESO-LLVKDONJSA-N 1 0 309.331 4.011 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCNc2ccccc2F)c(O)c1C ZINC000757659078 1046197863 /nfs/dbraw/zinc/19/78/63/1046197863.db2.gz VRJPROTVYSCMJN-OAHLLOKOSA-N 1 0 316.420 4.301 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC000757674157 1046199684 /nfs/dbraw/zinc/19/96/84/1046199684.db2.gz QILLJAKPVARMGO-CWSCBRNRSA-N 1 0 320.433 4.238 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2COc3cc(F)cc(F)c32)c(O)c1C ZINC000757663097 1046199957 /nfs/dbraw/zinc/19/99/57/1046199957.db2.gz HTBFDRFMYWMKTH-XHDPSFHLSA-N 1 0 319.351 4.072 20 10 DICDRO C[C@H]([NH2+]CCN1CCCCCC1)c1ccc2ccccc2c1O ZINC000321196599 1046213082 /nfs/dbraw/zinc/21/30/82/1046213082.db2.gz WTTZCRTZJQKCLP-INIZCTEOSA-N 1 0 312.457 4.072 20 10 DICDRO CC[C@@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1cc(Cl)ccc1O ZINC000903283633 1046222972 /nfs/dbraw/zinc/22/29/72/1046222972.db2.gz RZTOSNRYBZKWOA-AAPKZHPUSA-N 1 0 309.837 4.044 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CC3(C2)COC(C)(C)C3)c(O)c1C ZINC000903324191 1046239353 /nfs/dbraw/zinc/23/93/53/1046239353.db2.gz MXSKHYBMDVXAQP-XVTSOASTSA-N 1 0 303.446 4.007 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C2CC3(C2)COC(C)(C)C3)c(O)c1C ZINC000903324190 1046240077 /nfs/dbraw/zinc/24/00/77/1046240077.db2.gz MXSKHYBMDVXAQP-TZGCNFNXSA-N 1 0 303.446 4.007 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccc(Cl)cc1O ZINC000903336089 1046247903 /nfs/dbraw/zinc/24/79/03/1046247903.db2.gz VWIIFCCVLQBSIG-DIFFPNOSSA-N 1 0 302.805 4.243 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccn2)C2CC2)c2c1c(F)ccc2O ZINC000903335907 1046249147 /nfs/dbraw/zinc/24/91/47/1046249147.db2.gz UPHWRILDPCMNOP-PRIMNGNOSA-N 1 0 312.388 4.216 20 10 DICDRO C[C@@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000245627332 1046249973 /nfs/dbraw/zinc/24/99/73/1046249973.db2.gz YTSMWWLFASZMEK-SFNKJDCFSA-N 1 0 316.489 4.284 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(OC)c(C)c2)c1 ZINC000897417732 1046254318 /nfs/dbraw/zinc/25/43/18/1046254318.db2.gz VOGLBQHYJYMMMZ-KGLIPLIRSA-N 1 0 315.413 4.130 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cc(F)ccc1OC ZINC000903371258 1046258761 /nfs/dbraw/zinc/25/87/61/1046258761.db2.gz QTWAGEKBIOEVJL-BLLLJJGKSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)c(O)c1 ZINC000903404874 1046266890 /nfs/dbraw/zinc/26/68/90/1046266890.db2.gz MPZFAFLNRNPGIJ-LSDHHAIUSA-N 1 0 313.445 4.109 20 10 DICDRO Cc1ncccc1CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000903415123 1046271232 /nfs/dbraw/zinc/27/12/32/1046271232.db2.gz HNGBYDJFBDSDOQ-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO Cc1cccc(Cl)c1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001138721900 1046278088 /nfs/dbraw/zinc/27/80/88/1046278088.db2.gz KRUCBNBVKAGBPP-UHFFFAOYSA-N 1 0 317.816 4.008 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(OC(F)F)c1)c1ccc(N(C)C)cc1 ZINC000089520335 1046287091 /nfs/dbraw/zinc/28/70/91/1046287091.db2.gz AKKZRXNWSNMEHY-CYBMUJFWSA-N 1 0 320.383 4.205 20 10 DICDRO CC[C@@H]([NH2+][C@H](COC)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000089668347 1046297194 /nfs/dbraw/zinc/29/71/94/1046297194.db2.gz XYCVSJHSCTZCAJ-WOJBJXKFSA-N 1 0 312.457 4.181 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccccc1OC(F)F ZINC001138912405 1046325910 /nfs/dbraw/zinc/32/59/10/1046325910.db2.gz OUOUDRXPTNTXLR-UHFFFAOYSA-N 1 0 307.340 4.016 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1c(Cl)ccc2cccnc21 ZINC000109771966 1046332751 /nfs/dbraw/zinc/33/27/51/1046332751.db2.gz YUMHSJGSDITCFJ-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO COC1CCN(c2ccc(C[N@@H+]3[C@H](C)CCC3(C)C)cc2)CC1 ZINC000832564551 1046350574 /nfs/dbraw/zinc/35/05/74/1046350574.db2.gz HHBRBLSYBFYJNF-MRXNPFEDSA-N 1 0 316.489 4.065 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000090536196 1046381298 /nfs/dbraw/zinc/38/12/98/1046381298.db2.gz ANFXSVLZWGHZJM-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO CC(C)(CC(F)(F)F)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000780588033 1046395254 /nfs/dbraw/zinc/39/52/54/1046395254.db2.gz BWNBBEAYHUQSMI-UHFFFAOYSA-N 1 0 314.395 4.498 20 10 DICDRO CCOCc1cc(C[NH2+]C(C)(C)CC(F)(F)F)ccc1OC ZINC000780588501 1046395618 /nfs/dbraw/zinc/39/56/18/1046395618.db2.gz XHGMFQSKQKRRED-UHFFFAOYSA-N 1 0 319.367 4.052 20 10 DICDRO CC[C@H]1C[C@H](C[N@H+](Cc2ccccc2O)C2CCCC2)CCO1 ZINC000780758442 1046403386 /nfs/dbraw/zinc/40/33/86/1046403386.db2.gz RVVVWIPNLPGNQJ-APWZRJJASA-N 1 0 317.473 4.342 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)CC1 ZINC000090722844 1046416929 /nfs/dbraw/zinc/41/69/29/1046416929.db2.gz XRQUEBZJBMKKAS-SFHVURJKSA-N 1 0 304.478 4.000 20 10 DICDRO CCC1CCC([NH2+]C[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 ZINC001202913464 1046418269 /nfs/dbraw/zinc/41/82/69/1046418269.db2.gz MXVJXAQAHSRYJN-ADKAHSJRSA-N 1 0 316.489 4.080 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc(-c3ccsc3)nc1)CC2 ZINC001139504831 1046457796 /nfs/dbraw/zinc/45/77/96/1046457796.db2.gz IXKKZTYVFAQXFF-UHFFFAOYSA-N 1 0 322.433 4.074 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)c(OC)c1)Cc1ccccc1O ZINC001139614406 1046486468 /nfs/dbraw/zinc/48/64/68/1046486468.db2.gz FSCUNDNLAJUBFY-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ccc(N(C)C)cc1 ZINC000781923375 1046487720 /nfs/dbraw/zinc/48/77/20/1046487720.db2.gz NBIJLOSEPRVQQB-SCLBCKFNSA-N 1 0 301.409 4.089 20 10 DICDRO CCOc1cccc(C[N@H+](CC)[C@@H](C)c2cccc(O)c2)c1O ZINC000091975038 1046490773 /nfs/dbraw/zinc/49/07/73/1046490773.db2.gz ZULVJNXHWIJGSJ-AWEZNQCLSA-N 1 0 315.413 4.080 20 10 DICDRO COc1cccc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)c1O ZINC000092221671 1046501020 /nfs/dbraw/zinc/50/10/20/1046501020.db2.gz QIUPOQXDDZSRTP-GOSISDBHSA-N 1 0 309.409 4.053 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cc(F)ccc1O ZINC000359974141 1046529452 /nfs/dbraw/zinc/52/94/52/1046529452.db2.gz NFAZUCYTXCJCGK-VLIAUNLRSA-N 1 0 322.383 4.367 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cc(F)ccc1O ZINC000359974142 1046529800 /nfs/dbraw/zinc/52/98/00/1046529800.db2.gz NFAZUCYTXCJCGK-XOBRGWDASA-N 1 0 322.383 4.367 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(Cl)c1OC)c1ccccc1O ZINC000897481850 1046555767 /nfs/dbraw/zinc/55/57/67/1046555767.db2.gz IUIHRCHEUPLAJU-HNNXBMFYSA-N 1 0 305.805 4.295 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc2ccccc2cn1 ZINC001140000595 1046565189 /nfs/dbraw/zinc/56/51/89/1046565189.db2.gz KVNQVLOSMFENTN-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000783309818 1046579826 /nfs/dbraw/zinc/57/98/26/1046579826.db2.gz MYXJKVONHXGSEC-QLFBSQMISA-N 1 0 322.880 4.016 20 10 DICDRO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cc(F)ccc1O ZINC001140063526 1046583476 /nfs/dbraw/zinc/58/34/76/1046583476.db2.gz RBZPRTWZUBBIBA-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@@H]1CC2CCC1CC2 ZINC001203005087 1046597578 /nfs/dbraw/zinc/59/75/78/1046597578.db2.gz ALATVUDEESOZFT-WOICTCIZSA-N 1 0 322.443 4.335 20 10 DICDRO C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(Cl)cc1[O-] ZINC000841743489 1046601948 /nfs/dbraw/zinc/60/19/48/1046601948.db2.gz HTPQRQCRWLLIBI-NSHDSACASA-N 1 0 310.869 4.005 20 10 DICDRO Cc1ccc([C@@H](C[NH2+][C@@H](C)c2ccccc2O)N2CCCC2)cc1 ZINC000783507314 1046602240 /nfs/dbraw/zinc/60/22/40/1046602240.db2.gz CBAZYAONTXMGBM-FXAWDEMLSA-N 1 0 324.468 4.188 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc(-c3ccncc3)cc1)CC2 ZINC001140171322 1046605644 /nfs/dbraw/zinc/60/56/44/1046605644.db2.gz MAUOVFVWFKJHHY-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1c(C)ccc(C)c1O ZINC001140184505 1046609034 /nfs/dbraw/zinc/60/90/34/1046609034.db2.gz XBDKFBLACMGQGZ-INIZCTEOSA-N 1 0 313.441 4.081 20 10 DICDRO Cc1ccc(C)c(C[N@H+](C)CCc2ccccc2Cl)c1O ZINC001140182707 1046609692 /nfs/dbraw/zinc/60/96/92/1046609692.db2.gz XUNXPBVDLFTUPV-UHFFFAOYSA-N 1 0 303.833 4.337 20 10 DICDRO COc1ccc([C@H]2CC[N@H+](Cc3c(C)ccc(C)c3O)C2)cc1 ZINC001140184494 1046609908 /nfs/dbraw/zinc/60/99/08/1046609908.db2.gz WSRITJSHKUCKAD-KRWDZBQOSA-N 1 0 311.425 4.007 20 10 DICDRO Cc1ccc(C)c(C[N@H+](C)Cc2nc3ccccc3s2)c1O ZINC001140178313 1046610018 /nfs/dbraw/zinc/61/00/18/1046610018.db2.gz HTKRMBVXOCAEFE-UHFFFAOYSA-N 1 0 312.438 4.251 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)c(O)cc1C ZINC001140202401 1046614271 /nfs/dbraw/zinc/61/42/71/1046614271.db2.gz CSOLNFDVRYVGCY-UHFFFAOYSA-N 1 0 312.457 4.097 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(C)cc2O)CCO1 ZINC000248499580 1046619109 /nfs/dbraw/zinc/61/91/09/1046619109.db2.gz MVZNZROZESCWKE-OGWOLHLISA-N 1 0 305.462 4.335 20 10 DICDRO Cc1ncsc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000093319349 1046622298 /nfs/dbraw/zinc/62/22/98/1046622298.db2.gz GHYGQFJEUJBCAR-UHFFFAOYSA-N 1 0 302.443 4.102 20 10 DICDRO Cc1[nH]c2ccc(C[NH2+][C@H]3CCc4cccc(O)c43)cc2c1C ZINC000834534494 1046627180 /nfs/dbraw/zinc/62/71/80/1046627180.db2.gz QTTZXOFFJWUCTM-SFHVURJKSA-N 1 0 306.409 4.267 20 10 DICDRO COc1cccc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)c1O ZINC000093441708 1046629250 /nfs/dbraw/zinc/62/92/50/1046629250.db2.gz JVUJUKWXXQOZKK-OAHLLOKOSA-N 1 0 301.386 4.111 20 10 DICDRO CCC(C)(C)[C@@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000834558840 1046631897 /nfs/dbraw/zinc/63/18/97/1046631897.db2.gz QJWJQPLGTPDXCS-OAHLLOKOSA-N 1 0 304.478 4.078 20 10 DICDRO Cc1cccc2[nH]cc(CC[NH2+][C@@H]3CCc4cccc(O)c43)c21 ZINC000834562533 1046632346 /nfs/dbraw/zinc/63/23/46/1046632346.db2.gz QCNWPALAKIKMIX-QGZVFWFLSA-N 1 0 306.409 4.002 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834611046 1046637980 /nfs/dbraw/zinc/63/79/80/1046637980.db2.gz CNTQNVUFCFBMSM-AWEZNQCLSA-N 1 0 303.402 4.030 20 10 DICDRO CSCc1cc(F)ccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834620418 1046639447 /nfs/dbraw/zinc/63/94/47/1046639447.db2.gz RKHYUZATMAZFNN-MRXNPFEDSA-N 1 0 317.429 4.171 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cc(F)ccc1F ZINC000834669001 1046646832 /nfs/dbraw/zinc/64/68/32/1046646832.db2.gz QATFKVLQCAPUAR-HOTGVXAUSA-N 1 0 303.352 4.399 20 10 DICDRO Cc1ccc([C@H]2CC[N@H+](Cc3c(O)ccc4ccncc43)C2)cc1 ZINC000784023716 1046652162 /nfs/dbraw/zinc/65/21/62/1046652162.db2.gz RQNDWKGATZSWJJ-SFHVURJKSA-N 1 0 318.420 4.238 20 10 DICDRO CC(C)c1csc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)n1 ZINC000841758266 1046664512 /nfs/dbraw/zinc/66/45/12/1046664512.db2.gz KXSYDYFCFFQRKT-SNVBAGLBSA-N 1 0 310.850 4.476 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001140341248 1046666686 /nfs/dbraw/zinc/66/66/86/1046666686.db2.gz GJFHOQPKCVQYQK-ZDUSSCGKSA-N 1 0 305.780 4.174 20 10 DICDRO Oc1cccc(C2CC[NH+](Cc3c(O)cccc3Cl)CC2)c1 ZINC001140342540 1046667954 /nfs/dbraw/zinc/66/79/54/1046667954.db2.gz OIZCIDNTDCIHEF-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@H](c1ccccc1)C(F)(F)F)CC2 ZINC000834774438 1046668192 /nfs/dbraw/zinc/66/81/92/1046668192.db2.gz PCFHFHMKAJKPDH-HUUCEWRRSA-N 1 0 321.342 4.315 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(O)cccc1Cl ZINC001140344946 1046668411 /nfs/dbraw/zinc/66/84/11/1046668411.db2.gz NYDDGCNCWCXEBG-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1ccccc1O[C@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001140341962 1046668877 /nfs/dbraw/zinc/66/88/77/1046668877.db2.gz NBMNHFPNBCRSPU-AWEZNQCLSA-N 1 0 317.816 4.007 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(Cl)cc1O ZINC000841757804 1046669923 /nfs/dbraw/zinc/66/99/23/1046669923.db2.gz QEIFDUIUHRVSOK-RKDXNWHRSA-N 1 0 312.747 4.131 20 10 DICDRO C[N@H+](Cc1ccc(-c2ccccn2)cc1)Cc1ccccc1O ZINC001140382738 1046680592 /nfs/dbraw/zinc/68/05/92/1046680592.db2.gz ZJFKLIUHKVQSNT-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(C)(C)c2ccccn2)c1O ZINC000834851196 1046686269 /nfs/dbraw/zinc/68/62/69/1046686269.db2.gz VQNNEAPORJXGNM-CYBMUJFWSA-N 1 0 318.848 4.377 20 10 DICDRO C[C@H]([NH2+]CCC(C)(C)CO)c1ccc(N2CCCCCC2)cc1 ZINC000834872223 1046691851 /nfs/dbraw/zinc/69/18/51/1046691851.db2.gz XSJUBPLOOKUIDJ-KRWDZBQOSA-N 1 0 318.505 4.126 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCc2ncccc2C)cc1 ZINC000834882669 1046695696 /nfs/dbraw/zinc/69/56/96/1046695696.db2.gz CBTWDFNHKZIXEA-QGZVFWFLSA-N 1 0 311.473 4.130 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c(O)c1C ZINC000834883353 1046697150 /nfs/dbraw/zinc/69/71/50/1046697150.db2.gz QAEJAXKRZCUOES-JKSUJKDBSA-N 1 0 303.446 4.009 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1nccn1CC)c1cc(Cl)ccc1O ZINC000834894916 1046705487 /nfs/dbraw/zinc/70/54/87/1046705487.db2.gz MZEIYJPMINWMEX-FZMZJTMJSA-N 1 0 307.825 4.064 20 10 DICDRO Cc1cccc(C[NH2+]C2CC(F)(c3cccc(Cl)c3)C2)c1O ZINC000796039924 1046705912 /nfs/dbraw/zinc/70/59/12/1046705912.db2.gz LUZZYNFUZKXRJA-UHFFFAOYSA-N 1 0 319.807 4.471 20 10 DICDRO C[C@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO[C@H]1C1CC1 ZINC000784688771 1046708310 /nfs/dbraw/zinc/70/83/10/1046708310.db2.gz YHNOGJJOEIRUQA-SFTDATJTSA-N 1 0 323.436 4.106 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000834908822 1046715408 /nfs/dbraw/zinc/71/54/08/1046715408.db2.gz HMLCIVDTDTYWGY-WFASDCNBSA-N 1 0 311.853 4.292 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCN(C)c2ccccc21)c1cc(F)ccc1O ZINC000834904080 1046715684 /nfs/dbraw/zinc/71/56/84/1046715684.db2.gz NGAULBSYDMCYNB-SUMWQHHRSA-N 1 0 314.404 4.153 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+][C@@H](C)c3cc(C)ccc3O)C2)c1 ZINC000834905748 1046715749 /nfs/dbraw/zinc/71/57/49/1046715749.db2.gz VVBZPBDPUGUCTO-XIRDDKMYSA-N 1 0 311.425 4.306 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c1O ZINC000834908629 1046717628 /nfs/dbraw/zinc/71/76/28/1046717628.db2.gz GTVXEOMJUMBOLU-STQMWFEESA-N 1 0 311.853 4.210 20 10 DICDRO COc1ccccc1[C@H]1CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140461900 1046734853 /nfs/dbraw/zinc/73/48/53/1046734853.db2.gz XERAKLOHQZGGFJ-ZDUSSCGKSA-N 1 0 317.816 4.044 20 10 DICDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140461899 1046736566 /nfs/dbraw/zinc/73/65/66/1046736566.db2.gz XERAKLOHQZGGFJ-CYBMUJFWSA-N 1 0 317.816 4.044 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC001140466247 1046737329 /nfs/dbraw/zinc/73/73/29/1046737329.db2.gz CLJNRECLSHLBHZ-LBPRGKRZSA-N 1 0 305.780 4.174 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001140465101 1046737419 /nfs/dbraw/zinc/73/74/19/1046737419.db2.gz HGKDFSQYXICBGO-ZDUSSCGKSA-N 1 0 305.780 4.174 20 10 DICDRO CC(C)OC1CCC([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835040441 1046746238 /nfs/dbraw/zinc/74/62/38/1046746238.db2.gz COJOZYJWUUMVSF-AATRIKPKSA-N 1 0 316.489 4.092 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cc1 ZINC000835048661 1046748241 /nfs/dbraw/zinc/74/82/41/1046748241.db2.gz KGDULVTZNXIHRU-ABCZVMIZSA-N 1 0 312.379 4.040 20 10 DICDRO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835048150 1046749915 /nfs/dbraw/zinc/74/99/15/1046749915.db2.gz MJVQUZSGYFMBMF-CGYSWORWSA-N 1 0 321.468 4.244 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@H+](C)C2CCC(F)(F)CC2)cc1 ZINC000835052794 1046751971 /nfs/dbraw/zinc/75/19/71/1046751971.db2.gz HQQUHIZAQHLBIK-PLNGDYQASA-N 1 0 308.416 4.276 20 10 DICDRO CC[C@@H](Nc1cc(C)cc(C[NH+](C)C)c1)c1ccc(F)cc1O ZINC000796890991 1046753385 /nfs/dbraw/zinc/75/33/85/1046753385.db2.gz IMWSFNUOXNUXBQ-GOSISDBHSA-N 1 0 316.420 4.465 20 10 DICDRO CC[C@@H](Nc1cc(C[NH+](C)C)ccc1C)c1ccc(F)cc1O ZINC000796925604 1046759623 /nfs/dbraw/zinc/75/96/23/1046759623.db2.gz YJRPGMMGCDSULV-QGZVFWFLSA-N 1 0 316.420 4.465 20 10 DICDRO C[C@H]([NH2+][C@H]1CSC[C@@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000797066232 1046785462 /nfs/dbraw/zinc/78/54/62/1046785462.db2.gz QCNOHCNTAKDFIW-ZQIUZPCESA-N 1 0 322.493 4.218 20 10 DICDRO CC[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1cc(Cl)ccc1O ZINC000797071754 1046786421 /nfs/dbraw/zinc/78/64/21/1046786421.db2.gz VDNMSCHQYCSCFQ-NSHDSACASA-N 1 0 307.743 4.429 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC2(c3ccccn3)CCC2)c(O)c1C ZINC000797100844 1046790098 /nfs/dbraw/zinc/79/00/98/1046790098.db2.gz QEIJIZIYQJCZLG-MRXNPFEDSA-N 1 0 310.441 4.177 20 10 DICDRO Cc1ccc(O)c(C[N@H+](Cc2ccccc2)Cc2cccnc2)c1 ZINC001140620997 1046814574 /nfs/dbraw/zinc/81/45/74/1046814574.db2.gz KZPOBUYLFQQGDS-UHFFFAOYSA-N 1 0 318.420 4.298 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1 ZINC001140623545 1046816525 /nfs/dbraw/zinc/81/65/25/1046816525.db2.gz UTBMBFMZTQYAKX-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC(c3ccc(F)cc3F)CC2)c1 ZINC001140624300 1046819649 /nfs/dbraw/zinc/81/96/49/1046819649.db2.gz PTBRGMZYGQIGCL-UHFFFAOYSA-N 1 0 317.379 4.358 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(OC)cc1C ZINC001140677541 1046845452 /nfs/dbraw/zinc/84/54/52/1046845452.db2.gz RUTHDCHILMIUMT-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO c1csc(SCCC[NH2+]Cc2ccc3occc3c2)n1 ZINC000796309815 1046874782 /nfs/dbraw/zinc/87/47/82/1046874782.db2.gz LXKWQOWNWCMUID-UHFFFAOYSA-N 1 0 304.440 4.161 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)c1O ZINC001140746423 1046882732 /nfs/dbraw/zinc/88/27/32/1046882732.db2.gz YPTPOTXMQFSDGV-KRWDZBQOSA-N 1 0 315.388 4.273 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c1O ZINC001140747441 1046884550 /nfs/dbraw/zinc/88/45/50/1046884550.db2.gz DCOFZLRIYYJXTR-CYBMUJFWSA-N 1 0 317.816 4.049 20 10 DICDRO Cc1c(O)ccc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2)c1O ZINC001140748535 1046885868 /nfs/dbraw/zinc/88/58/68/1046885868.db2.gz HWOBVTMEOUQIAH-LBPRGKRZSA-N 1 0 305.805 4.253 20 10 DICDRO Cc1c(O)ccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)c1O ZINC001140747649 1046886030 /nfs/dbraw/zinc/88/60/30/1046886030.db2.gz HROIPIIHAIFQBP-GFCCVEGCSA-N 1 0 305.805 4.253 20 10 DICDRO COc1ccc(C[NH2+]CCc2c(C)[nH]c3ccccc32)cc1C ZINC000237387725 1046888302 /nfs/dbraw/zinc/88/83/02/1046888302.db2.gz OFWCUQXFVHOEOZ-UHFFFAOYSA-N 1 0 308.425 4.126 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)c1 ZINC000797876532 1046900812 /nfs/dbraw/zinc/90/08/12/1046900812.db2.gz ABNXHXNQHUHLNJ-CZIWCDLHSA-N 1 0 301.817 4.390 20 10 DICDRO C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000237428089 1046907461 /nfs/dbraw/zinc/90/74/61/1046907461.db2.gz BCEMFISKKPHZAG-CKEIUWERSA-N 1 0 324.415 4.035 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1ccc(N(C)C)cc1 ZINC000797998676 1046917953 /nfs/dbraw/zinc/91/79/53/1046917953.db2.gz JSPCQTWSJRWCGA-LSBZLQRGSA-N 1 0 312.432 4.489 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCN2C2CCCCC2)c1 ZINC000798002900 1046920102 /nfs/dbraw/zinc/92/01/02/1046920102.db2.gz WBKJCFBILYQMGY-AEFFLSMTSA-N 1 0 316.489 4.148 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCN2C2CCCCC2)c1 ZINC000798002903 1046920144 /nfs/dbraw/zinc/92/01/44/1046920144.db2.gz WBKJCFBILYQMGY-WMZOPIPTSA-N 1 0 316.489 4.148 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCN1C1CCCCC1)c1ccccc1O ZINC000798002303 1046920327 /nfs/dbraw/zinc/92/03/27/1046920327.db2.gz CVKWPZYNQOQGJG-MJGOQNOKSA-N 1 0 316.489 4.230 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)c1O ZINC000798086529 1046926261 /nfs/dbraw/zinc/92/62/61/1046926261.db2.gz SSKMUCXNGOFYDS-SAZUREKKSA-N 1 0 317.816 4.090 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCC(F)(F)CC2)c(Cl)c1 ZINC001140921985 1046950553 /nfs/dbraw/zinc/95/05/53/1046950553.db2.gz YXMAZYXOTXKRFI-UHFFFAOYSA-N 1 0 302.796 4.027 20 10 DICDRO C[C@H]1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)CCC1(F)F ZINC001140921668 1046950649 /nfs/dbraw/zinc/95/06/49/1046950649.db2.gz MGYCHMCKGOBPQB-LBPRGKRZSA-N 1 0 316.823 4.273 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2ccc(Cl)nc2)c(Cl)c1 ZINC001140924066 1046950724 /nfs/dbraw/zinc/95/07/24/1046950724.db2.gz CKAFLEDFECANOX-UHFFFAOYSA-N 1 0 324.255 4.086 20 10 DICDRO CN(C)c1ccc(CN2CCC[C@H]2c2nccs2)c(Cl)c1 ZINC001140926011 1046951170 /nfs/dbraw/zinc/95/11/70/1046951170.db2.gz XKWVOPPXNNGWOC-HNNXBMFYSA-N 1 0 321.877 4.200 20 10 DICDRO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(C)cc2O)cc1 ZINC001140950862 1046960399 /nfs/dbraw/zinc/96/03/99/1046960399.db2.gz LWNXDHVPXZYAQV-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c(O)c1 ZINC001140950952 1046960500 /nfs/dbraw/zinc/96/05/00/1046960500.db2.gz QKRBTJNVEMROMU-AWEZNQCLSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1ccc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)c(O)c1 ZINC001140958243 1046962004 /nfs/dbraw/zinc/96/20/04/1046962004.db2.gz VKJDUQOEANKBHZ-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc(-c3ccccn3)s1)CC2 ZINC001141007027 1046977421 /nfs/dbraw/zinc/97/74/21/1046977421.db2.gz UVLAIRNUPNHFHH-UHFFFAOYSA-N 1 0 322.433 4.074 20 10 DICDRO Cc1cccnc1[C@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000798925584 1046985643 /nfs/dbraw/zinc/98/56/43/1046985643.db2.gz BWTUHPALGQLKNC-OALUTQOASA-N 1 0 322.452 4.141 20 10 DICDRO C[C@@H]([NH2+]CCCCC1CCOCC1)c1ccc(N(C)C)cc1 ZINC000799167344 1047006526 /nfs/dbraw/zinc/00/65/26/1047006526.db2.gz XGQKSDDWBMVMRG-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1ccc(N(C)C)cc1 ZINC000799729931 1047059814 /nfs/dbraw/zinc/05/98/14/1047059814.db2.gz WCAWBOBLZYYDRR-HNNXBMFYSA-N 1 0 307.441 4.127 20 10 DICDRO c1ccc(C[C@@H]2CC[N@@H+]2Cc2ccc(N3CCCC3)cc2)cc1 ZINC001116444936 1047142638 /nfs/dbraw/zinc/14/26/38/1047142638.db2.gz IGNOIWZXIAKBDP-NRFANRHFSA-N 1 0 306.453 4.104 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)cc1F ZINC001116565173 1047156135 /nfs/dbraw/zinc/15/61/35/1047156135.db2.gz JXPWPPWRVLCPAG-IUODEOHRSA-N 1 0 315.388 4.186 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1ccc(F)cc1 ZINC001116567452 1047158624 /nfs/dbraw/zinc/15/86/24/1047158624.db2.gz GBTFKMITNTXCET-KSSFIOAISA-N 1 0 317.404 4.186 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCCC1CCOCC1 ZINC001117831492 1047247732 /nfs/dbraw/zinc/24/77/32/1047247732.db2.gz PASGSWDXZRHMOH-GDBMZVCRSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1csc(CC[NH2+][C@@H](C)c2ccc3ccccc3c2O)n1 ZINC000387767470 1047285742 /nfs/dbraw/zinc/28/57/42/1047285742.db2.gz BLJXBVOSQQDSCH-ZDUSSCGKSA-N 1 0 312.438 4.204 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)[C@H]2CCc3ccccc32)c1O ZINC000388481524 1047286553 /nfs/dbraw/zinc/28/65/53/1047286553.db2.gz BCFRFRVFSDIHTK-INIZCTEOSA-N 1 0 317.816 4.174 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)CCOCc2ccccc2)c(O)c1 ZINC000389935973 1047292529 /nfs/dbraw/zinc/29/25/29/1047292529.db2.gz MNSONIBVABEXAF-IRXDYDNUSA-N 1 0 313.441 4.347 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)COCc2ccccc2)c(O)c1 ZINC000389898451 1047292626 /nfs/dbraw/zinc/29/26/26/1047292626.db2.gz ABMDTAIMNQOPTE-SJORKVTESA-N 1 0 313.441 4.204 20 10 DICDRO CSc1cccc(F)c1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000796448584 1047293877 /nfs/dbraw/zinc/29/38/77/1047293877.db2.gz IJPQQROWBYSEPC-UHFFFAOYSA-N 1 0 322.424 4.043 20 10 DICDRO FC1(F)CCC[C@@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000390551403 1047296878 /nfs/dbraw/zinc/29/68/78/1047296878.db2.gz KEXSGHZJLHBYQN-MRXNPFEDSA-N 1 0 308.416 4.202 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCN2Cc2ccccc2)c(O)c1 ZINC000390577308 1047299086 /nfs/dbraw/zinc/29/90/86/1047299086.db2.gz XFZZFTJJTBOSIJ-IEBWSBKVSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)c1O ZINC001118489838 1047299458 /nfs/dbraw/zinc/29/94/58/1047299458.db2.gz WHGQWCVQLTZEID-PCGAWMICSA-N 1 0 315.791 4.438 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)c1O ZINC000528038027 1047300715 /nfs/dbraw/zinc/30/07/15/1047300715.db2.gz OLFOBDXQWWFZAQ-MNOVXSKESA-N 1 0 308.784 4.300 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccnc(C)c2)c(C)n1-c1ccccc1 ZINC000391182075 1047303717 /nfs/dbraw/zinc/30/37/17/1047303717.db2.gz LFHAYPWXABKLMR-UHFFFAOYSA-N 1 0 305.425 4.087 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCn2ccc3ccccc32)c1 ZINC000391881655 1047306008 /nfs/dbraw/zinc/30/60/08/1047306008.db2.gz KHWNQQOXYWLPHK-OAHLLOKOSA-N 1 0 324.424 4.096 20 10 DICDRO Cc1cccnc1[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)C(C)(C)C ZINC000897997741 1047310052 /nfs/dbraw/zinc/31/00/52/1047310052.db2.gz JNHJYAZLCKLARG-LJQANCHMSA-N 1 0 310.441 4.202 20 10 DICDRO Cc1cc(C[NH2+]Cc2ncccc2C)c(C)n1-c1cccc(C)c1 ZINC001118883032 1047315507 /nfs/dbraw/zinc/31/55/07/1047315507.db2.gz XUBSZYISUWTYTJ-UHFFFAOYSA-N 1 0 319.452 4.396 20 10 DICDRO COCCC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000725841747 1047318438 /nfs/dbraw/zinc/31/84/38/1047318438.db2.gz YYPKIPPQLLHZGZ-UHFFFAOYSA-N 1 0 307.478 4.113 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](c2cccs2)C2CC2)c(O)c1 ZINC000725844271 1047319165 /nfs/dbraw/zinc/31/91/65/1047319165.db2.gz QKWAROHPBRMRPL-KRWDZBQOSA-N 1 0 303.427 4.093 20 10 DICDRO [O-]c1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001142534507 1047319333 /nfs/dbraw/zinc/31/93/33/1047319333.db2.gz LXRIEBCJDMDKCZ-OAHLLOKOSA-N 1 0 321.342 4.017 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)c1 ZINC000725847667 1047320110 /nfs/dbraw/zinc/32/01/10/1047320110.db2.gz AAKAPCCXWHCPHD-UHFFFAOYSA-N 1 0 324.424 4.179 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c(C)c1 ZINC000840722409 1047321183 /nfs/dbraw/zinc/32/11/83/1047321183.db2.gz HPXFPALBKLVYLT-INIZCTEOSA-N 1 0 312.457 4.229 20 10 DICDRO c1cc([C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C2CC2)ccn1 ZINC000898323982 1047336725 /nfs/dbraw/zinc/33/67/25/1047336725.db2.gz ATKLJZQUKRSRIX-OAQYLSRUSA-N 1 0 321.468 4.313 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](c2ccncc2)C2CC2)cc1 ZINC000898324903 1047338177 /nfs/dbraw/zinc/33/81/77/1047338177.db2.gz LXLRVROCAAAPPW-FQEVSTJZSA-N 1 0 309.457 4.169 20 10 DICDRO C[C@@H]([NH2+]Cc1cnccc1C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000840856776 1047346791 /nfs/dbraw/zinc/34/67/91/1047346791.db2.gz UIJMSCJMZSNVFB-OAHLLOKOSA-N 1 0 311.473 4.296 20 10 DICDRO C[C@H](C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)CC(F)(F)F ZINC000840874353 1047351656 /nfs/dbraw/zinc/35/16/56/1047351656.db2.gz YPHWBEABRZEPEI-ATZCPNFKSA-N 1 0 305.315 4.258 20 10 DICDRO COCC1CCC([NH2+][C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000840882531 1047353038 /nfs/dbraw/zinc/35/30/38/1047353038.db2.gz WFJFFCLWJFGFKQ-HPUBIQBYSA-N 1 0 313.441 4.401 20 10 DICDRO COc1cccc([C@@H]2C[C@H]2C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000840888736 1047354829 /nfs/dbraw/zinc/35/48/29/1047354829.db2.gz NVJUPLWBCLXMOP-QOKNQOGYSA-N 1 0 311.425 4.164 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccccn2)c(Cl)c1 ZINC000840910450 1047358858 /nfs/dbraw/zinc/35/88/58/1047358858.db2.gz MUWMKVRGWKTQNX-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(N(C)C)cc2C)s1 ZINC000840918084 1047360722 /nfs/dbraw/zinc/36/07/22/1047360722.db2.gz QIXFHQAJWCDJMK-CQSZACIVSA-N 1 0 317.502 4.327 20 10 DICDRO Cc1nc(C(C)(C)[NH2+]Cc2ccc(N(C)C)cc2C)sc1C ZINC000840934503 1047361518 /nfs/dbraw/zinc/36/15/18/1047361518.db2.gz QZCABVMFZJIBFN-UHFFFAOYSA-N 1 0 317.502 4.159 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000840938402 1047363534 /nfs/dbraw/zinc/36/35/34/1047363534.db2.gz DIALKCPEFNMPIA-PZJWPPBQSA-N 1 0 324.468 4.071 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)C[C@@H](C)c2nccs2)c(Cl)c1 ZINC000840940363 1047363841 /nfs/dbraw/zinc/36/38/41/1047363841.db2.gz ZCXLGDCGPJFWTL-LLVKDONJSA-N 1 0 310.850 4.046 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cnccc1C(C)(C)C ZINC000840959969 1047365778 /nfs/dbraw/zinc/36/57/78/1047365778.db2.gz ZJDMZLNGQKFNNC-UHFFFAOYSA-N 1 0 311.473 4.043 20 10 DICDRO Cc1cccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)c1O ZINC000840963872 1047365819 /nfs/dbraw/zinc/36/58/19/1047365819.db2.gz QXCXPGQIFTXKHE-FQEVSTJZSA-N 1 0 323.436 4.054 20 10 DICDRO [NH3+]C1(CNC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CCC1 ZINC000841004734 1047368973 /nfs/dbraw/zinc/36/89/73/1047368973.db2.gz OONNNOKVFNZTMZ-UHFFFAOYSA-N 1 0 323.400 4.105 20 10 DICDRO C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CCc1ccc(N)cc1 ZINC000841037927 1047373173 /nfs/dbraw/zinc/37/31/73/1047373173.db2.gz DBLYAJCMFIKXGM-CYBMUJFWSA-N 1 0 322.374 4.051 20 10 DICDRO C[C@@H]([NH3+])c1ccc(NCc2ccc(N3CCCCC3)cc2)cc1 ZINC000841029658 1047374006 /nfs/dbraw/zinc/37/40/06/1047374006.db2.gz XYNCJYSTPNVOKG-MRXNPFEDSA-N 1 0 309.457 4.309 20 10 DICDRO CCN(CC)c1ccc(CNc2ccccc2C[NH2+]C)cc1F ZINC000841043335 1047375580 /nfs/dbraw/zinc/37/55/80/1047375580.db2.gz PEUSTXYBEUYKFC-UHFFFAOYSA-N 1 0 315.436 4.003 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc3c2CCCN3)cc1 ZINC000841083761 1047380951 /nfs/dbraw/zinc/38/09/51/1047380951.db2.gz SBJFOUFDHLEHEF-UHFFFAOYSA-N 1 0 323.484 4.181 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000841744253 1047447263 /nfs/dbraw/zinc/44/72/63/1047447263.db2.gz GNDLQHCFWOBNGZ-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1[O-] ZINC000841748195 1047448191 /nfs/dbraw/zinc/44/81/91/1047448191.db2.gz IHRXTRSAYCCMLL-JSGCOSHPSA-N 1 0 309.837 4.188 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841745393 1047448710 /nfs/dbraw/zinc/44/87/10/1047448710.db2.gz YXGMTHWKQVUCLD-ZDUSSCGKSA-N 1 0 319.832 4.433 20 10 DICDRO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841744187 1047448785 /nfs/dbraw/zinc/44/87/85/1047448785.db2.gz MSJBCFCDSKSZKP-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO COc1ccc(C2([NH2+][C@@H](C)c3ccc(Cl)cc3O)CC2)cc1 ZINC000841751109 1047450048 /nfs/dbraw/zinc/45/00/48/1047450048.db2.gz WQFDYTRFNHUTJO-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)CO2 ZINC000841751122 1047450081 /nfs/dbraw/zinc/45/00/81/1047450081.db2.gz KVVQIWWRHBFGIO-IAQYHMDHSA-N 1 0 303.789 4.138 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841751807 1047451354 /nfs/dbraw/zinc/45/13/54/1047451354.db2.gz KPJCAABZXFRXSB-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1c(C)noc1C ZINC000841751967 1047452068 /nfs/dbraw/zinc/45/20/68/1047452068.db2.gz POESKRASBCOJAC-YMTOWFKASA-N 1 0 308.809 4.452 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841760599 1047453430 /nfs/dbraw/zinc/45/34/30/1047453430.db2.gz SYCCRRZIVDXZAP-MEDUHNTESA-N 1 0 317.816 4.392 20 10 DICDRO CCOc1ccc(C[NH2+]C2(c3ccccc3F)CCC2)c(O)c1 ZINC000842748708 1047502070 /nfs/dbraw/zinc/50/20/70/1047502070.db2.gz RZHBUXCQGGKEDV-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO CC[C@H]([NH2+]C1(c2ccccc2OC)CC1)c1ccc(N(C)C)cc1 ZINC000842901740 1047512386 /nfs/dbraw/zinc/51/23/86/1047512386.db2.gz KMAPBAAJRRWSKL-IBGZPJMESA-N 1 0 324.468 4.491 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C2(c3ccccc3OC)CC2)cc1 ZINC000842900091 1047512721 /nfs/dbraw/zinc/51/27/21/1047512721.db2.gz FHSSBRHZEAVPSA-INIZCTEOSA-N 1 0 324.468 4.491 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2(c3ccc(C)cc3)CCC2)c1 ZINC000842927780 1047513946 /nfs/dbraw/zinc/51/39/46/1047513946.db2.gz LPZBNYCLNCTVFH-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c1O ZINC001143111069 1047531861 /nfs/dbraw/zinc/53/18/61/1047531861.db2.gz WHZFRJBMDXCOHI-LBPRGKRZSA-N 1 0 301.352 4.074 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC001143110429 1047531930 /nfs/dbraw/zinc/53/19/30/1047531930.db2.gz FYQFHBAIIQYEGI-GOSISDBHSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CC(C)(C)OC(C)(C)C2)c1O ZINC001143111322 1047532170 /nfs/dbraw/zinc/53/21/70/1047532170.db2.gz BDIGKGNWMMWQFC-UHFFFAOYSA-N 1 0 305.462 4.079 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H]2Cc2ccccn2)c1O ZINC001143111043 1047532247 /nfs/dbraw/zinc/53/22/47/1047532247.db2.gz VEXHGSGSEGBKNA-SFHVURJKSA-N 1 0 324.468 4.292 20 10 DICDRO CC[C@H]([NH2+]CCCCCC[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000843342765 1047543114 /nfs/dbraw/zinc/54/31/14/1047543114.db2.gz UCYLTJGBHHEMIC-ZDUSSCGKSA-N 1 0 319.276 4.259 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]23)cc1 ZINC001203199454 1047590279 /nfs/dbraw/zinc/59/02/79/1047590279.db2.gz GFXWNHRJPJQCMK-PWRODBHTSA-N 1 0 324.443 4.100 20 10 DICDRO CC[C@@H]([NH2+]Cc1ncc(C)cc1C)c1cc(Cl)ccc1O ZINC000926960546 1047641695 /nfs/dbraw/zinc/64/16/95/1047641695.db2.gz OXZXVGXJJRVECK-OAHLLOKOSA-N 1 0 304.821 4.298 20 10 DICDRO O=C(c1ccccc1)c1ccccc1Nc1ccc2c(c1)C[NH2+]C2 ZINC001159477550 1047851597 /nfs/dbraw/zinc/85/15/97/1047851597.db2.gz NCXBWSCRZPHDAB-UHFFFAOYSA-N 1 0 314.388 4.264 20 10 DICDRO c1cc(C[NH+]2CCCC2)cc(Nc2ccc3c(c2)CCCN3)c1 ZINC001159507064 1047856066 /nfs/dbraw/zinc/85/60/66/1047856066.db2.gz ADIMLNNZKHZHNV-UHFFFAOYSA-N 1 0 307.441 4.384 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CC[C@H](OCCC(C)C)CC2)c1O ZINC001182891930 1047859418 /nfs/dbraw/zinc/85/94/18/1047859418.db2.gz QIALEPNTOIKLLI-WGSAOQKQSA-N 1 0 319.489 4.418 20 10 DICDRO c1nn(C2C[NH2+]C2)cc1Nc1ccc(/N=N/c2ccccc2)cc1 ZINC001159517085 1047860473 /nfs/dbraw/zinc/86/04/73/1047860473.db2.gz XCYXDIHFYHDPGY-GHVJWSGMSA-N 1 0 318.384 4.186 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000479433402 1047887054 /nfs/dbraw/zinc/88/70/54/1047887054.db2.gz ARAOUMJYRJKMHD-CYBMUJFWSA-N 1 0 313.832 4.386 20 10 DICDRO COc1ccsc1[C@H](C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000479454976 1047898225 /nfs/dbraw/zinc/89/82/25/1047898225.db2.gz MJRYJSMSGYEOCF-ZDUSSCGKSA-N 1 0 314.454 4.408 20 10 DICDRO COc1cc(C)c(C[NH2+][C@H]2CCc3ccc(Cl)cc32)c(O)c1 ZINC001183157043 1047903007 /nfs/dbraw/zinc/90/30/07/1047903007.db2.gz QNCPAQXHXSJYGN-KRWDZBQOSA-N 1 0 317.816 4.140 20 10 DICDRO Nc1ccc(N(Cc2ccccc2)c2ccc3c(c2)C[NH2+]C3)cc1 ZINC001159712972 1047907075 /nfs/dbraw/zinc/90/70/75/1047907075.db2.gz PESIXDNTOKDCGM-UHFFFAOYSA-N 1 0 315.420 4.210 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccsc2C(F)(F)F)c1O ZINC001183206312 1047910051 /nfs/dbraw/zinc/91/00/51/1047910051.db2.gz OSEZOFPLYKXGDW-UHFFFAOYSA-N 1 0 315.360 4.325 20 10 DICDRO Cc1ccc(CCC[NH2+]Cc2ccc(N(C)C)cc2C)c(C)c1 ZINC001183312225 1047917974 /nfs/dbraw/zinc/91/79/74/1047917974.db2.gz GZCDQUZWINGYCG-UHFFFAOYSA-N 1 0 310.485 4.400 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](Oc2ccccc2)C1(C)C)c1ccccc1O ZINC001183362883 1047918749 /nfs/dbraw/zinc/91/87/49/1047918749.db2.gz FLQGGBKUJMLRFJ-JVPBZIDWSA-N 1 0 311.425 4.289 20 10 DICDRO CSc1ccccc1C[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC001183355190 1047920262 /nfs/dbraw/zinc/92/02/62/1047920262.db2.gz NIDVNZDUNREKRN-UONOGXRCSA-N 1 0 301.455 4.396 20 10 DICDRO O=C1c2ccccc2-c2cccc(Nc3ccc4c(c3)C[NH2+]C4)c21 ZINC001159785217 1047924543 /nfs/dbraw/zinc/92/45/43/1047924543.db2.gz ZURVXCXHTPLFGK-UHFFFAOYSA-N 1 0 312.372 4.245 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(Cl)cc1O)c1ccccc1OC ZINC001183444616 1047929407 /nfs/dbraw/zinc/92/94/07/1047929407.db2.gz OVMAKRQQNBSALY-OAHLLOKOSA-N 1 0 305.805 4.295 20 10 DICDRO COc1ccc(N(c2ccc(N)cc2)c2cc[nH+]c(C)c2)cc1 ZINC001174656767 1047937559 /nfs/dbraw/zinc/93/75/59/1047937559.db2.gz UPCYGWCDHQLOJO-UHFFFAOYSA-N 1 0 305.381 4.451 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)cc1 ZINC001198271957 1047944405 /nfs/dbraw/zinc/94/44/05/1047944405.db2.gz YXQXMLWJOGCAOD-PLTPHKKDSA-N 1 0 306.453 4.430 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)c(O)cc1Br ZINC001250120779 1047953619 /nfs/dbraw/zinc/95/36/19/1047953619.db2.gz QAVOSARCQRETSU-QWHCGFSZSA-N 1 0 324.262 4.085 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)cc1Cl ZINC001183674153 1047955720 /nfs/dbraw/zinc/95/57/20/1047955720.db2.gz VMKBFCGZLGHJRK-ZDUSSCGKSA-N 1 0 301.817 4.473 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c(O)cc1Br ZINC001250129111 1047962307 /nfs/dbraw/zinc/96/23/07/1047962307.db2.gz XWMAPTLQAMBEEN-SWLSCSKDSA-N 1 0 324.262 4.228 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH+]1CCC(Oc2ccccc2)CC1 ZINC001183855322 1047971970 /nfs/dbraw/zinc/97/19/70/1047971970.db2.gz ONKCBFQRDFAIET-UHFFFAOYSA-N 1 0 324.468 4.104 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](C3CCOCC3)C2)c1 ZINC001183958177 1047986413 /nfs/dbraw/zinc/98/64/13/1047986413.db2.gz IHTKJTZBLDNIOM-GOSISDBHSA-N 1 0 317.473 4.154 20 10 DICDRO Cc1cc(Br)cc(C[N@H+](C)CC2CCCC2)c1O ZINC000160966745 1048026095 /nfs/dbraw/zinc/02/60/95/1048026095.db2.gz MJVXEQKMVWPZGI-UHFFFAOYSA-N 1 0 312.251 4.085 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](C)N2CCCC[C@@H]2C)cc1C ZINC001199296689 1048052904 /nfs/dbraw/zinc/05/29/04/1048052904.db2.gz XOYFHVXGZWFOIC-ROUUACIJSA-N 1 0 318.505 4.136 20 10 DICDRO CCCN(CCC)c1ccc(C[N@H+]2CC=C(COC)CC2)cc1 ZINC000775993855 1048079554 /nfs/dbraw/zinc/07/95/54/1048079554.db2.gz CUVAQWXBDUCWBM-UHFFFAOYSA-N 1 0 316.489 4.092 20 10 DICDRO CCOCCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000776003634 1048084532 /nfs/dbraw/zinc/08/45/32/1048084532.db2.gz JRQFOHJLACIJID-QGZVFWFLSA-N 1 0 313.441 4.382 20 10 DICDRO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000776013771 1048089309 /nfs/dbraw/zinc/08/93/09/1048089309.db2.gz OFOWCYOZAOIYDA-JOYOIKCWSA-N 1 0 307.743 4.208 20 10 DICDRO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000776013664 1048090295 /nfs/dbraw/zinc/09/02/95/1048090295.db2.gz MXCBWDZYUQZNPQ-DGCLKSJQSA-N 1 0 318.358 4.055 20 10 DICDRO Cc1cc2cc(C[NH2+]Cc3ccc4c(c3)CCO4)oc2cc1C ZINC001199934159 1048123674 /nfs/dbraw/zinc/12/36/74/1048123674.db2.gz QERWXIFVPWQPJL-UHFFFAOYSA-N 1 0 307.393 4.274 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCCOc3ccccc32)cc1 ZINC001199971738 1048128154 /nfs/dbraw/zinc/12/81/54/1048128154.db2.gz FKUPKFZLWOPDET-BPJPHKDRSA-N 1 0 322.452 4.269 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2Cl)c(O)c1 ZINC000774836513 1048135876 /nfs/dbraw/zinc/13/58/76/1048135876.db2.gz LKVLJDWIAFJWJT-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+](C)Cc2ccccc2O)c1 ZINC000774839050 1048143611 /nfs/dbraw/zinc/14/36/11/1048143611.db2.gz ADXLJLDWFBSNBJ-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)c1O ZINC001203613900 1048160200 /nfs/dbraw/zinc/16/02/00/1048160200.db2.gz IXDVLSFEZHHTQW-MRXNPFEDSA-N 1 0 303.446 4.193 20 10 DICDRO Cc1ccccc1/N=N/c1ccc(NC(=O)C2C[NH+](C)C2)c(C)c1 ZINC001142599339 1048172458 /nfs/dbraw/zinc/17/24/58/1048172458.db2.gz UKBHRJPOYAMOCS-QURGRASLSA-N 1 0 322.412 4.219 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCc2ccc(F)cc2C)c(Cl)c1 ZINC001200999737 1048177208 /nfs/dbraw/zinc/17/72/08/1048177208.db2.gz ZRRYZZRYJJIDKB-UHFFFAOYSA-N 1 0 307.796 4.134 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000776157981 1048244911 /nfs/dbraw/zinc/24/49/11/1048244911.db2.gz RIPVAEKMSGWRAO-HXUWFJFHSA-N 1 0 312.432 4.367 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC[C@H](c2ccccc2)O1)c1ccccc1O ZINC001175418919 1048301597 /nfs/dbraw/zinc/30/15/97/1048301597.db2.gz PWNJAZLTHSKGLR-XAUMDUMWSA-N 1 0 311.425 4.353 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCO[C@H](CC(C)C)C1 ZINC001201663407 1048344378 /nfs/dbraw/zinc/34/43/78/1048344378.db2.gz DEPZESUZBKNISZ-IAGOWNOFSA-N 1 0 314.473 4.170 20 10 DICDRO Cc1cccc(C[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)c1O ZINC000776223892 1048391697 /nfs/dbraw/zinc/39/16/97/1048391697.db2.gz NEFKOYGJJJGGHC-CYBMUJFWSA-N 1 0 324.207 4.231 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H](C3CCC3)CC2)c1O ZINC001175610141 1048394036 /nfs/dbraw/zinc/39/40/36/1048394036.db2.gz FSAQOJCBIPGRPM-OAHLLOKOSA-N 1 0 319.420 4.136 20 10 DICDRO Cc1cc(C[N@@H+]2CCSC[C@@H]2C(C)(C)C)ccc1N(C)C ZINC001175698557 1048401122 /nfs/dbraw/zinc/40/11/22/1048401122.db2.gz QUMMYFHZACMQNF-QGZVFWFLSA-N 1 0 306.519 4.025 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)CCc1ccc(O)cc1 ZINC000775141212 1048434129 /nfs/dbraw/zinc/43/41/29/1048434129.db2.gz ZNUWMMNFHODTJB-INIZCTEOSA-N 1 0 312.457 4.089 20 10 DICDRO c1ccc(C[C@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001202058937 1048434497 /nfs/dbraw/zinc/43/44/97/1048434497.db2.gz SMJIORWNAUCVMC-XLIONFOSSA-N 1 0 307.437 4.123 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2ccc(Cl)cc2F)cc1 ZINC001202093447 1048447567 /nfs/dbraw/zinc/44/75/67/1048447567.db2.gz VGUSJYDJSASBNT-ARJAWSKDSA-N 1 0 318.823 4.348 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2C(C)(C)C2(C)C)cc1F ZINC001202118016 1048456027 /nfs/dbraw/zinc/45/60/27/1048456027.db2.gz AVWSSLTVVNURAV-UHFFFAOYSA-N 1 0 306.469 4.444 20 10 DICDRO COc1cc[nH+]c(N[C@@H]2c3c(c(C)cc(C)c3O)CC2(C)C)c1 ZINC001163488462 1048477862 /nfs/dbraw/zinc/47/78/62/1048477862.db2.gz ZUKYEAPHXBELCR-GOSISDBHSA-N 1 0 312.413 4.148 20 10 DICDRO C[N@H+](CCCC(F)(F)F)Cc1ccc(N2CCCC2)cc1 ZINC001202416005 1048544376 /nfs/dbraw/zinc/54/43/76/1048544376.db2.gz RAGPQHWFQMUIJO-UHFFFAOYSA-N 1 0 300.368 4.061 20 10 DICDRO CCO[C@H](C[NH2+]Cc1cc(Cl)cc(C)c1O)c1ccccc1 ZINC000775199442 1048555511 /nfs/dbraw/zinc/55/55/11/1048555511.db2.gz CRWQNBPSCYRECF-QGZVFWFLSA-N 1 0 319.832 4.221 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccc(F)c1F ZINC000776305165 1048562052 /nfs/dbraw/zinc/56/20/52/1048562052.db2.gz DBZFFNDOEQJHBE-CYBMUJFWSA-N 1 0 316.395 4.198 20 10 DICDRO C[C@H]([NH2+][C@@H](C)[C@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000780747334 1048588736 /nfs/dbraw/zinc/58/87/36/1048588736.db2.gz XDVIBUVQIUBXGH-LNLFQRSKSA-N 1 0 316.489 4.143 20 10 DICDRO COC1CCN(c2ccc(C[N@H+](C)[C@@H](C)C(C)(C)C)cc2)CC1 ZINC000827401068 1048595194 /nfs/dbraw/zinc/59/51/94/1048595194.db2.gz XGJADGNHPPWLSP-INIZCTEOSA-N 1 0 318.505 4.168 20 10 DICDRO Cc1cccc2[nH]c(C[NH2+]Cc3ccc4c(c3)CCCN4C)cc21 ZINC000850099780 1048618243 /nfs/dbraw/zinc/61/82/43/1048618243.db2.gz YDGHPKZODDJFRT-UHFFFAOYSA-N 1 0 319.452 4.149 20 10 DICDRO Cc1ccc2cc(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)[nH]c2c1 ZINC000850252435 1048628134 /nfs/dbraw/zinc/62/81/34/1048628134.db2.gz SIMZYRJRADCKRP-OAHLLOKOSA-N 1 0 307.441 4.393 20 10 DICDRO CCC(C)(C)CC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000775257062 1048630813 /nfs/dbraw/zinc/63/08/13/1048630813.db2.gz FGWDEUQZAZPFGS-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2sc(C)nc2C)cc1F ZINC000076869448 1048638127 /nfs/dbraw/zinc/63/81/27/1048638127.db2.gz JYUNKEQOSVQIBN-UHFFFAOYSA-N 1 0 321.465 4.035 20 10 DICDRO Oc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCCCC3)cc1)CC2 ZINC000850387444 1048645833 /nfs/dbraw/zinc/64/58/33/1048645833.db2.gz QXXZDJMSZUXDRI-OAQYLSRUSA-N 1 0 322.452 4.160 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccc(C(F)F)nc1 ZINC000850435155 1048655580 /nfs/dbraw/zinc/65/55/80/1048655580.db2.gz IVWGPWQNFPBPSE-ZDUSSCGKSA-N 1 0 319.399 4.244 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCO2)c1ccc(N(C)C)cc1 ZINC000850463600 1048665900 /nfs/dbraw/zinc/66/59/00/1048665900.db2.gz WLTDXHOMOKVXTR-CVEARBPZSA-N 1 0 324.468 4.489 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ccc2ccccc2c1O ZINC000850481072 1048669775 /nfs/dbraw/zinc/66/97/75/1048669775.db2.gz HEHBPUGJNUEYOD-HOCLYGCPSA-N 1 0 312.457 4.069 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)c1cccs1 ZINC000850488202 1048671256 /nfs/dbraw/zinc/67/12/56/1048671256.db2.gz LVNNYKCVGXGCGL-RHSMWYFYSA-N 1 0 316.470 4.076 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1cc(Cl)ccc1O ZINC000850482373 1048671365 /nfs/dbraw/zinc/67/13/65/1048671365.db2.gz OVMTWXJUODDKGZ-SWLSCSKDSA-N 1 0 304.821 4.285 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](C)c2ccccn2)c1O ZINC000850481427 1048671408 /nfs/dbraw/zinc/67/14/08/1048671408.db2.gz GWRPATOOQWJVRX-QWHCGFSZSA-N 1 0 304.821 4.203 20 10 DICDRO Cc1ccncc1CC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000850505944 1048672283 /nfs/dbraw/zinc/67/22/83/1048672283.db2.gz DMQHNYAVFGRPER-GOSISDBHSA-N 1 0 323.484 4.274 20 10 DICDRO Cc1ccncc1CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000850505946 1048672733 /nfs/dbraw/zinc/67/27/33/1048672733.db2.gz DPMSNFPGUWIYKH-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccnc2ccccc12)c1ccccc1O ZINC000850508659 1048675221 /nfs/dbraw/zinc/67/52/21/1048675221.db2.gz WIKWOKVDGWHYRF-GOSISDBHSA-N 1 0 306.409 4.224 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1cscn1 ZINC000850512235 1048675445 /nfs/dbraw/zinc/67/54/45/1048675445.db2.gz YUQOPAVSJYISBH-RYUDHWBXSA-N 1 0 302.443 4.139 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)c1 ZINC000850520664 1048677273 /nfs/dbraw/zinc/67/72/73/1048677273.db2.gz FLVXWTVNLMHOIV-ZDUSSCGKSA-N 1 0 315.388 4.232 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)COc2c(F)cccc2F)c(O)c1 ZINC000850522384 1048677498 /nfs/dbraw/zinc/67/74/98/1048677498.db2.gz ARUJZUUATVECKG-STQMWFEESA-N 1 0 321.367 4.097 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C[C@H](O)c3ccccc32)c1O ZINC000850527753 1048680323 /nfs/dbraw/zinc/68/03/23/1048680323.db2.gz YNJUPIWHUKTCHS-GOPGUHFVSA-N 1 0 317.816 4.183 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@H](O)c2ccccc21)c1cc(Cl)ccc1O ZINC000850527543 1048680832 /nfs/dbraw/zinc/68/08/32/1048680832.db2.gz GUQCHYDSZQSAHG-BQFCYCMXSA-N 1 0 317.816 4.265 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(N2CCCCC2)cc1 ZINC000850534453 1048684231 /nfs/dbraw/zinc/68/42/31/1048684231.db2.gz JVXMYQPURYKHNL-YOEHRIQHSA-N 1 0 308.416 4.373 20 10 DICDRO COCc1csc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000850532680 1048684301 /nfs/dbraw/zinc/68/43/01/1048684301.db2.gz NJSNLKAYXAFMIW-CYBMUJFWSA-N 1 0 305.443 4.068 20 10 DICDRO COCc1csc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000850531814 1048684437 /nfs/dbraw/zinc/68/44/37/1048684437.db2.gz HTEIPEHKVNAZEP-JTQLQIEISA-N 1 0 311.834 4.104 20 10 DICDRO COCc1csc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000850532746 1048684563 /nfs/dbraw/zinc/68/45/63/1048684563.db2.gz ONRYHETWNCJPON-HZMBPMFUSA-N 1 0 321.417 4.077 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)c1O ZINC000850535903 1048684943 /nfs/dbraw/zinc/68/49/43/1048684943.db2.gz DOLUGNASSMOIKU-HZMBPMFUSA-N 1 0 303.780 4.440 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cc(Cl)ccc1O ZINC000850543539 1048687201 /nfs/dbraw/zinc/68/72/01/1048687201.db2.gz LTNLZIWUMVUJAZ-HWPZZCPQSA-N 1 0 303.789 4.089 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@@H](O)C(C)C)c1ccccc1O ZINC000850555200 1048688706 /nfs/dbraw/zinc/68/87/06/1048688706.db2.gz NGLADUQUIFZQJG-SXLOBPIMSA-N 1 0 313.441 4.191 20 10 DICDRO C[C@H]([NH2+]C1CCC2(CC2(F)F)CC1)c1ccc(N(C)C)cc1 ZINC000850549622 1048688897 /nfs/dbraw/zinc/68/88/97/1048688897.db2.gz IESLCDZFXMNWNC-KTAKPFMOSA-N 1 0 308.416 4.371 20 10 DICDRO C[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc2ccccc2c1O ZINC000850553098 1048689198 /nfs/dbraw/zinc/68/91/98/1048689198.db2.gz RSBLZAZPVFMOCD-NHYWBVRUSA-N 1 0 305.368 4.487 20 10 DICDRO C[C@@H]([NH2+]CC1SCCS1)c1ccc(N2CCCCC2)cc1 ZINC000850559819 1048690479 /nfs/dbraw/zinc/69/04/79/1048690479.db2.gz AAFOUENCPYXEMN-CQSZACIVSA-N 1 0 322.543 4.134 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H](O)C(C)C)c(O)c1 ZINC000850557173 1048690529 /nfs/dbraw/zinc/69/05/29/1048690529.db2.gz UUVWAOSYFPVAAI-RYGJVYDSSA-N 1 0 313.441 4.109 20 10 DICDRO C[C@@H]([NH2+]CCCc1ccco1)c1cc(Br)ccc1O ZINC000850569398 1048696513 /nfs/dbraw/zinc/69/65/13/1048696513.db2.gz CNUWAYJLEHURFG-LLVKDONJSA-N 1 0 324.218 4.031 20 10 DICDRO COc1cccc(C2([NH2+][C@H](C)c3cc(F)ccc3O)CCC2)c1 ZINC000850566692 1048696534 /nfs/dbraw/zinc/69/65/34/1048696534.db2.gz QAYGIMRDVGUNIN-CYBMUJFWSA-N 1 0 315.388 4.270 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCOC1(C)C)c1ccc(N2CCCCC2)cc1 ZINC000850571068 1048697787 /nfs/dbraw/zinc/69/77/87/1048697787.db2.gz MBJLHGOCSYXJAG-FUHWJXTLSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCOC1(C)C)c1ccc(N2CCCCC2)cc1 ZINC000850571069 1048697946 /nfs/dbraw/zinc/69/79/46/1048697946.db2.gz MBJLHGOCSYXJAG-SJLPKXTDSA-N 1 0 316.489 4.143 20 10 DICDRO c1csc(SCc2cccc(C[NH+]3CCCCC3)c2)n1 ZINC001165561683 1048698707 /nfs/dbraw/zinc/69/87/07/1048698707.db2.gz CGPFIXQGRSVVKG-UHFFFAOYSA-N 1 0 304.484 4.421 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c1C ZINC000850578566 1048699565 /nfs/dbraw/zinc/69/95/65/1048699565.db2.gz NIAKYNCBNVIXFQ-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2cccnc2c1)c1ccc(N(C)C)cc1 ZINC000775361859 1048705279 /nfs/dbraw/zinc/70/52/79/1048705279.db2.gz GHGHOFHZGAIFKU-OAHLLOKOSA-N 1 0 305.425 4.152 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(F)c2Cl)c1 ZINC000775368576 1048706032 /nfs/dbraw/zinc/70/60/32/1048706032.db2.gz BGVKZIVCZRJKNB-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO COc1ccc([C@H](C)C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000775365701 1048708527 /nfs/dbraw/zinc/70/85/27/1048708527.db2.gz WCZKNKGUOKRKRX-CVEARBPZSA-N 1 0 312.457 4.216 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCSc2ccc(C)cc2)c1 ZINC000775371424 1048713557 /nfs/dbraw/zinc/71/35/57/1048713557.db2.gz OFERFPWFMWMCDJ-CQSZACIVSA-N 1 0 317.454 4.152 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCc3ccccc32)c1 ZINC000775369904 1048713600 /nfs/dbraw/zinc/71/36/00/1048713600.db2.gz BYQPBCFBOSBHBM-GDBMZVCRSA-N 1 0 311.425 4.172 20 10 DICDRO COCCC1(C[NH2+]Cc2cc(Cl)ccc2O)CCCCC1 ZINC000775373309 1048717785 /nfs/dbraw/zinc/71/77/85/1048717785.db2.gz CAZPVXOTAASFOQ-UHFFFAOYSA-N 1 0 311.853 4.122 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(CC(C)C)cc2)c1 ZINC000775372728 1048719412 /nfs/dbraw/zinc/71/94/12/1048719412.db2.gz HHNMFIIBIUHJKT-HNNXBMFYSA-N 1 0 313.441 4.450 20 10 DICDRO Cc1cc(C[NH2+][C@H]2CCCOCC2)c(C)n1-c1cccc(C)c1 ZINC000776498324 1048721338 /nfs/dbraw/zinc/72/13/38/1048721338.db2.gz SFACFXAKWHDGPL-IBGZPJMESA-N 1 0 312.457 4.061 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)[C@H](OC)c2ccccc2F)cc1C ZINC000776498930 1048727038 /nfs/dbraw/zinc/72/70/38/1048727038.db2.gz QZTMBUMOASYTEE-LIRRHRJNSA-N 1 0 317.404 4.009 20 10 DICDRO Oc1ccccc1C[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000775381468 1048738881 /nfs/dbraw/zinc/73/88/81/1048738881.db2.gz QQIKUIDKZLHPGN-OAHLLOKOSA-N 1 0 303.789 4.049 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCc2cc(F)ccc21 ZINC000775393054 1048749619 /nfs/dbraw/zinc/74/96/19/1048749619.db2.gz KJSOTDWXMMYHCM-HXUWFJFHSA-N 1 0 312.432 4.367 20 10 DICDRO CC[C@@H](CSC)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000775424167 1048808504 /nfs/dbraw/zinc/80/85/04/1048808504.db2.gz UYJFCWYZKUCBRA-WBVHZDCISA-N 1 0 306.519 4.469 20 10 DICDRO Cc1nocc1C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000851878901 1048808943 /nfs/dbraw/zinc/80/89/43/1048808943.db2.gz DDWZOAWUNYYZLS-INIZCTEOSA-N 1 0 322.408 4.452 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc(Cl)s2)c(Cl)c1 ZINC001177162299 1048840027 /nfs/dbraw/zinc/84/00/27/1048840027.db2.gz KVWSJBQVVVXVFB-UHFFFAOYSA-N 1 0 302.226 4.359 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2cccc(N(C)C)c2)cc1 ZINC001191075403 1048839947 /nfs/dbraw/zinc/83/99/47/1048839947.db2.gz AIAICYXQPCQDRX-NRFANRHFSA-N 1 0 323.484 4.156 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC2(c3ccccc3)CC2)c(Cl)c1 ZINC001177231419 1048852860 /nfs/dbraw/zinc/85/28/60/1048852860.db2.gz PMAZWCBTLXXXPH-UHFFFAOYSA-N 1 0 301.817 4.175 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)cc1C ZINC000853095314 1048882258 /nfs/dbraw/zinc/88/22/58/1048882258.db2.gz WACUVIATCNXLHA-HNNXBMFYSA-N 1 0 311.425 4.185 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cnccc2C(F)(F)F)c(O)c1C ZINC000853243099 1048893007 /nfs/dbraw/zinc/89/30/07/1048893007.db2.gz XJMUKMRQGDVNIO-LBPRGKRZSA-N 1 0 324.346 4.274 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)Cc2ccsc2)cc1F ZINC001177442512 1048893601 /nfs/dbraw/zinc/89/36/01/1048893601.db2.gz UFZWHFFTKLYDID-CQSZACIVSA-N 1 0 320.477 4.454 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccncc2)cc1C ZINC000853628694 1048912047 /nfs/dbraw/zinc/91/20/47/1048912047.db2.gz CTLJFCWBZKFBBO-IBGZPJMESA-N 1 0 308.425 4.131 20 10 DICDRO Cc1cccc(C(C)(C)C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001177558033 1048916660 /nfs/dbraw/zinc/91/66/60/1048916660.db2.gz PPJXDHOGXZDOKQ-UHFFFAOYSA-N 1 0 309.453 4.387 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001203556207 1048926364 /nfs/dbraw/zinc/92/63/64/1048926364.db2.gz OCICEYGHHMRFIM-MRXNPFEDSA-N 1 0 319.857 4.336 20 10 DICDRO CC1(C)OC2(CC[NH+](Cc3ccccc3O)CC2)c2ccccc21 ZINC001203556131 1048927695 /nfs/dbraw/zinc/92/76/95/1048927695.db2.gz KMMIORKETMUVIN-UHFFFAOYSA-N 1 0 323.436 4.149 20 10 DICDRO CCCCN1CCCC[C@H]1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001177741703 1048938730 /nfs/dbraw/zinc/93/87/30/1048938730.db2.gz BXISXIRJHZYZCY-HNNXBMFYSA-N 1 0 324.896 4.098 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1O ZINC001203599612 1048940138 /nfs/dbraw/zinc/94/01/38/1048940138.db2.gz JTWURTBPEFBYDL-HNNXBMFYSA-N 1 0 319.351 4.016 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2C2CCCCC2)c1O ZINC001203614317 1048941901 /nfs/dbraw/zinc/94/19/01/1048941901.db2.gz WLLJHAZJWHHDLB-QGZVFWFLSA-N 1 0 303.446 4.336 20 10 DICDRO C[C@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001191474191 1048948476 /nfs/dbraw/zinc/94/84/76/1048948476.db2.gz HMJSSZYYTUUNQT-FXAWDEMLSA-N 1 0 308.469 4.206 20 10 DICDRO Oc1cccc(C2CC[NH+](Cc3cc(Cl)ccc3O)CC2)c1 ZINC001203664370 1048952955 /nfs/dbraw/zinc/95/29/55/1048952955.db2.gz BTXXJUSGZSQTJH-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCc3ccccc32)cc1 ZINC001177855081 1048954628 /nfs/dbraw/zinc/95/46/28/1048954628.db2.gz KKMSGGRBJGEPQP-SFFCAUCYSA-N 1 0 306.453 4.085 20 10 DICDRO Fc1ccc(C[NH2+]CCCSc2nccs2)c(Cl)c1 ZINC001177903382 1048957538 /nfs/dbraw/zinc/95/75/38/1048957538.db2.gz BPIOWYHRSUDIAX-UHFFFAOYSA-N 1 0 316.854 4.208 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)c1 ZINC001203675107 1048959356 /nfs/dbraw/zinc/95/93/56/1048959356.db2.gz NHXCRXGTANUVLG-GOSISDBHSA-N 1 0 315.388 4.267 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cc(C)cc(C)c2)c1 ZINC001203680623 1048959612 /nfs/dbraw/zinc/95/96/12/1048959612.db2.gz AORAPQZOOGHDDL-IBGZPJMESA-N 1 0 311.425 4.355 20 10 DICDRO CCN(C)c1ccc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)cc1 ZINC000773732540 1049004098 /nfs/dbraw/zinc/00/40/98/1049004098.db2.gz FBISOSUMKLGWMH-UHFFFAOYSA-N 1 0 322.452 4.138 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)cc1C ZINC001203897758 1049024899 /nfs/dbraw/zinc/02/48/99/1049024899.db2.gz CZUZUFNRNCTZIU-UHFFFAOYSA-N 1 0 324.468 4.236 20 10 DICDRO CC[C@@H]([NH2+]CCCCOc1ccc(F)cc1)c1ccccc1O ZINC000775493374 1049028168 /nfs/dbraw/zinc/02/81/68/1049028168.db2.gz ZEMPDOMPPJZVQE-GOSISDBHSA-N 1 0 317.404 4.431 20 10 DICDRO CC[C@H]([NH2+]C[C@H](c1ccc(C)cc1)N(C)C)c1ccccc1O ZINC000775497200 1049030123 /nfs/dbraw/zinc/03/01/23/1049030123.db2.gz OBPCEBKZPBQAIQ-RBUKOAKNSA-N 1 0 312.457 4.044 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775497851 1049031418 /nfs/dbraw/zinc/03/14/18/1049031418.db2.gz WSMQIGJHHRNTNM-GXFFZTMASA-N 1 0 319.276 4.080 20 10 DICDRO COc1ccc2ccccc2c1C[NH2+]Cc1cc(C)ccc1O ZINC000113317418 1049031661 /nfs/dbraw/zinc/03/16/61/1049031661.db2.gz KIHMWRRTWJHMAM-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)c1ccccc1OC)c1ccccc1O ZINC000775497207 1049032237 /nfs/dbraw/zinc/03/22/37/1049032237.db2.gz OHQKWYACKRMLCL-QGZVFWFLSA-N 1 0 313.441 4.419 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)cc1 ZINC001203936476 1049034499 /nfs/dbraw/zinc/03/44/99/1049034499.db2.gz HCJRCTCXDRITDS-SFHVURJKSA-N 1 0 316.395 4.368 20 10 DICDRO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)cc1 ZINC001203934379 1049035454 /nfs/dbraw/zinc/03/54/54/1049035454.db2.gz SUBYJYXEWZDXCY-OAQYLSRUSA-N 1 0 324.468 4.488 20 10 DICDRO CC[C@@H]([NH2+]CCCOC1CCCC1)c1cc(Cl)ccc1O ZINC000775500463 1049041903 /nfs/dbraw/zinc/04/19/03/1049041903.db2.gz PNJWNFUOVSIPDO-MRXNPFEDSA-N 1 0 311.853 4.436 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)Oc1cccc(F)c1)c1ccccc1O ZINC000775508625 1049041777 /nfs/dbraw/zinc/04/17/77/1049041777.db2.gz KZFGEGBIOONWHX-CXAGYDPISA-N 1 0 303.377 4.040 20 10 DICDRO CC[C@H]([NH2+]CCc1ccccc1O)c1cc(Cl)ccc1O ZINC000775500505 1049041838 /nfs/dbraw/zinc/04/18/38/1049041838.db2.gz KSFOGPYRWSVVNK-HNNXBMFYSA-N 1 0 305.805 4.035 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)Oc1ccc(F)cc1)c1ccccc1O ZINC000775509318 1049042325 /nfs/dbraw/zinc/04/23/25/1049042325.db2.gz PCSPMAWZZVKZPI-SUMWQHHRSA-N 1 0 303.377 4.040 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H](c2ccccc2)C(F)(F)F)cc1C ZINC000776815117 1049043665 /nfs/dbraw/zinc/04/36/65/1049043665.db2.gz HOAOURLDQWNHTN-INIZCTEOSA-N 1 0 323.358 4.445 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000775507612 1049046548 /nfs/dbraw/zinc/04/65/48/1049046548.db2.gz NRASWIRTXKFATM-VQIMIIECSA-N 1 0 310.441 4.102 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)Oc1ccc(F)cc1)c1ccccc1O ZINC000775509315 1049049303 /nfs/dbraw/zinc/04/93/03/1049049303.db2.gz PCSPMAWZZVKZPI-CXAGYDPISA-N 1 0 303.377 4.040 20 10 DICDRO CC[C@H]([NH2+][C@H](C)Cc1ccncc1)c1cc(Cl)ccc1O ZINC000775513341 1049050053 /nfs/dbraw/zinc/05/00/53/1049050053.db2.gz XKRCSLWXSVIHMD-WBMJQRKESA-N 1 0 304.821 4.113 20 10 DICDRO CC[C@H]([NH2+]CCCc1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775513626 1049050154 /nfs/dbraw/zinc/05/01/54/1049050154.db2.gz SGWPHBXUYXXETP-INIZCTEOSA-N 1 0 322.836 4.324 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCO[C@H]2CC(C)C)cc1 ZINC001178542839 1049055270 /nfs/dbraw/zinc/05/52/70/1049055270.db2.gz STRJLHOLTITCEQ-PMACEKPBSA-N 1 0 318.505 4.216 20 10 DICDRO COc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)c2ccccc12 ZINC001203994651 1049056082 /nfs/dbraw/zinc/05/60/82/1049056082.db2.gz HBBOALOSLJNSOE-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO CC[C@H]([NH2+]C[C@]1(C)CCCC[C@@H]1O)c1cc(Cl)ccc1O ZINC000775512454 1049056159 /nfs/dbraw/zinc/05/61/59/1049056159.db2.gz PRNFZSZMDKRQFI-XIRDDKMYSA-N 1 0 311.853 4.028 20 10 DICDRO CC[C@H]([NH2+][C@@H](CO)c1ccccc1C)c1cc(Cl)ccc1O ZINC000775511621 1049056449 /nfs/dbraw/zinc/05/64/49/1049056449.db2.gz FRZFPLOEPBVLDI-IRXDYDNUSA-N 1 0 319.832 4.128 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](CC)c2ccccc2O)C12CCCC2 ZINC000775512520 1049056616 /nfs/dbraw/zinc/05/66/16/1049056616.db2.gz LPCAIRWCDBOMJP-RYQLBKOJSA-N 1 0 303.446 4.171 20 10 DICDRO CCO[C@@H](CC[NH2+][C@@H](CC)c1ccccc1O)C1CCCC1 ZINC000775513708 1049056995 /nfs/dbraw/zinc/05/69/95/1049056995.db2.gz SODVUOAKDDXUHS-HKUYNNGSSA-N 1 0 305.462 4.418 20 10 DICDRO CCN(C)c1ccc(C[NH+]2CCC(OC3CCCC3)CC2)cc1 ZINC000773754144 1049063304 /nfs/dbraw/zinc/06/33/04/1049063304.db2.gz HIDARLIQCZZPEZ-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO Fc1ccc([C@@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001178623900 1049066796 /nfs/dbraw/zinc/06/67/96/1049066796.db2.gz BSSCWTDXTYPTKF-APWZRJJASA-N 1 0 311.400 4.187 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CC[C@H](C)SC2)c(C)n1-c1ccccc1 ZINC001203357249 1049075592 /nfs/dbraw/zinc/07/55/92/1049075592.db2.gz INOQBWIZUQLKMR-MAUKXSAKSA-N 1 0 314.498 4.468 20 10 DICDRO Cc1ccc(F)c(CC[NH2+]Cc2c(O)cc(C)cc2Cl)c1 ZINC001178731680 1049078769 /nfs/dbraw/zinc/07/87/69/1049078769.db2.gz UWVJJJQBKQSFRG-UHFFFAOYSA-N 1 0 307.796 4.134 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](O)c1cccc(C)c1)c1cc(Cl)ccc1O ZINC000775522769 1049082678 /nfs/dbraw/zinc/08/26/78/1049082678.db2.gz ZWJSHNZVISMISO-FUHWJXTLSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+]CCCc1ccccn1)c1cc(Cl)ccc1O ZINC000775522577 1049083507 /nfs/dbraw/zinc/08/35/07/1049083507.db2.gz VAOBNYWUOHWZEG-INIZCTEOSA-N 1 0 304.821 4.114 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCO[C@@H](C(C)C)C1 ZINC001178758880 1049083548 /nfs/dbraw/zinc/08/35/48/1049083548.db2.gz LZLZECLRAWEGRI-OXJNMPFZSA-N 1 0 314.473 4.028 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccncc1C)c1cc(Cl)ccc1O ZINC000775524017 1049085077 /nfs/dbraw/zinc/08/50/77/1049085077.db2.gz ONENGEDREZVPTC-MRXNPFEDSA-N 1 0 304.821 4.032 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H]1Oc2ccccc2[C@@H]1C)c1ccccc1O ZINC000775526064 1049091927 /nfs/dbraw/zinc/09/19/27/1049091927.db2.gz IQADRQMSXCXNEN-ACNBBOPNSA-N 1 0 311.425 4.386 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1Cl ZINC001204143858 1049095142 /nfs/dbraw/zinc/09/51/42/1049095142.db2.gz BOSRWXFHGIRXQR-UHFFFAOYSA-N 1 0 302.849 4.346 20 10 DICDRO CC[C@@H]([NH2+]CC1(c2ccc(F)cc2F)CC1)c1ccccc1O ZINC000775526679 1049095863 /nfs/dbraw/zinc/09/58/63/1049095863.db2.gz SUKMLGQVLOEMCY-QGZVFWFLSA-N 1 0 317.379 4.443 20 10 DICDRO CC[C@@H]([NH2+][C@H](CO)C1CCCCC1)c1cc(Cl)ccc1O ZINC000775527688 1049096816 /nfs/dbraw/zinc/09/68/16/1049096816.db2.gz SMVYBSWEISVLDL-HZPDHXFCSA-N 1 0 311.853 4.028 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000773777838 1049102983 /nfs/dbraw/zinc/10/29/83/1049102983.db2.gz VQAPYPLUGWTPEM-FQEVSTJZSA-N 1 0 310.441 4.185 20 10 DICDRO CN(C)c1ccc(C[NH+]2CC3(C2)CC(F)(F)C3)c2ccccc21 ZINC001204233968 1049111341 /nfs/dbraw/zinc/11/13/41/1049111341.db2.gz VHRQGRVRZJNUSX-UHFFFAOYSA-N 1 0 316.395 4.137 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)c2ccccc21 ZINC001204234110 1049112442 /nfs/dbraw/zinc/11/24/42/1049112442.db2.gz WUGFOGMABHZNCU-LJQANCHMSA-N 1 0 300.421 4.230 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](F)CC2)c2ccccc21 ZINC001204234365 1049115719 /nfs/dbraw/zinc/11/57/19/1049115719.db2.gz ZJQHYQKICZXGKR-INIZCTEOSA-N 1 0 300.421 4.230 20 10 DICDRO Cc1cc(C)cc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)c1 ZINC001178972358 1049116261 /nfs/dbraw/zinc/11/62/61/1049116261.db2.gz RXVBMTHOGSHWDN-SFHVURJKSA-N 1 0 310.485 4.399 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC3(CCCO3)CC2)c2ccccc21 ZINC001204241817 1049117636 /nfs/dbraw/zinc/11/76/36/1049117636.db2.gz JBLXXNHUMDSTMP-UHFFFAOYSA-N 1 0 324.468 4.051 20 10 DICDRO COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N(C)C)c2ccccc12 ZINC001204240498 1049118225 /nfs/dbraw/zinc/11/82/25/1049118225.db2.gz VMNFKBSXCULXBM-JWTNVVGKSA-N 1 0 324.468 4.048 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccccc2O)c2ccccc21 ZINC001204240097 1049119006 /nfs/dbraw/zinc/11/90/06/1049119006.db2.gz IAISDUVUMQPRQE-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001178998959 1049120388 /nfs/dbraw/zinc/12/03/88/1049120388.db2.gz VBYRBCSUIXAPGI-WOJBJXKFSA-N 1 0 310.416 4.014 20 10 DICDRO CCCc1ccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)s1 ZINC000857046727 1049123068 /nfs/dbraw/zinc/12/30/68/1049123068.db2.gz PTVQJEAQAVSFIE-GFCCVEGCSA-N 1 0 305.443 4.266 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(OC)ccc1F)c1ccc(N(C)C)cc1 ZINC000857081399 1049125832 /nfs/dbraw/zinc/12/58/32/1049125832.db2.gz OGYHUQBEDFFVTN-LJQANCHMSA-N 1 0 316.420 4.141 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)c(O)c1C ZINC000857083616 1049127500 /nfs/dbraw/zinc/12/75/00/1049127500.db2.gz YGZXAQAOSJDVNY-RYUDHWBXSA-N 1 0 302.245 4.244 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CC[C@H]2CC2(Cl)Cl)c2c1c(F)ccc2O ZINC000857082348 1049127797 /nfs/dbraw/zinc/12/77/97/1049127797.db2.gz MUFDWPFUIYNKLZ-YWVKMMECSA-N 1 0 318.219 4.253 20 10 DICDRO C[C@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1cc(Cl)ccc1O ZINC000857082561 1049127871 /nfs/dbraw/zinc/12/78/71/1049127871.db2.gz OMRWDRQHJIVUST-DTWKUNHWSA-N 1 0 308.636 4.280 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1cc(Cl)ccc1O ZINC000775546183 1049134671 /nfs/dbraw/zinc/13/46/71/1049134671.db2.gz FYLYGIVCDRDEBZ-ZUZCIYMTSA-N 1 0 308.784 4.382 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCOC)c1ccco1)c1cc(Cl)ccc1O ZINC000775546769 1049136612 /nfs/dbraw/zinc/13/66/12/1049136612.db2.gz KZOUZXZWDBSWCI-HUUCEWRRSA-N 1 0 323.820 4.457 20 10 DICDRO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204328270 1049141965 /nfs/dbraw/zinc/14/19/65/1049141965.db2.gz FMMGEYNBZLUPQS-KRWDZBQOSA-N 1 0 306.453 4.234 20 10 DICDRO C[N@H+](C/C=C/c1ccccc1)Cc1ccc(N2CCCC2)cc1 ZINC001204323038 1049142007 /nfs/dbraw/zinc/14/20/07/1049142007.db2.gz ZLPDNMKPTHZVHJ-JXMROGBWSA-N 1 0 306.453 4.432 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)c1nccs1)c1cc(Cl)ccc1O ZINC000775551022 1049142645 /nfs/dbraw/zinc/14/26/45/1049142645.db2.gz GIRYJMNPCIJCGU-GWCFXTLKSA-N 1 0 310.850 4.347 20 10 DICDRO c1ccc(C2CC[NH+](Cc3ccc(N4CCCC4)cc3)CC2)nc1 ZINC001204327436 1049142755 /nfs/dbraw/zinc/14/27/55/1049142755.db2.gz UEAAUUQGIHTCEB-UHFFFAOYSA-N 1 0 321.468 4.061 20 10 DICDRO CC[C@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000775550824 1049142986 /nfs/dbraw/zinc/14/29/86/1049142986.db2.gz CGJKTJWGKSVHKH-WWGRRREGSA-N 1 0 311.853 4.292 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1c(F)cccc1C(F)(F)F ZINC001204465911 1049168363 /nfs/dbraw/zinc/16/83/63/1049168363.db2.gz LLTIMBBBPFEYFN-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CCC3(CCC3)O2)cc1 ZINC001179654767 1049187634 /nfs/dbraw/zinc/18/76/34/1049187634.db2.gz OOKYFGNBYBKZBF-IBGZPJMESA-N 1 0 316.489 4.114 20 10 DICDRO CC[C@H]([NH2+]C1(c2ccc(OC)cc2)CC1)c1ccc(N(C)C)cc1 ZINC000776959811 1049196245 /nfs/dbraw/zinc/19/62/45/1049196245.db2.gz CICYHYFXSVSRSX-FQEVSTJZSA-N 1 0 324.468 4.491 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C2(c3ccc(OC)cc3)CC2)cc1 ZINC000776959846 1049196335 /nfs/dbraw/zinc/19/63/35/1049196335.db2.gz DFDZXTYQKOONOX-INIZCTEOSA-N 1 0 324.468 4.491 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC[C@@H]2CCC(F)(F)C2)cc1 ZINC001179758601 1049205164 /nfs/dbraw/zinc/20/51/64/1049205164.db2.gz KJJLGFHWTRAZSD-QGZUEGPWSA-N 1 0 308.416 4.181 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)ccn1 ZINC000858115974 1049220088 /nfs/dbraw/zinc/22/00/88/1049220088.db2.gz MXRPEOVGROHQPG-UHFFFAOYSA-N 1 0 323.484 4.449 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2cncc(F)c2)c(C)n1-c1ccccc1 ZINC000858294422 1049237616 /nfs/dbraw/zinc/23/76/16/1049237616.db2.gz YUBJAOJITFFMTG-HNNXBMFYSA-N 1 0 323.415 4.479 20 10 DICDRO Cc1cc(C[NH2+]Cc2cccnc2C)c(C)n1-c1ccccc1 ZINC000858293132 1049238032 /nfs/dbraw/zinc/23/80/32/1049238032.db2.gz JWMKDWGDEHTTEN-UHFFFAOYSA-N 1 0 305.425 4.087 20 10 DICDRO C[C@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(N(C)C)cc1 ZINC000195615663 1049240757 /nfs/dbraw/zinc/24/07/57/1049240757.db2.gz KJWDOGZRCVCDNL-HNNXBMFYSA-N 1 0 307.441 4.127 20 10 DICDRO COc1cc(C[NH2+][C@H](C)c2ccns2)c(O)c(C(C)(C)C)c1 ZINC000858318278 1049240797 /nfs/dbraw/zinc/24/07/97/1049240797.db2.gz NDWGACPWWWPTIW-LLVKDONJSA-N 1 0 320.458 4.006 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1O ZINC000858320449 1049241910 /nfs/dbraw/zinc/24/19/10/1049241910.db2.gz CXAKWTJUMZEMPE-MRXNPFEDSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)nc1 ZINC000858489113 1049264684 /nfs/dbraw/zinc/26/46/84/1049264684.db2.gz TZPCVYUJBWNNEA-INIZCTEOSA-N 1 0 311.473 4.084 20 10 DICDRO CCC(F)(F)C(C)(C)C[NH2+][C@H](C)c1cccc(OC)c1O ZINC000858513586 1049268613 /nfs/dbraw/zinc/26/86/13/1049268613.db2.gz MIPMMRQGBUEMSZ-LLVKDONJSA-N 1 0 301.377 4.123 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1csc(C(F)(F)F)c1)CC2 ZINC000858564383 1049274920 /nfs/dbraw/zinc/27/49/20/1049274920.db2.gz LQVIAZHPDHTXKV-LLVKDONJSA-N 1 0 313.344 4.250 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c1 ZINC000858567305 1049276275 /nfs/dbraw/zinc/27/62/75/1049276275.db2.gz BCHZYQPFEPYXRY-GFCCVEGCSA-N 1 0 301.352 4.474 20 10 DICDRO C[C@H]([NH2+]CC1(C(F)(F)F)CCCC1)c1cc(F)ccc1O ZINC000858568677 1049276868 /nfs/dbraw/zinc/27/68/68/1049276868.db2.gz OXKCTNBSXRALPF-JTQLQIEISA-N 1 0 305.315 4.305 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1cccc(C(F)(F)F)c1[O-] ZINC000858576374 1049277736 /nfs/dbraw/zinc/27/77/36/1049277736.db2.gz JWAMSPLRPSUDQW-BDAKNGLRSA-N 1 0 316.348 4.279 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCc3ccc(Cl)cc32)c1O ZINC000858583111 1049282512 /nfs/dbraw/zinc/28/25/12/1049282512.db2.gz WWRYJHLCJMUPQU-BZNIZROVSA-N 1 0 317.816 4.392 20 10 DICDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2cccc(F)c2[O-])C12CCCCC2 ZINC001180098286 1049286785 /nfs/dbraw/zinc/28/67/85/1049286785.db2.gz KTSOAAWYYLPWDU-SJORKVTESA-N 1 0 321.436 4.091 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1C[C@@H]2CCCC[C@@]21c1ccccc1 ZINC001180113632 1049288452 /nfs/dbraw/zinc/28/84/52/1049288452.db2.gz ZNKXCUMIMHETTM-FXAWDEMLSA-N 1 0 311.400 4.433 20 10 DICDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001180125106 1049291043 /nfs/dbraw/zinc/29/10/43/1049291043.db2.gz RHVATTKPTJMFSV-OCCSQVGLSA-N 1 0 303.352 4.048 20 10 DICDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001180125104 1049293023 /nfs/dbraw/zinc/29/30/23/1049293023.db2.gz RHVATTKPTJMFSV-GXTWGEPZSA-N 1 0 303.352 4.048 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@H]2CCCC[C@H]12 ZINC001204887807 1049299015 /nfs/dbraw/zinc/29/90/15/1049299015.db2.gz ASBHJTCTSFXSLQ-SIIHOXLZSA-N 1 0 322.443 4.431 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)CC)cc1)c1nc(C)cs1 ZINC000773841579 1049299664 /nfs/dbraw/zinc/29/96/64/1049299664.db2.gz XHMYIQBVKZYDIU-MRXNPFEDSA-N 1 0 303.475 4.149 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@@H]2CCCC[C@H]12 ZINC001204887802 1049300138 /nfs/dbraw/zinc/30/01/38/1049300138.db2.gz ASBHJTCTSFXSLQ-DDUZABMNSA-N 1 0 322.443 4.431 20 10 DICDRO Cc1ccc(C[N@H+](C)CCCOc2cccc(Cl)c2)c(O)c1 ZINC001180161601 1049303308 /nfs/dbraw/zinc/30/33/08/1049303308.db2.gz IWGINHKKOPHVBV-UHFFFAOYSA-N 1 0 319.832 4.255 20 10 DICDRO CNc1ccccc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC001204915435 1049308736 /nfs/dbraw/zinc/30/87/36/1049308736.db2.gz KNSRCOXFSJNRIN-UHFFFAOYSA-N 1 0 310.441 4.379 20 10 DICDRO CC(C)[C@H]1CC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001204976708 1049327654 /nfs/dbraw/zinc/32/76/54/1049327654.db2.gz QZDXNIWSSLHVGD-LJQANCHMSA-N 1 0 311.425 4.202 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2cccc(O)c2)cc1Cl ZINC001180288740 1049337213 /nfs/dbraw/zinc/33/72/13/1049337213.db2.gz LCECJJGLTMQFHH-GFCCVEGCSA-N 1 0 305.805 4.253 20 10 DICDRO C[C@]1(C[N@H+](Cc2ccccc2O)C2CCCC2)CCCCO1 ZINC001180288072 1049337676 /nfs/dbraw/zinc/33/76/76/1049337676.db2.gz AQALUVQZYVMYAK-LJQANCHMSA-N 1 0 303.446 4.096 20 10 DICDRO C[C@H]([NH2+]CCOC1CCC1)c1ccc(N2CCCCCC2)cc1 ZINC000777118415 1049343119 /nfs/dbraw/zinc/34/31/19/1049343119.db2.gz CWZIEOBEZZPXSU-KRWDZBQOSA-N 1 0 316.489 4.287 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)CC2(OC)CCCCC2)cc1 ZINC001205024086 1049346119 /nfs/dbraw/zinc/34/61/19/1049346119.db2.gz PPPSQTIENXUZQC-UHFFFAOYSA-N 1 0 318.505 4.314 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccc3c2OCC3)cc1 ZINC001205024414 1049346231 /nfs/dbraw/zinc/34/62/31/1049346231.db2.gz XLJUVKYJNHJXMX-UHFFFAOYSA-N 1 0 324.468 4.100 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cc(C)oc2C)cc1 ZINC001205032713 1049348844 /nfs/dbraw/zinc/34/88/44/1049348844.db2.gz MAIHKNRLGSLSBD-UHFFFAOYSA-N 1 0 300.446 4.375 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(-c2cnco2)cc1)c1ccc(N(C)C)cc1 ZINC000906527128 1049352531 /nfs/dbraw/zinc/35/25/31/1049352531.db2.gz ZMJVNXCJUCJYAJ-HNNXBMFYSA-N 1 0 321.424 4.258 20 10 DICDRO COCC1(C[N@H+](Cc2ccccc2O)C2CCCCC2)CCC1 ZINC001180479494 1049362785 /nfs/dbraw/zinc/36/27/85/1049362785.db2.gz OAUOHWDWSXENMY-UHFFFAOYSA-N 1 0 317.473 4.344 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(C)c1F ZINC001180480251 1049364986 /nfs/dbraw/zinc/36/49/86/1049364986.db2.gz XVRNDYXFYMUXMZ-UHFFFAOYSA-N 1 0 300.421 4.222 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCC[C@H]2c2cccn2C)cc1Cl ZINC001180505257 1049376994 /nfs/dbraw/zinc/37/69/94/1049376994.db2.gz LVHZLOMBQMFRJJ-INIZCTEOSA-N 1 0 304.821 4.030 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001180540262 1049377526 /nfs/dbraw/zinc/37/75/26/1049377526.db2.gz KAGLAGJWOSCUHF-LXXRFIIISA-N 1 0 324.468 4.467 20 10 DICDRO Cc1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc(C)c1O ZINC001180557787 1049380180 /nfs/dbraw/zinc/38/01/80/1049380180.db2.gz GRSJHRMFQRRINP-UHFFFAOYSA-N 1 0 324.468 4.240 20 10 DICDRO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1cc(C)cc(OC)c1O ZINC001180613110 1049383162 /nfs/dbraw/zinc/38/31/62/1049383162.db2.gz NLTXBYDSTJBDFT-SFHVURJKSA-N 1 0 311.425 4.046 20 10 DICDRO Cc1ccccc1C[N@@H+](C)Cc1ccc(Br)cc1O ZINC001205155860 1049396278 /nfs/dbraw/zinc/39/62/78/1049396278.db2.gz FXDLTVDCSMMNPB-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1O ZINC001205178040 1049404215 /nfs/dbraw/zinc/40/42/15/1049404215.db2.gz QDLIHTIONBZKQJ-GFCCVEGCSA-N 1 0 305.368 4.426 20 10 DICDRO C[C@H]([NH2+]C1(C2CC2)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000777149864 1049406516 /nfs/dbraw/zinc/40/65/16/1049406516.db2.gz QGSYXOFJWWTHFK-AWEZNQCLSA-N 1 0 302.437 4.409 20 10 DICDRO Cc1cccc([C@@H]2CC[N@@H+](Cc3ccc(N(C)C)cc3C)C2)c1 ZINC001180818950 1049410177 /nfs/dbraw/zinc/41/01/77/1049410177.db2.gz FFPLWQAPJNLMCC-HXUWFJFHSA-N 1 0 308.469 4.359 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@H+](Cc2cccs2)C2CC2)cc1 ZINC001205207767 1049410998 /nfs/dbraw/zinc/41/09/98/1049410998.db2.gz CVGRCKSXQSGQDL-HYXAFXHYSA-N 1 0 312.482 4.492 20 10 DICDRO CC(C)O[C@H]1C[C@H]([NH2+]Cc2cc(C(C)C)ccc2O)C1(C)C ZINC001205268924 1049420964 /nfs/dbraw/zinc/42/09/64/1049420964.db2.gz BUOALRQAPZUKLR-ROUUACIJSA-N 1 0 305.462 4.197 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](CC(F)(F)F)C(C)C)cc1 ZINC000773889421 1049425092 /nfs/dbraw/zinc/42/50/92/1049425092.db2.gz VOYMUZLWULWFGQ-HNNXBMFYSA-N 1 0 302.384 4.209 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C2(c3cccc(OC)c3)CC2)cc1 ZINC000777157003 1049430594 /nfs/dbraw/zinc/43/05/94/1049430594.db2.gz KSRGNNBAPBVEHR-INIZCTEOSA-N 1 0 324.468 4.491 20 10 DICDRO CCc1cccc(C[N@@H+]2CC[C@](F)(c3ccccc3C)C2)c1O ZINC001181196056 1049452064 /nfs/dbraw/zinc/45/20/64/1049452064.db2.gz HUKBIBSNHUVDEN-HXUWFJFHSA-N 1 0 313.416 4.334 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CCC[C@H](C(C)(C)C)CC2)c1 ZINC001205427747 1049467897 /nfs/dbraw/zinc/46/78/97/1049467897.db2.gz WEXUNMMHEDZKKO-HOTGVXAUSA-N 1 0 305.462 4.485 20 10 DICDRO COc1cc(C)c(C[NH2+]CCCc2cccc(Cl)c2)c(O)c1 ZINC001181349130 1049470350 /nfs/dbraw/zinc/47/03/50/1049470350.db2.gz KUYVPVYOQYACTI-UHFFFAOYSA-N 1 0 319.832 4.085 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2ccccc2Br)c1O ZINC000775642284 1049486997 /nfs/dbraw/zinc/48/69/97/1049486997.db2.gz JJUDIYAHIVRZKU-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2)c1O ZINC000775641840 1049487071 /nfs/dbraw/zinc/48/70/71/1049487071.db2.gz CLBHMWZDMLUDOT-UHFFFAOYSA-N 1 0 307.393 4.496 20 10 DICDRO CCCC[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C1CCC1 ZINC001181534231 1049487863 /nfs/dbraw/zinc/48/78/63/1049487863.db2.gz HOLYHFMSCDMFSF-KRWDZBQOSA-N 1 0 310.432 4.479 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2ccc(Br)cc2)c1O ZINC000775642813 1049487882 /nfs/dbraw/zinc/48/78/82/1049487882.db2.gz OQKNXXUXPRARPQ-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2c2cccn2C)c1O ZINC000775644146 1049489101 /nfs/dbraw/zinc/48/91/01/1049489101.db2.gz DAWZKDLYICCPBY-MRXNPFEDSA-N 1 0 304.821 4.030 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)C1CC(F)(F)C1 ZINC000862394183 1049491833 /nfs/dbraw/zinc/49/18/33/1049491833.db2.gz DBXOQKROCLZODJ-KGLIPLIRSA-N 1 0 310.432 4.015 20 10 DICDRO C[C@H]([NH2+]Cc1ccsc1C(F)(F)F)c1ccccc1O ZINC000862401855 1049492769 /nfs/dbraw/zinc/49/27/69/1049492769.db2.gz VBVFVIMVEFTVNQ-VIFPVBQESA-N 1 0 301.333 4.323 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](c3ccc(C)cc3)C[C@@H]2C)c1 ZINC001205568461 1049498943 /nfs/dbraw/zinc/49/89/43/1049498943.db2.gz IOAMXENELUFWMH-RDJZCZTQSA-N 1 0 311.425 4.087 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC001181689253 1049499365 /nfs/dbraw/zinc/49/93/65/1049499365.db2.gz XEPZEIUZBVYHRQ-UHFFFAOYSA-N 1 0 314.395 4.225 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](c3ccc(C)cc3)C[C@@H]2C)c1 ZINC001205568459 1049499802 /nfs/dbraw/zinc/49/98/02/1049499802.db2.gz IOAMXENELUFWMH-DOTOQJQBSA-N 1 0 311.425 4.087 20 10 DICDRO Cc1cc(C[NH2+]Cc2oc(C)nc2C)c(C)n1-c1cccc(C)c1 ZINC000862528265 1049499982 /nfs/dbraw/zinc/49/99/82/1049499982.db2.gz SFHOFMKWUSEYLO-UHFFFAOYSA-N 1 0 323.440 4.297 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccccc2Cl)c1 ZINC000775648283 1049499993 /nfs/dbraw/zinc/49/99/93/1049499993.db2.gz CUSUORRPKQDKLA-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO Cc1cccc(C[NH2+]Cc2ccccc2CC(F)(F)F)c1O ZINC000862547827 1049502974 /nfs/dbraw/zinc/50/29/74/1049502974.db2.gz QJTXKQWKXMQLMI-UHFFFAOYSA-N 1 0 309.331 4.095 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)c2cccc(Cl)c2)c1 ZINC000775649036 1049508220 /nfs/dbraw/zinc/50/82/20/1049508220.db2.gz JVVPNVBSOQRNCR-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)c1O ZINC000775649303 1049514854 /nfs/dbraw/zinc/51/48/54/1049514854.db2.gz NZHLPCSPESYDKC-UHFFFAOYSA-N 1 0 303.352 4.143 20 10 DICDRO Cc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1O ZINC000775650815 1049518298 /nfs/dbraw/zinc/51/82/98/1049518298.db2.gz GBZLEHYVVKOYNU-UHFFFAOYSA-N 1 0 314.385 4.019 20 10 DICDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1cc(OC)ccc1O ZINC000775652973 1049525805 /nfs/dbraw/zinc/52/58/05/1049525805.db2.gz XTTFFDSPDXGMHO-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+](Cc2ccccn2)C(C)C)c1O ZINC000775658536 1049534853 /nfs/dbraw/zinc/53/48/53/1049534853.db2.gz POVZVNKOKVWKFM-UHFFFAOYSA-N 1 0 304.821 4.160 20 10 DICDRO CC[N@H+](Cc1ccoc1)Cc1cc(Br)cc(C)c1O ZINC000775674866 1049588178 /nfs/dbraw/zinc/58/81/78/1049588178.db2.gz MTZZCWLDJOSYRA-UHFFFAOYSA-N 1 0 324.218 4.078 20 10 DICDRO Cc1nc(C)c(C[N@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000119638831 1049593646 /nfs/dbraw/zinc/59/36/46/1049593646.db2.gz KEPXOMHFEVCBBL-UHFFFAOYSA-N 1 0 316.470 4.410 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@@H](C)Cc1cccc(F)c1 ZINC001182272695 1049599339 /nfs/dbraw/zinc/59/93/39/1049599339.db2.gz VVYMELXPEAIGPL-INIZCTEOSA-N 1 0 314.448 4.263 20 10 DICDRO CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000774113233 1049602334 /nfs/dbraw/zinc/60/23/34/1049602334.db2.gz CNWWGLZLOKZBMM-LLVKDONJSA-N 1 0 319.276 4.080 20 10 DICDRO Cc1ccc(C2(C[NH2+]Cc3ccc(N(C)C)cc3C)CC2)c(C)c1 ZINC001206004320 1049625722 /nfs/dbraw/zinc/62/57/22/1049625722.db2.gz CLMIQQTTWDPIOI-UHFFFAOYSA-N 1 0 322.496 4.499 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c1O ZINC000775696498 1049630140 /nfs/dbraw/zinc/63/01/40/1049630140.db2.gz MQFVTLAZGKZXAE-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)c1 ZINC000775706985 1049639126 /nfs/dbraw/zinc/63/91/26/1049639126.db2.gz SXVJNYXHFMIRQH-ACJLOTCBSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1ccc(CC[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)cc1C ZINC001182423551 1049642559 /nfs/dbraw/zinc/64/25/59/1049642559.db2.gz GENHVORBPVDROS-IBGZPJMESA-N 1 0 324.512 4.441 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccc(N(C)C)cc1 ZINC000119880497 1049645054 /nfs/dbraw/zinc/64/50/54/1049645054.db2.gz DJEPRBIQWSXLGE-FQEVSTJZSA-N 1 0 311.473 4.060 20 10 DICDRO Cc1cc(O)c(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)cc1C ZINC000119939826 1049646443 /nfs/dbraw/zinc/64/64/43/1049646443.db2.gz MOAWCKLDTOYNJN-KDOFPFPSSA-N 1 0 317.454 4.033 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCCN1C1CC1)c1ccc2ccccc2c1O ZINC000774380802 1049654102 /nfs/dbraw/zinc/65/41/02/1049654102.db2.gz UJISLVFGITVKBW-YJBOKZPZSA-N 1 0 324.468 4.213 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000775726057 1049670379 /nfs/dbraw/zinc/67/03/79/1049670379.db2.gz WDAWBYJCSFOSAX-MRXNPFEDSA-N 1 0 303.789 4.001 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000775726053 1049670895 /nfs/dbraw/zinc/67/08/95/1049670895.db2.gz WDAWBYJCSFOSAX-INIZCTEOSA-N 1 0 303.789 4.001 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1)c1ccc(C)cc1O ZINC000794791882 1049698148 /nfs/dbraw/zinc/69/81/48/1049698148.db2.gz JXXHYLMQJANMJO-AEFFLSMTSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+]CCCn1cnc2ccccc21)c1ccc(C)cc1O ZINC000794794288 1049698576 /nfs/dbraw/zinc/69/85/76/1049698576.db2.gz QTSFWSCUMXLVRS-KRWDZBQOSA-N 1 0 323.440 4.181 20 10 DICDRO Cc1ccc(CC[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)cc1 ZINC001206321980 1049711462 /nfs/dbraw/zinc/71/14/62/1049711462.db2.gz YTMPVGDODOBRIE-SFHVURJKSA-N 1 0 310.485 4.133 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH+]1CC(c2ccccc2)(C(C)C)C1 ZINC001206320671 1049712059 /nfs/dbraw/zinc/71/20/59/1049712059.db2.gz LRSROYOENGQINV-UHFFFAOYSA-N 1 0 322.496 4.471 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1C1CC1 ZINC001206319990 1049712189 /nfs/dbraw/zinc/71/21/89/1049712189.db2.gz GHCZVOOWEWNTQH-VZJWBNGJSA-N 1 0 300.490 4.016 20 10 DICDRO Cc1ccc(CC[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)cc1 ZINC001206321979 1049712537 /nfs/dbraw/zinc/71/25/37/1049712537.db2.gz YTMPVGDODOBRIE-GOSISDBHSA-N 1 0 310.485 4.133 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC2(CCCCCC2)O1)c1ccccc1O ZINC001197013021 1049715043 /nfs/dbraw/zinc/71/50/43/1049715043.db2.gz LEGJFEXCJVCXRU-HOTGVXAUSA-N 1 0 303.446 4.315 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2cncc(C)c2)cc1 ZINC001197135741 1049720537 /nfs/dbraw/zinc/72/05/37/1049720537.db2.gz OMCSTZSWFQYRDM-HXUWFJFHSA-N 1 0 309.457 4.183 20 10 DICDRO Cc1ccc(C[NH+]2CCC(c3cccc(F)c3F)CC2)c(O)c1 ZINC001206429745 1049734330 /nfs/dbraw/zinc/73/43/30/1049734330.db2.gz JMEJWCUPSLYNEV-UHFFFAOYSA-N 1 0 317.379 4.358 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c1 ZINC001206728320 1049784695 /nfs/dbraw/zinc/78/46/95/1049784695.db2.gz QAPUDCWKFYSBIW-LJQANCHMSA-N 1 0 311.425 4.169 20 10 DICDRO CC(C)[C@H]([NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)C1CC1 ZINC001206728567 1049785705 /nfs/dbraw/zinc/78/57/05/1049785705.db2.gz QOPPWLMNBLCARZ-INIZCTEOSA-N 1 0 314.395 4.296 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C1(c2ccc(F)cc2)CCC1 ZINC001206777354 1049798345 /nfs/dbraw/zinc/79/83/45/1049798345.db2.gz RRMLQUAMFOHMMP-UHFFFAOYSA-N 1 0 312.432 4.369 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CCCC3(CC3)CC2)c1O ZINC001206999651 1049818877 /nfs/dbraw/zinc/81/88/77/1049818877.db2.gz LSYHBTIMUCQLMY-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(O)c(F)c2)c(C)n1-c1ccccc1 ZINC001207101664 1049835391 /nfs/dbraw/zinc/83/53/91/1049835391.db2.gz IEJJGTMLKTWTLH-UHFFFAOYSA-N 1 0 324.399 4.229 20 10 DICDRO CCSc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC001207312130 1049879479 /nfs/dbraw/zinc/87/94/79/1049879479.db2.gz FGWQFJDXFDNPAH-UHFFFAOYSA-N 1 0 314.498 4.463 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2O)cc1C ZINC001207691640 1049928269 /nfs/dbraw/zinc/92/82/69/1049928269.db2.gz PHFHOQDNZSEBTA-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO Oc1c(C[NH2+][C@H]2CCSC3(CCC3)C2)ccc2ccccc21 ZINC001207719424 1049930652 /nfs/dbraw/zinc/93/06/52/1049930652.db2.gz ILMKWPGSNBURMD-INIZCTEOSA-N 1 0 313.466 4.453 20 10 DICDRO C[N@@H+](Cc1ccc(N2CCCC2)cc1)CC1Cc2ccccc2C1 ZINC001209322113 1050052414 /nfs/dbraw/zinc/05/24/14/1050052414.db2.gz SGZFFSBBJQJEAZ-UHFFFAOYSA-N 1 0 320.480 4.134 20 10 DICDRO CC[N@H+](Cc1ccc(-n2c(C)ccc2C)cc1)C1CCOCC1 ZINC001209517408 1050065609 /nfs/dbraw/zinc/06/56/09/1050065609.db2.gz GPBOFBIVSPVGML-UHFFFAOYSA-N 1 0 312.457 4.095 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@H+](C)CCc2cccnc2)cc1 ZINC001209518175 1050065882 /nfs/dbraw/zinc/06/58/82/1050065882.db2.gz OKWLJQMEMUFVPV-UHFFFAOYSA-N 1 0 319.452 4.164 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)cc1 ZINC001209517101 1050065962 /nfs/dbraw/zinc/06/59/62/1050065962.db2.gz YCDXXACDBKAESC-HFSMHLIXSA-N 1 0 324.468 4.093 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2c(Cl)cccc2C1)c1ccccc1O ZINC001171027931 1050151867 /nfs/dbraw/zinc/15/18/67/1050151867.db2.gz UIQARGYKJSOHNC-JSGCOSHPSA-N 1 0 301.817 4.254 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1nc2ccccc2s1 ZINC000378871043 1050190172 /nfs/dbraw/zinc/19/01/72/1050190172.db2.gz NRNVTRCVRZARKJ-CYBMUJFWSA-N 1 0 311.454 4.213 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)[C@H](OC)c2ccc(F)cc2)cc1C ZINC000770749687 1050191789 /nfs/dbraw/zinc/19/17/89/1050191789.db2.gz XGNPKNOPWOOKLG-LIRRHRJNSA-N 1 0 317.404 4.009 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2OC)cc1C ZINC000378876998 1050192086 /nfs/dbraw/zinc/19/20/86/1050192086.db2.gz ATZSGKXDEPEKGA-ZDUSSCGKSA-N 1 0 303.377 4.002 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2ccccc2O)c2ccccc2)cc1 ZINC000378928498 1050193930 /nfs/dbraw/zinc/19/39/30/1050193930.db2.gz VXIXEHRNRHZORG-OAQYLSRUSA-N 1 0 319.404 4.280 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)[C@@H]2CCCCO2)c(C)n1-c1ccccc1 ZINC000379148803 1050196600 /nfs/dbraw/zinc/19/66/00/1050196600.db2.gz BENAOEYZKIMRRK-UZLBHIALSA-N 1 0 312.457 4.141 20 10 DICDRO CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000760870913 1050197219 /nfs/dbraw/zinc/19/72/19/1050197219.db2.gz UCSDNFCSZSAKIA-VBHSOAQHSA-N 1 0 319.832 4.472 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)c1O ZINC000824468049 1050215102 /nfs/dbraw/zinc/21/51/02/1050215102.db2.gz BANOBAIBINAHDG-KRWDZBQOSA-N 1 0 303.352 4.146 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2CCCc3c(F)cccc32)c1O ZINC000824468998 1050218096 /nfs/dbraw/zinc/21/80/96/1050218096.db2.gz UTJXPACOPMMLBG-KRWDZBQOSA-N 1 0 315.388 4.097 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1O ZINC000824548653 1050222301 /nfs/dbraw/zinc/22/23/01/1050222301.db2.gz KKJSOTOAXMGCDK-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1Cl ZINC000824566290 1050223748 /nfs/dbraw/zinc/22/37/48/1050223748.db2.gz HUSXNWSMIBVCLT-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c(O)c1 ZINC000824548217 1050225160 /nfs/dbraw/zinc/22/51/60/1050225160.db2.gz BTPROUNSTBBZNF-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO [O-]c1c(Cl)cccc1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000825104543 1050271662 /nfs/dbraw/zinc/27/16/62/1050271662.db2.gz ZPWJHOKWOQRREH-INIZCTEOSA-N 1 0 303.789 4.366 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2cnc(CC)o2)cc1 ZINC000825079464 1050274554 /nfs/dbraw/zinc/27/45/54/1050274554.db2.gz VDTMGMVICWWION-UHFFFAOYSA-N 1 0 315.461 4.153 20 10 DICDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000734476360 1050275734 /nfs/dbraw/zinc/27/57/34/1050275734.db2.gz FNCYEDWZNDFPTC-BEFAXECRSA-N 1 0 307.437 4.259 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1ccccc1O ZINC000825117688 1050275921 /nfs/dbraw/zinc/27/59/21/1050275921.db2.gz JRKHGCMLQTXKNA-ROUUACIJSA-N 1 0 310.441 4.404 20 10 DICDRO COc1ccc2ccc(O)c(C[NH+](CC3CC3)CC3CC3)c2c1 ZINC000734477453 1050277756 /nfs/dbraw/zinc/27/77/56/1050277756.db2.gz CHPRVJMQGLDZNT-UHFFFAOYSA-N 1 0 311.425 4.176 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)c1 ZINC000825127510 1050279598 /nfs/dbraw/zinc/27/95/98/1050279598.db2.gz XYNNTBFRXNACFP-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO COc1cccc([C@H]2C[C@H]([N@H+](C)Cc3cc(C)ccc3O)C2)c1 ZINC000825290308 1050290611 /nfs/dbraw/zinc/29/06/11/1050290611.db2.gz VGPFUGPVAHQMIZ-SAABIXHNSA-N 1 0 311.425 4.087 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2ccc(F)cc2)C2CC2)c1O ZINC000771935125 1050299923 /nfs/dbraw/zinc/29/99/23/1050299923.db2.gz IZLFFWOQSVRNRY-UHFFFAOYSA-N 1 0 315.388 4.095 20 10 DICDRO Oc1ccc(Br)cc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000771937407 1050300869 /nfs/dbraw/zinc/30/08/69/1050300869.db2.gz BXMWTGAZJNCSHX-OAHLLOKOSA-N 1 0 318.214 4.102 20 10 DICDRO CCO[C@@H]1CCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000771941144 1050302923 /nfs/dbraw/zinc/30/29/23/1050302923.db2.gz YPCVPDNMUQAWBR-LJQANCHMSA-N 1 0 311.425 4.060 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCCc1ccccn1 ZINC000771976047 1050310520 /nfs/dbraw/zinc/31/05/20/1050310520.db2.gz FICPIYOWRZIDBF-UHFFFAOYSA-N 1 0 318.420 4.177 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2ccc(F)c(Cl)c2F)cc1 ZINC001143627271 1050321834 /nfs/dbraw/zinc/32/18/34/1050321834.db2.gz HTKCEHUDTOUAGT-UHFFFAOYSA-N 1 0 324.802 4.316 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)C(C)(C)O ZINC000734841867 1050325648 /nfs/dbraw/zinc/32/56/48/1050325648.db2.gz ZCIQQJMYYSXMPU-CYBMUJFWSA-N 1 0 321.505 4.236 20 10 DICDRO COc1ccc(N2CCC[N@H+](C[C@H](C)c3ccccc3)CC2)cc1 ZINC000735078074 1050344811 /nfs/dbraw/zinc/34/48/11/1050344811.db2.gz DNBDLOHSAZHWRO-SFHVURJKSA-N 1 0 324.468 4.011 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cc(Cl)ccc2C1)c1ccccc1O ZINC001171099490 1050350101 /nfs/dbraw/zinc/35/01/01/1050350101.db2.gz JGNGOIBKRDJKGA-BLLLJJGKSA-N 1 0 301.817 4.254 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC(C)(C)C[C@@H]3C)CC2)cc1 ZINC000766213653 1050370878 /nfs/dbraw/zinc/37/08/78/1050370878.db2.gz HVYKQQJASIARGN-HNAYVOBHSA-N 1 0 316.489 4.078 20 10 DICDRO C[C@H](C[NH2+]Cc1ccccc1O)c1ccc(C(F)(F)F)cc1 ZINC000785561601 1050393446 /nfs/dbraw/zinc/39/34/46/1050393446.db2.gz ZBLDMUMOJNFSRO-GFCCVEGCSA-N 1 0 309.331 4.304 20 10 DICDRO Cc1c(C[N@@H+]2CCc3cccc(O)c3C2)cccc1C(F)(F)F ZINC001143930429 1050412422 /nfs/dbraw/zinc/41/24/22/1050412422.db2.gz QRPKAARCYWWRHF-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)Oc1ccccc1F ZINC000766215912 1050463461 /nfs/dbraw/zinc/46/34/61/1050463461.db2.gz IFCBCDFQXZIONJ-CABCVRRESA-N 1 0 316.420 4.010 20 10 DICDRO CSCC[C@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000736365197 1050469225 /nfs/dbraw/zinc/46/92/25/1050469225.db2.gz WFFFSLLUCPZSFZ-AWEZNQCLSA-N 1 0 301.455 4.290 20 10 DICDRO Cc1noc(C)c1C[N@@H+](C)Cc1cc(C(C)C)c(C)cc1O ZINC000046478227 1050475338 /nfs/dbraw/zinc/47/53/38/1050475338.db2.gz ZUOZNJXACRCYAT-UHFFFAOYSA-N 1 0 302.418 4.061 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCCc1nccs1 ZINC000736641350 1050485240 /nfs/dbraw/zinc/48/52/40/1050485240.db2.gz GRXXNERXOXMGER-UHFFFAOYSA-N 1 0 324.449 4.238 20 10 DICDRO C[NH2+]Cc1cccc(N(c2ccc(N)cc2)c2ccc(N)cc2)c1 ZINC001211139945 1050494058 /nfs/dbraw/zinc/49/40/58/1050494058.db2.gz ZWJKYRDAESQZLK-UHFFFAOYSA-N 1 0 318.424 4.040 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)n1 ZINC000736945641 1050497616 /nfs/dbraw/zinc/49/76/16/1050497616.db2.gz QNZKSIOTDCQUDE-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 ZINC000766225935 1050503098 /nfs/dbraw/zinc/50/30/98/1050503098.db2.gz KDXRNADDKOOIDX-ABSDTBQOSA-N 1 0 316.489 4.143 20 10 DICDRO COc1cccc(C[NH2+]C[C@H](Cc2ccccc2)C(C)C)c1O ZINC000786836509 1050519570 /nfs/dbraw/zinc/51/95/70/1050519570.db2.gz ZIAIRYXZANNVBZ-SFHVURJKSA-N 1 0 313.441 4.005 20 10 DICDRO CCc1cc(C[N@H+](CC)C[C@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000738079938 1050522454 /nfs/dbraw/zinc/52/24/54/1050522454.db2.gz DZZUGKBHVHXWOQ-MRXNPFEDSA-N 1 0 319.489 4.111 20 10 DICDRO C[C@@H]1CSCC[N@@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000738278543 1050528238 /nfs/dbraw/zinc/52/82/38/1050528238.db2.gz TZJQFNDXRIRKMW-GFCCVEGCSA-N 1 0 313.422 4.229 20 10 DICDRO COCC(C)(C)CCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000808428179 1050555978 /nfs/dbraw/zinc/55/59/78/1050555978.db2.gz BBIWPVJOGNSLFM-UHFFFAOYSA-N 1 0 318.505 4.219 20 10 DICDRO Cc1nc(F)ccc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000787163257 1050558722 /nfs/dbraw/zinc/55/87/22/1050558722.db2.gz FBIBRMTZCIHLDJ-UHFFFAOYSA-N 1 0 314.404 4.180 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C/C=C/c2ccc(Cl)cc2)c1 ZINC000787278320 1050580503 /nfs/dbraw/zinc/58/05/03/1050580503.db2.gz DGLXDUDIAFHYCT-OOPCZODUSA-N 1 0 317.816 4.418 20 10 DICDRO Oc1cc(O)c(C[NH+](C2CCCCC2)C2CCCCC2)c(O)c1 ZINC001144499466 1050602456 /nfs/dbraw/zinc/60/24/56/1050602456.db2.gz GTAZPKKUTYUBHG-UHFFFAOYSA-N 1 0 319.445 4.271 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+](C)C(C)(C)c2ccccc2)c1O ZINC000792928894 1050622100 /nfs/dbraw/zinc/62/21/00/1050622100.db2.gz XIJCMWQUMGYMKA-UHFFFAOYSA-N 1 0 315.388 4.101 20 10 DICDRO Cc1cc(O)c(C[N@H+](Cc2ccc(F)cc2F)C2CC2)cc1C ZINC000059579863 1050623198 /nfs/dbraw/zinc/62/31/98/1050623198.db2.gz WQEAIYABEQAGLW-UHFFFAOYSA-N 1 0 317.379 4.452 20 10 DICDRO CCC[N@H+](Cc1cc(C)c(C)cc1O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000740859933 1050632291 /nfs/dbraw/zinc/63/22/91/1050632291.db2.gz WENPKIDWWUMCGT-QXAKKESOSA-N 1 0 317.473 4.035 20 10 DICDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2c(O)ccc3ccccc32)C1(C)C ZINC000740863661 1050634863 /nfs/dbraw/zinc/63/48/63/1050634863.db2.gz WCNFQKDMUTWCCJ-RBUKOAKNSA-N 1 0 313.441 4.181 20 10 DICDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2c(O)ccc3ccccc32)C1(C)C ZINC000740863660 1050635257 /nfs/dbraw/zinc/63/52/57/1050635257.db2.gz WCNFQKDMUTWCCJ-OALUTQOASA-N 1 0 313.441 4.181 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ncc(C(C)(C)C)s2)c1 ZINC000845972547 1050638790 /nfs/dbraw/zinc/63/87/90/1050638790.db2.gz RQGXLNYSZGZEFT-NSHDSACASA-N 1 0 320.458 4.006 20 10 DICDRO C[C@@H](CO)[C@H](C)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000740898716 1050638999 /nfs/dbraw/zinc/63/89/99/1050638999.db2.gz WYBBKBSMNHUVHB-KBPBESRZSA-N 1 0 321.505 4.094 20 10 DICDRO C[C@H]([NH2+]CC1CCSCC1)c1ccc2ccccc2c1O ZINC000168774211 1050643102 /nfs/dbraw/zinc/64/31/02/1050643102.db2.gz LVHQQDMZODLQMR-ZDUSSCGKSA-N 1 0 301.455 4.339 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC[C@]2(C)C[C@]2(F)Cl)cc1 ZINC000846028589 1050650552 /nfs/dbraw/zinc/65/05/52/1050650552.db2.gz CHDXQYDDPDLGKF-OSNZYPHYSA-N 1 0 310.844 4.060 20 10 DICDRO C[C@@]1(CC[NH2+]Cc2ccc3ccccc3c2O)C[C@@]1(F)Cl ZINC000846031586 1050651192 /nfs/dbraw/zinc/65/11/92/1050651192.db2.gz ASJFTTWVPNNFSG-SJORKVTESA-N 1 0 307.796 4.340 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000846055844 1050659635 /nfs/dbraw/zinc/65/96/35/1050659635.db2.gz QDOCDTQZOPLCDT-GUYCJALGSA-N 1 0 316.832 4.257 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000846056804 1050662044 /nfs/dbraw/zinc/66/20/44/1050662044.db2.gz ZXGPHDALRIGLCO-UHFFFAOYSA-N 1 0 323.864 4.406 20 10 DICDRO CCC(O)(CC)CC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000788262493 1050662394 /nfs/dbraw/zinc/66/23/94/1050662394.db2.gz NLNGVWMDFIUSEM-QGZVFWFLSA-N 1 0 318.505 4.269 20 10 DICDRO FC1(F)C[C@]12CCC[N@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000846108793 1050665061 /nfs/dbraw/zinc/66/50/61/1050665061.db2.gz QIFRCDFLMAUVHH-SFHVURJKSA-N 1 0 320.427 4.298 20 10 DICDRO Cc1cccc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)c1O ZINC000846113914 1050666452 /nfs/dbraw/zinc/66/64/52/1050666452.db2.gz CYYBIECTFOIHQV-UHFFFAOYSA-N 1 0 321.342 4.498 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(C)s2)c1O ZINC000846148469 1050672501 /nfs/dbraw/zinc/67/25/01/1050672501.db2.gz ZVODTDCYQZLJPU-WCQYABFASA-N 1 0 305.443 4.053 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCc2ccc(F)cc2Cl)c1O ZINC000846151269 1050674001 /nfs/dbraw/zinc/67/40/01/1050674001.db2.gz YPQCNTZUQQWGOC-LLVKDONJSA-N 1 0 323.795 4.087 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]CCc1ccc(Cl)s1 ZINC000227441189 1050674356 /nfs/dbraw/zinc/67/43/56/1050674356.db2.gz RALWFQGINMOGFO-UHFFFAOYSA-N 1 0 302.226 4.093 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)c1O ZINC000846157907 1050674355 /nfs/dbraw/zinc/67/43/55/1050674355.db2.gz PGIHBNCFQZSISJ-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](CC(F)(F)F)C(C)C)c1O ZINC000846162499 1050676465 /nfs/dbraw/zinc/67/64/65/1050676465.db2.gz CCEWYOYXBBNRRI-PWSUYJOCSA-N 1 0 305.340 4.028 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2c(C)oc3ccccc32)c1O ZINC000846162834 1050677280 /nfs/dbraw/zinc/67/72/80/1050677280.db2.gz FVZDTKRCGVXMPO-GFCCVEGCSA-N 1 0 311.381 4.306 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCc2ccc(SC)cc2)c1O ZINC000846167912 1050678533 /nfs/dbraw/zinc/67/85/33/1050678533.db2.gz NZTTYECOMFIEHP-CYBMUJFWSA-N 1 0 317.454 4.016 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)c1O ZINC000846166106 1050678723 /nfs/dbraw/zinc/67/87/23/1050678723.db2.gz SLARLJXEWNSKHB-CKFHNAJUSA-N 1 0 311.425 4.293 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCSc3ccccc32)c1O ZINC000846139844 1050682025 /nfs/dbraw/zinc/68/20/25/1050682025.db2.gz ALIWEACHNYTVIC-SWLSCSKDSA-N 1 0 315.438 4.289 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(CSC)cc2)c1O ZINC000846173568 1050682290 /nfs/dbraw/zinc/68/22/90/1050682290.db2.gz SVHANGOOKSJNGV-ZDUSSCGKSA-N 1 0 317.454 4.115 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccc(OC)cc1 ZINC000846138581 1050682435 /nfs/dbraw/zinc/68/24/35/1050682435.db2.gz WLGHXOIJWITGDF-DYVFJYSZSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c1O ZINC000846135702 1050682695 /nfs/dbraw/zinc/68/26/95/1050682695.db2.gz FTDJIPHJPMXKEY-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC(C)(C)c2cccc(F)c2)c1O ZINC000846144289 1050683855 /nfs/dbraw/zinc/68/38/55/1050683855.db2.gz KCRYPSBGMQAAPX-ZDUSSCGKSA-N 1 0 317.404 4.168 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cccc(OC)c2O)on1 ZINC000846143433 1050683999 /nfs/dbraw/zinc/68/39/99/1050683999.db2.gz BSMDRJGVZBSOEQ-LBPRGKRZSA-N 1 0 318.417 4.143 20 10 DICDRO C[C@H](COCC1CC1)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000846205435 1050685258 /nfs/dbraw/zinc/68/52/58/1050685258.db2.gz PMCBZBHKJFLURK-IAGOWNOFSA-N 1 0 316.489 4.143 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1O ZINC000846147089 1050685589 /nfs/dbraw/zinc/68/55/89/1050685589.db2.gz SMWPBCWOESSSSD-NSHDSACASA-N 1 0 320.458 4.006 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)c1O ZINC000846145205 1050686641 /nfs/dbraw/zinc/68/66/41/1050686641.db2.gz PBTNLQPOGNUIHW-AWEZNQCLSA-N 1 0 324.424 4.350 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000846189738 1050690248 /nfs/dbraw/zinc/69/02/48/1050690248.db2.gz RYZOKGLNFNHNNK-BPAFIMBUSA-N 1 0 313.441 4.038 20 10 DICDRO CC[C@H]([NH2+][C@H](C1CC1)C1CCOCC1)c1cc(Cl)ccc1O ZINC000846189884 1050691249 /nfs/dbraw/zinc/69/12/49/1050691249.db2.gz VQFFPDFIXGUSNB-FUHWJXTLSA-N 1 0 323.864 4.292 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C2CC2)C2CCOCC2)c1O ZINC000846187616 1050691299 /nfs/dbraw/zinc/69/12/99/1050691299.db2.gz LKZWRCQFVPNSIT-SJKOYZFVSA-N 1 0 323.864 4.210 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](O)c2ccc(Cl)cc2)c(O)c1 ZINC000788503573 1050694544 /nfs/dbraw/zinc/69/45/44/1050694544.db2.gz DIHYDGHWSJCPKV-GUYCJALGSA-N 1 0 319.832 4.047 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](O)c2ccc(Cl)cc2)c(O)c1 ZINC000788503569 1050694902 /nfs/dbraw/zinc/69/49/02/1050694902.db2.gz DIHYDGHWSJCPKV-CXAGYDPISA-N 1 0 319.832 4.047 20 10 DICDRO COc1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)cc1C ZINC000788532248 1050702908 /nfs/dbraw/zinc/70/29/08/1050702908.db2.gz PEMGINYICUKTEE-UHFFFAOYSA-N 1 0 311.759 4.225 20 10 DICDRO CC1(C)CC([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC000788578342 1050709659 /nfs/dbraw/zinc/70/96/59/1050709659.db2.gz SAVVWTMQAZKNFJ-UHFFFAOYSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCOc2ccc(F)cc2F)c(O)c1 ZINC000788614809 1050715712 /nfs/dbraw/zinc/71/57/12/1050715712.db2.gz XDGUDIULTAFXIL-CYBMUJFWSA-N 1 0 321.367 4.017 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2c(C)cc(C)cc2O)C12CCC2 ZINC000788615101 1050716550 /nfs/dbraw/zinc/71/65/50/1050716550.db2.gz UZRLHXILQICNQR-HYVNUMGLSA-N 1 0 303.446 4.007 20 10 DICDRO COc1ccccc1C[N@H+](Cc1cc(C)c(C)cc1O)C1CC1 ZINC000060112541 1050716853 /nfs/dbraw/zinc/71/68/53/1050716853.db2.gz CMLOSWJOKJMVFW-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C(C)C)[C@@H](O)c2ccccc2)c(O)c1 ZINC000788618551 1050719183 /nfs/dbraw/zinc/71/91/83/1050719183.db2.gz AUBFYOGDWXXJNX-YSSFQJQWSA-N 1 0 313.441 4.109 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCCO[C@H]2C(C)C)c(O)c1 ZINC000788661625 1050726763 /nfs/dbraw/zinc/72/67/63/1050726763.db2.gz BLUAZGRUOKAANY-FCEWJHQRSA-N 1 0 305.462 4.111 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c(F)c1 ZINC000788670515 1050728561 /nfs/dbraw/zinc/72/85/61/1050728561.db2.gz TWVSDFRUPJHSMV-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccc3[nH]ccc3c2)c(O)c1 ZINC000788816186 1050755069 /nfs/dbraw/zinc/75/50/69/1050755069.db2.gz QQDKPRNTVMJWMQ-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cc(Cl)ccc2O)c(C)c1 ZINC000788970346 1050766744 /nfs/dbraw/zinc/76/67/44/1050766744.db2.gz RABHOXQXODIUTO-UHFFFAOYSA-N 1 0 319.832 4.433 20 10 DICDRO CCOC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C(C)C ZINC000788985186 1050772374 /nfs/dbraw/zinc/77/23/74/1050772374.db2.gz ONTDWRUXBFGECY-FXAWDEMLSA-N 1 0 318.505 4.389 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)C1CCC(F)(F)CC1 ZINC000788989059 1050775051 /nfs/dbraw/zinc/77/50/51/1050775051.db2.gz UPVSGARIRFEAJS-LLVKDONJSA-N 1 0 320.474 4.429 20 10 DICDRO c1cc(N2CCSCC2)ccc1C[NH2+][C@@H]1CCC12CCCC2 ZINC000788978039 1050778091 /nfs/dbraw/zinc/77/80/91/1050778091.db2.gz MQCULRGDCXXRMY-GOSISDBHSA-N 1 0 316.514 4.052 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@@H]1CCc2cc(F)ccc2C1 ZINC001168410283 1050778925 /nfs/dbraw/zinc/77/89/25/1050778925.db2.gz BRNURGQTHMHQMR-HXUWFJFHSA-N 1 0 321.395 4.332 20 10 DICDRO CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)C1 ZINC000742367580 1050822563 /nfs/dbraw/zinc/82/25/63/1050822563.db2.gz ZBXPERFDWYFOAT-WMZOPIPTSA-N 1 0 318.530 4.298 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H](SC)C2)cc1F ZINC000742383767 1050827361 /nfs/dbraw/zinc/82/73/61/1050827361.db2.gz TXCHLXZLLDURHL-CABCVRRESA-N 1 0 310.482 4.046 20 10 DICDRO CCn1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c1 ZINC000789482009 1050837048 /nfs/dbraw/zinc/83/70/48/1050837048.db2.gz YGHJYDHUJJZVSH-UHFFFAOYSA-N 1 0 311.473 4.130 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2C[C@H]2C2CCCCC2)ccc1OC ZINC000742375427 1050837494 /nfs/dbraw/zinc/83/74/94/1050837494.db2.gz MYRVIGYNFKQCFM-RBUKOAKNSA-N 1 0 317.473 4.290 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2C[C@@H]2C2CCCCC2)ccc1OC ZINC000742375428 1050838356 /nfs/dbraw/zinc/83/83/56/1050838356.db2.gz MYRVIGYNFKQCFM-RTBURBONSA-N 1 0 317.473 4.290 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2OCCc3ccccc32)cc1 ZINC000772980473 1050881064 /nfs/dbraw/zinc/88/10/64/1050881064.db2.gz PFMXKHRQRINUAL-IERDGZPVSA-N 1 0 324.468 4.107 20 10 DICDRO C[C@H](COc1ccccc1)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000742723303 1050925049 /nfs/dbraw/zinc/92/50/49/1050925049.db2.gz IVEQKAGAQABBLN-GOSISDBHSA-N 1 0 324.468 4.234 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]CCCCCO)c(O)c(C(C)(C)C)c1 ZINC000790483427 1050962775 /nfs/dbraw/zinc/96/27/75/1050962775.db2.gz PCXWWPDCRJFHJH-UHFFFAOYSA-N 1 0 321.505 4.239 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCSC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000790496812 1050965141 /nfs/dbraw/zinc/96/51/41/1050965141.db2.gz OBBMFKPGRDKYIQ-GJZGRUSLSA-N 1 0 322.493 4.220 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)cc1 ZINC000790624444 1050983130 /nfs/dbraw/zinc/98/31/30/1050983130.db2.gz ZWSQXXINBDJAPO-UHFFFAOYSA-N 1 0 324.468 4.364 20 10 DICDRO C[C@@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1cc(Cl)ccc1O ZINC000790703699 1050986706 /nfs/dbraw/zinc/98/67/06/1050986706.db2.gz UEXDOVUORNEBAB-PXAZEXFGSA-N 1 0 311.853 4.028 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1cc(F)ccc1O ZINC000790714663 1050988209 /nfs/dbraw/zinc/98/82/09/1050988209.db2.gz GZVHMINCKKDQCX-ZFWWWQNUSA-N 1 0 307.409 4.064 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000282739229 1050990269 /nfs/dbraw/zinc/99/02/69/1050990269.db2.gz NAPALWCHFXQEEM-ZDUSSCGKSA-N 1 0 304.821 4.217 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1ccc(-c2cccc(F)c2F)o1 ZINC000790955584 1051009464 /nfs/dbraw/zinc/00/94/64/1051009464.db2.gz UPOZOJZITOLDLZ-UHFFFAOYSA-N 1 0 315.319 4.220 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2CCN(Cc3ccccc3)CC2)c1 ZINC000192743402 1051012168 /nfs/dbraw/zinc/01/21/68/1051012168.db2.gz MWZUHYDQUNCYRB-QGZVFWFLSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(F)c(F)c2)ccc1N(C)C ZINC000772999574 1051014066 /nfs/dbraw/zinc/01/40/66/1051014066.db2.gz MRMSCHNORWPAEF-ZDUSSCGKSA-N 1 0 304.384 4.190 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cc1 ZINC000772999524 1051015404 /nfs/dbraw/zinc/01/54/04/1051015404.db2.gz LTZZHGIQLJJFQR-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000773002628 1051017768 /nfs/dbraw/zinc/01/77/68/1051017768.db2.gz XKGROZBSCRCSHX-MRXNPFEDSA-N 1 0 312.457 4.229 20 10 DICDRO CC[C@H](O)CCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000773014697 1051022436 /nfs/dbraw/zinc/02/24/36/1051022436.db2.gz KAZKTJHQWKWOEH-WBVHZDCISA-N 1 0 322.468 4.018 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OCC3CC3)CC2)cc1C(C)C ZINC000743407266 1051025950 /nfs/dbraw/zinc/02/59/50/1051025950.db2.gz NVZQLGWCUMYHNF-UHFFFAOYSA-N 1 0 317.473 4.215 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(OC)cc2C)cc1 ZINC000773050406 1051039170 /nfs/dbraw/zinc/03/91/70/1051039170.db2.gz HSIBKDFWCANYBR-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO CC(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000773092881 1051057925 /nfs/dbraw/zinc/05/79/25/1051057925.db2.gz NOFJQHSUCMDINW-CABCVRRESA-N 1 0 324.896 4.262 20 10 DICDRO CC(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000773092889 1051058303 /nfs/dbraw/zinc/05/83/03/1051058303.db2.gz NOFJQHSUCMDINW-GJZGRUSLSA-N 1 0 324.896 4.262 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)c1cn[nH]c1 ZINC000773105521 1051062953 /nfs/dbraw/zinc/06/29/53/1051062953.db2.gz HQPLFOXYMFORKC-HZPDHXFCSA-N 1 0 312.461 4.202 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)ncn1 ZINC000773107002 1051065236 /nfs/dbraw/zinc/06/52/36/1051065236.db2.gz NQSGYPLQTMXRMM-KRWDZBQOSA-N 1 0 324.472 4.016 20 10 DICDRO Oc1cc2ccccc2cc1CNc1cc(OCC2CC2)cc[nH+]1 ZINC001171402195 1051089211 /nfs/dbraw/zinc/08/92/11/1051089211.db2.gz INBDKUXYGBKVQJ-UHFFFAOYSA-N 1 0 320.392 4.341 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2c(F)cccc2C1)c1ccc(N(C)C)cc1 ZINC001171406862 1051093493 /nfs/dbraw/zinc/09/34/93/1051093493.db2.gz GUJRAHBLCRFZAO-WMLDXEAASA-N 1 0 312.432 4.100 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(OC)ccc1O)c1cccc(Cl)c1 ZINC000036921197 1051101039 /nfs/dbraw/zinc/10/10/39/1051101039.db2.gz GSIVSKCSRXZHAF-MRXNPFEDSA-N 1 0 305.805 4.295 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000037107938 1051110893 /nfs/dbraw/zinc/11/08/93/1051110893.db2.gz JZXQDYJTEFOIBQ-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000037142049 1051113436 /nfs/dbraw/zinc/11/34/36/1051113436.db2.gz GPWTYVPGBBZKIX-JQWIXIFHSA-N 1 0 307.743 4.256 20 10 DICDRO CC(C)([NH2+]Cc1ccccc1O)c1ccc(Br)cc1 ZINC000037129024 1051113561 /nfs/dbraw/zinc/11/35/61/1051113561.db2.gz FKRYIRKXQUQYBW-UHFFFAOYSA-N 1 0 320.230 4.180 20 10 DICDRO COCC1(C)CC[NH+](Cc2cc(C)cc(C(C)(C)C)c2O)CC1 ZINC000773273001 1051123685 /nfs/dbraw/zinc/12/36/85/1051123685.db2.gz VBDQYDNUWITOPA-UHFFFAOYSA-N 1 0 319.489 4.247 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)c1O ZINC000792189346 1051124030 /nfs/dbraw/zinc/12/40/30/1051124030.db2.gz NDZZDOPCLRUYBO-ZDUSSCGKSA-N 1 0 301.352 4.111 20 10 DICDRO COC1(C[N@H+](Cc2ccccc2O)C2CCCC2)CCCC1 ZINC000792167609 1051124406 /nfs/dbraw/zinc/12/44/06/1051124406.db2.gz LNNWTOVLKKJKDJ-UHFFFAOYSA-N 1 0 303.446 4.096 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1Cl ZINC000037233621 1051129473 /nfs/dbraw/zinc/12/94/73/1051129473.db2.gz SWUSYYRFUXFTTG-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C2CC(OCc3ccccc3)C2)c1 ZINC000716283576 1051129562 /nfs/dbraw/zinc/12/95/62/1051129562.db2.gz FPDAHFVEDPAYSP-ZLPCBKJTSA-N 1 0 311.425 4.099 20 10 DICDRO CC[C@@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccccc1O ZINC000716284872 1051129641 /nfs/dbraw/zinc/12/96/41/1051129641.db2.gz LSDFUFZCURHJTR-FAFZWHIHSA-N 1 0 311.425 4.181 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c2C1)c1ccccc1O ZINC001171511975 1051157642 /nfs/dbraw/zinc/15/76/42/1051157642.db2.gz LVOPJQASVGTXES-CMPLNLGQSA-N 1 0 321.342 4.018 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H](C)Cc2ccccc2Cl)c(O)c1 ZINC001170259065 1051166396 /nfs/dbraw/zinc/16/63/96/1051166396.db2.gz AVUUKFVWJZJLEP-CQSZACIVSA-N 1 0 303.833 4.383 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Br)cc2O)cc1 ZINC000691412429 1051168591 /nfs/dbraw/zinc/16/85/91/1051168591.db2.gz BHMQUSDQBGHAEG-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)CCc2ccc(Cl)cc2)cc1 ZINC001168774046 1051174642 /nfs/dbraw/zinc/17/46/42/1051174642.db2.gz IJFYACQYVDTIQY-UHFFFAOYSA-N 1 0 302.849 4.081 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)cc1F ZINC001203250008 1051199277 /nfs/dbraw/zinc/19/92/77/1051199277.db2.gz YXWAHHNFYANMNH-HXUWFJFHSA-N 1 0 312.432 4.307 20 10 DICDRO Fc1cccc2c1C[C@H]([NH2+]Cc1ccc(N3CCCCC3)cc1)C2 ZINC001171772903 1051210210 /nfs/dbraw/zinc/21/02/10/1051210210.db2.gz GCECTJGXJKFZFM-GOSISDBHSA-N 1 0 324.443 4.073 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@H]1Cc2cccc(F)c2C1 ZINC001171806053 1051224508 /nfs/dbraw/zinc/22/45/08/1051224508.db2.gz XIAZYGLXOFQUQZ-IBGZPJMESA-N 1 0 324.443 4.025 20 10 DICDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000747099753 1051242627 /nfs/dbraw/zinc/24/26/27/1051242627.db2.gz KMKNTTMFFDFDKX-HZPDHXFCSA-N 1 0 312.457 4.043 20 10 DICDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000747099754 1051243219 /nfs/dbraw/zinc/24/32/19/1051243219.db2.gz KMKNTTMFFDFDKX-JKSUJKDBSA-N 1 0 312.457 4.043 20 10 DICDRO C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@@H](C2CC2)O1 ZINC000793214803 1051259833 /nfs/dbraw/zinc/25/98/33/1051259833.db2.gz RHKXYUZWZXHZCG-VFNWGFHPSA-N 1 0 323.436 4.059 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2ccccc2SC)c(O)c1 ZINC000793232777 1051266120 /nfs/dbraw/zinc/26/61/20/1051266120.db2.gz NLYWBFICBQOJEN-UHFFFAOYSA-N 1 0 317.454 4.145 20 10 DICDRO CCC[C@@H]([NH2+]Cc1cc(Cl)ccc1O)[C@H](O)c1ccccc1 ZINC000793241499 1051272132 /nfs/dbraw/zinc/27/21/32/1051272132.db2.gz PBZYWYUVODNEEI-SJLPKXTDSA-N 1 0 319.832 4.038 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cnccc2C)cc1F ZINC000793338133 1051285529 /nfs/dbraw/zinc/28/55/29/1051285529.db2.gz CFIAKBRXRROOKN-UHFFFAOYSA-N 1 0 315.436 4.007 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000793351509 1051291862 /nfs/dbraw/zinc/29/18/62/1051291862.db2.gz JBAPJHQUUFJPSZ-DYVFJYSZSA-N 1 0 303.352 4.096 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)[C@H](C)c2ccc(Cl)cc2)c(O)c1 ZINC000793386535 1051294898 /nfs/dbraw/zinc/29/48/98/1051294898.db2.gz VRUQBMVAUWZOQV-QWHCGFSZSA-N 1 0 319.832 4.336 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC000746047708 1051310762 /nfs/dbraw/zinc/31/07/62/1051310762.db2.gz PYQOWXFHATUIJS-ZDUSSCGKSA-N 1 0 304.384 4.190 20 10 DICDRO CC[C@H](C)OCC[C@@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001172345333 1051364686 /nfs/dbraw/zinc/36/46/86/1051364686.db2.gz WOPMNRIPTJPSGN-CABCVRRESA-N 1 0 301.430 4.229 20 10 DICDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766360791 1051409314 /nfs/dbraw/zinc/40/93/14/1051409314.db2.gz NXFBWJJMDXCLOH-ZIFCJYIRSA-N 1 0 318.505 4.125 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)C ZINC000766364847 1051409442 /nfs/dbraw/zinc/40/94/42/1051409442.db2.gz BHNUGRORKUXNGH-BEFAXECRSA-N 1 0 322.468 4.138 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)C ZINC000766364878 1051409897 /nfs/dbraw/zinc/40/98/97/1051409897.db2.gz BHNUGRORKUXNGH-KXBFYZLASA-N 1 0 322.468 4.138 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCSC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766447719 1051421761 /nfs/dbraw/zinc/42/17/61/1051421761.db2.gz ZZELDBVNYDULDJ-ZBFHGGJFSA-N 1 0 322.493 4.362 20 10 DICDRO C[C@@H]([NH2+]CCC(F)(F)F)c1ccc(N2CCCCC2)c(F)c1 ZINC000766529261 1051468642 /nfs/dbraw/zinc/46/86/42/1051468642.db2.gz OGOIXEPPILIVLK-GFCCVEGCSA-N 1 0 318.358 4.419 20 10 DICDRO C[C@@H]([NH2+]C[C@]1(C)CCCO1)c1ccc(N2CCCCCC2)cc1 ZINC000766561784 1051485278 /nfs/dbraw/zinc/48/52/78/1051485278.db2.gz XMXNIKIFIIXHLK-XLIONFOSSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCS1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766566809 1051495287 /nfs/dbraw/zinc/49/52/87/1051495287.db2.gz GUCOOQRZMPCDFG-GDBMZVCRSA-N 1 0 322.493 4.362 20 10 DICDRO Cc1ccc2c(c1)C[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CC2 ZINC001172825912 1051515963 /nfs/dbraw/zinc/51/59/63/1051515963.db2.gz LQQKGWBAYOPEFK-OAQYLSRUSA-N 1 0 320.480 4.242 20 10 DICDRO C[C@@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H](C)c1ccccc1O ZINC001172855799 1051541217 /nfs/dbraw/zinc/54/12/17/1051541217.db2.gz HHSIOLDVUBFURO-RYUDHWBXSA-N 1 0 307.796 4.467 20 10 DICDRO C[C@@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001168456643 1051592475 /nfs/dbraw/zinc/59/24/75/1051592475.db2.gz UOCPVTCEEOUJAV-INIZCTEOSA-N 1 0 312.432 4.147 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)Cc1ccsc1 ZINC001169603664 1051654211 /nfs/dbraw/zinc/65/42/11/1051654211.db2.gz CPIPNJGKFFZESJ-HNNXBMFYSA-N 1 0 302.487 4.267 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(OC)c(C)c2)C1(CC)CC ZINC001169582005 1051655798 /nfs/dbraw/zinc/65/57/98/1051655798.db2.gz NPIUVJHMFPDFJY-QZTJIDSGSA-N 1 0 305.462 4.077 20 10 DICDRO CNc1cc(Nc2ccc(Cc3ccc(N)cc3)cc2)cc[nH+]1 ZINC001216337503 1051706257 /nfs/dbraw/zinc/70/62/57/1051706257.db2.gz DAQOSABDJHJYRP-UHFFFAOYSA-N 1 0 304.397 4.040 20 10 DICDRO CC[C@@H]1CC[C@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000806141091 1051749020 /nfs/dbraw/zinc/74/90/20/1051749020.db2.gz FZRLXIGEKZAWRD-JKIFEVAISA-N 1 0 324.415 4.035 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H]2CCCc3sccc32)c(O)c1 ZINC000767190438 1051771704 /nfs/dbraw/zinc/77/17/04/1051771704.db2.gz MWGAIDUVDGNLLQ-OAHLLOKOSA-N 1 0 303.427 4.020 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCSC1)c1ccc(N2CCCCC2)cc1 ZINC000806178363 1051772232 /nfs/dbraw/zinc/77/22/32/1051772232.db2.gz FTDCOSNAXOSSOF-IRXDYDNUSA-N 1 0 318.530 4.471 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(F)c(C)c2)cc1 ZINC000806688091 1051842464 /nfs/dbraw/zinc/84/24/64/1051842464.db2.gz RIDWHLPBSGELNG-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO C[C@H](Cc1cccc(F)c1)[NH2+]Cc1cc2ccccc2cc1O ZINC001168465306 1051884686 /nfs/dbraw/zinc/88/46/86/1051884686.db2.gz QRKKEOJZAGKZNE-CQSZACIVSA-N 1 0 309.384 4.405 20 10 DICDRO CC[N@H+](Cc1cnc(C(C)C)s1)Cc1ccc(N(C)C)cc1 ZINC000768131996 1051886650 /nfs/dbraw/zinc/88/66/50/1051886650.db2.gz FTMYGQZYAHHFQB-UHFFFAOYSA-N 1 0 317.502 4.355 20 10 DICDRO Oc1cccc(C[N@H+](Cc2ccccc2O)C2CCCCC2)c1 ZINC000768134015 1051887276 /nfs/dbraw/zinc/88/72/76/1051887276.db2.gz NXVXVGGBYJAQLD-UHFFFAOYSA-N 1 0 311.425 4.433 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cnc2ccccc2c1 ZINC000768134295 1051887360 /nfs/dbraw/zinc/88/73/60/1051887360.db2.gz RUVGDFYLFFZYAY-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)cc1 ZINC000768139206 1051887504 /nfs/dbraw/zinc/88/75/04/1051887504.db2.gz XNNFESSHJIGGQJ-HXUWFJFHSA-N 1 0 309.457 4.265 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCCC[C@H]2c2ccncc2)cc1 ZINC000768139203 1051889177 /nfs/dbraw/zinc/88/91/77/1051889177.db2.gz XNNFESSHJIGGQJ-FQEVSTJZSA-N 1 0 309.457 4.265 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(O)c1 ZINC000768225546 1051904556 /nfs/dbraw/zinc/90/45/56/1051904556.db2.gz HWAZAMLSVCTCEP-SFHVURJKSA-N 1 0 315.388 4.267 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(O)c1 ZINC000768225545 1051904634 /nfs/dbraw/zinc/90/46/34/1051904634.db2.gz HWAZAMLSVCTCEP-GOSISDBHSA-N 1 0 315.388 4.267 20 10 DICDRO COc1cccc(O)c1C[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000768240349 1051905086 /nfs/dbraw/zinc/90/50/86/1051905086.db2.gz VEJXBTFCWZOFAR-ZDUSSCGKSA-N 1 0 311.381 4.340 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000768227678 1051906401 /nfs/dbraw/zinc/90/64/01/1051906401.db2.gz UZOISPHJURSHSF-SFHVURJKSA-N 1 0 315.388 4.267 20 10 DICDRO CCOc1ccc(C[N@H+](Cc2cccc(F)c2)C2CC2)c(O)c1 ZINC000768256913 1051909580 /nfs/dbraw/zinc/90/95/80/1051909580.db2.gz GDJZURUFEHUPJO-UHFFFAOYSA-N 1 0 315.388 4.095 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1O ZINC000768319533 1051916389 /nfs/dbraw/zinc/91/63/89/1051916389.db2.gz PLKFGNZLAJRINE-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO CC(C)[N@H+](Cc1[nH]nc2ccccc21)Cc1ccc(N(C)C)cc1 ZINC000768353411 1051920623 /nfs/dbraw/zinc/92/06/23/1051920623.db2.gz UCCCJKPGRXRECE-UHFFFAOYSA-N 1 0 322.456 4.040 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c1O ZINC000768316372 1051921203 /nfs/dbraw/zinc/92/12/03/1051921203.db2.gz DAJYFHHPFNMKIA-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1c(O)cccc1OC ZINC000768342110 1051921232 /nfs/dbraw/zinc/92/12/32/1051921232.db2.gz OYWQQOPYGNLRSW-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)o1 ZINC000768541542 1051943208 /nfs/dbraw/zinc/94/32/08/1051943208.db2.gz PFCUFCWYZHRYCC-HNNXBMFYSA-N 1 0 321.804 4.122 20 10 DICDRO COCC[N@H+](Cc1cc(C)c(C)cc1O)[C@H](C)c1ccccc1 ZINC000768598482 1051947386 /nfs/dbraw/zinc/94/73/86/1051947386.db2.gz ZBFVIPWSRIGQDY-QGZVFWFLSA-N 1 0 313.441 4.219 20 10 DICDRO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(C(C)C)c(C)cc2O)no1 ZINC000747448592 1051971422 /nfs/dbraw/zinc/97/14/22/1051971422.db2.gz IGPOGZWNROVHMZ-GOSISDBHSA-N 1 0 314.429 4.458 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]2c2cc(C)no2)cc1 ZINC000768879786 1051976318 /nfs/dbraw/zinc/97/63/18/1051976318.db2.gz XQQBDIGAWPBWEE-GOSISDBHSA-N 1 0 313.445 4.166 20 10 DICDRO CCOc1ccc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c(O)c1 ZINC000769101323 1051996360 /nfs/dbraw/zinc/99/63/60/1051996360.db2.gz COLHWMTXMDNWLP-ZDUSSCGKSA-N 1 0 301.386 4.110 20 10 DICDRO Cc1cc(O)c(C[N@@H+](Cc2cccc(O)c2)CC2CC2)cc1C ZINC000769192520 1052004075 /nfs/dbraw/zinc/00/40/75/1052004075.db2.gz MHFSPZIFXQAJBK-UHFFFAOYSA-N 1 0 311.425 4.127 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1c(O)cccc1Cl ZINC000769200572 1052007262 /nfs/dbraw/zinc/00/72/62/1052007262.db2.gz AEDSQXXLMQMZNA-UHFFFAOYSA-N 1 0 305.805 4.163 20 10 DICDRO Cc1ccc(C)n1C1CC[NH+](Cc2cc(C)c(C)cc2O)CC1 ZINC000769207938 1052009908 /nfs/dbraw/zinc/00/99/08/1052009908.db2.gz FFYSPPHHSOWMOQ-UHFFFAOYSA-N 1 0 312.457 4.264 20 10 DICDRO COc1ccc([C@H]2CC[N@H+](Cc3cc(Cl)ccc3O)C2)cc1 ZINC000769246229 1052013593 /nfs/dbraw/zinc/01/35/93/1052013593.db2.gz XYMSIPVUOYNGBL-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1O)c1ccc(Oc2cccnc2)cc1 ZINC000808436118 1052021138 /nfs/dbraw/zinc/02/11/38/1052021138.db2.gz NDNAUQUJPQWWNT-HNNXBMFYSA-N 1 0 320.392 4.430 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1CCCSC1 ZINC000808431256 1052030845 /nfs/dbraw/zinc/03/08/45/1052030845.db2.gz YCQGLNNVZKEWKW-OAHLLOKOSA-N 1 0 313.466 4.292 20 10 DICDRO Oc1ccc2ccccc2c1C[N@H+](Cc1cn[nH]c1)C1CCCC1 ZINC000769384272 1052036539 /nfs/dbraw/zinc/03/65/39/1052036539.db2.gz NBLDOCYWGKZTLK-UHFFFAOYSA-N 1 0 321.424 4.213 20 10 DICDRO COc1ccc(C[N@H+](Cc2ccccc2O)C2CCCC2)cc1 ZINC000769389203 1052039138 /nfs/dbraw/zinc/03/91/38/1052039138.db2.gz NVZLMAJFTSDPEB-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1O ZINC000769405429 1052041015 /nfs/dbraw/zinc/04/10/15/1052041015.db2.gz VQFAPLGJYTVWGM-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO CCOc1cccc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)c1O ZINC000769445439 1052054688 /nfs/dbraw/zinc/05/46/88/1052054688.db2.gz IICNASNWFUNPHN-YJBOKZPZSA-N 1 0 311.425 4.169 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CCC(C(F)F)CC2)cc1F ZINC000769446391 1052055223 /nfs/dbraw/zinc/05/52/23/1052055223.db2.gz NZSOYLUKPKBFQG-UHFFFAOYSA-N 1 0 314.395 4.149 20 10 DICDRO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000769446323 1052055419 /nfs/dbraw/zinc/05/54/19/1052055419.db2.gz NFOGIQMGJNUOMU-CVEARBPZSA-N 1 0 304.503 4.003 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)c1O ZINC000769456092 1052059016 /nfs/dbraw/zinc/05/90/16/1052059016.db2.gz HHDCAVPMTCOCOK-CXAGYDPISA-N 1 0 315.388 4.123 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)c1O ZINC000769492984 1052066440 /nfs/dbraw/zinc/06/64/40/1052066440.db2.gz PPABMLDNFXRVKN-MAUKXSAKSA-N 1 0 311.425 4.026 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CCC1 ZINC000808703321 1052067009 /nfs/dbraw/zinc/06/70/09/1052067009.db2.gz WPUCYGJZCQSKDD-CYBMUJFWSA-N 1 0 311.853 4.211 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)CO2 ZINC000808706676 1052068250 /nfs/dbraw/zinc/06/82/50/1052068250.db2.gz QTLAXGWQDPYUJV-LRDDRELGSA-N 1 0 317.816 4.447 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808703806 1052069528 /nfs/dbraw/zinc/06/95/28/1052069528.db2.gz XIWMVWGHFFGVDB-OLZOCXBDSA-N 1 0 304.821 4.469 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccc(Cl)cn2)c1O ZINC000808710283 1052071030 /nfs/dbraw/zinc/07/10/30/1052071030.db2.gz OTCKQUDQTWSONW-JTQLQIEISA-N 1 0 311.212 4.253 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000808708152 1052071428 /nfs/dbraw/zinc/07/14/28/1052071428.db2.gz INROUBBYODDZBT-CYBMUJFWSA-N 1 0 311.853 4.211 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)c1O ZINC000769526435 1052075887 /nfs/dbraw/zinc/07/58/87/1052075887.db2.gz LOAADCBHEYACKN-GOEBONIOSA-N 1 0 315.413 4.357 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c1O ZINC000808716938 1052075976 /nfs/dbraw/zinc/07/59/76/1052075976.db2.gz AADWMGOSFCSSGY-XJKSGUPXSA-N 1 0 323.864 4.354 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)[C@@H](O)c1ccccc1 ZINC000808720365 1052078856 /nfs/dbraw/zinc/07/88/56/1052078856.db2.gz UDZLIBHRFCVCGW-BXTJHSDWSA-N 1 0 321.420 4.318 20 10 DICDRO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000769538797 1052079362 /nfs/dbraw/zinc/07/93/62/1052079362.db2.gz WQVSWYYWBFZEKF-MRXNPFEDSA-N 1 0 304.821 4.111 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccccc1)c1cc(Cl)ccc1O ZINC000808720834 1052079528 /nfs/dbraw/zinc/07/95/28/1052079528.db2.gz ZMBMHSQNSDLYLC-ULFGMLNVSA-N 1 0 319.832 4.208 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2COc3ccccc32)c1O ZINC000808728644 1052083314 /nfs/dbraw/zinc/08/33/14/1052083314.db2.gz UAQXSWKLXAYARN-STQMWFEESA-N 1 0 317.816 4.181 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2COc3ccccc32)c1O ZINC000808728643 1052083405 /nfs/dbraw/zinc/08/34/05/1052083405.db2.gz UAQXSWKLXAYARN-QWHCGFSZSA-N 1 0 317.816 4.181 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[C@H](c3ccccc3)O2)c(O)c1 ZINC000808728039 1052084494 /nfs/dbraw/zinc/08/44/94/1052084494.db2.gz NLRYMCAQSTXHLA-WRWLIDTKSA-N 1 0 311.425 4.272 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1COc2ccccc21)c1cc(Cl)ccc1O ZINC000808727257 1052084980 /nfs/dbraw/zinc/08/49/80/1052084980.db2.gz FTXFXPGJBOSBLF-BLLLJJGKSA-N 1 0 317.816 4.263 20 10 DICDRO CCC[N@H+](Cc1ccc(C(F)(F)F)cn1)Cc1ccccc1O ZINC000769726705 1052099314 /nfs/dbraw/zinc/09/93/14/1052099314.db2.gz AJJKRIAHGPTORF-UHFFFAOYSA-N 1 0 324.346 4.218 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000769915252 1052120310 /nfs/dbraw/zinc/12/03/10/1052120310.db2.gz ZYERRXZPMDOAKN-UHFFFAOYSA-N 1 0 314.498 4.463 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1OC1CC2(C1)CC[NH2+]C2 ZINC001218060358 1052191270 /nfs/dbraw/zinc/19/12/70/1052191270.db2.gz JLKCSGHVBHUNEO-QURGRASLSA-N 1 0 323.396 4.329 20 10 DICDRO C[C@@H]1C[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)CC[NH2+]1 ZINC001218056840 1052191408 /nfs/dbraw/zinc/19/14/08/1052191408.db2.gz POUMOZZZJMVQGI-XZQSZFKWSA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(OC2CC3(C2)CC[NH2+]C3)=C1 ZINC001218063225 1052191894 /nfs/dbraw/zinc/19/18/94/1052191894.db2.gz IVCOMPHKVFOLDC-QURGRASLSA-N 1 0 323.396 4.329 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@@H]3CC[NH2+][C@H]4CCO[C@@H]43)cc2)cc1 ZINC001218165622 1052202268 /nfs/dbraw/zinc/20/22/68/1052202268.db2.gz VTXWMMKDTYCCOY-ZZGUXWCQSA-N 1 0 323.396 4.000 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001218185131 1052203285 /nfs/dbraw/zinc/20/32/85/1052203285.db2.gz VHPKIIVKSMJJLA-RYMDOBDFSA-N 1 0 323.396 4.469 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@H]1CC[NH2+]C1 ZINC001218181295 1052203334 /nfs/dbraw/zinc/20/33/34/1052203334.db2.gz BAPLDKCQJGKAPV-KRWDZBQOSA-N 1 0 310.401 4.190 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1C[C@H]2CC[NH2+][C@H]2C1 ZINC001218253126 1052213219 /nfs/dbraw/zinc/21/32/19/1052213219.db2.gz WWBDZUKFDXCXTO-VWIRZYSMSA-N 1 0 323.396 4.327 20 10 DICDRO Cc1ccc(O[C@@H]2C[C@@H]3C[NH2+]C[C@@H]23)c(/N=N/c2ccccc2)c1 ZINC001218329831 1052225559 /nfs/dbraw/zinc/22/55/59/1052225559.db2.gz GUVSPKFBELMPNM-YKDSUUFTSA-N 1 0 307.397 4.397 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@H]1C=CC[NH2+]C1 ZINC001218334253 1052227421 /nfs/dbraw/zinc/22/74/21/1052227421.db2.gz MRIYAEVJWOHKCK-SFHVURJKSA-N 1 0 322.412 4.356 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@H]3C[NH2+]CCC34CC4)cc2)C=C1 ZINC001218401169 1052234175 /nfs/dbraw/zinc/23/41/75/1052234175.db2.gz AHIMATJWLPFIGI-SFHVURJKSA-N 1 0 323.396 4.329 20 10 DICDRO C[C@@H]1CC[C@@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C[NH2+]1 ZINC001218400331 1052235031 /nfs/dbraw/zinc/23/50/31/1052235031.db2.gz DIDCMHZNHOPXPM-APQGHPQYSA-N 1 0 311.385 4.327 20 10 DICDRO C[C@@H]1C[NH2+]CC[C@@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218412429 1052235581 /nfs/dbraw/zinc/23/55/81/1052235581.db2.gz FMSPCXGUYMZSMZ-XWEZPQROSA-N 1 0 311.385 4.184 20 10 DICDRO C[C@H]1C[NH2+]CC[C@@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218412422 1052235828 /nfs/dbraw/zinc/23/58/28/1052235828.db2.gz FMSPCXGUYMZSMZ-JCNVQDTGSA-N 1 0 311.385 4.184 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)=C1 ZINC001218479969 1052246598 /nfs/dbraw/zinc/24/65/98/1052246598.db2.gz UWLIDHYQOBFGTC-YQOLHGENSA-N 1 0 309.369 4.079 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1O ZINC000153544452 1052382103 /nfs/dbraw/zinc/38/21/03/1052382103.db2.gz QZLIUZGUKKEQRS-OAHLLOKOSA-N 1 0 303.427 4.190 20 10 DICDRO Cc1noc(C)c1[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000317676676 1052393373 /nfs/dbraw/zinc/39/33/73/1052393373.db2.gz PDHVYZXMDQRDDJ-SUNKGSAMSA-N 1 0 300.402 4.205 20 10 DICDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000317676674 1052393425 /nfs/dbraw/zinc/39/34/25/1052393425.db2.gz PDHVYZXMDQRDDJ-JTNHKYCSSA-N 1 0 300.402 4.205 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)c1O ZINC000237229725 1052437757 /nfs/dbraw/zinc/43/77/57/1052437757.db2.gz GQQURLOYIQVMMI-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(C)nc2)c(C)n1-c1cccc(C)c1 ZINC000915683156 1052468009 /nfs/dbraw/zinc/46/80/09/1052468009.db2.gz MRIGHLGYHVZQGK-UHFFFAOYSA-N 1 0 319.452 4.396 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC000763394330 1052623892 /nfs/dbraw/zinc/62/38/92/1052623892.db2.gz BYRDWKMLTDSYNU-IBGZPJMESA-N 1 0 314.860 4.492 20 10 DICDRO CC(C)[N@H+](Cc1nc2ccccc2o1)Cc1ccc(N(C)C)cc1 ZINC000917074826 1052690847 /nfs/dbraw/zinc/69/08/47/1052690847.db2.gz HHGUGVTWLUJPRT-UHFFFAOYSA-N 1 0 323.440 4.304 20 10 DICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC1(Cl)Cl ZINC000917075519 1052691115 /nfs/dbraw/zinc/69/11/15/1052691115.db2.gz YJBCNQRPWWXETN-CQSZACIVSA-N 1 0 315.288 4.157 20 10 DICDRO COc1ccc(C)cc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074311 1052691377 /nfs/dbraw/zinc/69/13/77/1052691377.db2.gz WZEZUOJWFTUSPX-UHFFFAOYSA-N 1 0 324.468 4.234 20 10 DICDRO CC[N@H+](Cc1ccccc1C)Cc1c(O)ccc2ccncc21 ZINC000917436073 1052727213 /nfs/dbraw/zinc/72/72/13/1052727213.db2.gz DUHLHYWCINECSS-UHFFFAOYSA-N 1 0 306.409 4.271 20 10 DICDRO Cc1cc(C[N@@H+]2CCO[C@H]3CCCC[C@H]32)c(O)c(C(C)(C)C)c1 ZINC000917473595 1052729378 /nfs/dbraw/zinc/72/93/78/1052729378.db2.gz QYVYJKPHTNGGMH-MSOLQXFVSA-N 1 0 317.473 4.142 20 10 DICDRO COc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)cc1 ZINC000154725753 1052797804 /nfs/dbraw/zinc/79/78/04/1052797804.db2.gz GVXLREPLZDXYGL-UHFFFAOYSA-N 1 0 323.392 4.196 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+]C(C)(C)c2cccc(C)c2)c1O ZINC000179597586 1053017493 /nfs/dbraw/zinc/01/74/93/1053017493.db2.gz HZJAQGGSVIUAIU-UHFFFAOYSA-N 1 0 315.388 4.067 20 10 DICDRO Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1ccccc1O ZINC000179583463 1053017516 /nfs/dbraw/zinc/01/75/16/1053017516.db2.gz BULFQUDRLYBENX-ZDUSSCGKSA-N 1 0 304.459 4.474 20 10 DICDRO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(N3CCCC3)cc2)o1 ZINC001318339329 1053161914 /nfs/dbraw/zinc/16/19/14/1053161914.db2.gz NNHKMVSUZCNZAJ-HNAYVOBHSA-N 1 0 310.441 4.293 20 10 DICDRO c1ccc(C[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C2CC2)cc1 ZINC001318618200 1053177801 /nfs/dbraw/zinc/17/78/01/1053177801.db2.gz RKJHORGOVXHTEW-QFIPXVFZSA-N 1 0 320.480 4.398 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3c(c2)CCC3)cc1 ZINC001318867050 1053200115 /nfs/dbraw/zinc/20/01/15/1053200115.db2.gz UMRDLEJFPSDXHZ-UHFFFAOYSA-N 1 0 308.469 4.311 20 10 DICDRO CCCC[N@H+](Cc1ccnc(Cl)c1)Cc1ccccc1O ZINC000801595811 1053258295 /nfs/dbraw/zinc/25/82/95/1053258295.db2.gz JMAIGCPPALPYKG-UHFFFAOYSA-N 1 0 304.821 4.243 20 10 DICDRO C[C@H]([NH2+]CCC1CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC001319767348 1053272033 /nfs/dbraw/zinc/27/20/33/1053272033.db2.gz VXGJGIJOERDRRA-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO CS[C@@H]1CCCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001319841774 1053279930 /nfs/dbraw/zinc/27/99/30/1053279930.db2.gz WBDSOUKFUKZARR-GOSISDBHSA-N 1 0 304.503 4.004 20 10 DICDRO COc1ccccc1C1([NH2+]Cc2cc(C)c(C)cc2O)CCC1 ZINC001319951010 1053289122 /nfs/dbraw/zinc/28/91/22/1053289122.db2.gz HDUREBYNDDRSHO-UHFFFAOYSA-N 1 0 311.425 4.187 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CCOc2ccccc21 ZINC001320118664 1053307836 /nfs/dbraw/zinc/30/78/36/1053307836.db2.gz OQYTUQFMHVAGLS-INMHGKMJSA-N 1 0 323.436 4.405 20 10 DICDRO COc1ccc(Cl)cc1CC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC001320129030 1053308025 /nfs/dbraw/zinc/30/80/25/1053308025.db2.gz ADJROHNRGWUGGG-NSHDSACASA-N 1 0 323.795 4.087 20 10 DICDRO Cc1nc(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)sc1C ZINC001320249347 1053318228 /nfs/dbraw/zinc/31/82/28/1053318228.db2.gz YENDCERPGMVGLD-BXUZGUMPSA-N 1 0 316.470 4.155 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001320246806 1053318346 /nfs/dbraw/zinc/31/83/46/1053318346.db2.gz PROJJTVWBROXBC-GOEBONIOSA-N 1 0 311.425 4.356 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001320246805 1053318404 /nfs/dbraw/zinc/31/84/04/1053318404.db2.gz PROJJTVWBROXBC-GDBMZVCRSA-N 1 0 311.425 4.356 20 10 DICDRO CCOCCC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC001320253757 1053320197 /nfs/dbraw/zinc/32/01/97/1053320197.db2.gz ZUAFNXKFAWOIMP-HZPDHXFCSA-N 1 0 317.473 4.435 20 10 DICDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001320293397 1053323315 /nfs/dbraw/zinc/32/33/15/1053323315.db2.gz XJDCVWSFIDXZSO-CQSZACIVSA-N 1 0 300.368 4.107 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCCc2nc(C)ncc21 ZINC001320410976 1053330759 /nfs/dbraw/zinc/33/07/59/1053330759.db2.gz JFWWYYCJWRCWRA-DQYPLSBCSA-N 1 0 323.440 4.015 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC001320425064 1053332621 /nfs/dbraw/zinc/33/26/21/1053332621.db2.gz SLSKXWGGSSOUON-YRGRVCCFSA-N 1 0 316.470 4.407 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCCc2nc(C)ncc21 ZINC001320410977 1053332712 /nfs/dbraw/zinc/33/27/12/1053332712.db2.gz JFWWYYCJWRCWRA-OAUYIBNBSA-N 1 0 323.440 4.015 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc2c(c1)COC2 ZINC001320424391 1053332785 /nfs/dbraw/zinc/33/27/85/1053332785.db2.gz JTZHKXXDUMOPGM-DYVFJYSZSA-N 1 0 309.409 4.069 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCSCC(F)(F)F ZINC001320423830 1053332797 /nfs/dbraw/zinc/33/27/97/1053332797.db2.gz CGFIMCNXMDQOIS-WDEREUQCSA-N 1 0 319.392 4.134 20 10 DICDRO COc1ccccc1C1([NH2+][C@H](C)c2cc(C)ccc2O)CCC1 ZINC001320424653 1053332829 /nfs/dbraw/zinc/33/28/29/1053332829.db2.gz NONHCQRKFJAVGW-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO COCCC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC001320411542 1053333160 /nfs/dbraw/zinc/33/31/60/1053333160.db2.gz PPFXZDHWTJARKE-CABCVRRESA-N 1 0 303.446 4.045 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc2c(c1)COC2 ZINC001320424390 1053333892 /nfs/dbraw/zinc/33/38/92/1053333892.db2.gz JTZHKXXDUMOPGM-CXAGYDPISA-N 1 0 309.409 4.069 20 10 DICDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001200067353 1053347734 /nfs/dbraw/zinc/34/77/34/1053347734.db2.gz FNPYPUCDFZDDCO-OAQYLSRUSA-N 1 0 306.453 4.372 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000775648395 1053353574 /nfs/dbraw/zinc/35/35/74/1053353574.db2.gz HFAPMZUFMARHBV-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO CCOC1CC(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)C1 ZINC001320793845 1053361939 /nfs/dbraw/zinc/36/19/39/1053361939.db2.gz ZRIUVXZSQVOZOI-SLTXQBBLSA-N 1 0 303.446 4.044 20 10 DICDRO CC1(C)CC[N@H+](Cc2ccc(N3CCCC3)cc2)CCS1 ZINC001320960654 1053377806 /nfs/dbraw/zinc/37/78/06/1053377806.db2.gz HYRZIHYIMMZAHI-UHFFFAOYSA-N 1 0 304.503 4.004 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCc1ccc2c(c1)CCO2 ZINC001321017861 1053382739 /nfs/dbraw/zinc/38/27/39/1053382739.db2.gz SSRLLCPGKZGNBZ-RHSMWYFYSA-N 1 0 323.436 4.016 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCOc1ccccc1F ZINC001321024775 1053383065 /nfs/dbraw/zinc/38/30/65/1053383065.db2.gz VNKJLUDMNZMBLI-HIFRSBDPSA-N 1 0 315.388 4.057 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCC2)c1cc(Cl)ccc1O ZINC001321022759 1053383212 /nfs/dbraw/zinc/38/32/12/1053383212.db2.gz IDKYAWOEDMIDCM-LBPRGKRZSA-N 1 0 301.817 4.385 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccc(F)cc1 ZINC000182323326 1053413101 /nfs/dbraw/zinc/41/31/01/1053413101.db2.gz HWMNUJMBNSHNLR-SJCJKPOMSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1cccc(CCC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC001321859184 1053438547 /nfs/dbraw/zinc/43/85/47/1053438547.db2.gz VUYXGRCAVXBVBV-WMLDXEAASA-N 1 0 310.441 4.175 20 10 DICDRO CC[C@@](C)([NH2+]Cc1ccc(N2CCCC2)cc1)c1nccs1 ZINC001322012357 1053446164 /nfs/dbraw/zinc/44/61/64/1053446164.db2.gz JVYXHWMCXHSTSI-GOSISDBHSA-N 1 0 315.486 4.158 20 10 DICDRO CC[C@](C)([NH2+]Cc1ccc(N2CCCC2)cc1)c1nccs1 ZINC001322012358 1053446949 /nfs/dbraw/zinc/44/69/49/1053446949.db2.gz JVYXHWMCXHSTSI-SFHVURJKSA-N 1 0 315.486 4.158 20 10 DICDRO C[C@H]1CC[N@H+](Cc2c(O)ccc(F)c2Cl)CCC1(F)F ZINC001237121834 1053463918 /nfs/dbraw/zinc/46/39/18/1053463918.db2.gz PTVXFEFZEXZASF-VIFPVBQESA-N 1 0 307.743 4.052 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C)c1c(F)cncc1F ZINC001322453026 1053506163 /nfs/dbraw/zinc/50/61/63/1053506163.db2.gz USQPVSRMPNGRCW-SUNKGSAMSA-N 1 0 318.367 4.273 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001322715000 1053538719 /nfs/dbraw/zinc/53/87/19/1053538719.db2.gz BIZDRTKMPUVTGK-LSDHHAIUSA-N 1 0 305.462 4.291 20 10 DICDRO Cc1cc(C)cc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001323117340 1053565549 /nfs/dbraw/zinc/56/55/49/1053565549.db2.gz OQGGWMWMIUTZOF-UHFFFAOYSA-N 1 0 308.469 4.236 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCc3ccc(F)cc32)cc1 ZINC001200334176 1053567703 /nfs/dbraw/zinc/56/77/03/1053567703.db2.gz QYVWXTCAHQHZJO-HXUWFJFHSA-N 1 0 312.432 4.449 20 10 DICDRO CC[N@H+](CCC(F)(F)F)Cc1ccc(N2CCCC2)cc1 ZINC001323302069 1053572482 /nfs/dbraw/zinc/57/24/82/1053572482.db2.gz AXAPQRFIRMTJGV-UHFFFAOYSA-N 1 0 300.368 4.061 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1 ZINC001323829232 1053604083 /nfs/dbraw/zinc/60/40/83/1053604083.db2.gz IOZKCBPPGVMTHY-AIANPOQGSA-N 1 0 317.473 4.432 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC(C)(C)OC1(C)C ZINC001323829247 1053604121 /nfs/dbraw/zinc/60/41/21/1053604121.db2.gz IVTGPRJMPDDTHK-VNHYZAJKSA-N 1 0 303.446 4.185 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc(Cl)c1C ZINC001200379523 1053610259 /nfs/dbraw/zinc/61/02/59/1053610259.db2.gz WAUNZZRGPMRTCB-UHFFFAOYSA-N 1 0 302.849 4.313 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCC2)cc1)[C@@H]1CCOC(C)(C)C1 ZINC001323937029 1053611858 /nfs/dbraw/zinc/61/18/58/1053611858.db2.gz ZQORAUBAGFETHF-LJQANCHMSA-N 1 0 316.489 4.066 20 10 DICDRO CC[C@H]([NH2+]CCc1cc(Cl)ccc1OC)c1ccccc1O ZINC001324135945 1053628727 /nfs/dbraw/zinc/62/87/27/1053628727.db2.gz IXJBZQMAXBDGMI-INIZCTEOSA-N 1 0 319.832 4.338 20 10 DICDRO CS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc3ccccc3c2O)C1 ZINC001324337994 1053646433 /nfs/dbraw/zinc/64/64/33/1053646433.db2.gz XTDABIRCPFSYAY-JKSUJKDBSA-N 1 0 301.455 4.261 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCSc2c(F)cccc21)c1ccccc1O ZINC000183413946 1053654257 /nfs/dbraw/zinc/65/42/57/1053654257.db2.gz YBCJHCCHINTTAD-XHDPSFHLSA-N 1 0 303.402 4.419 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCSc2c(F)cccc21)c1ccccc1O ZINC000183414002 1053654363 /nfs/dbraw/zinc/65/43/63/1053654363.db2.gz YBCJHCCHINTTAD-ABAIWWIYSA-N 1 0 303.402 4.419 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(F)cc1C(F)(F)F)c1ccccc1O ZINC000183418951 1053654584 /nfs/dbraw/zinc/65/45/84/1053654584.db2.gz MLWZJEPKEGYZSH-JTQLQIEISA-N 1 0 313.294 4.401 20 10 DICDRO Cc1cc(C[NH+]2CCC(Nc3ccccc3)CC2)ccc1N(C)C ZINC001324488559 1053657275 /nfs/dbraw/zinc/65/72/75/1053657275.db2.gz MVSWMULSTWAMJC-UHFFFAOYSA-N 1 0 323.484 4.138 20 10 DICDRO C[C@H]([NH2+]CCCc1nc2c(s1)CCCC2)c1ccccc1O ZINC000183485456 1053664801 /nfs/dbraw/zinc/66/48/01/1053664801.db2.gz WWICXENUBSVPFZ-ZDUSSCGKSA-N 1 0 316.470 4.011 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1ccccc1O ZINC000183504086 1053665826 /nfs/dbraw/zinc/66/58/26/1053665826.db2.gz LBILRPHKXSWKIR-QGZVFWFLSA-N 1 0 324.468 4.479 20 10 DICDRO CC[C@@H](C[NH2+][C@H](C)c1ccccc1O)Oc1ccccc1F ZINC000183544508 1053676713 /nfs/dbraw/zinc/67/67/13/1053676713.db2.gz TXHPCOQGTLPQBW-KGLIPLIRSA-N 1 0 303.377 4.040 20 10 DICDRO Oc1cccc(Br)c1C[NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC001200485318 1053695376 /nfs/dbraw/zinc/69/53/76/1053695376.db2.gz CTMKEGCDVZWGCD-FRRDWIJNSA-N 1 0 324.262 4.213 20 10 DICDRO C[C@@H]([NH2+]CCCOCc1ccccc1)c1cc(Cl)ccc1O ZINC001325338868 1053714007 /nfs/dbraw/zinc/71/40/07/1053714007.db2.gz CYRCCGRFGLBJOO-CQSZACIVSA-N 1 0 319.832 4.303 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccc(F)cc1 ZINC001325355856 1053716506 /nfs/dbraw/zinc/71/65/06/1053716506.db2.gz GNHVLXHYMIGAAW-PIGZYNQJSA-N 1 0 323.795 4.223 20 10 DICDRO COc1ccc(Cl)cc1CC[NH2+][C@@H](C)c1cc(C)ccc1O ZINC001325357561 1053717406 /nfs/dbraw/zinc/71/74/06/1053717406.db2.gz UKXHZJLEEJOGKT-ZDUSSCGKSA-N 1 0 319.832 4.256 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCC[C@@H]1CCCCO1 ZINC001325420756 1053718984 /nfs/dbraw/zinc/71/89/84/1053718984.db2.gz BRKWUQTZXJRNNJ-OWCLPIDISA-N 1 0 303.446 4.188 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3C[NH+]4CCC3CC4)cc2)C=C1 ZINC001231318735 1053725535 /nfs/dbraw/zinc/72/55/35/1053725535.db2.gz CKIOKCPLGOWRIP-LJQANCHMSA-N 1 0 323.396 4.281 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001325724259 1053727038 /nfs/dbraw/zinc/72/70/38/1053727038.db2.gz WMVFNJSZOTUENY-FQEVSTJZSA-N 1 0 309.457 4.265 20 10 DICDRO CC1CC([N@H+](C)Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001231468263 1053757157 /nfs/dbraw/zinc/75/71/57/1053757157.db2.gz UZUXJZVXFYSGLP-UHFFFAOYSA-N 1 0 311.425 4.202 20 10 DICDRO CC1(C)[C@@H]2C[N@@H+](Cc3ccc(OCc4ccccc4)cc3O)C[C@@H]21 ZINC001231470211 1053757289 /nfs/dbraw/zinc/75/72/89/1053757289.db2.gz QWKIOZWMCJZTFP-KDURUIRLSA-N 1 0 323.436 4.059 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001231465928 1053759083 /nfs/dbraw/zinc/75/90/83/1053759083.db2.gz IAYPNTQSKGQTEO-HDICACEKSA-N 1 0 323.436 4.203 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001231586365 1053789499 /nfs/dbraw/zinc/78/94/99/1053789499.db2.gz FWOQXXXIQYOHOC-INIZCTEOSA-N 1 0 309.331 4.115 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCc2nc(Cl)ccc2C1 ZINC001231590401 1053792185 /nfs/dbraw/zinc/79/21/85/1053792185.db2.gz YCZIRRWFVXMUPO-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001231590139 1053792733 /nfs/dbraw/zinc/79/27/33/1053792733.db2.gz LWDDWADZGDIRSJ-QGZVFWFLSA-N 1 0 318.420 4.320 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@H]1Cc1ccccn1 ZINC001231590111 1053793634 /nfs/dbraw/zinc/79/36/34/1053793634.db2.gz KAMCXXHRIGRMCV-SFHVURJKSA-N 1 0 318.420 4.148 20 10 DICDRO C[N@H+](Cc1cnc(Cl)s1)Cc1c(O)ccc2ccccc21 ZINC001231588493 1053793909 /nfs/dbraw/zinc/79/39/09/1053793909.db2.gz QWFYZKQTQACVSI-UHFFFAOYSA-N 1 0 318.829 4.287 20 10 DICDRO Cc1cccc(C[N@H+]2CCC[C@@H](Oc3ccccc3C)C2)c1O ZINC001231592383 1053794116 /nfs/dbraw/zinc/79/41/16/1053794116.db2.gz KVFURBFAMHCTSQ-GOSISDBHSA-N 1 0 311.425 4.052 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)cc1 ZINC001327255004 1053844709 /nfs/dbraw/zinc/84/47/09/1053844709.db2.gz QCCFUPBEIMZOOF-OIISXLGYSA-N 1 0 308.416 4.056 20 10 DICDRO CCCOc1ccc(C[NH2+][C@](C)(CO)C2CCCCC2)cc1C ZINC001200648389 1053848921 /nfs/dbraw/zinc/84/89/21/1053848921.db2.gz QCALBRBKDWOYTA-HXUWFJFHSA-N 1 0 319.489 4.205 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2c(C)oc3ccccc32)c1O ZINC000183921946 1053856989 /nfs/dbraw/zinc/85/69/89/1053856989.db2.gz VUCJJEQCJWFQTC-UHFFFAOYSA-N 1 0 311.381 4.135 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001231854238 1053891339 /nfs/dbraw/zinc/89/13/39/1053891339.db2.gz CICUKJKODSIHED-UHFFFAOYSA-N 1 0 322.452 4.051 20 10 DICDRO Cc1cc(C)c(C[N@@H+]2CCc3cc(Cl)ccc3C2)c(O)c1 ZINC001231847498 1053891888 /nfs/dbraw/zinc/89/18/88/1053891888.db2.gz ZLQZIGFTXCWUIP-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1cc(C)c(C[NH+]2CCC(c3ccc(O)cc3)CC2)c(O)c1 ZINC001231846211 1053892312 /nfs/dbraw/zinc/89/23/12/1053892312.db2.gz DGUVAIIEOMNHGQ-UHFFFAOYSA-N 1 0 311.425 4.094 20 10 DICDRO C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1cc2c(cc1O)CCCC2 ZINC000183991158 1053894509 /nfs/dbraw/zinc/89/45/09/1053894509.db2.gz UYBRLVRLYHATMC-QAPCUYQASA-N 1 0 317.473 4.271 20 10 DICDRO CC[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000183989413 1053897722 /nfs/dbraw/zinc/89/77/22/1053897722.db2.gz KLEZIMRHMWZJCS-OALUTQOASA-N 1 0 304.478 4.143 20 10 DICDRO Cc1cc(O)c(CN2CCC(=O)[C@H](C)C23CCCC3)cc1Cl ZINC001231872238 1053898220 /nfs/dbraw/zinc/89/82/20/1053898220.db2.gz XXZGDIYVFPXKHP-ZDUSSCGKSA-N 1 0 321.848 4.078 20 10 DICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(Cl)c(C)cc1O ZINC001231870044 1053900183 /nfs/dbraw/zinc/90/01/83/1053900183.db2.gz HBPTWUYOSRRFEK-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CCC(C)(C)O3)CC2)cc1Cl ZINC001231870347 1053900557 /nfs/dbraw/zinc/90/05/57/1053900557.db2.gz VISSBKNOARGDMT-UHFFFAOYSA-N 1 0 323.864 4.278 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)ccc2ccccc21 ZINC001231880720 1053906325 /nfs/dbraw/zinc/90/63/25/1053906325.db2.gz FONHFFZZRXJTCZ-LJQANCHMSA-N 1 0 318.420 4.148 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccncc1 ZINC001200702988 1053906929 /nfs/dbraw/zinc/90/69/29/1053906929.db2.gz JRFZUEQDNWOMTH-HXUWFJFHSA-N 1 0 309.457 4.313 20 10 DICDRO COc1ccc(CC[N@H+](C)Cc2ccc3ccccc3c2O)cc1 ZINC001231880921 1053907067 /nfs/dbraw/zinc/90/70/67/1053907067.db2.gz NIUAJYKLTVABSF-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCc2c(F)cccc2Cl)c1O ZINC001328726003 1053951178 /nfs/dbraw/zinc/95/11/78/1053951178.db2.gz FYGGDDVJUNHKLY-LLVKDONJSA-N 1 0 323.795 4.087 20 10 DICDRO Cc1ccccc1O[C@@H](C)C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001200772622 1053961068 /nfs/dbraw/zinc/96/10/68/1053961068.db2.gz CYZQNCYWIATACH-KOEDOTQGSA-N 1 0 324.468 4.131 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCc2ccc(O)cc21 ZINC001329589921 1053998657 /nfs/dbraw/zinc/99/86/57/1053998657.db2.gz WICLFYJAQLZFPK-OAUYIBNBSA-N 1 0 309.409 4.232 20 10 DICDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232262915 1054005131 /nfs/dbraw/zinc/00/51/31/1054005131.db2.gz VZIHUWGTBXSSSH-INIZCTEOSA-N 1 0 317.816 4.261 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCCC[C@H]2c2ccccc2)cc1Cl ZINC001232261219 1054005820 /nfs/dbraw/zinc/00/58/20/1054005820.db2.gz XGEMRJBEMDFUCI-INIZCTEOSA-N 1 0 317.816 4.478 20 10 DICDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)c(O)cc2O)cc1 ZINC001232262053 1054006342 /nfs/dbraw/zinc/00/63/42/1054006342.db2.gz YQBAVTSTFQMSGF-INIZCTEOSA-N 1 0 317.816 4.397 20 10 DICDRO Oc1cc(O)c(C[N@H+](Cc2ccccc2)C2CCC2)cc1Cl ZINC001232263906 1054006360 /nfs/dbraw/zinc/00/63/60/1054006360.db2.gz XEBOHAKPCSZRCS-UHFFFAOYSA-N 1 0 317.816 4.306 20 10 DICDRO Cc1cccc(C[N@@H+]2CCc3cccc(O)c3C2)c1OC(C)C ZINC001232395015 1054040742 /nfs/dbraw/zinc/04/07/42/1054040742.db2.gz NJQTXLJKGMCIMC-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H](c1ccccn1)C1CC1 ZINC001332455118 1054118691 /nfs/dbraw/zinc/11/86/91/1054118691.db2.gz GUUZCAOBMNQOAU-AUJRIZCKSA-N 1 0 308.425 4.385 20 10 DICDRO C[C@@]1(CC[NH2+]Cc2ccc(N3CCCC3)cc2)C[C@]1(F)Cl ZINC001332612112 1054123393 /nfs/dbraw/zinc/12/33/93/1054123393.db2.gz XBHPKEOQYIUJLG-IAGOWNOFSA-N 1 0 310.844 4.081 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cccc3ccccc32)c(O)c1 ZINC001232838427 1054128611 /nfs/dbraw/zinc/12/86/11/1054128611.db2.gz FGOVIIOKFMRYCR-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO Cc1cnc(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c(C)c1 ZINC001332947614 1054133670 /nfs/dbraw/zinc/13/36/70/1054133670.db2.gz ZRDPIZMIRKFVPW-RDJZCZTQSA-N 1 0 310.441 4.093 20 10 DICDRO Cc1cnc(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c(C)c1 ZINC001332947611 1054133802 /nfs/dbraw/zinc/13/38/02/1054133802.db2.gz ZRDPIZMIRKFVPW-NVXWUHKLSA-N 1 0 310.441 4.093 20 10 DICDRO C[N@H+](Cc1ccc(-c2cccc(F)c2)nc1)Cc1ccccc1O ZINC001232890364 1054141132 /nfs/dbraw/zinc/14/11/32/1054141132.db2.gz TWJSFZQXKPGHOH-UHFFFAOYSA-N 1 0 322.383 4.225 20 10 DICDRO CC[N@H+](Cc1cncc(-c2ccccc2)c1)Cc1ccccc1O ZINC001232902193 1054146393 /nfs/dbraw/zinc/14/63/93/1054146393.db2.gz IACHQYGSFKICJT-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](CC)c2ccccc2F)c1O ZINC000848556778 1054148177 /nfs/dbraw/zinc/14/81/77/1054148177.db2.gz CIWNJRYBCNQTKV-MRXNPFEDSA-N 1 0 303.377 4.171 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000848560290 1054148769 /nfs/dbraw/zinc/14/87/69/1054148769.db2.gz KONGBWVZNDUGHQ-IUODEOHRSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C2CC2)[C@H]2CCCCO2)c(O)c1C ZINC000848560115 1054149729 /nfs/dbraw/zinc/14/97/29/1054149729.db2.gz YUZINMPOPJDXQI-BMGDILEWSA-N 1 0 303.446 4.007 20 10 DICDRO CC[C@H]([NH2+][C@H](C1CC1)[C@@H]1CCCCO1)c1ccc(C)cc1O ZINC000848557543 1054149738 /nfs/dbraw/zinc/14/97/38/1054149738.db2.gz FOGIAGDJKWMOOI-YTQUADARSA-N 1 0 303.446 4.089 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000848561194 1054151355 /nfs/dbraw/zinc/15/13/55/1054151355.db2.gz WFRRABXZQMULMO-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@@H](Cc1ccccn1)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000848565346 1054151369 /nfs/dbraw/zinc/15/13/69/1054151369.db2.gz NOXFPGLZDNBCHX-GJZGRUSLSA-N 1 0 306.409 4.222 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1O ZINC000848567628 1054154873 /nfs/dbraw/zinc/15/48/73/1054154873.db2.gz KEFBNCISHMPVGX-NWDGAFQWSA-N 1 0 313.388 4.265 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)C2CCC(F)(F)CC2)c1O ZINC000848567627 1054154878 /nfs/dbraw/zinc/15/48/78/1054154878.db2.gz KEFBNCISHMPVGX-NEPJUHHUSA-N 1 0 313.388 4.265 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC3(CCCC3)O2)c(O)c1C ZINC000848569559 1054156629 /nfs/dbraw/zinc/15/66/29/1054156629.db2.gz BHJOCQODCBLTIF-HZPDHXFCSA-N 1 0 303.446 4.151 20 10 DICDRO c1ccc2c(C[NH2+]Cc3ccc(N4CCCCC4)cc3)noc2c1 ZINC000848579888 1054160309 /nfs/dbraw/zinc/16/03/09/1054160309.db2.gz QCHFLEWXDSKWEL-UHFFFAOYSA-N 1 0 321.424 4.108 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c(Cl)n1 ZINC001333595599 1054162650 /nfs/dbraw/zinc/16/26/50/1054162650.db2.gz LSKXYAXCNBJMOJ-BXUZGUMPSA-N 1 0 316.832 4.396 20 10 DICDRO COc1ccccc1C1([NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC001333943871 1054178094 /nfs/dbraw/zinc/17/80/94/1054178094.db2.gz AONOUYOXXKTIHB-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO CC(C)OC1CC[NH+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233286165 1054222097 /nfs/dbraw/zinc/22/20/97/1054222097.db2.gz IFSYXMPKMAMUAF-UHFFFAOYSA-N 1 0 305.462 4.079 20 10 DICDRO C[N@H+](Cc1cccc(F)c1)Cc1cc(C(C)(C)C)ccc1O ZINC001233284030 1054222251 /nfs/dbraw/zinc/22/22/51/1054222251.db2.gz FFSOBDUYEKAGCZ-UHFFFAOYSA-N 1 0 301.405 4.461 20 10 DICDRO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233286238 1054222886 /nfs/dbraw/zinc/22/28/86/1054222886.db2.gz LLYMBCVKHKRXAF-KRWDZBQOSA-N 1 0 305.462 4.079 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c1 ZINC001233286481 1054226370 /nfs/dbraw/zinc/22/63/70/1054226370.db2.gz WAZUZFOONMEZDQ-INIZCTEOSA-N 1 0 324.468 4.464 20 10 DICDRO CSc1cccc(Cl)c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001233353282 1054248929 /nfs/dbraw/zinc/24/89/29/1054248929.db2.gz NHVGZMPNEKNHAV-UHFFFAOYSA-N 1 0 319.857 4.326 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC001233454273 1054277849 /nfs/dbraw/zinc/27/78/49/1054277849.db2.gz OBIGPWLDTHJVQG-HNNXBMFYSA-N 1 0 322.330 4.143 20 10 DICDRO C[C@@]1(F)CCCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233451859 1054278121 /nfs/dbraw/zinc/27/81/21/1054278121.db2.gz BWKCGJATUGCRBX-CQSZACIVSA-N 1 0 305.315 4.125 20 10 DICDRO CC[N@H+](Cc1ccccc1)Cc1ccc(C(F)(F)F)cc1O ZINC001233451314 1054278269 /nfs/dbraw/zinc/27/82/69/1054278269.db2.gz GMRWJYISFDLGNO-UHFFFAOYSA-N 1 0 309.331 4.433 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@H]2CCCc3nc(C)sc32)c1O ZINC000848886303 1054284842 /nfs/dbraw/zinc/28/48/42/1054284842.db2.gz ZCHKDQMZFSTSQM-INIZCTEOSA-N 1 0 316.470 4.229 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC001337784521 1054285742 /nfs/dbraw/zinc/28/57/42/1054285742.db2.gz BUIOICSAWUIJPZ-JKIFEVAISA-N 1 0 311.425 4.175 20 10 DICDRO Cc1ccsc1CC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001337800334 1054286233 /nfs/dbraw/zinc/28/62/33/1054286233.db2.gz MWEGLDSIIPVUOL-UONOGXRCSA-N 1 0 301.455 4.451 20 10 DICDRO CCC(CC)(CCO)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001337785387 1054286145 /nfs/dbraw/zinc/28/61/45/1054286145.db2.gz LNJUXAOTVPVOJT-GJZGRUSLSA-N 1 0 305.462 4.027 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](c2ccc(OC)cc2)C2CC2)c1O ZINC000848893550 1054287603 /nfs/dbraw/zinc/28/76/03/1054287603.db2.gz XFJJCTHXBIKYQE-LJQANCHMSA-N 1 0 311.425 4.204 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CCOc3c(Cl)cccc32)c1O ZINC000848894588 1054287617 /nfs/dbraw/zinc/28/76/17/1054287617.db2.gz NKYAYPLNXVHSPN-MRXNPFEDSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc(Cl)cn1 ZINC001337801422 1054287540 /nfs/dbraw/zinc/28/75/40/1054287540.db2.gz STPWLCCEEMBMGA-RISCZKNCSA-N 1 0 302.805 4.087 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2cccc(OC(F)F)c2)c1O ZINC000848895796 1054288174 /nfs/dbraw/zinc/28/81/74/1054288174.db2.gz YEDWZASHDVZUMG-GFCCVEGCSA-N 1 0 321.367 4.407 20 10 DICDRO CCc1cccc(C[NH2+]Cc2cc(C(CC)CC)no2)c1O ZINC000848898686 1054289032 /nfs/dbraw/zinc/28/90/32/1054289032.db2.gz XEMQNBWSUXDVMT-UHFFFAOYSA-N 1 0 302.418 4.136 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccccc2OCC2CC2)c1O ZINC000848898155 1054289840 /nfs/dbraw/zinc/28/98/40/1054289840.db2.gz ZFGCAFRQPVGURT-UHFFFAOYSA-N 1 0 311.425 4.033 20 10 DICDRO CCc1cccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)c1O ZINC000848906650 1054293770 /nfs/dbraw/zinc/29/37/70/1054293770.db2.gz BTABTSDKWRLGNV-UHFFFAOYSA-N 1 0 311.759 4.176 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(Cl)cc(OC)c1O)c1ccccc1F ZINC000848922290 1054299587 /nfs/dbraw/zinc/29/95/87/1054299587.db2.gz PUWNRPBSJDEBSE-OAHLLOKOSA-N 1 0 323.795 4.434 20 10 DICDRO Cc1cccc([C@@H](C)C[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001339432926 1054338067 /nfs/dbraw/zinc/33/80/67/1054338067.db2.gz ZCXOIOJNQUREOG-SFHVURJKSA-N 1 0 308.469 4.489 20 10 DICDRO Cc1cccc([C@H](C)C[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001339432925 1054338320 /nfs/dbraw/zinc/33/83/20/1054338320.db2.gz ZCXOIOJNQUREOG-GOSISDBHSA-N 1 0 308.469 4.489 20 10 DICDRO CCC[N@H+](Cc1cccc(OC(F)(F)F)c1O)[C@@H](C)CC ZINC001233726354 1054343344 /nfs/dbraw/zinc/34/33/44/1054343344.db2.gz CGOLPESUZWXHMX-NSHDSACASA-N 1 0 305.340 4.301 20 10 DICDRO COc1cccc(C[NH2+][C@H]2c3ccccc3CCC[C@@H]2C)c1O ZINC000185084740 1054352273 /nfs/dbraw/zinc/35/22/73/1054352273.db2.gz YZGAITMOWBCPNH-IFXJQAMLSA-N 1 0 311.425 4.204 20 10 DICDRO CCc1cccc(CC)c1NC(=[NH2+])NCc1ccc(N(C)C)cc1 ZINC000849056945 1054364988 /nfs/dbraw/zinc/36/49/88/1054364988.db2.gz HLBRXAOOKVTNQT-UHFFFAOYSA-N 1 0 324.472 4.014 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001342409737 1054420853 /nfs/dbraw/zinc/42/08/53/1054420853.db2.gz WVXDPPAGNSNDFT-JMSVASOKSA-N 1 0 314.429 4.247 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)C1CCOCC1 ZINC001342407411 1054420920 /nfs/dbraw/zinc/42/09/20/1054420920.db2.gz QDKLNYNZIMSKTD-VNQPRFMTSA-N 1 0 303.446 4.044 20 10 DICDRO C[C@H]1c2ccsc2CC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001343333109 1054442704 /nfs/dbraw/zinc/44/27/04/1054442704.db2.gz BPAQQQANOIFMQC-HNNXBMFYSA-N 1 0 312.482 4.468 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCCOCc2ccccc2)c(O)c1 ZINC000185247074 1054487820 /nfs/dbraw/zinc/48/78/20/1054487820.db2.gz CYTTXJIBCCFUFA-QGZVFWFLSA-N 1 0 313.441 4.348 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1cccc2c1CCCN2 ZINC001345483023 1054496435 /nfs/dbraw/zinc/49/64/35/1054496435.db2.gz PXHNYSHOESONFL-KDOFPFPSSA-N 1 0 322.452 4.397 20 10 DICDRO CC(C)[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000072786418 1054535451 /nfs/dbraw/zinc/53/54/51/1054535451.db2.gz BMEJABHDGZBFTG-NRFANRHFSA-N 1 0 324.468 4.010 20 10 DICDRO CCc1nc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)cs1 ZINC000185397266 1054539297 /nfs/dbraw/zinc/53/92/97/1054539297.db2.gz FBFSAZNPQSAURF-GFCCVEGCSA-N 1 0 316.470 4.141 20 10 DICDRO COc1ccc2ccc(O)c(C[NH+]3CCC4(CCC4)CC3)c2c1 ZINC001234525841 1054542658 /nfs/dbraw/zinc/54/26/58/1054542658.db2.gz KULRSICDNKAZBB-UHFFFAOYSA-N 1 0 311.425 4.320 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3Cc4ccc(F)cc4C3)c2c1 ZINC001234553109 1054546755 /nfs/dbraw/zinc/54/67/55/1054546755.db2.gz VJJUVWOEPIWOQZ-UHFFFAOYSA-N 1 0 323.367 4.209 20 10 DICDRO COc1ccc2ccc(O)c(C[NH+]3CC4CCC(CC4)C3)c2c1 ZINC001234561903 1054547243 /nfs/dbraw/zinc/54/72/43/1054547243.db2.gz FSHAEJXXKATKGD-UHFFFAOYSA-N 1 0 311.425 4.176 20 10 DICDRO COc1ccc2ccc(O)c(C[NH+]3C4CCCC3CCC4)c2c1 ZINC001234569570 1054549771 /nfs/dbraw/zinc/54/97/71/1054549771.db2.gz PKWTULDGZUBMQH-UHFFFAOYSA-N 1 0 311.425 4.461 20 10 DICDRO C[C@@H]([NH2+]C1CC2(CC2(F)F)C1)c1ccc2ccccc2c1O ZINC001346867261 1054552171 /nfs/dbraw/zinc/55/21/71/1054552171.db2.gz HCVBSWGMTKTMPE-FFLHNBHYSA-N 1 0 303.352 4.384 20 10 DICDRO CCOC1CC[NH+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001234993298 1054638285 /nfs/dbraw/zinc/63/82/85/1054638285.db2.gz BRORPLCXXYBNIE-UHFFFAOYSA-N 1 0 311.425 4.060 20 10 DICDRO C[C@@]1(F)CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C[C@H]1F ZINC001234998146 1054640519 /nfs/dbraw/zinc/64/05/19/1054640519.db2.gz GJEFMRBNJRZTPY-IEBWSBKVSA-N 1 0 317.379 4.331 20 10 DICDRO C[C@]1(F)CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C[C@H]1F ZINC001234998147 1054641097 /nfs/dbraw/zinc/64/10/97/1054641097.db2.gz GJEFMRBNJRZTPY-MJGOQNOKSA-N 1 0 317.379 4.331 20 10 DICDRO COCC1CCC([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001348493453 1054651431 /nfs/dbraw/zinc/65/14/31/1054651431.db2.gz PUDWIGLYBOPNHR-PRLABOORSA-N 1 0 303.446 4.044 20 10 DICDRO COCC1CCC([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001348493449 1054651804 /nfs/dbraw/zinc/65/18/04/1054651804.db2.gz PUDWIGLYBOPNHR-LBDPXKHJSA-N 1 0 303.446 4.044 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2csc(-c3ccco3)n2)c1 ZINC000185803623 1054665547 /nfs/dbraw/zinc/66/55/47/1054665547.db2.gz HESFHMASJCPEEL-GFCCVEGCSA-N 1 0 314.410 4.268 20 10 DICDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(C(C)(C)C)cc2O)no1 ZINC001235674609 1054770357 /nfs/dbraw/zinc/77/03/57/1054770357.db2.gz HCCZOJMRKPSWKF-KRWDZBQOSA-N 1 0 314.429 4.323 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCOC3(CCCCC3)C2)c(O)c1 ZINC001235677183 1054771874 /nfs/dbraw/zinc/77/18/74/1054771874.db2.gz CEHVKVPLXRNOFW-UHFFFAOYSA-N 1 0 317.473 4.225 20 10 DICDRO CC(C)(C)c1ccc(C[NH+]2CCC3(CC(F)C3)CC2)c(O)c1 ZINC001235678441 1054773316 /nfs/dbraw/zinc/77/33/16/1054773316.db2.gz CEXIPAYGBWHELA-UHFFFAOYSA-N 1 0 305.437 4.404 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2OC2CCC2)c(O)c1 ZINC000186055619 1054871536 /nfs/dbraw/zinc/87/15/36/1054871536.db2.gz VOYUQRLQQXHVJF-HNNXBMFYSA-N 1 0 311.425 4.483 20 10 DICDRO Cc1ccn(-c2ccccc2C[NH2+][C@H](C)c2ccc(C)cc2O)n1 ZINC000186123006 1054929183 /nfs/dbraw/zinc/92/91/83/1054929183.db2.gz UWDHXBJDZXAYAH-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1cccc([C@H](O)C[NH2+][C@H](C)c2ccc3ccccc3c2O)c1 ZINC000186124703 1054955859 /nfs/dbraw/zinc/95/58/59/1054955859.db2.gz UQAUXJJXZDBCFQ-FOIQADDNSA-N 1 0 321.420 4.238 20 10 DICDRO CCCC[C@@H]1CN(Cc2cccc(-c3ccccc3)c2O)CC[NH2+]1 ZINC001236141277 1054968667 /nfs/dbraw/zinc/96/86/67/1054968667.db2.gz JANHDUXSMQFMHK-LJQANCHMSA-N 1 0 324.468 4.023 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCC[C@H](C)[C@@H]3C)CC2)cc1 ZINC000764434107 1055185615 /nfs/dbraw/zinc/18/56/15/1055185615.db2.gz SRDSWNDHOSYRRC-TWOQFEAHSA-N 1 0 316.489 4.078 20 10 DICDRO CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000764437681 1055187929 /nfs/dbraw/zinc/18/79/29/1055187929.db2.gz UUQHIVWIXQZVQW-KGLIPLIRSA-N 1 0 310.869 4.016 20 10 DICDRO CCC(CC)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000764490643 1055194816 /nfs/dbraw/zinc/19/48/16/1055194816.db2.gz RAEFMRDFZFDEAG-ZDUSSCGKSA-N 1 0 310.869 4.016 20 10 DICDRO C[C@@H]([NH2+]C1CCCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000764550986 1055210018 /nfs/dbraw/zinc/21/00/18/1055210018.db2.gz PNVMFYDYCPYDIG-CQSZACIVSA-N 1 0 322.880 4.160 20 10 DICDRO CCCCC[N@H+](C)Cc1cc(C)cc(Br)c1[O-] ZINC001236674114 1055220896 /nfs/dbraw/zinc/22/08/96/1055220896.db2.gz UINWCGQOZWFHLN-UHFFFAOYSA-N 1 0 300.240 4.085 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CCc1ccco1)c1ccc(N(C)C)cc1 ZINC000764610356 1055221206 /nfs/dbraw/zinc/22/12/06/1055221206.db2.gz YYWWAPCRKMTCBB-HNAYVOBHSA-N 1 0 300.446 4.408 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CCc1ccco1)c1ccc(N(C)C)cc1 ZINC000764610354 1055221985 /nfs/dbraw/zinc/22/19/85/1055221985.db2.gz YYWWAPCRKMTCBB-BEFAXECRSA-N 1 0 300.446 4.408 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CCc1ccco1)c1ccc(N(C)C)cc1 ZINC000764610357 1055222164 /nfs/dbraw/zinc/22/21/64/1055222164.db2.gz YYWWAPCRKMTCBB-KXBFYZLASA-N 1 0 300.446 4.408 20 10 DICDRO Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1ccc(N(C)C)cc1)CCCO2 ZINC000764633695 1055226245 /nfs/dbraw/zinc/22/62/45/1055226245.db2.gz FKMPIKPCANQYMY-HXUWFJFHSA-N 1 0 324.468 4.373 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C)c2)cc1 ZINC000764743673 1055242731 /nfs/dbraw/zinc/24/27/31/1055242731.db2.gz RNBNUVIKCWQZRZ-HNNXBMFYSA-N 1 0 300.421 4.441 20 10 DICDRO C[C@@H]([NH2+]CCC1CCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000764768483 1055246918 /nfs/dbraw/zinc/24/69/18/1055246918.db2.gz QGXKTZJFUDDPOF-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[NH+]1CCC2(CC2)CC1 ZINC001236778095 1055255334 /nfs/dbraw/zinc/25/53/34/1055255334.db2.gz BYFKGPGMWJRVLG-UHFFFAOYSA-N 1 0 323.436 4.347 20 10 DICDRO C[C@H]1C[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C2(CC2)C1 ZINC001236781801 1055256066 /nfs/dbraw/zinc/25/60/66/1055256066.db2.gz HVYJFAXQIFFTCW-MRXNPFEDSA-N 1 0 323.436 4.346 20 10 DICDRO C[N@@H+](Cc1cc(OCc2ccccc2)ccc1O)CC1CCC1 ZINC001236784931 1055258187 /nfs/dbraw/zinc/25/81/87/1055258187.db2.gz JDCZEZLCYIVGRF-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO CC[C@@H]1CC[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001236782708 1055259204 /nfs/dbraw/zinc/25/92/04/1055259204.db2.gz MMHWAAQIZNWYNM-MRXNPFEDSA-N 1 0 311.425 4.203 20 10 DICDRO CCc1ccc(C[NH+]2CCC(C(=O)c3ccccc3)CC2)c(O)c1 ZINC001236784023 1055259788 /nfs/dbraw/zinc/25/97/88/1055259788.db2.gz RDUJFESUKVLLRI-UHFFFAOYSA-N 1 0 323.436 4.050 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2cccc3cccnc32)c(O)c1 ZINC001236794426 1055263115 /nfs/dbraw/zinc/26/31/15/1055263115.db2.gz MLWLEXJGBJWNEL-UHFFFAOYSA-N 1 0 306.409 4.135 20 10 DICDRO C[C@H]1CCCC[N@@H+]1Cc1cc(OCc2ccccc2)ccc1O ZINC001236792584 1055263214 /nfs/dbraw/zinc/26/32/14/1055263214.db2.gz OCPWNIRJRSJZKS-INIZCTEOSA-N 1 0 311.425 4.346 20 10 DICDRO CC[N@H+](Cc1cccs1)Cc1ccc(OC)c(Cl)c1[O-] ZINC001236805886 1055267838 /nfs/dbraw/zinc/26/78/38/1055267838.db2.gz GUUDTHKJYVDPQP-UHFFFAOYSA-N 1 0 311.834 4.138 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCc3ccccc3[C@H]2C)c(Cl)c1 ZINC001236798085 1055267902 /nfs/dbraw/zinc/26/79/02/1055267902.db2.gz LBCITSRNRFMGHY-GFCCVEGCSA-N 1 0 317.816 4.174 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(O)c1 ZINC001236808053 1055268283 /nfs/dbraw/zinc/26/82/83/1055268283.db2.gz LATDUZWODMAMBL-SFHVURJKSA-N 1 0 315.388 4.185 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@H]2c2ccccc2)c(Cl)c1 ZINC001236804491 1055269293 /nfs/dbraw/zinc/26/92/93/1055269293.db2.gz USSVRFGUEKXFJF-INIZCTEOSA-N 1 0 303.789 4.001 20 10 DICDRO COc1cc(O)c(C[N@H+](Cc2ccccc2)C2CC2)c(Cl)c1 ZINC001236809356 1055272414 /nfs/dbraw/zinc/27/24/14/1055272414.db2.gz UWABCRJAXZYCLU-UHFFFAOYSA-N 1 0 317.816 4.219 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2)c(O)c1 ZINC001236819161 1055276100 /nfs/dbraw/zinc/27/61/00/1055276100.db2.gz VCHJFQUQVZKLPZ-LJQANCHMSA-N 1 0 311.425 4.355 20 10 DICDRO CC[N@H+](Cc1cccc(F)c1F)Cc1c(C)cc(OC)cc1O ZINC001236820294 1055276549 /nfs/dbraw/zinc/27/65/49/1055276549.db2.gz KPSPFVPTXHHXMA-UHFFFAOYSA-N 1 0 321.367 4.010 20 10 DICDRO Oc1cc2ccccc2cc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC001236827121 1055280534 /nfs/dbraw/zinc/28/05/34/1055280534.db2.gz PLQCCIQUMMRXDY-UHFFFAOYSA-N 1 0 309.331 4.320 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC001236826030 1055281204 /nfs/dbraw/zinc/28/12/04/1055281204.db2.gz FDNORWAHJZVUOU-HXUWFJFHSA-N 1 0 319.404 4.119 20 10 DICDRO C[C@H]1C(=O)CC[N@H+](Cc2cc3ccccc3cc2O)C12CCCC2 ZINC001236835432 1055284235 /nfs/dbraw/zinc/28/42/35/1055284235.db2.gz LDSYMKMBLATLSD-HNNXBMFYSA-N 1 0 323.436 4.269 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@@H]1Cc1ccccn1 ZINC001236842059 1055286819 /nfs/dbraw/zinc/28/68/19/1055286819.db2.gz SSVLEKWQPNHIFM-HXUWFJFHSA-N 1 0 318.420 4.148 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC001236839336 1055288414 /nfs/dbraw/zinc/28/84/14/1055288414.db2.gz FRFLXIRGZXBFRK-SFHVURJKSA-N 1 0 318.420 4.320 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001236839356 1055289894 /nfs/dbraw/zinc/28/98/94/1055289894.db2.gz FSNLDTLVVJDTLX-FQEVSTJZSA-N 1 0 319.404 4.199 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000765035177 1055316913 /nfs/dbraw/zinc/31/69/13/1055316913.db2.gz AOFZWVQWSUYKPR-MRXNPFEDSA-N 1 0 312.457 4.392 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)CCC(=O)c2ccccc2)c(O)c1 ZINC001237049117 1055349533 /nfs/dbraw/zinc/34/95/33/1055349533.db2.gz LSHLPDMFIKUWHT-UHFFFAOYSA-N 1 0 311.425 4.220 20 10 DICDRO CCOc1ccc(C[N@H+](CC)Cc2ccc(Cl)cc2)c(O)c1 ZINC001237044721 1055349849 /nfs/dbraw/zinc/34/98/49/1055349849.db2.gz SWGHBLKEQRFEET-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2C[C@@H](CF)[C@H](C(F)(F)F)C2)c(O)c1 ZINC001237044906 1055350159 /nfs/dbraw/zinc/35/01/59/1055350159.db2.gz FQBMGRMFHUZVNN-ZIAGYGMSSA-N 1 0 319.342 4.095 20 10 DICDRO Cc1ccn2cc(C[N@@H+](C)Cc3ccc(C(C)C)cc3O)nc2c1 ZINC001237051970 1055350344 /nfs/dbraw/zinc/35/03/44/1055350344.db2.gz SBAUYTMIJVQULO-UHFFFAOYSA-N 1 0 323.440 4.104 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC3(CCOC3(C)C)CC2)c(O)c1 ZINC001237056317 1055353890 /nfs/dbraw/zinc/35/38/90/1055353890.db2.gz XSCCSMQZLSSYLQ-UHFFFAOYSA-N 1 0 317.473 4.297 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC(c3cccnc3)CC2)c(O)c1 ZINC001237055837 1055355065 /nfs/dbraw/zinc/35/50/65/1055355065.db2.gz QXHHIOWCWZZWEN-UHFFFAOYSA-N 1 0 310.441 4.290 20 10 DICDRO CCOc1ccccc1C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765282658 1055355756 /nfs/dbraw/zinc/35/57/56/1055355756.db2.gz WYNVKLJFOFVLLA-IBGZPJMESA-N 1 0 312.457 4.392 20 10 DICDRO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000765312224 1055359337 /nfs/dbraw/zinc/35/93/37/1055359337.db2.gz ALVPSZYFBOFNQK-KKUMJFAQSA-N 1 0 324.896 4.262 20 10 DICDRO CC(C)=CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000765329430 1055362319 /nfs/dbraw/zinc/36/23/19/1055362319.db2.gz JFCWFAMQCGDQKY-MSOLQXFVSA-N 1 0 316.489 4.309 20 10 DICDRO C[C@H]([NH2+]CC1CCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000765326933 1055362803 /nfs/dbraw/zinc/36/28/03/1055362803.db2.gz XVTLAMNWNJDLNH-AWEZNQCLSA-N 1 0 322.880 4.017 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCC[C@H]1C)c1ccc(N2CCOCC2)cc1 ZINC000765342482 1055366087 /nfs/dbraw/zinc/36/60/87/1055366087.db2.gz FVVJMEBQRAWFAD-AOIWGVFYSA-N 1 0 316.489 4.000 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@@H]3CCCC[C@H]3C)CC2)cc1 ZINC000765342425 1055366513 /nfs/dbraw/zinc/36/65/13/1055366513.db2.gz DDAPJWBWZNGIPV-SJORKVTESA-N 1 0 316.489 4.080 20 10 DICDRO C[C@]1(F)CCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001237137847 1055377295 /nfs/dbraw/zinc/37/72/95/1055377295.db2.gz OZLUJNFDTMYIEZ-AWEZNQCLSA-N 1 0 305.315 4.125 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001237127104 1055377447 /nfs/dbraw/zinc/37/74/47/1055377447.db2.gz UZTVCWJWPCLQDJ-GFCCVEGCSA-N 1 0 323.770 4.313 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[NH+]1CCC2(CC(F)C2)CC1 ZINC001237135632 1055378097 /nfs/dbraw/zinc/37/80/97/1055378097.db2.gz LJDRLVSIPBOZOX-UHFFFAOYSA-N 1 0 317.326 4.125 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC001237126677 1055378356 /nfs/dbraw/zinc/37/83/56/1055378356.db2.gz OLTUOUHQQAWGQA-NSHDSACASA-N 1 0 323.770 4.313 20 10 DICDRO C[N@H+](CC/C=C/c1cccnc1)Cc1c(O)ccc(F)c1Cl ZINC001237131227 1055379440 /nfs/dbraw/zinc/37/94/40/1055379440.db2.gz VHSALJJYEUUOEU-GORDUTHDSA-N 1 0 320.795 4.115 20 10 DICDRO C[N@H+](Cc1c(O)ccc(F)c1Cl)[C@H]1CCc2ccccc21 ZINC001237128538 1055379584 /nfs/dbraw/zinc/37/95/84/1055379584.db2.gz RIJPOVCOIHTTEP-HNNXBMFYSA-N 1 0 305.780 4.304 20 10 DICDRO CCC(CC)[N@H+](CC)Cc1c(O)cccc1OC(F)(F)F ZINC001237123793 1055380310 /nfs/dbraw/zinc/38/03/10/1055380310.db2.gz SPMJEQFHYWXXMV-UHFFFAOYSA-N 1 0 305.340 4.301 20 10 DICDRO CC[N@H+](Cc1ccccc1)Cc1cc(C(F)(F)F)ccc1O ZINC001237135249 1055381799 /nfs/dbraw/zinc/38/17/99/1055381799.db2.gz GJMZMADJOYQBGC-UHFFFAOYSA-N 1 0 309.331 4.433 20 10 DICDRO C[N@H+](CCc1cccs1)Cc1cc(C(F)(F)F)ccc1O ZINC001237140107 1055383749 /nfs/dbraw/zinc/38/37/49/1055383749.db2.gz UYMRGDVYUGTEEI-UHFFFAOYSA-N 1 0 315.360 4.147 20 10 DICDRO C[C@@H]([NH2+][C@H]1CSCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000765423920 1055383990 /nfs/dbraw/zinc/38/39/90/1055383990.db2.gz JPZYMLIWCDRXPW-KUHUBIRLSA-N 1 0 312.482 4.391 20 10 DICDRO C[C@H]([NH2+][C@@H]1CSCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000765423919 1055384539 /nfs/dbraw/zinc/38/45/39/1055384539.db2.gz JPZYMLIWCDRXPW-IFXJQAMLSA-N 1 0 312.482 4.391 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cc2ccccc2o1 ZINC000765475375 1055397844 /nfs/dbraw/zinc/39/78/44/1055397844.db2.gz TWCGLWJISWEZFI-ZDUSSCGKSA-N 1 0 312.388 4.489 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cc2c(s1)CCC2 ZINC000765475917 1055398257 /nfs/dbraw/zinc/39/82/57/1055398257.db2.gz XWWJABQSJGSNIY-LBPRGKRZSA-N 1 0 318.461 4.293 20 10 DICDRO Oc1cc2c(cc1O)C[N@H+](Cc1ccc3cccccc1-3)CCC2 ZINC001237192663 1055398497 /nfs/dbraw/zinc/39/84/97/1055398497.db2.gz IGHNVOSSSBNHOO-UHFFFAOYSA-N 1 0 319.404 4.151 20 10 DICDRO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC000765473072 1055401046 /nfs/dbraw/zinc/40/10/46/1055401046.db2.gz BOKKQOKBSIHBQB-GFCCVEGCSA-N 1 0 306.450 4.366 20 10 DICDRO CCC(O)(CC)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765473644 1055401650 /nfs/dbraw/zinc/40/16/50/1055401650.db2.gz ZUMUTDSNOSZQFC-KRWDZBQOSA-N 1 0 318.505 4.269 20 10 DICDRO CC(C)C[C@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765474976 1055401667 /nfs/dbraw/zinc/40/16/67/1055401667.db2.gz SQAMUHZHKFQLJK-XLIONFOSSA-N 1 0 318.505 4.125 20 10 DICDRO CCC(O)(CC)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765473645 1055401784 /nfs/dbraw/zinc/40/17/84/1055401784.db2.gz ZUMUTDSNOSZQFC-QGZVFWFLSA-N 1 0 318.505 4.269 20 10 DICDRO Cc1cccc2c1CC[C@H]2[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765485225 1055403465 /nfs/dbraw/zinc/40/34/65/1055403465.db2.gz KYWCPLPOEYWMDH-HXUWFJFHSA-N 1 0 306.453 4.155 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCSC[C@H]1c1ccc(F)cc1 ZINC001237486666 1055459012 /nfs/dbraw/zinc/45/90/12/1055459012.db2.gz APEJXARJUSREIN-KRWDZBQOSA-N 1 0 317.429 4.130 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC(c2nc3ccccc3o2)CC1 ZINC001237483581 1055459055 /nfs/dbraw/zinc/45/90/55/1055459055.db2.gz PONGWQWKLDFWOV-UHFFFAOYSA-N 1 0 322.408 4.221 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001237487672 1055459858 /nfs/dbraw/zinc/45/98/58/1055459858.db2.gz KCJISRQLTRZBIM-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cccc(O)c1C[N@H+](C)CCc1ccc(C(F)(F)F)cc1 ZINC001237490307 1055461369 /nfs/dbraw/zinc/46/13/69/1055461369.db2.gz DGGCVHZNEBWAEA-UHFFFAOYSA-N 1 0 323.358 4.394 20 10 DICDRO C[N@H+](Cc1cccc(Cl)c1)Cc1cc(Cl)cc(F)c1[O-] ZINC001237619709 1055484656 /nfs/dbraw/zinc/48/46/56/1055484656.db2.gz BYCRTZXNUCAHDH-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001237620107 1055486033 /nfs/dbraw/zinc/48/60/33/1055486033.db2.gz JDXDGSPPVBRCAH-AWEZNQCLSA-N 1 0 319.807 4.249 20 10 DICDRO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(Cl)cc(F)c1[O-] ZINC001237621996 1055486084 /nfs/dbraw/zinc/48/60/84/1055486084.db2.gz LBCIQXWEWNQVDT-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001237641024 1055491103 /nfs/dbraw/zinc/49/11/03/1055491103.db2.gz KPXUOQICNBEEIJ-CALCHBBNSA-N 1 0 311.400 4.430 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@](C)(C(F)(F)F)C2)cc1Cl ZINC001621511090 1055492002 /nfs/dbraw/zinc/49/20/02/1055492002.db2.gz QROKGNGEQOKGGO-ZDUSSCGKSA-N 1 0 307.743 4.128 20 10 DICDRO CC[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1c(C)noc1C ZINC001620866156 1055494359 /nfs/dbraw/zinc/49/43/59/1055494359.db2.gz FGZKSCBGBBWRNM-INIZCTEOSA-N 1 0 311.429 4.332 20 10 DICDRO Cc1cc(O)c(C[NH+]2CC3CCC(CC3)C2)cc1Br ZINC001237680203 1055502420 /nfs/dbraw/zinc/50/24/20/1055502420.db2.gz ALLWXESBSXQPMD-UHFFFAOYSA-N 1 0 324.262 4.085 20 10 DICDRO Cc1cc(Cl)cc(CN2CCc3ccc(F)cc3C2)c1O ZINC001237686092 1055503146 /nfs/dbraw/zinc/50/31/46/1055503146.db2.gz GUVXLWHQKDBGLX-UHFFFAOYSA-N 1 0 305.780 4.051 20 10 DICDRO Cc1cc(O)c(C[N@@H+](CC2CC2)C(C)C)cc1Br ZINC001237679971 1055503894 /nfs/dbraw/zinc/50/38/94/1055503894.db2.gz XUMSADDSJJWLQR-UHFFFAOYSA-N 1 0 312.251 4.084 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2ccccc2n1 ZINC000765607357 1055510297 /nfs/dbraw/zinc/51/02/97/1055510297.db2.gz BYZVXCINFLEVKV-CQSZACIVSA-N 1 0 304.393 4.021 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccsc2S1 ZINC000765607391 1055511141 /nfs/dbraw/zinc/51/11/41/1055511141.db2.gz DNQPEWFYRMBUHK-NHYWBVRUSA-N 1 0 317.479 4.398 20 10 DICDRO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765610648 1055512878 /nfs/dbraw/zinc/51/28/78/1055512878.db2.gz WSAQYDYZRQKIFK-LBPRGKRZSA-N 1 0 317.816 4.134 20 10 DICDRO CCc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)CCO2 ZINC001620896071 1055521429 /nfs/dbraw/zinc/52/14/29/1055521429.db2.gz YQHILIKVCPINRQ-SFHVURJKSA-N 1 0 311.425 4.179 20 10 DICDRO CCOCc1cc(C[NH2+]CC2C(C)(C)C2(C)C)ccc1OC ZINC001620910659 1055536159 /nfs/dbraw/zinc/53/61/59/1055536159.db2.gz AQXYWHRYOBXVDI-UHFFFAOYSA-N 1 0 305.462 4.004 20 10 DICDRO Fc1ccccc1[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001620918306 1055541443 /nfs/dbraw/zinc/54/14/43/1055541443.db2.gz LCRHJAZZWKHIAZ-QAQDUYKDSA-N 1 0 311.400 4.187 20 10 DICDRO CCO[C@@H](C[NH2+]Cc1c(C)c2ccccc2n1C)c1ccccc1 ZINC001620919465 1055541485 /nfs/dbraw/zinc/54/14/85/1055541485.db2.gz DSBYHDLGGGQAST-NRFANRHFSA-N 1 0 322.452 4.354 20 10 DICDRO Fc1cc(C[NH2+]Cc2ccc3c(c2)CCCO3)c(F)cc1Cl ZINC001620923635 1055543788 /nfs/dbraw/zinc/54/37/88/1055543788.db2.gz PHSWUOIGQPZSFH-UHFFFAOYSA-N 1 0 323.770 4.233 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CCC[C@H]2CC)ccc1OC ZINC001620941223 1055554888 /nfs/dbraw/zinc/55/48/88/1055554888.db2.gz QJDJYLVNVUHFQN-IAGOWNOFSA-N 1 0 305.462 4.148 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CCC[C@@H]2CC)ccc1OC ZINC001620941222 1055555603 /nfs/dbraw/zinc/55/56/03/1055555603.db2.gz QJDJYLVNVUHFQN-DLBZAZTESA-N 1 0 305.462 4.148 20 10 DICDRO Cc1ccc(C2(C[NH2+]Cc3ccc4c(c3)CCO4)CC2)c(C)c1 ZINC001620951870 1055569339 /nfs/dbraw/zinc/56/93/39/1055569339.db2.gz ZITCDVNFUFHKTF-UHFFFAOYSA-N 1 0 307.437 4.060 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3c(F)cccc32)cc1F ZINC001620954170 1055575545 /nfs/dbraw/zinc/57/55/45/1055575545.db2.gz KQSNCNXGAFZTTL-SFHVURJKSA-N 1 0 316.395 4.198 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cccc(-c3cccs3)n1)CC2 ZINC001238213731 1055620865 /nfs/dbraw/zinc/62/08/65/1055620865.db2.gz MPOVIGNNAXMRGO-UHFFFAOYSA-N 1 0 322.433 4.074 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCCC[C@H]2OCC)cc1C ZINC001620968605 1055726077 /nfs/dbraw/zinc/72/60/77/1055726077.db2.gz CHOMWCCLAZGFAO-IEBWSBKVSA-N 1 0 305.462 4.221 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2ccccc2O)cc(C)c1OC(C)C ZINC001238751278 1055740402 /nfs/dbraw/zinc/74/04/02/1055740402.db2.gz CHWXDEFTQQASAL-UHFFFAOYSA-N 1 0 313.441 4.428 20 10 DICDRO CCN(CC)C[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765764837 1055769418 /nfs/dbraw/zinc/76/94/18/1055769418.db2.gz BJEUSICOJYWETE-ZWKOTPCHSA-N 1 0 317.521 4.058 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCc3cc(F)ccc32)cc1 ZINC001649070690 1055880667 /nfs/dbraw/zinc/88/06/67/1055880667.db2.gz ITPDUCYHJJXEPD-YADGQWAMSA-N 1 0 310.416 4.182 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3c2cccc3Cl)cc1F ZINC001649071209 1055883437 /nfs/dbraw/zinc/88/34/37/1055883437.db2.gz ZNKQWRULEMUOGW-KRWDZBQOSA-N 1 0 318.823 4.322 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]C2(c3ccccc3)CCC2)cc1F ZINC001620756744 1055927911 /nfs/dbraw/zinc/92/79/11/1055927911.db2.gz IYPAHTCYECTSDU-UHFFFAOYSA-N 1 0 316.395 4.200 20 10 DICDRO CC(C)C1CCC(C[NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC001620756252 1055928321 /nfs/dbraw/zinc/92/83/21/1055928321.db2.gz IFWPHVSKYSMRFO-UHFFFAOYSA-N 1 0 306.469 4.444 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3ccc(C)cc32)c1 ZINC000186200084 1055933906 /nfs/dbraw/zinc/93/39/06/1055933906.db2.gz DBVKAYHCUUCSRX-KUHUBIRLSA-N 1 0 311.425 4.437 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C/C=C/c2ccccc2)cc1F ZINC001620786117 1055959529 /nfs/dbraw/zinc/95/95/29/1055959529.db2.gz YQSNEBIDHYCBPC-DHZHZOJOSA-N 1 0 312.432 4.475 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C(C)(C)C)oc2C)c1 ZINC001620989434 1055961811 /nfs/dbraw/zinc/96/18/11/1055961811.db2.gz ATMJOAQKMSZJKD-LBPRGKRZSA-N 1 0 317.429 4.451 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)oc2C)c1 ZINC001620989433 1055962247 /nfs/dbraw/zinc/96/22/47/1055962247.db2.gz ATMJOAQKMSZJKD-GFCCVEGCSA-N 1 0 317.429 4.451 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccncc2C)c(C)n1-c1cccc(C)c1 ZINC001621029754 1055992703 /nfs/dbraw/zinc/99/27/03/1055992703.db2.gz JMYWORRJOSSEMD-UHFFFAOYSA-N 1 0 319.452 4.396 20 10 DICDRO C[C@H](Nc1ccc(N2CCCCC2)cn1)c1cc(F)ccc1O ZINC000186281266 1056087783 /nfs/dbraw/zinc/08/77/83/1056087783.db2.gz ANESGRCIMJQFRQ-ZDUSSCGKSA-N 1 0 315.392 4.090 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)c1 ZINC000765818596 1056182974 /nfs/dbraw/zinc/18/29/74/1056182974.db2.gz FUYYNRONXGCYQR-WMLDXEAASA-N 1 0 313.445 4.206 20 10 DICDRO CN(c1ccc(C[NH2+]C[C@@H]2CCSC2)cc1)C1CCCCC1 ZINC000785442777 1056187259 /nfs/dbraw/zinc/18/72/59/1056187259.db2.gz VFDOMGUIYIULJL-KRWDZBQOSA-N 1 0 318.530 4.298 20 10 DICDRO Cc1ccc([C@H](C)NCc2nc(C(C)(C)C)co2)c(O)c1C ZINC000903313716 1056205992 /nfs/dbraw/zinc/20/59/92/1056205992.db2.gz XLRRAUHOHHZMCA-ZDUSSCGKSA-N 1 0 302.418 4.145 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C(F)F)cc1)c1cc(F)cc(F)c1[O-] ZINC000765819981 1056212568 /nfs/dbraw/zinc/21/25/68/1056212568.db2.gz KTDVEVCIJBAARJ-VIFPVBQESA-N 1 0 313.294 4.459 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)c(O)c1 ZINC000765824668 1056274783 /nfs/dbraw/zinc/27/47/83/1056274783.db2.gz VVOCFCGBODEKCV-PBHICJAKSA-N 1 0 313.445 4.206 20 10 DICDRO C[C@H]([NH2+]CCOCC1CC1)c1ccc(N2CCCCCC2)cc1 ZINC000765864623 1056346047 /nfs/dbraw/zinc/34/60/47/1056346047.db2.gz AXOUQFIVLSFICR-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO c1cn2cc(-c3[nH+]ccc4c3ccn4Cc3ccccc3)ccc2n1 ZINC001240214895 1056373899 /nfs/dbraw/zinc/37/38/99/1056373899.db2.gz QRNKVYJKHCJFGC-UHFFFAOYSA-N 1 0 324.387 4.399 20 10 DICDRO C[N@@H+](Cc1ccccc1O)C[C@@H]1CCC[C@H](c2ccccc2)O1 ZINC001615930747 1056596961 /nfs/dbraw/zinc/59/69/61/1056596961.db2.gz DCKMKMXPWJCGRO-AZUAARDMSA-N 1 0 311.425 4.134 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000765957902 1056649336 /nfs/dbraw/zinc/64/93/36/1056649336.db2.gz KVLLGPXQQUSIIU-PXNSSMCTSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@H]([NH2+]CC1CCSCC1)c1ccc(N2CCCCC2)cc1 ZINC000765961497 1056659083 /nfs/dbraw/zinc/65/90/83/1056659083.db2.gz NPKUISDTAJSRDE-INIZCTEOSA-N 1 0 318.530 4.471 20 10 DICDRO COc1cccc2[nH]cc(CC[NH2+][C@@H](C)c3cc(C)ccc3O)c21 ZINC000186507097 1056760952 /nfs/dbraw/zinc/76/09/52/1056760952.db2.gz IQXXJQULTHOHLB-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO C[N@H+](Cc1ccc(F)cc1)Cc1cccc(C(C)(C)C)c1O ZINC001143103581 1056766310 /nfs/dbraw/zinc/76/63/10/1056766310.db2.gz FWJULCROGXHFRJ-UHFFFAOYSA-N 1 0 301.405 4.461 20 10 DICDRO C[N@H+](CCc1cccs1)Cc1cccc(C(C)(C)C)c1O ZINC001143110529 1056778513 /nfs/dbraw/zinc/77/85/13/1056778513.db2.gz IGFDBWUGHRMVFU-UHFFFAOYSA-N 1 0 303.471 4.426 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)c1 ZINC000186511708 1056791101 /nfs/dbraw/zinc/79/11/01/1056791101.db2.gz YDEFLHZHAOERLO-PJSUUKDQSA-N 1 0 311.425 4.293 20 10 DICDRO CCCC[N@H+](CCN(C)c1ccccc1)Cc1ccccc1O ZINC001617538437 1056846212 /nfs/dbraw/zinc/84/62/12/1056846212.db2.gz AIZLQCFMAMOWQQ-UHFFFAOYSA-N 1 0 312.457 4.131 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H](C2CCOCC2)C1)c1ccccc1O ZINC000922330515 1057010024 /nfs/dbraw/zinc/01/00/24/1057010024.db2.gz YLBSKYABIULNGF-DJIMGWMZSA-N 1 0 303.446 4.028 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](c2cnn(C)c2)C(C)C)cc1C ZINC000922891135 1057098920 /nfs/dbraw/zinc/09/89/20/1057098920.db2.gz RQOPDUUBXOONCA-LJQANCHMSA-N 1 0 315.461 4.004 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168739758 1057104566 /nfs/dbraw/zinc/10/45/66/1057104566.db2.gz PKQHAZJVBHPLSF-OAHLLOKOSA-N 1 0 301.817 4.035 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)c1nccs1)c1cc2c(cc1O)CCCC2 ZINC000186740313 1057107048 /nfs/dbraw/zinc/10/70/48/1057107048.db2.gz IRYSMMLKDQLZFZ-QWHCGFSZSA-N 1 0 316.470 4.182 20 10 DICDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)CCC2 ZINC000766030693 1057131407 /nfs/dbraw/zinc/13/14/07/1057131407.db2.gz WGMQRXVIINMRJQ-NRFANRHFSA-N 1 0 324.468 4.237 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000766030653 1057131867 /nfs/dbraw/zinc/13/18/67/1057131867.db2.gz VMNWVGUOENBTEB-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO Cc1nc([C@H]2CCC[N@@H+]2Cc2cc(C)cc(C)c2O)cs1 ZINC000186863549 1057137024 /nfs/dbraw/zinc/13/70/24/1057137024.db2.gz HBMZQUJNSYTADC-MRXNPFEDSA-N 1 0 302.443 4.111 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@H]2Cc3cccc(Cl)c3C2)cc1 ZINC001168744082 1057139546 /nfs/dbraw/zinc/13/95/46/1057139546.db2.gz OLNHURGOLDWYEV-KRWDZBQOSA-N 1 0 314.860 4.005 20 10 DICDRO Cc1cccc2c1CC[C@H]2[NH2+]CCCSc1nccs1 ZINC000766071762 1057284940 /nfs/dbraw/zinc/28/49/40/1057284940.db2.gz APTLQIGWSMVCMK-OAHLLOKOSA-N 1 0 304.484 4.211 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+]CCCSc2nccs2)cc1 ZINC000766071746 1057285305 /nfs/dbraw/zinc/28/53/05/1057285305.db2.gz NROCPHUAEMSPHG-ZDUSSCGKSA-N 1 0 322.499 4.375 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766073625 1057285730 /nfs/dbraw/zinc/28/57/30/1057285730.db2.gz RSADJHJFIIMMFH-KVSKMBFKSA-N 1 0 318.505 4.245 20 10 DICDRO CSC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766073508 1057285793 /nfs/dbraw/zinc/28/57/93/1057285793.db2.gz AMOILEOHVQSXKC-UONOGXRCSA-N 1 0 310.482 4.218 20 10 DICDRO c1csc(SCCC[NH2+][C@@H](Cc2ccccc2)C2CC2)n1 ZINC000766072654 1057285899 /nfs/dbraw/zinc/28/58/99/1057285899.db2.gz KHTGZJHXBSVHBW-INIZCTEOSA-N 1 0 318.511 4.236 20 10 DICDRO CSCC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766083885 1057302380 /nfs/dbraw/zinc/30/23/80/1057302380.db2.gz QMXFFFAZHLGYTE-HZPDHXFCSA-N 1 0 306.519 4.469 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2c(O)cccc2Br)cc1 ZINC000706809759 1057481573 /nfs/dbraw/zinc/48/15/73/1057481573.db2.gz MGWQAKBIQWPBGX-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)C ZINC000766164006 1057530479 /nfs/dbraw/zinc/53/04/79/1057530479.db2.gz WPQSWFDGXDLJFE-CRAIPNDOSA-N 1 0 322.468 4.138 20 10 DICDRO COc1ccc2ccc(O)c(C[NH+]3Cc4ccccc4C3)c2c1 ZINC000729983422 1057699913 /nfs/dbraw/zinc/69/99/13/1057699913.db2.gz QIXGCRQJSQQGGT-UHFFFAOYSA-N 1 0 305.377 4.070 20 10 DICDRO CCc1cc(C[N@H+](C)C[C@H]2CCCOC2)c(O)c(C(C)(C)C)c1 ZINC000730806732 1057726483 /nfs/dbraw/zinc/72/64/83/1057726483.db2.gz KCNUACJNXDSARI-MRXNPFEDSA-N 1 0 319.489 4.111 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCOc3ccccc32)cc1 ZINC000731218170 1057739010 /nfs/dbraw/zinc/73/90/10/1057739010.db2.gz QHRHJILWHZDQHC-SFHVURJKSA-N 1 0 324.468 4.189 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1CC(c2ccc(F)cc2)C1 ZINC000731360987 1057742276 /nfs/dbraw/zinc/74/22/76/1057742276.db2.gz SIJPHCGMMWBOFO-UHFFFAOYSA-N 1 0 305.780 4.221 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccccc2C)cc1F ZINC000731361121 1057742589 /nfs/dbraw/zinc/74/25/89/1057742589.db2.gz UOYGYUGQTGYJGL-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(Cl)nc1 ZINC000731752004 1057753521 /nfs/dbraw/zinc/75/35/21/1057753521.db2.gz JVXWWNXNODSLNQ-UHFFFAOYSA-N 1 0 317.864 4.212 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C[C@H]1CCCc2ccccc21 ZINC000733322676 1057812180 /nfs/dbraw/zinc/81/21/80/1057812180.db2.gz RPLGIYJZDXIZNF-CQSZACIVSA-N 1 0 301.817 4.255 20 10 DICDRO CC1(c2ccccc2)CC([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000733326661 1057813529 /nfs/dbraw/zinc/81/35/29/1057813529.db2.gz RXBCGCCMULLKFN-UHFFFAOYSA-N 1 0 301.817 4.256 20 10 DICDRO Nc1ccc(C[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)cc1 ZINC001246168386 1058711621 /nfs/dbraw/zinc/71/16/21/1058711621.db2.gz CWJUBCIWCPWFBA-OAHLLOKOSA-N 1 0 321.251 4.223 20 10 DICDRO C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]Cc1ccc(N)cc1 ZINC001246169594 1058712064 /nfs/dbraw/zinc/71/20/64/1058712064.db2.gz IGGRUMOJIWNOJO-NSHDSACASA-N 1 0 324.802 4.311 20 10 DICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCC(C)(C)CO1 ZINC001559492683 1059269293 /nfs/dbraw/zinc/26/92/93/1059269293.db2.gz ZNLIKCOGXTZGEZ-IBGZPJMESA-N 1 0 318.505 4.168 20 10 DICDRO CCN(C)c1ccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)cc1 ZINC001559529876 1059328445 /nfs/dbraw/zinc/32/84/45/1059328445.db2.gz CWJKWQRZLQTPIN-UHFFFAOYSA-N 1 0 324.468 4.261 20 10 DICDRO Cc1cc(C[NH+]2CCC(C(F)F)CC2)ccc1N1CCCCC1 ZINC001559596890 1059432714 /nfs/dbraw/zinc/43/27/14/1059432714.db2.gz STHYJMRYRFEZSN-UHFFFAOYSA-N 1 0 322.443 4.462 20 10 DICDRO CCC1(CC)[C@H]([N@H+](C)Cc2ccc(N(C)C)c(C)c2)C[C@@H]1OC ZINC001559612364 1059443406 /nfs/dbraw/zinc/44/34/06/1059443406.db2.gz ULUTVUORQBHSMD-MOPGFXCFSA-N 1 0 318.505 4.087 20 10 DICDRO CCC[C@H](O)C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC001559659036 1059488727 /nfs/dbraw/zinc/48/87/27/1059488727.db2.gz YOKAFZMGYDKLQL-LPHOPBHVSA-N 1 0 313.441 4.116 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2ccc3c(c2)CCC3)cc1 ZINC001559703860 1059533588 /nfs/dbraw/zinc/53/35/88/1059533588.db2.gz SXVYHEPDPQXDNF-MRXNPFEDSA-N 1 0 308.469 4.482 20 10 DICDRO CCS[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)CC)cc1 ZINC001559762908 1059601207 /nfs/dbraw/zinc/60/12/07/1059601207.db2.gz XEEWSMWBOUCNHE-MSOLQXFVSA-N 1 0 306.519 4.297 20 10 DICDRO COc1ccc(N(CC2CC2)C[C@@H]2CCCC[N@@H+]2C(C)C)cc1 ZINC001559848699 1059674412 /nfs/dbraw/zinc/67/44/12/1059674412.db2.gz ZQKIWZIOJSAHDT-IBGZPJMESA-N 1 0 316.489 4.175 20 10 DICDRO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)cs1)c1ccccc1O ZINC001560075189 1059885032 /nfs/dbraw/zinc/88/50/32/1059885032.db2.gz VVJHWUOQACLKML-CYBMUJFWSA-N 1 0 310.422 4.367 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(Cl)cc2cccnc21)c1ccccc1O ZINC001560073692 1059886184 /nfs/dbraw/zinc/88/61/84/1059886184.db2.gz BPQXMTUQGXGRCQ-GFCCVEGCSA-N 1 0 312.800 4.445 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(F)c2F)cc1 ZINC001560274402 1060048789 /nfs/dbraw/zinc/04/87/89/1060048789.db2.gz KXOKFYCMNQBUBY-UHFFFAOYSA-N 1 0 304.384 4.101 20 10 DICDRO CC(C)COc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC001560288704 1060068407 /nfs/dbraw/zinc/06/84/07/1060068407.db2.gz NPZBIZJZWIJPPF-UHFFFAOYSA-N 1 0 319.832 4.370 20 10 DICDRO Cc1ccc(OCCC[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001560300463 1060085314 /nfs/dbraw/zinc/08/53/14/1060085314.db2.gz BNVHEOSMLZVACA-GQCTYLIASA-N 1 0 324.468 4.133 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C1CCCCC1 ZINC001560302699 1060090117 /nfs/dbraw/zinc/09/01/17/1060090117.db2.gz IGPVROSEFQTNCC-QGZVFWFLSA-N 1 0 310.432 4.479 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C1CCCCC1 ZINC001560302698 1060090386 /nfs/dbraw/zinc/09/03/86/1060090386.db2.gz IGPVROSEFQTNCC-KRWDZBQOSA-N 1 0 310.432 4.479 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H](C)c2cccc(F)c2)c(Cl)c1 ZINC001560317673 1060104867 /nfs/dbraw/zinc/10/48/67/1060104867.db2.gz ZWRBINDDANSBEQ-LBPRGKRZSA-N 1 0 307.796 4.386 20 10 DICDRO Cc1ccc(C[C@@H](C)[NH2+]C/C=C\c2ccc(N(C)C)cc2)s1 ZINC001560342835 1060127712 /nfs/dbraw/zinc/12/77/12/1060127712.db2.gz ITEWTSXMOATRDK-IYKSTZQJSA-N 1 0 314.498 4.357 20 10 DICDRO Cc1ccc(C[C@H](C)[NH2+]C/C=C/c2ccc(N(C)C)cc2)s1 ZINC001560342837 1060128453 /nfs/dbraw/zinc/12/84/53/1060128453.db2.gz ITEWTSXMOATRDK-NFAHFFEMSA-N 1 0 314.498 4.357 20 10 DICDRO COc1ccc(C[NH2+]CC2(c3cccc(Cl)c3)CC2)cc1C ZINC001560344983 1060130376 /nfs/dbraw/zinc/13/03/76/1060130376.db2.gz CWPNIDJSRAETJB-UHFFFAOYSA-N 1 0 315.844 4.478 20 10 DICDRO Oc1cccc(Br)c1C[NH2+][C@H]1C[C@H]1C1CCCCC1 ZINC001560359352 1060145081 /nfs/dbraw/zinc/14/50/81/1060145081.db2.gz JDQLEFYLYGHFRG-WFASDCNBSA-N 1 0 324.262 4.213 20 10 DICDRO CCC1(C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CCC1 ZINC001560369467 1060154560 /nfs/dbraw/zinc/15/45/60/1060154560.db2.gz YEOJIWUUKAVSOW-UHFFFAOYSA-N 1 0 305.462 4.368 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001560379801 1060165460 /nfs/dbraw/zinc/16/54/60/1060165460.db2.gz APNUABITPURZET-XJDXJNMNSA-N 1 0 322.452 4.052 20 10 DICDRO c1ccc(CC2(C[NH2+]Cc3ccc4c(c3)CCO4)CCC2)cc1 ZINC001560381680 1060169258 /nfs/dbraw/zinc/16/92/58/1060169258.db2.gz LDPCUTHMFUDECA-UHFFFAOYSA-N 1 0 307.437 4.124 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CC(C)(C)c3ccccc32)cc1F ZINC001560384941 1060171677 /nfs/dbraw/zinc/17/16/77/1060171677.db2.gz CHIWKKBGHIGHDF-SFHVURJKSA-N 1 0 312.432 4.404 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[NH+]3C[C@@H]4CCCC[C@H]4C3)ccc2O1 ZINC001249223994 1060193292 /nfs/dbraw/zinc/19/32/92/1060193292.db2.gz QGVLGWAPMDRFRH-GJZGRUSLSA-N 1 0 313.441 4.198 20 10 DICDRO CCC[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)CC1CC1 ZINC001249223224 1060193917 /nfs/dbraw/zinc/19/39/17/1060193917.db2.gz BUOZVRKKZXJKLZ-UHFFFAOYSA-N 1 0 301.430 4.198 20 10 DICDRO C[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001560416688 1060201903 /nfs/dbraw/zinc/20/19/03/1060201903.db2.gz VQEUGTDEDCDTCC-VLIAUNLRSA-N 1 0 312.432 4.305 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C2(Cc3ccccc3)CC2)cc1 ZINC001560445268 1060237209 /nfs/dbraw/zinc/23/72/09/1060237209.db2.gz PWRMDVQFZSVVRX-RMKNXTFCSA-N 1 0 306.453 4.131 20 10 DICDRO Fc1cccc([C@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)c1 ZINC001560463237 1060254353 /nfs/dbraw/zinc/25/43/53/1060254353.db2.gz KOOAIDFZLHMSDZ-LPHOPBHVSA-N 1 0 311.400 4.187 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H]2CCO[C@H](C(C)C)C2)cc1C ZINC001560479187 1060268732 /nfs/dbraw/zinc/26/87/32/1060268732.db2.gz ZQUFSWHXVKDBSL-ICSRJNTNSA-N 1 0 319.489 4.325 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](CO)CC2CCCCC2)cc1C ZINC001560510246 1060306489 /nfs/dbraw/zinc/30/64/89/1060306489.db2.gz LGKALDZTPHWHSE-IBGZPJMESA-N 1 0 319.489 4.205 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)CCc2ccccc2)c1 ZINC001560519454 1060318572 /nfs/dbraw/zinc/31/85/72/1060318572.db2.gz DBWLDSNNBKRANG-CVEARBPZSA-N 1 0 313.441 4.320 20 10 DICDRO CC[C@@H]1CCC[C@@H](C[NH2+][C@@H]2CCN(c3ccc(OC)cc3)C2)C1 ZINC001560529136 1060330103 /nfs/dbraw/zinc/33/01/03/1060330103.db2.gz SSJDGGAPLUNVCS-KZNAEPCWSA-N 1 0 316.489 4.080 20 10 DICDRO CC[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCN(c3ccc(OC)cc3)C2)C1 ZINC001560529134 1060330350 /nfs/dbraw/zinc/33/03/50/1060330350.db2.gz SSJDGGAPLUNVCS-FGTMMUONSA-N 1 0 316.489 4.080 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C2CCC2)[C@@H]2CCCO2)cc1C ZINC001560547843 1060358796 /nfs/dbraw/zinc/35/87/96/1060358796.db2.gz STNUCPUCBSKVTE-VQTJNVASSA-N 1 0 317.473 4.221 20 10 DICDRO CC[C@H]1C[C@H]([NH2+]Cc2cc(C)n(-c3ccccc3)c2C)CCO1 ZINC001560556418 1060367689 /nfs/dbraw/zinc/36/76/89/1060367689.db2.gz XBBBLBCFFVIASN-QUCCMNQESA-N 1 0 312.457 4.141 20 10 DICDRO CCC[C@H](C)CC[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC001560573254 1060388653 /nfs/dbraw/zinc/38/86/53/1060388653.db2.gz PESYWAYCBCAZQC-INIZCTEOSA-N 1 0 304.478 4.080 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cscc2Cl)c(Cl)c1 ZINC001560590838 1060404555 /nfs/dbraw/zinc/40/45/55/1060404555.db2.gz GLDDRNUYCJCFJL-UHFFFAOYSA-N 1 0 302.226 4.359 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCC1(c2ccccc2)CC1 ZINC001560594696 1060407798 /nfs/dbraw/zinc/40/77/98/1060407798.db2.gz VUZKDFQOFOPDFX-UHFFFAOYSA-N 1 0 301.817 4.257 20 10 DICDRO CCc1cccc(C[NH+]2CCC(c3ccccc3F)CC2)c1O ZINC001560655978 1060480117 /nfs/dbraw/zinc/48/01/17/1060480117.db2.gz PEUFHGUSFDFUFJ-UHFFFAOYSA-N 1 0 313.416 4.473 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)cc1 ZINC001560662042 1060487716 /nfs/dbraw/zinc/48/77/16/1060487716.db2.gz OHOGHWMAFKIWPJ-CQQBRXBZSA-N 1 0 316.514 4.126 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)cc1 ZINC001560662041 1060487830 /nfs/dbraw/zinc/48/78/30/1060487830.db2.gz OHOGHWMAFKIWPJ-ASIGSXEYSA-N 1 0 316.514 4.126 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC001560665090 1060493079 /nfs/dbraw/zinc/49/30/79/1060493079.db2.gz MACGAEQYQDDNOU-HCZHMGAMSA-N 1 0 306.453 4.255 20 10 DICDRO CCC[N@H+](Cc1ccc(C)cc1O)Cc1ccc(F)cc1F ZINC001560695327 1060547835 /nfs/dbraw/zinc/54/78/35/1060547835.db2.gz FQGODEUSAWJICY-UHFFFAOYSA-N 1 0 305.368 4.391 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@H](C)c2ccccc2F)c1O ZINC001560717850 1060577653 /nfs/dbraw/zinc/57/76/53/1060577653.db2.gz ANVQHYJVPSDJLP-CYBMUJFWSA-N 1 0 303.377 4.041 20 10 DICDRO CC(C)[C@H](C)[N@H+](Cc1c(O)cccc1Br)C1CC1 ZINC001560724719 1060588114 /nfs/dbraw/zinc/58/81/14/1060588114.db2.gz SMEOOGDTTVIXEJ-NSHDSACASA-N 1 0 312.251 4.164 20 10 DICDRO CCCC[N@H+](Cc1c(Cl)n[nH]c1CC)Cc1ccccc1O ZINC001560784075 1060644725 /nfs/dbraw/zinc/64/47/25/1060644725.db2.gz PXPVLVJYKFYNGE-UHFFFAOYSA-N 1 0 321.852 4.133 20 10 DICDRO CCCN(Cc1ccc(CC(C)C)nc1)c1ccc(C[NH3+])cc1 ZINC001560808366 1060668767 /nfs/dbraw/zinc/66/87/67/1060668767.db2.gz IYEMVRBRAMWHPZ-UHFFFAOYSA-N 1 0 311.473 4.155 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)Cc2cc(C)cc(C)c2)c1O ZINC001560808886 1060669336 /nfs/dbraw/zinc/66/93/36/1060669336.db2.gz SSLMXMRBGSPEND-UHFFFAOYSA-N 1 0 319.832 4.303 20 10 DICDRO Cc1ccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)c(O)c1 ZINC001560834569 1060691097 /nfs/dbraw/zinc/69/10/97/1060691097.db2.gz QTQMEYRMOOGZOE-UHFFFAOYSA-N 1 0 321.342 4.498 20 10 DICDRO CSC(C)(C)CC[NH2+][C@H](C)Cc1ccc(N(C)C)cc1C ZINC001560891101 1060753657 /nfs/dbraw/zinc/75/36/57/1060753657.db2.gz YJULLYGWAUJLNB-OAHLLOKOSA-N 1 0 308.535 4.113 20 10 DICDRO Nc1ccc(Cc2ccc(Nc3ccc4c[nH+]cn4c3)cc2)cc1 ZINC001250330853 1060783994 /nfs/dbraw/zinc/78/39/94/1060783994.db2.gz FUQHZOPKTVVADL-UHFFFAOYSA-N 1 0 314.392 4.251 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+][C@H](C)CCC3CCCC3)C2)cc1 ZINC001560928003 1060792313 /nfs/dbraw/zinc/79/23/13/1060792313.db2.gz HLILUPGUOAFOQH-SJLPKXTDSA-N 1 0 316.489 4.222 20 10 DICDRO Cc1ccc(CC2C[NH+](Cc3cc(C(C)C)ccc3O)C2)cc1 ZINC001560935407 1060796327 /nfs/dbraw/zinc/79/63/27/1060796327.db2.gz WDVDXKSRGZSQCX-UHFFFAOYSA-N 1 0 309.453 4.499 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC([C@H]3CCCCO3)CC2)c(Cl)c1 ZINC001560934176 1060797850 /nfs/dbraw/zinc/79/78/50/1060797850.db2.gz KNKHZZCLRUHOJC-GOSISDBHSA-N 1 0 323.864 4.135 20 10 DICDRO CC1(C)CC([NH2+]Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001560941497 1060804943 /nfs/dbraw/zinc/80/49/43/1060804943.db2.gz QHPFCHKYFCYCQB-UHFFFAOYSA-N 1 0 311.425 4.249 20 10 DICDRO COc1cc(O)c(C[NH2+][C@@H]2CCC[C@@H](C(C)C)CC2)cc1OC ZINC001462125124 1060947525 /nfs/dbraw/zinc/94/75/25/1060947525.db2.gz ICCMFOZYYJLUAU-GDBMZVCRSA-N 1 0 321.461 4.104 20 10 DICDRO CCCN(Cc1c(F)cccc1OCC)c1ccc(C[NH3+])cc1 ZINC001462188731 1061009883 /nfs/dbraw/zinc/00/98/83/1061009883.db2.gz LUUZJLDMBQBPIF-UHFFFAOYSA-N 1 0 316.420 4.100 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCC[C@H](C(C)(C)C)CC2)c1O ZINC001462189557 1061011343 /nfs/dbraw/zinc/01/13/43/1061011343.db2.gz CENMTUITQTXLEM-JKSUJKDBSA-N 1 0 305.462 4.485 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCC[C@H](C(C)(C)C)CC2)c1O ZINC001462189554 1061011961 /nfs/dbraw/zinc/01/19/61/1061011961.db2.gz CENMTUITQTXLEM-HOTGVXAUSA-N 1 0 305.462 4.485 20 10 DICDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001462204279 1061025050 /nfs/dbraw/zinc/02/50/50/1061025050.db2.gz UIRGINSDXOTXFH-UKRRQHHQSA-N 1 0 305.462 4.461 20 10 DICDRO CSCC1CCC([NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC001462279126 1061073564 /nfs/dbraw/zinc/07/35/64/1061073564.db2.gz YAOJXVBOSZWFAL-UHFFFAOYSA-N 1 0 313.894 4.365 20 10 DICDRO CCCc1nc(C)c(C[NH2+]Cc2cc(C(C)C)ccc2O)o1 ZINC001462302037 1061090941 /nfs/dbraw/zinc/09/09/41/1061090941.db2.gz BGAOPQUFAZSAPJ-UHFFFAOYSA-N 1 0 302.418 4.054 20 10 DICDRO COCC1(C[NH2+]Cc2cc(C(C)C)ccc2O)CCCCC1 ZINC001462301965 1061091756 /nfs/dbraw/zinc/09/17/56/1061091756.db2.gz ACZWELRCXCRQTK-UHFFFAOYSA-N 1 0 305.462 4.202 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cc2c(ccnc2Cl)o1 ZINC001462391567 1061146232 /nfs/dbraw/zinc/14/62/32/1061146232.db2.gz GFPMPTYPDVARAB-UHFFFAOYSA-N 1 0 323.179 4.130 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2C2CCC2)c1O ZINC001462408914 1061155741 /nfs/dbraw/zinc/15/57/41/1061155741.db2.gz GOEVUNCSQCYCPN-OAHLLOKOSA-N 1 0 309.837 4.209 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CC[C@H](C3CCCCC3)C2)cc1F ZINC001462414073 1061158405 /nfs/dbraw/zinc/15/84/05/1061158405.db2.gz ONIIKHNOWFDUSF-HNNXBMFYSA-N 1 0 322.443 4.433 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)cc1F ZINC001462414074 1061158936 /nfs/dbraw/zinc/15/89/36/1061158936.db2.gz ONIIKHNOWFDUSF-OAHLLOKOSA-N 1 0 322.443 4.433 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]C[C@@H]1CC=CC[C@H]1C(F)(F)F ZINC001462516028 1061224738 /nfs/dbraw/zinc/22/47/38/1061224738.db2.gz CMBUSMBQVJYCJZ-GXFFZTMASA-N 1 0 319.754 4.280 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCO[C@H](c2ccccc2)CC1 ZINC001462681732 1061335759 /nfs/dbraw/zinc/33/57/59/1061335759.db2.gz YWSJGQXASGJSSS-NRFANRHFSA-N 1 0 324.468 4.025 20 10 DICDRO CCOc1cccc(Cl)c1C[NH2+][C@H](C)c1ccccc1O ZINC001473723000 1061370521 /nfs/dbraw/zinc/37/05/21/1061370521.db2.gz VALKLWZXXJMTIH-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCC[C@H]2Cc2ccc(O)cc2)cc1 ZINC001473875737 1061444361 /nfs/dbraw/zinc/44/43/61/1061444361.db2.gz WZVVGYSUILIRHS-FQEVSTJZSA-N 1 0 324.468 4.055 20 10 DICDRO c1ccc2c(c1)CCC[C@H]2C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001251724214 1061458636 /nfs/dbraw/zinc/45/86/36/1061458636.db2.gz IYARPBQPVUGSTI-FQEVSTJZSA-N 1 0 320.480 4.497 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCc2cccc(Cl)c2)cc1 ZINC001473913776 1061461302 /nfs/dbraw/zinc/46/13/02/1061461302.db2.gz BUCUOTFYSQGKOK-GQCTYLIASA-N 1 0 314.860 4.252 20 10 DICDRO c1ccc2c(c1)SCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001473915371 1061463772 /nfs/dbraw/zinc/46/37/72/1061463772.db2.gz UZNWNPLCEUVVRF-KRWDZBQOSA-N 1 0 311.450 4.338 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1F ZINC001473918321 1061465199 /nfs/dbraw/zinc/46/51/99/1061465199.db2.gz PSTADSIMHOWSLB-SQWLQELKSA-N 1 0 322.443 4.479 20 10 DICDRO CC(C)(C)Oc1cccc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC001473970727 1061516553 /nfs/dbraw/zinc/51/65/53/1061516553.db2.gz ZQKQICDVRRJJMS-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C/C=C/c1ccc(F)cc1F ZINC001473995355 1061537969 /nfs/dbraw/zinc/53/79/69/1061537969.db2.gz HJCJDBOKCJLAGI-SNAWJCMRSA-N 1 0 316.395 4.142 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc(N(C)C)cc2C)c(Cl)c1 ZINC001473996326 1061539276 /nfs/dbraw/zinc/53/92/76/1061539276.db2.gz RBIFLGOYEYOHMK-UHFFFAOYSA-N 1 0 318.848 4.018 20 10 DICDRO CCOCc1cc(C[NH2+]Cc2ccccc2CC)ccc1OC ZINC001474015613 1061557877 /nfs/dbraw/zinc/55/78/77/1061557877.db2.gz DBCGNUVIWKWMKB-UHFFFAOYSA-N 1 0 313.441 4.084 20 10 DICDRO c1csc(SCCC[NH2+]Cc2ccc3c(c2)CCCC3)n1 ZINC001474018300 1061558981 /nfs/dbraw/zinc/55/89/81/1061558981.db2.gz HHBLHQJMHFSUCR-UHFFFAOYSA-N 1 0 318.511 4.294 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](CC)[C@H]2CCCO2)cc1 ZINC001474099237 1061645550 /nfs/dbraw/zinc/64/55/50/1061645550.db2.gz IEILFENISWDFNO-VQTJNVASSA-N 1 0 318.505 4.360 20 10 DICDRO CC1CCC(C)(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC001474136215 1061684754 /nfs/dbraw/zinc/68/47/54/1061684754.db2.gz WSJVVAXIEOYMTB-UHFFFAOYSA-N 1 0 310.432 4.337 20 10 DICDRO CSCC1CCC([NH2+]Cc2c(O)cc(C)cc2Cl)CC1 ZINC001474159078 1061701740 /nfs/dbraw/zinc/70/17/40/1061701740.db2.gz GAHOSODMEYHOET-UHFFFAOYSA-N 1 0 313.894 4.365 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H]2COc3ccccc32)cc1C ZINC001474167727 1061713412 /nfs/dbraw/zinc/71/34/12/1061713412.db2.gz QABDAENQDFSDQO-QGZVFWFLSA-N 1 0 311.425 4.050 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cnccc1C(C)(C)C ZINC001474178389 1061723286 /nfs/dbraw/zinc/72/32/86/1061723286.db2.gz GVENGJPHMVDKOS-UHFFFAOYSA-N 1 0 321.468 4.469 20 10 DICDRO CCc1ccc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)s1 ZINC001474185028 1061732749 /nfs/dbraw/zinc/73/27/49/1061732749.db2.gz MCBROXQMCXDFPY-OAHLLOKOSA-N 1 0 316.514 4.406 20 10 DICDRO Cc1ccccc1C1([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC001474189074 1061738938 /nfs/dbraw/zinc/73/89/38/1061738938.db2.gz NYBCEVJLHFHCGO-SOFGYWHQSA-N 1 0 306.453 4.353 20 10 DICDRO Cc1ccc(CC[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1C ZINC001474205377 1061760932 /nfs/dbraw/zinc/76/09/32/1061760932.db2.gz WIZYRLGNWPNMGJ-AATRIKPKSA-N 1 0 308.469 4.215 20 10 DICDRO COc1ccc(C[NH2+]CC2CCc3ccccc3CC2)cc1C ZINC001474220784 1061779951 /nfs/dbraw/zinc/77/99/51/1061779951.db2.gz QGBGQTNDNZKULR-UHFFFAOYSA-N 1 0 309.453 4.288 20 10 DICDRO COc1ccc(C[NH2+]CCc2cc(C)n(-c3ccccc3)c2C)o1 ZINC001474227404 1061789097 /nfs/dbraw/zinc/78/90/97/1061789097.db2.gz KZYRPHGEILWTGU-UHFFFAOYSA-N 1 0 324.424 4.028 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2C[C@H]2C(F)(F)F)cc1 ZINC001474244994 1061808632 /nfs/dbraw/zinc/80/86/32/1061808632.db2.gz NXSOCMJOMUIWEG-HZPDHXFCSA-N 1 0 314.395 4.353 20 10 DICDRO COc1cc(C[NH2+]C[C@H](C)C(C)(C)C)c(O)c(C(C)(C)C)c1 ZINC001474269045 1061835912 /nfs/dbraw/zinc/83/59/12/1061835912.db2.gz ARFWHLKHOGUVHY-ZDUSSCGKSA-N 1 0 307.478 4.470 20 10 DICDRO Cc1cc(F)c(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)c(F)c1 ZINC001474278711 1061847561 /nfs/dbraw/zinc/84/75/61/1061847561.db2.gz RSTDXSZVLFISEL-PLNGDYQASA-N 1 0 316.395 4.142 20 10 DICDRO C[C@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)[C@H]1C ZINC001474309491 1061877571 /nfs/dbraw/zinc/87/75/71/1061877571.db2.gz HPKWKHMTWUTTAD-STQMWFEESA-N 1 0 314.395 4.392 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+](C)[C@H](C)C2(C)CC2)c1O ZINC001474330491 1061917530 /nfs/dbraw/zinc/91/75/30/1061917530.db2.gz XPXLRJVTWUWXIG-LLVKDONJSA-N 1 0 312.251 4.084 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CC(C)(C)[C@H]2c2ccccc2)c(O)c1 ZINC001474341064 1061943242 /nfs/dbraw/zinc/94/32/42/1061943242.db2.gz IOUBPTKFWFGVOO-LJQANCHMSA-N 1 0 311.425 4.292 20 10 DICDRO CC(C)[N@H+](Cc1cccn1C1CC1)Cc1ccc(N(C)C)cc1 ZINC001474347487 1061953853 /nfs/dbraw/zinc/95/38/53/1061953853.db2.gz RNXMHQABQBTKRC-UHFFFAOYSA-N 1 0 311.473 4.300 20 10 DICDRO COc1cc(C)c(C[NH+]2CCC(CCC(C)C)CC2)c(O)c1 ZINC001474354779 1061968831 /nfs/dbraw/zinc/96/88/31/1061968831.db2.gz WBQRIQQGPAMORM-UHFFFAOYSA-N 1 0 305.462 4.357 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+](Cc1ccc(F)cc1)CC1CC1 ZINC001474356578 1061973208 /nfs/dbraw/zinc/97/32/08/1061973208.db2.gz LZSNBZYTLLXDFQ-UHFFFAOYSA-N 1 0 303.352 4.083 20 10 DICDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001474360600 1061988026 /nfs/dbraw/zinc/98/80/26/1061988026.db2.gz BQQGEWVSQXHLMF-DYVFJYSZSA-N 1 0 310.432 4.431 20 10 DICDRO CC[C@H](C)[C@H](C)[N@H+](Cc1cc(Cl)cc(OC)c1O)C1CC1 ZINC001474366996 1061997272 /nfs/dbraw/zinc/99/72/72/1061997272.db2.gz KLTXSJWSUFMUQZ-RYUDHWBXSA-N 1 0 311.853 4.453 20 10 DICDRO CCCO[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001254011112 1062010592 /nfs/dbraw/zinc/01/05/92/1062010592.db2.gz ULOQIIAEPPANQM-FQEVSTJZSA-N 1 0 316.489 4.068 20 10 DICDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(Cl)cc2O)s1 ZINC001474380178 1062023432 /nfs/dbraw/zinc/02/34/32/1062023432.db2.gz NBFKCEJONVXNKW-SNVBAGLBSA-N 1 0 310.850 4.312 20 10 DICDRO CC(C)[C@@H]1CCCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001474390523 1062040911 /nfs/dbraw/zinc/04/09/11/1062040911.db2.gz GPYDRACRYPABMO-KRWDZBQOSA-N 1 0 310.432 4.431 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@H+](C)[C@@H]2CCc3ccccc32)cc1 ZINC001474413027 1062076224 /nfs/dbraw/zinc/07/62/24/1062076224.db2.gz QYPIWSAQFMCZHS-IRUYWQDXSA-N 1 0 306.453 4.385 20 10 DICDRO CC[C@@H]1CCC[C@H](CN(C)c2ccc(OCC[NH+](C)C)cc2)C1 ZINC001474421996 1062096229 /nfs/dbraw/zinc/09/62/29/1062096229.db2.gz PNHRKVNEBFDVDH-MSOLQXFVSA-N 1 0 318.505 4.280 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c1O ZINC001474429217 1062103592 /nfs/dbraw/zinc/10/35/92/1062103592.db2.gz FJZTVCJWAIMNGY-LBPRGKRZSA-N 1 0 309.837 4.066 20 10 DICDRO COc1cc(C)c(C[N@H+](C)Cc2ccc(F)c(Cl)c2)c(O)c1 ZINC001474442205 1062121397 /nfs/dbraw/zinc/12/13/97/1062121397.db2.gz JDZFCMFBIKAOTP-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO CCC[C@]1(COC)CCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001474476802 1062153622 /nfs/dbraw/zinc/15/36/22/1062153622.db2.gz IKPSPAICTOBPCS-LQOHYYORSA-N 1 0 316.489 4.047 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)c(Cl)c1 ZINC001474474319 1062154368 /nfs/dbraw/zinc/15/43/68/1062154368.db2.gz GGLPHTKVIXULMR-GOSISDBHSA-N 1 0 319.807 4.425 20 10 DICDRO COc1ccc(O)c(C[NH2+]CC[C@@H]2C[C@@H](C)CC(C)(C)C2)c1 ZINC001474484028 1062164255 /nfs/dbraw/zinc/16/42/55/1062164255.db2.gz MECPCIMOAXBGCI-HUUCEWRRSA-N 1 0 305.462 4.343 20 10 DICDRO CCC1(CC)CCC([NH2+]Cc2cc(OC)c(OC)cc2O)CC1 ZINC001474487176 1062168295 /nfs/dbraw/zinc/16/82/95/1062168295.db2.gz HHSFUXRDCIEFHM-UHFFFAOYSA-N 1 0 321.461 4.248 20 10 DICDRO CCCN(Cc1c(F)cccc1CC)c1ccc(C[NH3+])cc1 ZINC001474495777 1062176146 /nfs/dbraw/zinc/17/61/46/1062176146.db2.gz OXUYCCDJEOCAMT-UHFFFAOYSA-N 1 0 300.421 4.263 20 10 DICDRO CO[C@@H](C)C[N@H+](Cc1ccc(N2CCCCC2)c(C)c1)C(C)C ZINC001459527129 1062185308 /nfs/dbraw/zinc/18/53/08/1062185308.db2.gz RSTDYAVUBDISQX-SFHVURJKSA-N 1 0 318.505 4.231 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CC(C)(C)OC1(C)C ZINC001459553972 1062205715 /nfs/dbraw/zinc/20/57/15/1062205715.db2.gz IJOXPYWFDOZHJL-MRXNPFEDSA-N 1 0 305.462 4.198 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCCC2(CCC2)O1 ZINC001459558551 1062206939 /nfs/dbraw/zinc/20/69/39/1062206939.db2.gz WNBAWDSRVRWGDV-QGZVFWFLSA-N 1 0 303.446 4.096 20 10 DICDRO CCC[N@H+](CCCc1cccc(F)c1)Cc1ccccc1O ZINC001459558486 1062209161 /nfs/dbraw/zinc/20/91/61/1062209161.db2.gz WAHNIPPDLJQGIT-UHFFFAOYSA-N 1 0 301.405 4.376 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)COc1ccccc1F)c1cc(Cl)ccc1O ZINC001254721284 1062237793 /nfs/dbraw/zinc/23/77/93/1062237793.db2.gz ONGXLOJOEHNHBG-NWDGAFQWSA-N 1 0 323.795 4.303 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N(C)C)cc1)c1cc(Cl)ccc1O ZINC001254720923 1062238194 /nfs/dbraw/zinc/23/81/94/1062238194.db2.gz CMUDMXDPUIFLLC-CYBMUJFWSA-N 1 0 318.848 4.005 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@@H](c3ccccc3)[C@@H]2C)c1 ZINC001474544438 1062238619 /nfs/dbraw/zinc/23/86/19/1062238619.db2.gz HFUMBQDQKNTDDG-ZRGWGRIASA-N 1 0 311.425 4.167 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH+]2CC(c3ccc(F)cc3)C2)cc1 ZINC001474567449 1062272741 /nfs/dbraw/zinc/27/27/41/1062272741.db2.gz JQAZLZSGYOGLRT-ONEGZZNKSA-N 1 0 310.416 4.004 20 10 DICDRO Cc1cc(Br)cc(C[NH+]2CC(C3CCCC3)C2)c1O ZINC001474569519 1062276438 /nfs/dbraw/zinc/27/64/38/1062276438.db2.gz CHFLMEOPAKISKY-UHFFFAOYSA-N 1 0 324.262 4.085 20 10 DICDRO Cc1cc(Br)cc(C[N@H+]2CC(C)(C)C[C@H]2C)c1O ZINC001474582634 1062293486 /nfs/dbraw/zinc/29/34/86/1062293486.db2.gz LRCVKVNFNMOEFY-LLVKDONJSA-N 1 0 312.251 4.084 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C1(c2ccccc2Cl)CC1 ZINC001474594607 1062306995 /nfs/dbraw/zinc/30/69/95/1062306995.db2.gz JWMURXSUSRYSCA-UHFFFAOYSA-N 1 0 314.860 4.493 20 10 DICDRO Cc1ccc(C[NH2+]Cc2cccc(Br)c2C)c(O)c1 ZINC001474601918 1062316526 /nfs/dbraw/zinc/31/65/26/1062316526.db2.gz GKNJFBFDGQFNOC-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO CC(C)(C)O[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C1(C)C ZINC001474608808 1062322314 /nfs/dbraw/zinc/32/23/14/1062322314.db2.gz JUYABYCVRZWZFT-CABCVRRESA-N 1 0 311.853 4.117 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]CC1(c2ccccc2F)CCC1 ZINC001474610905 1062326391 /nfs/dbraw/zinc/32/63/91/1062326391.db2.gz DGTIUFXSJNQXFH-UHFFFAOYSA-N 1 0 319.807 4.396 20 10 DICDRO CC[C@H]1CCC[C@H](C[N@H+](C)CCN(C)c2ccc(OC)cc2)C1 ZINC001474612429 1062328090 /nfs/dbraw/zinc/32/80/90/1062328090.db2.gz IAKNIIUAXZTLAM-ROUUACIJSA-N 1 0 318.505 4.280 20 10 DICDRO Oc1ccccc1C[N@H+](CCCC1CCCC1)C[C@@H]1CCCO1 ZINC001459736586 1062349511 /nfs/dbraw/zinc/34/95/11/1062349511.db2.gz WCWUBRIUOKQCRX-IBGZPJMESA-N 1 0 317.473 4.344 20 10 DICDRO C[C@H](C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1)C(C)(C)C ZINC001459743604 1062355228 /nfs/dbraw/zinc/35/52/28/1062355228.db2.gz XYINWHZICAEBTO-NVXWUHKLSA-N 1 0 305.462 4.055 20 10 DICDRO COc1cccc2c(C[NH2+]Cc3cc(C)ccc3O)cccc12 ZINC001474635240 1062359310 /nfs/dbraw/zinc/35/93/10/1062359310.db2.gz QTTGBCZCPAXAHM-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1(CC)CC ZINC001459756249 1062366986 /nfs/dbraw/zinc/36/69/86/1062366986.db2.gz VKDYPLXKCPFWCN-RBUKOAKNSA-N 1 0 318.505 4.168 20 10 DICDRO CC1(C)C[C@]1([NH2+]Cc1ccc(Cl)cc1O)c1ccccc1 ZINC001474647603 1062376004 /nfs/dbraw/zinc/37/60/04/1062376004.db2.gz QUWWQQYTHUAALZ-SFHVURJKSA-N 1 0 301.817 4.461 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CSC[C@H]2C)c(C)n1-c1cccc(C)c1 ZINC001474662546 1062391419 /nfs/dbraw/zinc/39/14/19/1062391419.db2.gz CMNVXDCGKDFJSD-AUUYWEPGSA-N 1 0 314.498 4.244 20 10 DICDRO CO[C@H](C[NH2+]Cc1cc(C)n(-c2ccccc2)c1C)CC(C)C ZINC001474662329 1062392638 /nfs/dbraw/zinc/39/26/38/1062392638.db2.gz FACMWOSRHNAFER-FQEVSTJZSA-N 1 0 314.473 4.245 20 10 DICDRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC001474670038 1062398652 /nfs/dbraw/zinc/39/86/52/1062398652.db2.gz WCDAUHSELDRGJV-WTVLQJKYSA-N 1 0 311.425 4.244 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCC[C@H](C2CCOCC2)C1 ZINC001474681556 1062413261 /nfs/dbraw/zinc/41/32/61/1062413261.db2.gz KARJNKKDMSOJRE-HNNXBMFYSA-N 1 0 323.864 4.074 20 10 DICDRO Oc1c(C[NH2+]CC[C@@H]2CCCC2(F)F)ccc2ccccc21 ZINC001474683061 1062414057 /nfs/dbraw/zinc/41/40/57/1062414057.db2.gz FLKVWNYSRJGKSR-HNNXBMFYSA-N 1 0 305.368 4.461 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C[C@]23C[C@H]2CCCC3)c1O ZINC001474708473 1062434241 /nfs/dbraw/zinc/43/42/41/1062434241.db2.gz WVXZGSDQEPOYMG-CJNGLKHVSA-N 1 0 324.262 4.133 20 10 DICDRO COC1CCC([NH2+][C@H]2c3c(c(C)cc(C)c3O)CC2(C)C)CC1 ZINC001255455593 1062452411 /nfs/dbraw/zinc/45/24/11/1062452411.db2.gz DIBHEMCWYKGYEM-ZOJXTTQQSA-N 1 0 317.473 4.180 20 10 DICDRO Cc1cc(C)c(C[NH2+]C2CCC(C(F)(F)F)CC2)c(O)c1 ZINC001255512324 1062469846 /nfs/dbraw/zinc/46/98/46/1062469846.db2.gz FJTLVONRFZIXNH-UHFFFAOYSA-N 1 0 301.352 4.220 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)c(O)c1 ZINC001255697691 1062523925 /nfs/dbraw/zinc/52/39/25/1062523925.db2.gz SEDWOGHKDWELJA-QWHCGFSZSA-N 1 0 301.352 4.220 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCC12CCOCC2)c1ccc(N(C)C)cc1 ZINC001459979000 1062541971 /nfs/dbraw/zinc/54/19/71/1062541971.db2.gz HJHGGXIYUZXYIM-AEFFLSMTSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@H](CSc1ccc(F)cc1)[N@@H+]1CCc2cccc(O)c2C1 ZINC001255750028 1062574091 /nfs/dbraw/zinc/57/40/91/1062574091.db2.gz YPCUGMLHHGTWQW-CYBMUJFWSA-N 1 0 317.429 4.070 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCc3cccc(Cl)c3C2)cc1 ZINC001460220146 1062703300 /nfs/dbraw/zinc/70/33/00/1062703300.db2.gz GPNMPINBGAIHHH-UHFFFAOYSA-N 1 0 314.860 4.354 20 10 DICDRO COc1cccc(C[C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001256144763 1062725826 /nfs/dbraw/zinc/72/58/26/1062725826.db2.gz SPGRVZSYVOSBOX-QGZVFWFLSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H](C)Cc1ccccn1 ZINC001256410530 1062809206 /nfs/dbraw/zinc/80/92/06/1062809206.db2.gz VDJYVSITNSLWPU-MGPUTAFESA-N 1 0 324.468 4.248 20 10 DICDRO CCOC1CCC([N@H+](C)Cc2ccc(N3CCCC3)cc2)CC1 ZINC001256442052 1062828066 /nfs/dbraw/zinc/82/80/66/1062828066.db2.gz JHTKZTBHAKQRGC-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3cc(F)ccc3[C@H]2C)ccc1N(C)C ZINC001460721504 1063013477 /nfs/dbraw/zinc/01/34/77/1063013477.db2.gz BPQDRTOFAGCHQN-OAHLLOKOSA-N 1 0 312.432 4.319 20 10 DICDRO CCC[NH+](CCC)Cc1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001256969498 1063061851 /nfs/dbraw/zinc/06/18/51/1063061851.db2.gz ATDLVRKLBGTRDH-UHFFFAOYSA-N 1 0 324.428 4.149 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+]C1C[C@@H](C)O[C@H](C)C1 ZINC001257086211 1063107913 /nfs/dbraw/zinc/10/79/13/1063107913.db2.gz FTKCTJUNAALOEY-LPMFXHHGSA-N 1 0 317.473 4.178 20 10 DICDRO C[C@@H](CCc1ccccc1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001460998583 1063173642 /nfs/dbraw/zinc/17/36/42/1063173642.db2.gz AHKQELQROUZBFB-VOCYLRNQSA-N 1 0 308.469 4.377 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(COC)cc2)cc1C ZINC001461020132 1063194993 /nfs/dbraw/zinc/19/49/93/1063194993.db2.gz CQWFANSHYSXQCY-UHFFFAOYSA-N 1 0 313.441 4.220 20 10 DICDRO CCOCc1ccc(C[NH2+]Cc2c(C)c3ccccc3n2C)cc1 ZINC001461029994 1063199192 /nfs/dbraw/zinc/19/91/92/1063199192.db2.gz LKSFMWKVFCMTHR-UHFFFAOYSA-N 1 0 322.452 4.313 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC2(c3ccccc3)CC2)cc1 ZINC001461034456 1063205022 /nfs/dbraw/zinc/20/50/22/1063205022.db2.gz DFAGGOGDPQKMOE-SREVYHEPSA-N 1 0 306.453 4.087 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCc2ccccc2Cl)cc1 ZINC001461175087 1063308108 /nfs/dbraw/zinc/30/81/08/1063308108.db2.gz SLFXNJZWDQIIIM-WAYWQWQTSA-N 1 0 314.860 4.252 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCCOc1ccccc1C ZINC001461184921 1063317119 /nfs/dbraw/zinc/31/71/19/1063317119.db2.gz NWXYTUGWEKMXOK-UHFFFAOYSA-N 1 0 322.452 4.354 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@@H](SC)C2)cc1F ZINC001461184506 1063318299 /nfs/dbraw/zinc/31/82/99/1063318299.db2.gz ZRCBSIDQNKWYHG-HZPDHXFCSA-N 1 0 324.509 4.436 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC1(c2cccc(F)c2)CC1 ZINC001461226045 1063347161 /nfs/dbraw/zinc/34/71/61/1063347161.db2.gz GQCQZWRFPCAZKI-UHFFFAOYSA-N 1 0 322.427 4.447 20 10 DICDRO c1csc(SCCC[NH2+]Cc2ccccc2C2CC2)n1 ZINC001461232114 1063351874 /nfs/dbraw/zinc/35/18/74/1063351874.db2.gz OMJORJCDBWEOOV-UHFFFAOYSA-N 1 0 304.484 4.293 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc2c(c1)CCCO2)Cc1cccs1 ZINC001461264758 1063376810 /nfs/dbraw/zinc/37/68/10/1063376810.db2.gz MHAUNJAYIBAESI-AWEZNQCLSA-N 1 0 301.455 4.042 20 10 DICDRO CC(C)OC1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001257870787 1063412735 /nfs/dbraw/zinc/41/27/35/1063412735.db2.gz VPWQCEPUFMMPHV-UHFFFAOYSA-N 1 0 316.489 4.113 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2(Cc3ccccc3)CC2)cc1 ZINC001461443718 1063510766 /nfs/dbraw/zinc/51/07/66/1063510766.db2.gz XFPWLUCVQBOKPG-UHFFFAOYSA-N 1 0 308.469 4.398 20 10 DICDRO CC(C)=CCC[C@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258093868 1063514909 /nfs/dbraw/zinc/51/49/09/1063514909.db2.gz HAYLBCNYANELFR-SFHVURJKSA-N 1 0 316.489 4.090 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C2CC(c3ccccc3)C2)cc1 ZINC001461466330 1063524931 /nfs/dbraw/zinc/52/49/31/1063524931.db2.gz XAVWNRBFXCWPLD-VOTSOKGWSA-N 1 0 306.453 4.302 20 10 DICDRO C[C@@H]1CC[C@@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001461480981 1063529011 /nfs/dbraw/zinc/52/90/11/1063529011.db2.gz QBMXJULGDZAEBE-CHWSQXEVSA-N 1 0 314.395 4.297 20 10 DICDRO CSCc1ccc(C[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001461493456 1063536754 /nfs/dbraw/zinc/53/67/54/1063536754.db2.gz TXHGDHUCQGQCOI-UHFFFAOYSA-N 1 0 313.466 4.164 20 10 DICDRO Cc1ccc(F)c(CC[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC001461512426 1063548637 /nfs/dbraw/zinc/54/86/37/1063548637.db2.gz VODYACCQDMQYKI-SNAWJCMRSA-N 1 0 312.432 4.046 20 10 DICDRO CCN(CC)c1ccc(CNc2ccc3c([nH+]2)CCC3)cc1F ZINC001461517845 1063550525 /nfs/dbraw/zinc/55/05/25/1063550525.db2.gz ZBQDOYWNMQKFIA-UHFFFAOYSA-N 1 0 313.420 4.168 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCCCC2(F)F)cc1 ZINC001461531843 1063563287 /nfs/dbraw/zinc/56/32/87/1063563287.db2.gz XUCFLGOSCZXNRL-OGZRUICASA-N 1 0 308.416 4.181 20 10 DICDRO C[N@H+](Cc1ccc(N2CCOCC2)cc1)C1CCCCCCC1 ZINC001258239960 1063577072 /nfs/dbraw/zinc/57/70/72/1063577072.db2.gz HRMZKFPLKFCKTN-UHFFFAOYSA-N 1 0 316.489 4.068 20 10 DICDRO CC[C@@H](OCC[NH2+]Cc1ccc(OC)c(C)c1)c1ccccc1 ZINC001461624211 1063621111 /nfs/dbraw/zinc/62/11/11/1063621111.db2.gz STQIKZONJUBHPY-LJQANCHMSA-N 1 0 313.441 4.261 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)CCc1ccc(OC)cc1 ZINC001258406870 1063643388 /nfs/dbraw/zinc/64/33/88/1063643388.db2.gz UTILILPQFIUDEM-INIZCTEOSA-N 1 0 313.441 4.244 20 10 DICDRO CCCCC[C@@H](CC)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258434742 1063652138 /nfs/dbraw/zinc/65/21/38/1063652138.db2.gz PTRRRVIYBBTGRR-GOSISDBHSA-N 1 0 318.505 4.305 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@H]2CCCC2(F)F)cc1 ZINC001461709344 1063671698 /nfs/dbraw/zinc/67/16/98/1063671698.db2.gz MDDPXDPAOMFKAZ-MRXNPFEDSA-N 1 0 310.432 4.448 20 10 DICDRO COc1cc(C[NH2+]C[C@@]2(C)CC2(C)C)c(O)c(C(C)(C)C)c1 ZINC001461724842 1063680070 /nfs/dbraw/zinc/68/00/70/1063680070.db2.gz AGAMGCIQLKGTGV-LJQANCHMSA-N 1 0 305.462 4.224 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)S3)cc1F ZINC001461798362 1063725141 /nfs/dbraw/zinc/72/51/41/1063725141.db2.gz PVZVNGWPQUSCJJ-MQVJKMGUSA-N 1 0 322.493 4.188 20 10 DICDRO CCC1(CC)[C@H](OC)C[C@@H]1[N@H+](C)Cc1ccc(N(C)C)cc1C ZINC001461861195 1063754593 /nfs/dbraw/zinc/75/45/93/1063754593.db2.gz KHJSBGCAZMLPKC-RBUKOAKNSA-N 1 0 318.505 4.087 20 10 DICDRO CCCCO[C@@H]1C[C@@H]([N@H+](C)Cc2cccc(CC)c2O)C1(C)C ZINC001461881172 1063771918 /nfs/dbraw/zinc/77/19/18/1063771918.db2.gz LRSUQZZCIPZNCE-QZTJIDSGSA-N 1 0 319.489 4.370 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)c1 ZINC001461885202 1063776011 /nfs/dbraw/zinc/77/60/11/1063776011.db2.gz VANVHNMBGPNXNV-CXAGYDPISA-N 1 0 315.413 4.275 20 10 DICDRO CCOc1ccc(C[N@H+](Cc2cc(F)ccc2O)C(C)C)cc1 ZINC001461892159 1063779975 /nfs/dbraw/zinc/77/99/75/1063779975.db2.gz MSDMFXZNOZJUKT-UHFFFAOYSA-N 1 0 317.404 4.341 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1cc(C(C)C)ccc1O)CC2 ZINC001461905072 1063789428 /nfs/dbraw/zinc/78/94/28/1063789428.db2.gz ZLCDSQDXTGBTQC-UHFFFAOYSA-N 1 0 311.425 4.083 20 10 DICDRO C[C@H](Cc1cccc(Cl)c1)[N@@H+]1CCc2cccc(O)c2C1 ZINC001258751336 1063797900 /nfs/dbraw/zinc/79/79/00/1063797900.db2.gz LUOAWBBXGMSXSA-CYBMUJFWSA-N 1 0 301.817 4.035 20 10 DICDRO CC(C)[N@H+](Cc1cccn1C(F)F)Cc1ccc(N(C)C)cc1 ZINC001461921752 1063804483 /nfs/dbraw/zinc/80/44/83/1063804483.db2.gz SREPVEHUFJIIJF-UHFFFAOYSA-N 1 0 321.415 4.360 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC001461926407 1063810513 /nfs/dbraw/zinc/81/05/13/1063810513.db2.gz JLMNVBBFSSYWAR-PXNSSMCTSA-N 1 0 308.469 4.439 20 10 DICDRO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(O)c1 ZINC001461953442 1063836639 /nfs/dbraw/zinc/83/66/39/1063836639.db2.gz FINPXVPPEWQZPD-UHFFFAOYSA-N 1 0 314.385 4.019 20 10 DICDRO COc1cc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001461965044 1063845858 /nfs/dbraw/zinc/84/58/58/1063845858.db2.gz YWPIVSMJSYQZLR-QWHCGFSZSA-N 1 0 323.502 4.024 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1C[C@@H]1c1ccccc1 ZINC001462025554 1063885778 /nfs/dbraw/zinc/88/57/78/1063885778.db2.gz IMJLTSHCAJNIAD-TZIWHRDSSA-N 1 0 308.469 4.378 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2cc(Cl)c(F)cc2[O-])cc1 ZINC001462030172 1063888211 /nfs/dbraw/zinc/88/82/11/1063888211.db2.gz UYDKAIGYSMTGRH-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO Cc1cnc([C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)s1 ZINC001262192543 1063959664 /nfs/dbraw/zinc/95/96/64/1063959664.db2.gz JFMQYKKKVZBNNP-KRWDZBQOSA-N 1 0 314.454 4.017 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C1CC1)[C@H]1CCCOC1 ZINC001262207197 1063961059 /nfs/dbraw/zinc/96/10/59/1063961059.db2.gz VVUAOCSWHJDVBB-XXLXZOJFSA-N 1 0 315.457 4.044 20 10 DICDRO Clc1ccc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC000387734835 1064082084 /nfs/dbraw/zinc/08/20/84/1064082084.db2.gz QDJYOBDEIBUBMI-UHFFFAOYSA-N 1 0 314.860 4.273 20 10 DICDRO CC(C)C(C)(C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000732229658 1064517761 /nfs/dbraw/zinc/51/77/61/1064517761.db2.gz UCHOEOTWQPLRLE-UHFFFAOYSA-N 1 0 319.449 4.109 20 10 DICDRO CCCC[C@H](CC)C[N@@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC001307424894 1065386752 /nfs/dbraw/zinc/38/67/52/1065386752.db2.gz WUVWYXRFBMUUFG-SFHVURJKSA-N 1 0 318.505 4.424 20 10 DICDRO CC(C)C[N@H+](Cc1ccc(N2CCOCC2)cc1)CC(C)(C)C ZINC001307583484 1065496299 /nfs/dbraw/zinc/49/62/99/1065496299.db2.gz OMUBZBAQAFGWFQ-UHFFFAOYSA-N 1 0 318.505 4.027 20 10 DICDRO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001307811214 1065634196 /nfs/dbraw/zinc/63/41/96/1065634196.db2.gz NZGFLLCMRIKCTP-LJQANCHMSA-N 1 0 312.457 4.344 20 10 DICDRO CO[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)c(C)c1 ZINC001307903174 1065673462 /nfs/dbraw/zinc/67/34/62/1065673462.db2.gz SNUWKSQLKLUUDW-UYAOXDASSA-N 1 0 316.489 4.033 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)Cc2cccnc2)ccc1N1CCCCC1 ZINC001308149650 1065781568 /nfs/dbraw/zinc/78/15/68/1065781568.db2.gz QJKGOKPSTJZRAJ-GOSISDBHSA-N 1 0 323.484 4.101 20 10 DICDRO Cc1ccc(CC[NH2+]C/C=C/c2ccc(N(C)C)cc2)c(C)c1 ZINC001308229978 1065836132 /nfs/dbraw/zinc/83/61/32/1065836132.db2.gz PZUVWGSFYYHQAC-AATRIKPKSA-N 1 0 308.469 4.215 20 10 DICDRO c1ccc2c(c1)CSC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001308259080 1065862033 /nfs/dbraw/zinc/86/20/33/1065862033.db2.gz LECUUCKIRXLFPF-HXUWFJFHSA-N 1 0 324.493 4.365 20 10 DICDRO CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N(CC)CC)c(F)c2)C1 ZINC001308261514 1065863542 /nfs/dbraw/zinc/86/35/42/1065863542.db2.gz UHYVLVVYOXFIBY-DLBZAZTESA-N 1 0 322.468 4.109 20 10 DICDRO CCc1ccc(CC[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001308278701 1065878321 /nfs/dbraw/zinc/87/83/21/1065878321.db2.gz DMMYZJSZYVYNGM-AATRIKPKSA-N 1 0 308.469 4.161 20 10 DICDRO Clc1cscc1C[NH2+]CCCSc1nccs1 ZINC001308282917 1065881080 /nfs/dbraw/zinc/88/10/80/1065881080.db2.gz XYPMSBJXWUNBPH-UHFFFAOYSA-N 1 0 304.893 4.130 20 10 DICDRO Cc1cc(C)cc(C[C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001308290925 1065887227 /nfs/dbraw/zinc/88/72/27/1065887227.db2.gz SDWSJHBKVMWRCI-KRWDZBQOSA-N 1 0 309.453 4.349 20 10 DICDRO CCC1(CC)[C@@H]([NH2+]Cc2c(O)cc(C)cc2Cl)C[C@@H]1OC ZINC001308341241 1065926200 /nfs/dbraw/zinc/92/62/00/1065926200.db2.gz GIBAXDOMFBMTBC-HOTGVXAUSA-N 1 0 311.853 4.037 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](CCO)C2CCCCC2)cc1C ZINC001308360063 1065939590 /nfs/dbraw/zinc/93/95/90/1065939590.db2.gz JKCHNSWMCJODOG-IBGZPJMESA-N 1 0 319.489 4.205 20 10 DICDRO Cc1cc(O)c(CNc2ccc(C[NH+](C)C)cc2F)c(Cl)c1 ZINC001308439034 1065987779 /nfs/dbraw/zinc/98/77/79/1065987779.db2.gz YFOROEZOWRZFII-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001308439407 1065989591 /nfs/dbraw/zinc/98/95/91/1065989591.db2.gz DFEWPTUYNGFJJT-ZDUSSCGKSA-N 1 0 322.905 4.497 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C/C=C/c2ccc(F)c(F)c2)c1 ZINC001308451094 1065996916 /nfs/dbraw/zinc/99/69/16/1065996916.db2.gz UYBOBOXGASULCO-PCAWENJQSA-N 1 0 319.351 4.043 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+]Cc3ccccc3C(C)C)C2)cc1 ZINC001308460473 1066003078 /nfs/dbraw/zinc/00/30/78/1066003078.db2.gz AKIKPFWLAYWWPK-GOSISDBHSA-N 1 0 324.468 4.187 20 10 DICDRO CC[C@H](C[NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)c1ccccc1 ZINC001308461719 1066003315 /nfs/dbraw/zinc/00/33/15/1066003315.db2.gz RKDOOAHHGGCFKN-MJGOQNOKSA-N 1 0 324.468 4.057 20 10 DICDRO CC[C@H](C[NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)c1ccccc1 ZINC001308461545 1066003388 /nfs/dbraw/zinc/00/33/88/1066003388.db2.gz RKDOOAHHGGCFKN-IEBWSBKVSA-N 1 0 324.468 4.057 20 10 DICDRO COc1ccc([C@H](C)[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1C ZINC001308515112 1066040325 /nfs/dbraw/zinc/04/03/25/1066040325.db2.gz XSANLIVRVVVQHX-LXXRFIIISA-N 1 0 324.468 4.434 20 10 DICDRO CCCCO[C@H]1C[C@@H]([N@H+](C)Cc2ccc(C)cc2O)C1(C)C ZINC001308578078 1066092617 /nfs/dbraw/zinc/09/26/17/1066092617.db2.gz MKOFBKPLFNFRNG-MSOLQXFVSA-N 1 0 305.462 4.116 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCC[C@H]1C1CC1 ZINC001308582729 1066099327 /nfs/dbraw/zinc/09/93/27/1066099327.db2.gz FTUPTNYTFZEDDX-FQEVSTJZSA-N 1 0 323.436 4.346 20 10 DICDRO Cc1ccc(C[NH+]2CCC(Cc3cccc(F)c3)CC2)c(O)c1 ZINC001308593257 1066105554 /nfs/dbraw/zinc/10/55/54/1066105554.db2.gz PSMWUKQGWXRXSS-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CCC(OC3CCCC3)CC2)c1 ZINC001308598007 1066109126 /nfs/dbraw/zinc/10/91/26/1066109126.db2.gz LFQRXJAQODZKRO-UHFFFAOYSA-N 1 0 317.473 4.439 20 10 DICDRO COc1cc(C)cc(C[NH+]2CCC(CCC(C)C)CC2)c1O ZINC001308602887 1066111768 /nfs/dbraw/zinc/11/17/68/1066111768.db2.gz GXHRZIKRDQDMDT-UHFFFAOYSA-N 1 0 305.462 4.357 20 10 DICDRO C[C@]1(c2ccccc2)CCC[N@H+](Cc2cc(F)c(F)cc2[O-])C1 ZINC001308607100 1066113665 /nfs/dbraw/zinc/11/36/65/1066113665.db2.gz JGMQKAAVWSFGAW-IBGZPJMESA-N 1 0 317.379 4.224 20 10 DICDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2cc(Cl)c(C)cc2O)C12CCC2 ZINC001308607504 1066115117 /nfs/dbraw/zinc/11/51/17/1066115117.db2.gz MXLKAADYTBMTDW-DLBZAZTESA-N 1 0 323.864 4.134 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1nc(Cl)cs1)C1CCCC1 ZINC001308635133 1066130256 /nfs/dbraw/zinc/13/02/56/1066130256.db2.gz VLMLVZVLZJDLDR-UHFFFAOYSA-N 1 0 322.861 4.447 20 10 DICDRO C[N@H+](Cc1ccc(Cl)s1)Cc1ccc(Cl)cc1O ZINC001308651594 1066138247 /nfs/dbraw/zinc/13/82/47/1066138247.db2.gz SXJCQSJAULYQMZ-UHFFFAOYSA-N 1 0 302.226 4.393 20 10 DICDRO CCC[C@@H](C[N@H+](Cc1ccccc1O)C1CCCCC1)OC ZINC001308656243 1066139072 /nfs/dbraw/zinc/13/90/72/1066139072.db2.gz IVVNCAXWCNWITQ-SFHVURJKSA-N 1 0 305.462 4.342 20 10 DICDRO CC(C)O[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)C1(C)C ZINC001308667539 1066145535 /nfs/dbraw/zinc/14/55/35/1066145535.db2.gz DHVDLXHEPRNTBE-ROUUACIJSA-N 1 0 313.441 4.227 20 10 DICDRO CC[C@H]1CC[N@H+](Cc2cc(Br)cc(C)c2O)[C@H]1C ZINC001308704187 1066190176 /nfs/dbraw/zinc/19/01/76/1066190176.db2.gz NIIPFUJIJDENOP-RYUDHWBXSA-N 1 0 312.251 4.084 20 10 DICDRO CCCN(Cc1cc(C(C)C)ccc1O)c1ccc(C[NH3+])cc1 ZINC001308738592 1066213961 /nfs/dbraw/zinc/21/39/61/1066213961.db2.gz AIAYYFRZKZMUBH-UHFFFAOYSA-N 1 0 312.457 4.391 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)cc1Cl ZINC001308782747 1066258338 /nfs/dbraw/zinc/25/83/38/1066258338.db2.gz QHUVHZISMFZNLP-CYBMUJFWSA-N 1 0 319.807 4.483 20 10 DICDRO Cc1cc(NCc2cc(C(C)C)ccc2O)ccc1C[NH+](C)C ZINC001308813388 1066288447 /nfs/dbraw/zinc/28/84/47/1066288447.db2.gz RPOVICLAYLXFAB-UHFFFAOYSA-N 1 0 312.457 4.498 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C/C=C\c1ccc(F)c(F)c1 ZINC001308845744 1066323424 /nfs/dbraw/zinc/32/34/24/1066323424.db2.gz KLPMUJGQYSXERK-UPHRSURJSA-N 1 0 309.743 4.127 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCc2cccc(Cl)c2C1 ZINC001308846726 1066324046 /nfs/dbraw/zinc/32/40/46/1066324046.db2.gz USFCOBDIEMGKJD-AWEZNQCLSA-N 1 0 322.235 4.346 20 10 DICDRO CC(C)C(C)(C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001308850542 1066329510 /nfs/dbraw/zinc/32/95/10/1066329510.db2.gz GQNGXWGRDBTVAH-UHFFFAOYSA-N 1 0 302.384 4.296 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@@H](CCF)C2)c(O)c(C(C)(C)C)c1 ZINC001308863396 1066344023 /nfs/dbraw/zinc/34/40/23/1066344023.db2.gz IAZPFDDIWOQJMA-AWEZNQCLSA-N 1 0 323.452 4.270 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001308887507 1066368143 /nfs/dbraw/zinc/36/81/43/1066368143.db2.gz IAUHKVCJXLLWDC-OAHLLOKOSA-N 1 0 308.208 4.476 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C[C@@H]2CCCC23CC3)c1O ZINC001308890268 1066370669 /nfs/dbraw/zinc/37/06/69/1066370669.db2.gz BHKYVHVFQVYUDF-ZDUSSCGKSA-N 1 0 324.262 4.133 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@]23C[C@H]2CCCC3)c1O ZINC001308899084 1066378663 /nfs/dbraw/zinc/37/86/63/1066378663.db2.gz ORHZHZLQQPSIJU-NDGTYSDOSA-N 1 0 309.837 4.113 20 10 DICDRO CSc1ccccc1C[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC001308902017 1066379539 /nfs/dbraw/zinc/37/95/39/1066379539.db2.gz NIDVNZDUNREKRN-KGLIPLIRSA-N 1 0 301.455 4.396 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)c1 ZINC001308905856 1066385803 /nfs/dbraw/zinc/38/58/03/1066385803.db2.gz MLRHTOKYRIELQT-IBGZPJMESA-N 1 0 317.473 4.439 20 10 DICDRO Cc1cc(Br)c(CN2Cc3cccc(O)c3C2)s1 ZINC001308911518 1066390638 /nfs/dbraw/zinc/39/06/38/1066390638.db2.gz VDEJFPPVOUWDQQ-UHFFFAOYSA-N 1 0 324.243 4.040 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2cc(F)ccc2O)C2CCC2)cc1 ZINC001308964599 1066423504 /nfs/dbraw/zinc/42/35/04/1066423504.db2.gz FULAIFRPYOSVQS-LJQANCHMSA-N 1 0 315.388 4.171 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC001308974641 1066428015 /nfs/dbraw/zinc/42/80/15/1066428015.db2.gz JYDGBJIOUJHDMZ-ZWKOTPCHSA-N 1 0 317.473 4.154 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(N2CCCC2)c1 ZINC000088764941 185264534 /nfs/dbraw/zinc/26/45/34/185264534.db2.gz NFLNJZSQLBXCGB-QGZVFWFLSA-N 1 0 323.484 4.204 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)c1O ZINC000093275176 193223383 /nfs/dbraw/zinc/22/33/83/193223383.db2.gz XEAABJQDUTZALR-LBPRGKRZSA-N 1 0 320.458 4.057 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)c1 ZINC000093275641 193223718 /nfs/dbraw/zinc/22/37/18/193223718.db2.gz YLLDPUAFLSQRSX-LBPRGKRZSA-N 1 0 320.458 4.057 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2cccc(Cl)c2)c1O ZINC000021811283 182292030 /nfs/dbraw/zinc/29/20/30/182292030.db2.gz JLOMTXQREXXKPT-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO FC(F)(F)CCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000097988937 193772222 /nfs/dbraw/zinc/77/22/22/193772222.db2.gz SWSHOPAOTGMKNJ-UHFFFAOYSA-N 1 0 300.368 4.109 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000271580702 129938486 /nfs/dbraw/zinc/93/84/86/129938486.db2.gz QWJWFFDZEVGUAW-KURKYZTESA-N 1 0 316.489 4.143 20 10 DICDRO COCC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1O)c1ccc(C)o1 ZINC000272632997 130048421 /nfs/dbraw/zinc/04/84/21/130048421.db2.gz NLMYJKJZNCICIW-OAHLLOKOSA-N 1 0 323.820 4.123 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(C)o1 ZINC000272706391 130055914 /nfs/dbraw/zinc/05/59/14/130055914.db2.gz ZUFKNTJFIHXVEE-YJBOKZPZSA-N 1 0 316.445 4.082 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c(O)c1C ZINC000273356970 130111039 /nfs/dbraw/zinc/11/10/39/130111039.db2.gz CXMDGFOHKPPUQI-HOTGVXAUSA-N 1 0 303.446 4.151 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c(O)c1C ZINC000273379250 130113610 /nfs/dbraw/zinc/11/36/10/130113610.db2.gz HUQBHBVFQYBDTR-KRWDZBQOSA-N 1 0 324.468 4.460 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2cc(F)ccc2O)c1 ZINC000273446430 130122116 /nfs/dbraw/zinc/12/21/16/130122116.db2.gz FBCLLNNNHRVCOF-ZDUSSCGKSA-N 1 0 302.393 4.074 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1F ZINC000273437050 130122226 /nfs/dbraw/zinc/12/22/26/130122226.db2.gz XDSVZVAJRDXUEP-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(O)c1 ZINC000273476841 130126368 /nfs/dbraw/zinc/12/63/68/130126368.db2.gz LBCVPGJGIVOBGL-STQMWFEESA-N 1 0 300.358 4.021 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(O)c1C ZINC000273521626 130132688 /nfs/dbraw/zinc/13/26/88/130132688.db2.gz UNZIYUMWSHKMGC-UONOGXRCSA-N 1 0 314.385 4.329 20 10 DICDRO COc1cccc(C2([NH2+][C@@H](C)c3ccc(C)c(C)c3O)CC2)c1 ZINC000273526930 130132709 /nfs/dbraw/zinc/13/27/09/130132709.db2.gz VKVIITWDCNFLCP-HNNXBMFYSA-N 1 0 311.425 4.358 20 10 DICDRO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273571639 130138653 /nfs/dbraw/zinc/13/86/53/130138653.db2.gz KURFXLBNLLALMD-CHWSQXEVSA-N 1 0 304.459 4.440 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)c(O)c1C ZINC000274756778 130259339 /nfs/dbraw/zinc/25/93/39/130259339.db2.gz JBJHQXAXBRTSKK-HNNXBMFYSA-N 1 0 313.441 4.087 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000275269754 130300477 /nfs/dbraw/zinc/30/04/77/130300477.db2.gz BQPABJCMMYZXNQ-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)n1 ZINC000284946602 131125725 /nfs/dbraw/zinc/12/57/25/131125725.db2.gz DZLHDAVYSIERAM-TZMCWYRMSA-N 1 0 304.459 4.228 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000286381162 131233893 /nfs/dbraw/zinc/23/38/93/131233893.db2.gz APZXNXGZSPNWQU-SNVBAGLBSA-N 1 0 309.381 4.243 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)c1 ZINC000287197473 131268480 /nfs/dbraw/zinc/26/84/80/131268480.db2.gz WCYUZJJNPZURLV-JKSUJKDBSA-N 1 0 321.424 4.298 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)c(F)c1)c1cccc(Cl)c1[O-] ZINC000287618759 131291439 /nfs/dbraw/zinc/29/14/39/131291439.db2.gz JRLJQSGLPQACBG-HNNXBMFYSA-N 1 0 323.795 4.434 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1nccc2ccccc21 ZINC000289521229 131392841 /nfs/dbraw/zinc/39/28/41/131392841.db2.gz AUHQFROKMKFXRB-OAHLLOKOSA-N 1 0 305.425 4.152 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297144895 132001758 /nfs/dbraw/zinc/00/17/58/132001758.db2.gz ZRTPFEPZIVKPHI-IAGOWNOFSA-N 1 0 309.409 4.055 20 10 DICDRO CC(F)(F)c1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000297361421 132012334 /nfs/dbraw/zinc/01/23/34/132012334.db2.gz PTFFVXXPQXSGSX-OAHLLOKOSA-N 1 0 303.352 4.281 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1 ZINC000119652769 132135446 /nfs/dbraw/zinc/13/54/46/132135446.db2.gz QWMBHMODQYPIPA-MNOVXSKESA-N 1 0 307.340 4.091 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1 ZINC000119652911 132135769 /nfs/dbraw/zinc/13/57/69/132135769.db2.gz QWMBHMODQYPIPA-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc(F)c(F)c2)c1 ZINC000121504947 132156068 /nfs/dbraw/zinc/15/60/68/132156068.db2.gz ZLSKOCYZKAUVNH-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO Cc1cnc(CN(Cc2ccccc2O)[C@@H](C)c2ccccc2)o1 ZINC000119287099 332368753 /nfs/dbraw/zinc/36/87/53/332368753.db2.gz ZVUPWGREWUFNJG-INIZCTEOSA-N 1 0 322.408 4.452 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOc2c(Cl)cccc21)c1cc(F)ccc1O ZINC000185185477 333205226 /nfs/dbraw/zinc/20/52/26/333205226.db2.gz VXDHWYBDCHVKMZ-MEBBXXQBSA-N 1 0 321.779 4.359 20 10 DICDRO C[C@H](CCCCO)[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000296373674 335144087 /nfs/dbraw/zinc/14/40/87/335144087.db2.gz JIEHMLSLDQIFPQ-HZPDHXFCSA-N 1 0 322.468 4.018 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(O)c1 ZINC000297262497 335152338 /nfs/dbraw/zinc/15/23/38/335152338.db2.gz KDDQXSGDALCHPU-STQMWFEESA-N 1 0 300.358 4.021 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1O ZINC000273462724 334047319 /nfs/dbraw/zinc/04/73/19/334047319.db2.gz QSLRXCFTIQDKBP-AXHNFQJDSA-N 1 0 315.388 4.102 20 10 DICDRO Oc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000276641383 334084422 /nfs/dbraw/zinc/08/44/22/334084422.db2.gz QQGFFSKKYLEJKF-HXUWFJFHSA-N 1 0 322.452 4.160 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C)cc1O ZINC000280231533 334115642 /nfs/dbraw/zinc/11/56/42/334115642.db2.gz VIUSEIODYFKSPR-GUYCJALGSA-N 1 0 314.385 4.411 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc(NC(C)=O)c1)c1ccccc1O ZINC000192947235 336285608 /nfs/dbraw/zinc/28/56/08/336285608.db2.gz JEITXJTUXYNAIB-SCLBCKFNSA-N 1 0 312.413 4.153 20 10 DICDRO Cc1cc(N2CC=C(c3c[nH]c4cc(F)ccc43)CC2)cc[nH+]1 ZINC000302277461 336356591 /nfs/dbraw/zinc/35/65/91/336356591.db2.gz IGXSPVGCOQIAID-UHFFFAOYSA-N 1 0 307.372 4.304 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cc(F)ccc1O ZINC000368234444 336840988 /nfs/dbraw/zinc/84/09/88/336840988.db2.gz KTWXBSZVMWPXIV-ZFWWWQNUSA-N 1 0 307.409 4.064 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)CCC2 ZINC000371602815 336908870 /nfs/dbraw/zinc/90/88/70/336908870.db2.gz UFSIKZYGLIHNFS-WBMJQRKESA-N 1 0 315.486 4.246 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCc3cnn(C(C)C)c32)c(O)c1 ZINC000375170608 337005035 /nfs/dbraw/zinc/00/50/35/337005035.db2.gz HTOFNPHODIUEKS-YOEHRIQHSA-N 1 0 313.445 4.206 20 10 DICDRO C[C@H](c1ccccc1)N1CCC([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000183516830 337191958 /nfs/dbraw/zinc/19/19/58/337191958.db2.gz NMWBZLASDVNNLP-DLBZAZTESA-N 1 0 324.468 4.268 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1ccccc1O ZINC000183716692 337193094 /nfs/dbraw/zinc/19/30/94/337193094.db2.gz VERSURXQKHGBJM-WBMJQRKESA-N 1 0 301.361 4.096 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(-c2ccccn2)c1)c1ccccc1O ZINC000183625295 337193858 /nfs/dbraw/zinc/19/38/58/337193858.db2.gz JLRVVBQGAOWRBT-HNNXBMFYSA-N 1 0 304.393 4.305 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1cc(F)ccc1O ZINC000527966830 337780855 /nfs/dbraw/zinc/78/08/55/337780855.db2.gz OVKCJQSKMCQJRO-XIKOKIGWSA-N 1 0 300.377 4.118 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000551277209 341336859 /nfs/dbraw/zinc/33/68/59/341336859.db2.gz ARTWUICAPYQDJV-SFHVURJKSA-N 1 0 320.436 4.360 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCCc3sccc32)c1 ZINC000160980087 521154867 /nfs/dbraw/zinc/15/48/67/521154867.db2.gz OUXWTUMUNWAYGJ-OAHLLOKOSA-N 1 0 303.427 4.020 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)C[C@H](O)c1cccs1)c1ccccc1O ZINC000156420386 522909192 /nfs/dbraw/zinc/90/91/92/522909192.db2.gz OCYBNUOPJOGYDS-BJJXKVORSA-N 1 0 305.443 4.007 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCOc2cc(F)ccc21)c1ccccc1O ZINC000157497072 522923961 /nfs/dbraw/zinc/92/39/61/522923961.db2.gz DOMMWXVJIJFJOD-IAGOWNOFSA-N 1 0 315.388 4.486 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccccc1O ZINC000156768398 522928832 /nfs/dbraw/zinc/92/88/32/522928832.db2.gz IYUQCBFBCXYOTR-NVXWUHKLSA-N 1 0 303.446 4.315 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1O ZINC000158133468 522952075 /nfs/dbraw/zinc/95/20/75/522952075.db2.gz PMLGLSNOURAFIC-HQRMLTQVSA-N 1 0 311.425 4.353 20 10 DICDRO CC[C@@](C)([NH2+]Cc1ccc(N(C)C)c(F)c1)c1nc(C)cs1 ZINC000266142324 523657327 /nfs/dbraw/zinc/65/73/27/523657327.db2.gz HORWTZPLTFMIKG-QGZVFWFLSA-N 1 0 321.465 4.072 20 10 DICDRO CC[C@@](C)([NH2+]Cc1cc(Cl)cc(C)c1O)c1nccs1 ZINC000182372677 523657403 /nfs/dbraw/zinc/65/74/03/523657403.db2.gz PWXYBMDOTTWMTQ-OAHLLOKOSA-N 1 0 310.850 4.226 20 10 DICDRO Cc1cccc(C[NH2+]Cc2cccc(COC(C)(C)C)c2)c1O ZINC000181382106 524436576 /nfs/dbraw/zinc/43/65/76/524436576.db2.gz FNXYFDADUDDICZ-UHFFFAOYSA-N 1 0 313.441 4.306 20 10 DICDRO C[C@@H](C[N@H+](C)Cc1c(O)ccc2ccccc21)c1nccs1 ZINC000182846440 524573772 /nfs/dbraw/zinc/57/37/72/524573772.db2.gz QFVILXLOIJFPSL-ZDUSSCGKSA-N 1 0 312.438 4.237 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)c1 ZINC000157987957 525361392 /nfs/dbraw/zinc/36/13/92/525361392.db2.gz LIKPQUUYSPJYBF-MDYRTPRTSA-N 1 0 311.425 4.272 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)c1 ZINC000188050544 525362134 /nfs/dbraw/zinc/36/21/34/525362134.db2.gz WCEASWWNQPGVOA-WBMJQRKESA-N 1 0 301.361 4.014 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(OC(F)F)cc1 ZINC000179874562 525613483 /nfs/dbraw/zinc/61/34/83/525613483.db2.gz ZRJRMMISVSDDJB-NEPJUHHUSA-N 1 0 307.340 4.405 20 10 DICDRO C[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1cc(Cl)ccc1O ZINC000185532019 525625328 /nfs/dbraw/zinc/62/53/28/525625328.db2.gz ZGEHSNLZTAGABE-DYVFJYSZSA-N 1 0 319.832 4.210 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOc2c(Cl)cccc21)c1ccccc1O ZINC000183459082 525688799 /nfs/dbraw/zinc/68/87/99/525688799.db2.gz NQZQSYHVDZBABZ-ABAIWWIYSA-N 1 0 303.789 4.220 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000136732757 526365240 /nfs/dbraw/zinc/36/52/40/526365240.db2.gz CCKUSGAWQBONLL-ZDUSSCGKSA-N 1 0 309.837 4.017 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccccc1O ZINC000286930944 535808841 /nfs/dbraw/zinc/80/88/41/535808841.db2.gz GGJCMFUPWMNWAR-IAGOWNOFSA-N 1 0 319.832 4.210 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1ccc(C)o1 ZINC000273507684 536818098 /nfs/dbraw/zinc/81/80/98/536818098.db2.gz ZWMFGYTUJURBNQ-WBVHZDCISA-N 1 0 317.429 4.339 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc(F)c2Cl)CCC1(F)F ZINC001237121833 1053463536 /nfs/dbraw/zinc/46/35/36/1053463536.db2.gz PTVXFEFZEXZASF-SECBINFHSA-N 1 0 307.743 4.052 20 10 DICDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCC[C@H]2C2CCC2)c1 ZINC000728198395 1035726187 /nfs/dbraw/zinc/72/61/87/1035726187.db2.gz CYNQUWPWBYHHLX-INIZCTEOSA-N 1 0 303.446 4.160 20 10 DICDRO C[C@H]([NH2+][C@H]1CCSc2ccc(F)cc21)c1ccccc1O ZINC000036968715 1035910070 /nfs/dbraw/zinc/91/00/70/1035910070.db2.gz XHOVFKLGRWPOLP-NHYWBVRUSA-N 1 0 303.402 4.419 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](CC)c2ccccc2O)cc1OC ZINC000155115163 1036135197 /nfs/dbraw/zinc/13/51/97/1036135197.db2.gz FNANDENAHMQTEP-MRXNPFEDSA-N 1 0 315.413 4.040 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccn(C)c2)c(C)n1-c1cccc(C)c1 ZINC000748098442 1036174525 /nfs/dbraw/zinc/17/45/25/1036174525.db2.gz CXHVXCJRTPZZJH-UHFFFAOYSA-N 1 0 307.441 4.031 20 10 DICDRO CCc1cnc(C[N@H+](C)Cc2c(O)ccc3ccccc32)s1 ZINC000177176445 1036540279 /nfs/dbraw/zinc/54/02/79/1036540279.db2.gz UWZLGWWOPBOSDL-UHFFFAOYSA-N 1 0 312.438 4.196 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccsc1Cl ZINC000312753325 1037011721 /nfs/dbraw/zinc/01/17/21/1037011721.db2.gz CTFHPMXBIQRUGE-UHFFFAOYSA-N 1 0 304.846 4.491 20 10 DICDRO CC(C)([NH2+]Cc1cc(Cl)ccc1O)c1ccc(F)c(F)c1 ZINC000175989093 1037496045 /nfs/dbraw/zinc/49/60/45/1037496045.db2.gz GPLQACHLBBGFBL-UHFFFAOYSA-N 1 0 311.759 4.349 20 10 DICDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1c(O)cccc1Br ZINC000706842349 1037498885 /nfs/dbraw/zinc/49/88/85/1037498885.db2.gz ASLXXZDWHGRFJY-RISCZKNCSA-N 1 0 312.251 4.213 20 10 DICDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1c(O)cccc1Br ZINC000706842350 1037499359 /nfs/dbraw/zinc/49/93/59/1037499359.db2.gz ASLXXZDWHGRFJY-SMDDNHRTSA-N 1 0 312.251 4.213 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(OC)c(F)c1)c1ccc(F)cc1[O-] ZINC000796675975 1037803686 /nfs/dbraw/zinc/80/36/86/1037803686.db2.gz OLYNVVOHQYCMQU-MEDUHNTESA-N 1 0 321.367 4.481 20 10 DICDRO CC1(C)CCC[N@H+](Cc2c(O)cccc2Br)CC1 ZINC000707128829 1037807715 /nfs/dbraw/zinc/80/77/15/1037807715.db2.gz BFEKTXBXSPAUKN-UHFFFAOYSA-N 1 0 312.251 4.167 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)c2ccc(C)cc2)c1O ZINC000228671514 1038015312 /nfs/dbraw/zinc/01/53/12/1038015312.db2.gz SLJWWOBZCVLMSX-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)[nH]1 ZINC000277247820 1038467339 /nfs/dbraw/zinc/46/73/39/1038467339.db2.gz NTJZHQPWPNHFAG-GDLCADMTSA-N 1 0 316.449 4.052 20 10 DICDRO CS[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000230698908 1038621426 /nfs/dbraw/zinc/62/14/26/1038621426.db2.gz XJPFTYIZTXFYMW-WMZOPIPTSA-N 1 0 304.503 4.051 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Br)cc2)c1 ZINC000048010770 1038662742 /nfs/dbraw/zinc/66/27/42/1038662742.db2.gz UNTAPLCOTRGFSA-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000112536836 1038685886 /nfs/dbraw/zinc/68/58/86/1038685886.db2.gz OGXLDOLMQOIFGF-LAUBAEHRSA-N 1 0 324.468 4.325 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](COCC(C)C)c2ccco2)cc1C ZINC000174328926 1038924206 /nfs/dbraw/zinc/92/42/06/1038924206.db2.gz JMXOVJFISBIQCL-KRWDZBQOSA-N 1 0 317.429 4.106 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](COCC(C)C)c2ccco2)cc1C ZINC000174328940 1038924545 /nfs/dbraw/zinc/92/45/45/1038924545.db2.gz JMXOVJFISBIQCL-QGZVFWFLSA-N 1 0 317.429 4.106 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000120871632 1039020712 /nfs/dbraw/zinc/02/07/12/1039020712.db2.gz LZQIAPOLGXQNQC-GHTZIAJQSA-N 1 0 324.468 4.010 20 10 DICDRO Oc1ccc2oc3c(c2c1C[N@@H+]1CCC[C@H]1C1CC1)CCCC3 ZINC000728562419 1039277868 /nfs/dbraw/zinc/27/78/68/1039277868.db2.gz OENMNERNBOINAN-INIZCTEOSA-N 1 0 311.425 4.392 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CSCCS1)c1ccc2ccccc2c1O ZINC000168819587 1039615642 /nfs/dbraw/zinc/61/56/42/1039615642.db2.gz IVLXRRQSBUQJFY-TZMCWYRMSA-N 1 0 319.495 4.045 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000926594555 1040092324 /nfs/dbraw/zinc/09/23/24/1040092324.db2.gz DJOHGJBAPVALII-NMACRGETSA-N 1 0 318.530 4.008 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000166965989 1040515197 /nfs/dbraw/zinc/51/51/97/1040515197.db2.gz CTBVFKGYJAEXKU-KRWDZBQOSA-N 1 0 315.461 4.106 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725851484 1040983629 /nfs/dbraw/zinc/98/36/29/1040983629.db2.gz RROVFHCFMXXMNR-UHFFFAOYSA-N 1 0 305.377 4.055 20 10 DICDRO CCc1cnc(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808699354 1041008219 /nfs/dbraw/zinc/00/82/19/1041008219.db2.gz DKGNFQYEVSPPGR-LLVKDONJSA-N 1 0 324.877 4.266 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2nccn2CC(C)C)c1O ZINC000808699025 1041009626 /nfs/dbraw/zinc/00/96/26/1041009626.db2.gz QFKMJBUZGYPZOT-ZDUSSCGKSA-N 1 0 321.852 4.057 20 10 DICDRO CCC(CC)(CCO)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808701136 1041011919 /nfs/dbraw/zinc/01/19/19/1041011919.db2.gz XATJBRGLFKEXSK-CYBMUJFWSA-N 1 0 313.869 4.193 20 10 DICDRO CSc1cc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)ccn1 ZINC000808703642 1041012066 /nfs/dbraw/zinc/01/20/66/1041012066.db2.gz QMLPDINJDUBSHP-NSHDSACASA-N 1 0 322.861 4.322 20 10 DICDRO CCC1(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CCOCC1 ZINC000808700789 1041012570 /nfs/dbraw/zinc/01/25/70/1041012570.db2.gz RCAATSLVHLTQHM-ZDUSSCGKSA-N 1 0 311.853 4.211 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)cc1 ZINC000808792945 1041032167 /nfs/dbraw/zinc/03/21/67/1041032167.db2.gz SFWWZMBXZXJLSO-FZNQNYSPSA-N 1 0 314.395 4.306 20 10 DICDRO CC(C)OCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178193493 1041034379 /nfs/dbraw/zinc/03/43/79/1041034379.db2.gz QSSJXQKGKPMBOU-QGZVFWFLSA-N 1 0 304.478 4.143 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H](C(F)F)C2)ccc1N1CCCCC1 ZINC000828545632 1041072734 /nfs/dbraw/zinc/07/27/34/1041072734.db2.gz ZVLUQLUIXYCYLF-INIZCTEOSA-N 1 0 308.416 4.072 20 10 DICDRO CCCCCC[C@H](CC)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001170580763 1041170484 /nfs/dbraw/zinc/17/04/84/1041170484.db2.gz GJCCILAUKXRJBV-IBGZPJMESA-N 1 0 318.505 4.362 20 10 DICDRO c1cncc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)c1 ZINC000809729501 1041222724 /nfs/dbraw/zinc/22/27/24/1041222724.db2.gz ULJXZZDMDRLMND-NRFANRHFSA-N 1 0 321.468 4.409 20 10 DICDRO c1cncc([C@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)c1 ZINC000809729502 1041225161 /nfs/dbraw/zinc/22/51/61/1041225161.db2.gz ULJXZZDMDRLMND-OAQYLSRUSA-N 1 0 321.468 4.409 20 10 DICDRO COc1cccc(C[NH2+]Cc2ccccc2-c2ccccc2)c1O ZINC000809739755 1041239893 /nfs/dbraw/zinc/23/98/93/1041239893.db2.gz DDPSNPYSXJKTTC-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)[C@@H](C)c2ccc(Cl)cc2)c1O ZINC000809739897 1041240056 /nfs/dbraw/zinc/24/00/56/1041240056.db2.gz GEJVBZPPPVJUTI-OLZOCXBDSA-N 1 0 319.832 4.336 20 10 DICDRO C[C@H]([NH2+]CCC(F)(F)F)c1ccc(N2CCCCC2)cc1 ZINC000165467855 1041297638 /nfs/dbraw/zinc/29/76/38/1041297638.db2.gz NHQGEUOHCWYGFO-ZDUSSCGKSA-N 1 0 300.368 4.280 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000810171061 1041322624 /nfs/dbraw/zinc/32/26/24/1041322624.db2.gz WDKQTFDKBYDBEL-AEFFLSMTSA-N 1 0 317.816 4.056 20 10 DICDRO CSc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000810153552 1041326157 /nfs/dbraw/zinc/32/61/57/1041326157.db2.gz ZSZVHDFIWVBKLS-LBPRGKRZSA-N 1 0 306.500 4.387 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nccc2ccccc21 ZINC000810215130 1041337455 /nfs/dbraw/zinc/33/74/55/1041337455.db2.gz RKUGBGHQIMQWEI-CQSZACIVSA-N 1 0 304.393 4.021 20 10 DICDRO CCC[C@@](C)(O)C[NH2+][C@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000810218010 1041338279 /nfs/dbraw/zinc/33/82/79/1041338279.db2.gz NQHKSPZNROBECN-UKRRQHHQSA-N 1 0 319.367 4.003 20 10 DICDRO CC[C@H]([NH2+]C1CCSCC1)c1ccc(C(F)(F)F)cc1O ZINC000810225100 1041341124 /nfs/dbraw/zinc/34/11/24/1041341124.db2.gz TXRNEMGILZKOGJ-ZDUSSCGKSA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810228551 1041343744 /nfs/dbraw/zinc/34/37/44/1041343744.db2.gz IFDCXOCDBANMPF-SUHUHFCYSA-N 1 0 317.351 4.019 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810228548 1041343942 /nfs/dbraw/zinc/34/39/42/1041343942.db2.gz IFDCXOCDBANMPF-JKOKRWQUSA-N 1 0 317.351 4.019 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccco1)c1ccc(C(F)(F)F)cc1O ZINC000810207824 1041347061 /nfs/dbraw/zinc/34/70/61/1041347061.db2.gz ONBRJFIUTBCAMZ-CQSZACIVSA-N 1 0 313.319 4.287 20 10 DICDRO CC[C@@H]([NH2+]C1CC(F)(F)C1)c1ccc(C(F)(F)F)cc1O ZINC000810236826 1041352733 /nfs/dbraw/zinc/35/27/33/1041352733.db2.gz AONZDXBCIBSYCI-LLVKDONJSA-N 1 0 309.278 4.249 20 10 DICDRO CC[C@H]([NH2+]CC1(c2cccc(OC)c2)CC1)c1ccccc1O ZINC000810241800 1041355645 /nfs/dbraw/zinc/35/56/45/1041355645.db2.gz DYMBUQWGNUFAQK-SFHVURJKSA-N 1 0 311.425 4.173 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1ccccc1O ZINC000810250271 1041358116 /nfs/dbraw/zinc/35/81/16/1041358116.db2.gz JTMFXMJESIBILU-POAQFYNOSA-N 1 0 311.425 4.353 20 10 DICDRO CC(C)COc1ccccc1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000236654392 1041415774 /nfs/dbraw/zinc/41/57/74/1041415774.db2.gz YYSITDUAOFNOLN-UHFFFAOYSA-N 1 0 312.457 4.077 20 10 DICDRO C[C@H]([NH2+][C@H]1COc2ccccc2C1)c1ccc2ccccc2c1O ZINC000328422617 1041435373 /nfs/dbraw/zinc/43/53/73/1041435373.db2.gz ZKAIIRYHJPTGCL-WMLDXEAASA-N 1 0 319.404 4.200 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCSCc2ccccc2)c1 ZINC000756355182 1041513429 /nfs/dbraw/zinc/51/34/29/1041513429.db2.gz KQMCROQRHXTWFJ-HNNXBMFYSA-N 1 0 301.455 4.285 20 10 DICDRO C[C@@H]([NH2+]Cc1ccnc(Cl)c1Cl)c1ccc(N(C)C)cc1 ZINC000811491399 1041524790 /nfs/dbraw/zinc/52/47/90/1041524790.db2.gz KKQAJTKDPPBWQX-LLVKDONJSA-N 1 0 324.255 4.305 20 10 DICDRO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1cccc(C)c1O)CCC2 ZINC000180544553 1041533861 /nfs/dbraw/zinc/53/38/61/1041533861.db2.gz TZKGDOBQNMYXIA-HNNXBMFYSA-N 1 0 316.470 4.229 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCC1(F)F ZINC000811512773 1041535234 /nfs/dbraw/zinc/53/52/34/1041535234.db2.gz SBNQQWUXATTZKB-HNNXBMFYSA-N 1 0 308.416 4.154 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3occc32)c2c1c(F)ccc2O ZINC000756402542 1041564086 /nfs/dbraw/zinc/56/40/86/1041564086.db2.gz UVOROPHXCPRZBO-DDTOSNHZSA-N 1 0 301.361 4.340 20 10 DICDRO CC[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccccc1F ZINC000183544475 1041584083 /nfs/dbraw/zinc/58/40/83/1041584083.db2.gz TXHPCOQGTLPQBW-KBPBESRZSA-N 1 0 303.377 4.040 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1ccc(F)cc1[O-])CCC2 ZINC000363868865 1041584963 /nfs/dbraw/zinc/58/49/63/1041584963.db2.gz OWWURVILADNJEU-RNCFNFMXSA-N 1 0 306.406 4.024 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccc2ccccc2c1O ZINC000185377923 1041611696 /nfs/dbraw/zinc/61/16/96/1041611696.db2.gz BDDKMHZLRKXWOL-ZDUSSCGKSA-N 1 0 320.367 4.407 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCCCC(=O)OC(C)(C)C)c(O)c1 ZINC000185597427 1041618003 /nfs/dbraw/zinc/61/80/03/1041618003.db2.gz UYQWNUNXTFCVAR-OAHLLOKOSA-N 1 0 321.461 4.253 20 10 DICDRO CC(C)C[C@H](CCO)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185615115 1041618340 /nfs/dbraw/zinc/61/83/40/1041618340.db2.gz ZSAMJCJHMBHFDT-CVEARBPZSA-N 1 0 315.457 4.241 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2cc3ccccc3o2)c1 ZINC000186070030 1041626052 /nfs/dbraw/zinc/62/60/52/1041626052.db2.gz LEPAZOYDKFRKMK-ZDUSSCGKSA-N 1 0 311.381 4.040 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3ccc(C)cc32)c1 ZINC000186200032 1041627079 /nfs/dbraw/zinc/62/70/79/1041627079.db2.gz DBVKAYHCUUCSRX-IFXJQAMLSA-N 1 0 311.425 4.437 20 10 DICDRO CO[C@@](C)(C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C1CC1 ZINC000812733885 1041642857 /nfs/dbraw/zinc/64/28/57/1041642857.db2.gz DCMPISWNFNNANZ-UZLBHIALSA-N 1 0 316.489 4.143 20 10 DICDRO COc1ccc(N2CCC([NH2+]C3C[C@H](C)C[C@@H](C)C3)CC2)cc1 ZINC000812835019 1041654116 /nfs/dbraw/zinc/65/41/16/1041654116.db2.gz ZIRIFZKDGPQMBZ-HZPDHXFCSA-N 1 0 316.489 4.078 20 10 DICDRO COc1ccc(N2CCC([NH2+]CC(C)(C)CC(C)C)CC2)cc1 ZINC000812836945 1041655462 /nfs/dbraw/zinc/65/54/62/1041655462.db2.gz GILVDIULWTZCGZ-UHFFFAOYSA-N 1 0 318.505 4.326 20 10 DICDRO Cc1csc(CCCC[NH2+][C@H](C)c2ccc(C)c(C)c2O)n1 ZINC000756533708 1041690832 /nfs/dbraw/zinc/69/08/32/1041690832.db2.gz HCBZQFMZTLBPHZ-OAHLLOKOSA-N 1 0 318.486 4.447 20 10 DICDRO Cc1csc(CCCC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)n1 ZINC000756533705 1041690991 /nfs/dbraw/zinc/69/09/91/1041690991.db2.gz HCBZQFMZTLBPHZ-HNNXBMFYSA-N 1 0 318.486 4.447 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@@H](C)C2)ccc1OC ZINC000747853676 1041702101 /nfs/dbraw/zinc/70/21/01/1041702101.db2.gz AFAJVCLJIHBPEC-HZPDHXFCSA-N 1 0 305.462 4.148 20 10 DICDRO CCOCc1cc(C[NH2+]CCC2CCCCC2)ccc1OC ZINC000747854614 1041703003 /nfs/dbraw/zinc/70/30/03/1041703003.db2.gz SEZYZKBTRDDTSI-UHFFFAOYSA-N 1 0 305.462 4.292 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2cc(C)c(C)cc2O)c1 ZINC000813790966 1041732206 /nfs/dbraw/zinc/73/22/06/1041732206.db2.gz LQCYMOWCVUIYAL-UHFFFAOYSA-N 1 0 301.455 4.411 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000813886012 1041742666 /nfs/dbraw/zinc/74/26/66/1041742666.db2.gz SPEWPAGKHKOBCK-LLVKDONJSA-N 1 0 322.836 4.454 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCc2nc(C)sc21)c1ccccc1O ZINC000364361891 1041762900 /nfs/dbraw/zinc/76/29/00/1041762900.db2.gz WXJGZDZPMOFBAC-UKRRQHHQSA-N 1 0 302.443 4.275 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cccs2)c1 ZINC000162710989 1041777995 /nfs/dbraw/zinc/77/79/95/1041777995.db2.gz HDNVAFUGFGPWLC-HNNXBMFYSA-N 1 0 303.427 4.190 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)cc1 ZINC000814169995 1041781428 /nfs/dbraw/zinc/78/14/28/1041781428.db2.gz PIUHWQQEDMVYIE-SJORKVTESA-N 1 0 308.416 4.010 20 10 DICDRO CCOC1(C)CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000814170559 1041782766 /nfs/dbraw/zinc/78/27/66/1041782766.db2.gz YUWPWXPUPBESSG-UHFFFAOYSA-N 1 0 316.489 4.068 20 10 DICDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756608831 1041788395 /nfs/dbraw/zinc/78/83/95/1041788395.db2.gz DULWYKJKDHENPZ-UONOGXRCSA-N 1 0 305.462 4.125 20 10 DICDRO CS[C@@H]1CC[C@H]([NH2+][C@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000756611594 1041793190 /nfs/dbraw/zinc/79/31/90/1041793190.db2.gz UAKTVIUQBSBWFQ-UHOFOFEASA-N 1 0 305.487 4.206 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC000814224314 1041794166 /nfs/dbraw/zinc/79/41/66/1041794166.db2.gz FMIDAIVHOLLGPB-SFHVURJKSA-N 1 0 318.420 4.320 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1c(C)nn(C)c1C ZINC000756615696 1041797490 /nfs/dbraw/zinc/79/74/90/1041797490.db2.gz FUJQULOSFWLQDZ-ZUZCIYMTSA-N 1 0 321.852 4.198 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)nc1 ZINC000815011261 1041904165 /nfs/dbraw/zinc/90/41/65/1041904165.db2.gz GRCFQRVFWJGOAL-UHFFFAOYSA-N 1 0 323.484 4.266 20 10 DICDRO Cc1cnc([C@@H]([NH2+]Cc2ccc(N(C)C)c(C)c2)C2CC2)s1 ZINC000815090186 1041908325 /nfs/dbraw/zinc/90/83/25/1041908325.db2.gz TTXIJMBWGRHDNM-KRWDZBQOSA-N 1 0 315.486 4.067 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)ccc1N(C)C ZINC000815065954 1041909687 /nfs/dbraw/zinc/90/96/87/1041909687.db2.gz TWDQRANMFMIWKQ-FQEVSTJZSA-N 1 0 310.441 4.104 20 10 DICDRO Cc1cc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)ccc1N(C)C ZINC000815092927 1041910232 /nfs/dbraw/zinc/91/02/32/1041910232.db2.gz VXLAODYMHVMGBT-QRWLVFNGSA-N 1 0 309.457 4.039 20 10 DICDRO Cc1cc(C[NH2+]C2(c3ccc(F)cc3)CCC2)ccc1N(C)C ZINC000815067993 1041910271 /nfs/dbraw/zinc/91/02/71/1041910271.db2.gz DOCSKRZMDAIIPC-UHFFFAOYSA-N 1 0 312.432 4.369 20 10 DICDRO C[C@H]([NH2+][C@@H]1C=CCCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000815082398 1041912722 /nfs/dbraw/zinc/91/27/22/1041912722.db2.gz OMJKNLTVRFBCHN-PKOBYXMFSA-N 1 0 314.473 4.063 20 10 DICDRO Cc1cc(C[NH2+][C@H](CC(F)(F)F)C(C)C)ccc1N(C)C ZINC000815099618 1041919860 /nfs/dbraw/zinc/91/98/60/1041919860.db2.gz LQUYDTKYFXSJJR-CQSZACIVSA-N 1 0 302.384 4.128 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000815166046 1041922044 /nfs/dbraw/zinc/92/20/44/1041922044.db2.gz ZLXGTLVGMHLPOV-JOCQHMNTSA-N 1 0 317.816 4.090 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]Cc1cccnc1 ZINC000815553274 1041961903 /nfs/dbraw/zinc/96/19/03/1041961903.db2.gz WAAAJZKYYUULTN-HXUWFJFHSA-N 1 0 318.420 4.251 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCc1ccco1 ZINC000815553816 1041962061 /nfs/dbraw/zinc/96/20/61/1041962061.db2.gz KWEULSWKVYLYLX-HXUWFJFHSA-N 1 0 321.420 4.491 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](c2ccsc2)N(C)C)c(O)c1 ZINC000815556140 1041963261 /nfs/dbraw/zinc/96/32/61/1041963261.db2.gz OPUAXZUWQHNMSQ-GDBMZVCRSA-N 1 0 318.486 4.024 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C2CCN(c3ccccc3)CC2)c(O)c1 ZINC000815564102 1041963865 /nfs/dbraw/zinc/96/38/65/1041963865.db2.gz XIZHCEHEPBFSCO-KRWDZBQOSA-N 1 0 324.468 4.329 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c(O)c1 ZINC000815580495 1041965675 /nfs/dbraw/zinc/96/56/75/1041965675.db2.gz LIVYMDRAZWYRNF-INIZCTEOSA-N 1 0 312.457 4.234 20 10 DICDRO CSC[C@H](C)[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815582000 1041967495 /nfs/dbraw/zinc/96/74/95/1041967495.db2.gz VHGIPCFIWIHRPK-MAUKXSAKSA-N 1 0 315.482 4.407 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)c(O)c1 ZINC000815597453 1041970931 /nfs/dbraw/zinc/97/09/31/1041970931.db2.gz WHFALHRLOPNICT-QMLHBMHXSA-N 1 0 307.437 4.246 20 10 DICDRO CS[C@@H](C)C[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815597949 1041971031 /nfs/dbraw/zinc/97/10/31/1041971031.db2.gz JIPGCAUGKDTHIS-MAUKXSAKSA-N 1 0 315.482 4.407 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)o1 ZINC000815629124 1041978807 /nfs/dbraw/zinc/97/88/07/1041978807.db2.gz VDJRVGFYXNDEBJ-AWEZNQCLSA-N 1 0 302.418 4.109 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](c2ccccc2)C2CC2)c1 ZINC000815630578 1041978901 /nfs/dbraw/zinc/97/89/01/1041978901.db2.gz OHYLLYKMWBPGHM-KUHUBIRLSA-N 1 0 311.425 4.245 20 10 DICDRO COc1cc(CC[NH2+][C@@H](C)c2cc(C)ccc2O)ccc1Cl ZINC000815658099 1041980991 /nfs/dbraw/zinc/98/09/91/1041980991.db2.gz SLFAMYCPDQYZQK-ZDUSSCGKSA-N 1 0 319.832 4.256 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccc(C(F)(F)F)n2)c(O)c1 ZINC000815637413 1041981693 /nfs/dbraw/zinc/98/16/93/1041981693.db2.gz WAQMZZPTMCCJBT-GFCCVEGCSA-N 1 0 324.346 4.008 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)c1 ZINC000756757759 1041981839 /nfs/dbraw/zinc/98/18/39/1041981839.db2.gz BRHXYVQOEPAWSV-ABAIWWIYSA-N 1 0 303.789 4.138 20 10 DICDRO COCC1(CC[NH2+][C@@H](C)c2ccc3ccccc3c2O)CCC1 ZINC000815641992 1041983066 /nfs/dbraw/zinc/98/30/66/1041983066.db2.gz OENCCVRXCQLASV-HNNXBMFYSA-N 1 0 313.441 4.403 20 10 DICDRO CCc1noc(C)c1C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000815640937 1041983079 /nfs/dbraw/zinc/98/30/79/1041983079.db2.gz KPLZWWNAALWXQN-SNVBAGLBSA-N 1 0 308.809 4.064 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1cc(Cl)ccc1O ZINC000815648644 1041984056 /nfs/dbraw/zinc/98/40/56/1041984056.db2.gz SOXRQYPLNBZUFW-IFIJOSMWSA-N 1 0 301.817 4.500 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)C1CC1 ZINC000815651003 1041985830 /nfs/dbraw/zinc/98/58/30/1041985830.db2.gz HGPSOZMTKGOSOY-OXQOHEQNSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)C(C)(C)O ZINC000815652350 1041985846 /nfs/dbraw/zinc/98/58/46/1041985846.db2.gz YXPSXWICKPBEGI-QFBILLFUSA-N 1 0 318.505 4.267 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOc2ccccc2Cl)c1 ZINC000756767316 1041995905 /nfs/dbraw/zinc/99/59/05/1041995905.db2.gz GAUXTDQERWPNLY-CYBMUJFWSA-N 1 0 305.805 4.084 20 10 DICDRO Fc1ccc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000104863691 1042057784 /nfs/dbraw/zinc/05/77/84/1042057784.db2.gz COLVTBQUJGXEHB-UHFFFAOYSA-N 1 0 312.432 4.148 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@H]2c2ccccn2)ccc2ccccc21 ZINC000816487095 1042057887 /nfs/dbraw/zinc/05/78/87/1042057887.db2.gz CUOWBJVJDWKTML-LJQANCHMSA-N 1 0 304.393 4.278 20 10 DICDRO Oc1c(C[N@@H+]2CCOC[C@H]2c2ccccc2)ccc2ccccc21 ZINC000816516078 1042061010 /nfs/dbraw/zinc/06/10/10/1042061010.db2.gz ULKDTKVPIWIJRL-FQEVSTJZSA-N 1 0 319.404 4.119 20 10 DICDRO Oc1c(C[N@@H+]2CCOC3(CCCCC3)C2)ccc2ccccc21 ZINC000816516246 1042061570 /nfs/dbraw/zinc/06/15/70/1042061570.db2.gz YXMZRQIPPNHGEO-UHFFFAOYSA-N 1 0 311.425 4.081 20 10 DICDRO CCOCc1ccccc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816531985 1042061914 /nfs/dbraw/zinc/06/19/14/1042061914.db2.gz MPPCGOWHHLXXHP-UHFFFAOYSA-N 1 0 321.420 4.372 20 10 DICDRO Cc1ccc(OCC[NH2+]Cc2ccc3ccccc3c2O)cc1 ZINC000816531438 1042062371 /nfs/dbraw/zinc/06/23/71/1042062371.db2.gz RWEXLISMIWEHEM-UHFFFAOYSA-N 1 0 307.393 4.022 20 10 DICDRO CC(C)Oc1ccc(C[NH2+]Cc2ccc3ccccc3c2O)cn1 ZINC000816535115 1042062810 /nfs/dbraw/zinc/06/28/10/1042062810.db2.gz GJFBYPRIYDWPTO-UHFFFAOYSA-N 1 0 322.408 4.017 20 10 DICDRO Oc1c(C[NH2+]Cc2ccc3ccccc3n2)ccc2ccccc21 ZINC000816542060 1042063241 /nfs/dbraw/zinc/06/32/41/1042063241.db2.gz BOTWLHQHNLXBCA-UHFFFAOYSA-N 1 0 314.388 4.383 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc3ccccc3c2O)cn1 ZINC000816536230 1042063334 /nfs/dbraw/zinc/06/33/34/1042063334.db2.gz PBFCFPCYVQHCPR-UHFFFAOYSA-N 1 0 322.408 4.019 20 10 DICDRO Cc1ccccc1OCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816537393 1042063643 /nfs/dbraw/zinc/06/36/43/1042063643.db2.gz DCWKODBCSKUHIB-UHFFFAOYSA-N 1 0 307.393 4.022 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@H](Cc3ccncc3)C2)ccc2ccccc21 ZINC000816566605 1042068426 /nfs/dbraw/zinc/06/84/26/1042068426.db2.gz ADTJMVLEHURJNJ-KRWDZBQOSA-N 1 0 318.420 4.005 20 10 DICDRO CC(C)(O)c1ccc(C[NH2+]Cc2ccc3ccccc3c2O)cc1 ZINC000816572380 1042069983 /nfs/dbraw/zinc/06/99/83/1042069983.db2.gz NAHSKGSKHHXINM-UHFFFAOYSA-N 1 0 321.420 4.063 20 10 DICDRO C[C@@H](O)C[C@H]1CCCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816608786 1042073749 /nfs/dbraw/zinc/07/37/49/1042073749.db2.gz JOOGWWKMFIIWLZ-CRAIPNDOSA-N 1 0 313.441 4.061 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000817408490 1042107385 /nfs/dbraw/zinc/10/73/85/1042107385.db2.gz IUQVEDJNEWRTSQ-OAHLLOKOSA-N 1 0 321.779 4.188 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccncc2Cl)cc1 ZINC000817576679 1042116136 /nfs/dbraw/zinc/11/61/36/1042116136.db2.gz UZRNMEQPTFRJTP-CQSZACIVSA-N 1 0 317.864 4.432 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC23CCSCC3)c2c1c(F)ccc2O ZINC000817588264 1042118202 /nfs/dbraw/zinc/11/82/02/1042118202.db2.gz DFEIEPSYCMIGDI-DYEKYZERSA-N 1 0 321.461 4.203 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C)nc(C)c1)c1cc(Cl)ccc1O ZINC000817589897 1042119332 /nfs/dbraw/zinc/11/93/32/1042119332.db2.gz RCMFVCIAGACAET-MRXNPFEDSA-N 1 0 304.821 4.298 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CC12CCSCC2)c1ccc(C)cc1O ZINC000817588796 1042120053 /nfs/dbraw/zinc/12/00/53/1042120053.db2.gz KGKBUFCFOWKLKE-ZBFHGGJFSA-N 1 0 305.487 4.275 20 10 DICDRO CC[C@@H]([NH2+]CCC[NH2+]C(C)C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817953942 1042131427 /nfs/dbraw/zinc/13/14/27/1042131427.db2.gz SITWTPVRXKNMCG-CYBMUJFWSA-N 1 0 319.276 4.128 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CCSc3c(Cl)cccc32)cc1 ZINC000817956119 1042131610 /nfs/dbraw/zinc/13/16/10/1042131610.db2.gz RBCQGACEVMRUNV-MRXNPFEDSA-N 1 0 318.873 4.291 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(SC(F)F)cc1 ZINC000817955722 1042131618 /nfs/dbraw/zinc/13/16/18/1042131618.db2.gz GDQXZCLFASKUGH-LBPRGKRZSA-N 1 0 322.424 4.477 20 10 DICDRO CCSc1ccccc1[C@@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955728 1042131740 /nfs/dbraw/zinc/13/17/40/1042131740.db2.gz GFRZTPQCFMWWQZ-CQSZACIVSA-N 1 0 300.471 4.274 20 10 DICDRO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817956066 1042131750 /nfs/dbraw/zinc/13/17/50/1042131750.db2.gz PUGOGBVFIZQJHP-CYBMUJFWSA-N 1 0 318.848 4.214 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CCSc3c(Cl)cccc32)cc1 ZINC000817956118 1042131845 /nfs/dbraw/zinc/13/18/45/1042131845.db2.gz RBCQGACEVMRUNV-INIZCTEOSA-N 1 0 318.873 4.291 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000817956451 1042132299 /nfs/dbraw/zinc/13/22/99/1042132299.db2.gz ZGKQIWPBSSWQME-INIZCTEOSA-N 1 0 318.873 4.291 20 10 DICDRO Nc1ccc(CC[NH2+][C@H](Cc2ccccc2Cl)C2CC2)cc1 ZINC000817957024 1042132591 /nfs/dbraw/zinc/13/25/91/1042132591.db2.gz HMAZKKPTOGVRML-LJQANCHMSA-N 1 0 314.860 4.076 20 10 DICDRO Cc1cc2c(cc1C)[C@H]([NH2+]CCc1ccc(N)cc1)CCS2 ZINC000817957917 1042132951 /nfs/dbraw/zinc/13/29/51/1042132951.db2.gz QTDDFQDGASLAFE-GOSISDBHSA-N 1 0 312.482 4.255 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000817967799 1042133431 /nfs/dbraw/zinc/13/34/31/1042133431.db2.gz MEWBBIXUXUJSIW-RTWAWAEBSA-N 1 0 323.484 4.453 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccc(C)cc1O ZINC000817968118 1042134752 /nfs/dbraw/zinc/13/47/52/1042134752.db2.gz PGOMJZGDRKSGMD-MOPGFXCFSA-N 1 0 310.441 4.401 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1cc(Cl)ccc1O ZINC000817968095 1042135017 /nfs/dbraw/zinc/13/50/17/1042135017.db2.gz PAHCCBYFZLFPSY-DIFFPNOSSA-N 1 0 316.832 4.356 20 10 DICDRO Cc1cc(N)cc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000817980230 1042135716 /nfs/dbraw/zinc/13/57/16/1042135716.db2.gz JWJQPCZVKRBSLU-LBPRGKRZSA-N 1 0 304.821 4.095 20 10 DICDRO Cc1cc(N)cc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000817979433 1042135748 /nfs/dbraw/zinc/13/57/48/1042135748.db2.gz AYTDUWYBTJIYPJ-QGZVFWFLSA-N 1 0 323.484 4.418 20 10 DICDRO CC(C)n1cncc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000822443534 1042283867 /nfs/dbraw/zinc/28/38/67/1042283867.db2.gz WZIHWLNGDDXKAY-UHFFFAOYSA-N 1 0 313.445 4.114 20 10 DICDRO CCCCOCCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000318707871 1042286577 /nfs/dbraw/zinc/28/65/77/1042286577.db2.gz ZVSDXMLHKHYHLO-OAHLLOKOSA-N 1 0 301.430 4.403 20 10 DICDRO CC(C)N(CC[NH2+][C@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000320073758 1042304568 /nfs/dbraw/zinc/30/45/68/1042304568.db2.gz WQDVMJFGYVQEBK-MRXNPFEDSA-N 1 0 314.473 4.315 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3c(Cl)cccc3C2)cc1 ZINC001171021473 1042332778 /nfs/dbraw/zinc/33/27/78/1042332778.db2.gz FFUYSGSHEITHHP-INIZCTEOSA-N 1 0 314.860 4.053 20 10 DICDRO COc1ccc(N2CCC[N@H+](Cc3cc(C)ccc3C)CC2)cc1 ZINC000108088763 1042351226 /nfs/dbraw/zinc/35/12/26/1042351226.db2.gz YHSRNEXIYWNHRQ-UHFFFAOYSA-N 1 0 324.468 4.024 20 10 DICDRO COc1cccc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)c1O ZINC000237363277 1042376672 /nfs/dbraw/zinc/37/66/72/1042376672.db2.gz VUHHZGFKICBUTN-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000248576385 1042442701 /nfs/dbraw/zinc/44/27/01/1042442701.db2.gz TXSFGOGCSSJSIC-ZAAXVRCTSA-N 1 0 312.457 4.124 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2CCc3c2cccc3Cl)c1O ZINC000894205469 1042503100 /nfs/dbraw/zinc/50/31/00/1042503100.db2.gz ZGPZPYSCFQQUNU-INIZCTEOSA-N 1 0 317.816 4.140 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCOc2ccc(F)cc2)c(Cl)c1 ZINC001648951394 1042522722 /nfs/dbraw/zinc/52/27/22/1042522722.db2.gz UNRPMVNOPHVMTQ-UHFFFAOYSA-N 1 0 323.795 4.052 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCOC)c1ccco1)c1ccc(C)cc1O ZINC000279998183 1042561002 /nfs/dbraw/zinc/56/10/02/1042561002.db2.gz FULRZLPZKOYFCC-HOTGVXAUSA-N 1 0 303.402 4.112 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccc(C)cc1O ZINC000280103667 1042564293 /nfs/dbraw/zinc/56/42/93/1042564293.db2.gz NGAWNJSHSKHPDX-MRXNPFEDSA-N 1 0 303.377 4.089 20 10 DICDRO CC[C@@H]([NH2+]Cc1csc([C@H](C)OC)n1)c1ccc(C)cc1O ZINC000280097794 1042564504 /nfs/dbraw/zinc/56/45/04/1042564504.db2.gz MXGVRZGPDLORME-SWLSCSKDSA-N 1 0 320.458 4.105 20 10 DICDRO COc1cc(C)cc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)c1O ZINC000894249862 1042598790 /nfs/dbraw/zinc/59/87/90/1042598790.db2.gz ZZMJEJPKBLYLCJ-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2cccs2)cc1F ZINC000740003138 1042955047 /nfs/dbraw/zinc/95/50/47/1042955047.db2.gz VYPZCSZAYQJZCU-UHFFFAOYSA-N 1 0 306.450 4.066 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2CCCc3ccc(F)cc32)c1O ZINC000894614391 1042970260 /nfs/dbraw/zinc/97/02/60/1042970260.db2.gz QOOAXZVDXFVYOU-KRWDZBQOSA-N 1 0 315.388 4.016 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccc(C)cc1O ZINC000794805282 1043049606 /nfs/dbraw/zinc/04/96/06/1043049606.db2.gz GJCBYEHZYDZQBR-MAUKXSAKSA-N 1 0 311.425 4.308 20 10 DICDRO CC[C@H]([NH2+]Cc1nc(C)c2ccccc2n1)c1ccc(C)cc1O ZINC000794803439 1043051407 /nfs/dbraw/zinc/05/14/07/1043051407.db2.gz IZACRRNJJGIEQI-KRWDZBQOSA-N 1 0 321.424 4.193 20 10 DICDRO CC[C@H]([NH2+]CC1(CCO)CCCCC1)c1ccc(C)cc1O ZINC000794811401 1043056621 /nfs/dbraw/zinc/05/66/21/1043056621.db2.gz QPRCVXIXORESLP-KRWDZBQOSA-N 1 0 305.462 4.074 20 10 DICDRO CC[C@H]([NH2+]CCc1sc(C)nc1C)c1ccc(C)cc1O ZINC000794811244 1043057245 /nfs/dbraw/zinc/05/72/45/1043057245.db2.gz WLGGLMVXSBWHBI-HNNXBMFYSA-N 1 0 304.459 4.057 20 10 DICDRO CC[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccc(C)cc1O ZINC000794814387 1043059562 /nfs/dbraw/zinc/05/95/62/1043059562.db2.gz FHHCYRDJFXXFKP-GJZGRUSLSA-N 1 0 319.351 4.153 20 10 DICDRO CC[C@H]([NH2+][C@@H]1COc2c1ccc(C)c2C)c1ccc(C)cc1O ZINC000794812323 1043061222 /nfs/dbraw/zinc/06/12/22/1043061222.db2.gz VUIQMXIUEFXQFT-ZWKOTPCHSA-N 1 0 311.425 4.492 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)C)c1ccc(C)cc1O ZINC000794820238 1043063655 /nfs/dbraw/zinc/06/36/55/1043063655.db2.gz ZKZOCGUKDNVRBG-IEZWGBDMSA-N 1 0 305.462 4.193 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CC)c1c(C)noc1C)c1ccc(C)cc1O ZINC000794820208 1043064150 /nfs/dbraw/zinc/06/41/50/1043064150.db2.gz YYXMCPASPJXFKW-CVEARBPZSA-N 1 0 302.418 4.497 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)cc1F)c1ccc(C)cc1O ZINC000794819657 1043065913 /nfs/dbraw/zinc/06/59/13/1043065913.db2.gz XAZGEDVBKLVDII-KRWDZBQOSA-N 1 0 303.377 4.089 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ncccc3c2)c2c1c(F)ccc2O ZINC000794827074 1043066486 /nfs/dbraw/zinc/06/64/86/1043066486.db2.gz FRBKUKNOAGPBOX-SJKOYZFVSA-N 1 0 322.383 4.418 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)c1cc(F)ccc1O ZINC000794832186 1043069540 /nfs/dbraw/zinc/06/95/40/1043069540.db2.gz HDRMCJWNNBRXGD-APPDUMDISA-N 1 0 303.352 4.399 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000777288321 1043075211 /nfs/dbraw/zinc/07/52/11/1043075211.db2.gz RVERNJJGSPHJSM-MRXNPFEDSA-N 1 0 311.473 4.296 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2cccc3ccccc32)c1 ZINC000120521074 1043091113 /nfs/dbraw/zinc/09/11/13/1043091113.db2.gz QMBJFCOOSWNTPI-CQSZACIVSA-N 1 0 307.393 4.405 20 10 DICDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CC2 ZINC000177973860 1043119675 /nfs/dbraw/zinc/11/96/75/1043119675.db2.gz YCSCRZDJUHJBSL-OAQYLSRUSA-N 1 0 322.452 4.073 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc2ccccc2n1 ZINC000178188232 1043123523 /nfs/dbraw/zinc/12/35/23/1043123523.db2.gz UQCOZFSMOPMVLJ-AWEZNQCLSA-N 1 0 323.415 4.291 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2CCC(OC(C)(C)C)CC2)c1 ZINC000865698890 1043125069 /nfs/dbraw/zinc/12/50/69/1043125069.db2.gz SDZRLIDXEKOEDE-UHFFFAOYSA-N 1 0 321.461 4.007 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000178427833 1043129834 /nfs/dbraw/zinc/12/98/34/1043129834.db2.gz CZFOBDYRJIPOFH-ROUUACIJSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000183344450 1043161290 /nfs/dbraw/zinc/16/12/90/1043161290.db2.gz DLROPBSSJAFUDY-DOTOQJQBSA-N 1 0 320.452 4.036 20 10 DICDRO CC(C)[C@H]([NH2+][C@@H](C)c1ccccc1O)c1nc2ccccc2[nH]1 ZINC000183448018 1043164540 /nfs/dbraw/zinc/16/45/40/1043164540.db2.gz BHMDJJXPZRWJQU-UGSOOPFHSA-N 1 0 309.413 4.316 20 10 DICDRO CC(C)COC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccco1 ZINC000183478094 1043164752 /nfs/dbraw/zinc/16/47/52/1043164752.db2.gz SUMAFZPANPLDSR-HOCLYGCPSA-N 1 0 303.402 4.050 20 10 DICDRO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000183608686 1043168828 /nfs/dbraw/zinc/16/88/28/1043168828.db2.gz KFHICRIYDBARNV-UONOGXRCSA-N 1 0 309.413 4.174 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOc2cc(F)ccc21)c1ccccc1O ZINC000183671625 1043169149 /nfs/dbraw/zinc/16/91/49/1043169149.db2.gz SREDYOHMWHHSAW-WBMJQRKESA-N 1 0 301.361 4.096 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000184932345 1043192590 /nfs/dbraw/zinc/19/25/90/1043192590.db2.gz ZVGHESHYVCXPSY-CYBMUJFWSA-N 1 0 319.832 4.433 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Cl)nc1)c1cc2c(cc1O)CCCC2 ZINC000185074162 1043194377 /nfs/dbraw/zinc/19/43/77/1043194377.db2.gz SJJGJZDFZOGBGX-LBPRGKRZSA-N 1 0 316.832 4.170 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1)c1cc(F)ccc1O ZINC000185225563 1043196241 /nfs/dbraw/zinc/19/62/41/1043196241.db2.gz HSCHFRDMXFZESX-AGRHKRQWSA-N 1 0 315.388 4.102 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+][C@@H](C)c2cc(OC)ccc2O)c1 ZINC000185229864 1043197476 /nfs/dbraw/zinc/19/74/76/1043197476.db2.gz IGXLEFMZKFRNKS-KGLIPLIRSA-N 1 0 315.413 4.211 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccccc1O ZINC000866404869 1043198128 /nfs/dbraw/zinc/19/81/28/1043198128.db2.gz WTVSTJUTSZMUPB-NJAPINKUSA-N 1 0 317.816 4.226 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)cc1F ZINC000185382953 1043200005 /nfs/dbraw/zinc/20/00/05/1043200005.db2.gz RBKZVPHVQJSHGD-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](c2ncccc2C)C(C)C)c1 ZINC000185457875 1043202546 /nfs/dbraw/zinc/20/25/46/1043202546.db2.gz HIOQMSRVRUXVDN-KDOFPFPSSA-N 1 0 314.429 4.152 20 10 DICDRO Cc1cccnc1[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)C(C)C ZINC000185458483 1043203104 /nfs/dbraw/zinc/20/31/04/1043203104.db2.gz FCELNLYHSCIJLC-GUYCJALGSA-N 1 0 302.393 4.283 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cc2c(cc1O)CCCC2)c1ccncc1 ZINC000185541468 1043203131 /nfs/dbraw/zinc/20/31/31/1043203131.db2.gz UKJNQNKKQNMUJO-AUUYWEPGSA-N 1 0 310.441 4.468 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c2ccccc2n1 ZINC000185573753 1043204561 /nfs/dbraw/zinc/20/45/61/1043204561.db2.gz ZCXSJPPIKAEXJU-AWEZNQCLSA-N 1 0 322.408 4.108 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2cnc(C)s2)cc1 ZINC000866454567 1043204552 /nfs/dbraw/zinc/20/45/52/1043204552.db2.gz CWQYIUVPQXONQU-OLZOCXBDSA-N 1 0 303.475 4.319 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(-n3cccn3)c2)c(O)c1 ZINC000185616873 1043204726 /nfs/dbraw/zinc/20/47/26/1043204726.db2.gz NKSMUCYJCNFQGT-HOTGVXAUSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC2([C@@H]3CCCCO3)CCC2)c(O)c1 ZINC000866480175 1043208373 /nfs/dbraw/zinc/20/83/73/1043208373.db2.gz AFKQENVZLXVAMF-QAPCUYQASA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866480598 1043209288 /nfs/dbraw/zinc/20/92/88/1043209288.db2.gz FVZMEAHXDBMEIC-AEFFLSMTSA-N 1 0 303.446 4.172 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1cc(F)ccc1F ZINC000186071114 1043212481 /nfs/dbraw/zinc/21/24/81/1043212481.db2.gz CXNFUOFTDHQJSX-PIGZYNQJSA-N 1 0 321.367 4.481 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1[N+](=O)[O-] ZINC000186093159 1043213954 /nfs/dbraw/zinc/21/39/54/1043213954.db2.gz LZBFWFJXPFMRPU-NEPJUHHUSA-N 1 0 318.348 4.160 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2noc3ccc(F)cc32)c(O)c1C ZINC000866511554 1043214727 /nfs/dbraw/zinc/21/47/27/1043214727.db2.gz QWWYYAVZXGTACQ-GFCCVEGCSA-N 1 0 314.360 4.140 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1[N+](=O)[O-] ZINC000186093212 1043215684 /nfs/dbraw/zinc/21/56/84/1043215684.db2.gz LZBFWFJXPFMRPU-NWDGAFQWSA-N 1 0 318.348 4.160 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000186155412 1043216739 /nfs/dbraw/zinc/21/67/39/1043216739.db2.gz OCDRLHCIOLVJST-HNNXBMFYSA-N 1 0 313.441 4.403 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccccc1O ZINC000186268779 1043218352 /nfs/dbraw/zinc/21/83/52/1043218352.db2.gz JMLQXURCIVIYSM-HOTGVXAUSA-N 1 0 301.361 4.096 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1[N+](=O)[O-] ZINC000866540475 1043219934 /nfs/dbraw/zinc/21/99/34/1043219934.db2.gz OWEPFGXEWANKCN-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCOc3c(F)cccc32)c1 ZINC000186506508 1043225036 /nfs/dbraw/zinc/22/50/36/1043225036.db2.gz LFHMYMQQAPBQJG-CXAGYDPISA-N 1 0 315.388 4.404 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCOc3c(F)cccc32)c1 ZINC000186506525 1043225501 /nfs/dbraw/zinc/22/55/01/1043225501.db2.gz LFHMYMQQAPBQJG-SUMWQHHRSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCOc3c(F)cccc32)c(O)c1 ZINC000186506787 1043227071 /nfs/dbraw/zinc/22/70/71/1043227071.db2.gz FNFFTRLAMYKDMX-SUMWQHHRSA-N 1 0 315.388 4.404 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCn2nccc21)c1ccc(N2CCCCC2)cc1 ZINC000866632700 1043240266 /nfs/dbraw/zinc/24/02/66/1043240266.db2.gz OCDFDUYKHGFTFN-VQIMIIECSA-N 1 0 324.472 4.059 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000187586184 1043246821 /nfs/dbraw/zinc/24/68/21/1043246821.db2.gz YNXBMSVPJYVWSH-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@H](CC(C)C)C2)c1O ZINC000777440649 1043253971 /nfs/dbraw/zinc/25/39/71/1043253971.db2.gz OQUYDGPKIXTLHU-JKSUJKDBSA-N 1 0 311.853 4.037 20 10 DICDRO C[C@@H]1C[C@H]([NH3+])CN1C(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000868090652 1043272823 /nfs/dbraw/zinc/27/28/23/1043272823.db2.gz MUFAQUDNEGDJRT-KGLIPLIRSA-N 1 0 323.400 4.055 20 10 DICDRO COc1ccc(C[NH2+]CCCn2ccc3ccccc32)cc1C ZINC000320082496 1043284759 /nfs/dbraw/zinc/28/47/59/1043284759.db2.gz XVRMDEBLTIAVOJ-UHFFFAOYSA-N 1 0 308.425 4.138 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@H](C)c2ccc(F)cc2)c1O ZINC000122179311 1043285201 /nfs/dbraw/zinc/28/52/01/1043285201.db2.gz ULGZEODXFHJGGF-CYBMUJFWSA-N 1 0 303.377 4.123 20 10 DICDRO CC1=Nc2ccccc2C12CC[NH+](Cc1ccccc1O)CC2 ZINC000895130251 1043293488 /nfs/dbraw/zinc/29/34/88/1043293488.db2.gz IYXUINZRWPXNLE-UHFFFAOYSA-N 1 0 306.409 4.032 20 10 DICDRO CCc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC000122417746 1043304057 /nfs/dbraw/zinc/30/40/57/1043304057.db2.gz OLANKAWIBLIALE-LLVKDONJSA-N 1 0 321.465 4.070 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000122424738 1043304597 /nfs/dbraw/zinc/30/45/97/1043304597.db2.gz SSIWXQKHGAIZNS-KBPBESRZSA-N 1 0 316.420 4.312 20 10 DICDRO COCCCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000122617430 1043318435 /nfs/dbraw/zinc/31/84/35/1043318435.db2.gz VBFHUQWPHPTDSL-KRWDZBQOSA-N 1 0 304.478 4.144 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1F ZINC000122689826 1043322579 /nfs/dbraw/zinc/32/25/79/1043322579.db2.gz OSCSPOWXUMTUSE-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCc2sccc21 ZINC000122763871 1043327409 /nfs/dbraw/zinc/32/74/09/1043327409.db2.gz CWYZKKIMYJKWQD-KRWDZBQOSA-N 1 0 300.471 4.290 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC2(C1)CCOCC2 ZINC000271230401 1043408908 /nfs/dbraw/zinc/40/89/08/1043408908.db2.gz UCYPWYKEZLOGMB-UHFFFAOYSA-N 1 0 323.436 4.062 20 10 DICDRO C[C@@H]([NH2+]CC1(C)CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC000271471323 1043421947 /nfs/dbraw/zinc/42/19/47/1043421947.db2.gz IWORDZDCNGFTMB-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000271582251 1043438430 /nfs/dbraw/zinc/43/84/30/1043438430.db2.gz WZZRRLNYAXHJCM-AOIWGVFYSA-N 1 0 316.489 4.285 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000271625088 1043443764 /nfs/dbraw/zinc/44/37/64/1043443764.db2.gz CBCDAKDCBOQLAF-IBGZPJMESA-N 1 0 315.388 4.089 20 10 DICDRO Cc1nccnc1[C@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000872134640 1043474817 /nfs/dbraw/zinc/47/48/17/1043474817.db2.gz SWPPLQPOGBRYSL-OCCSQVGLSA-N 1 0 307.397 4.056 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1OC(F)F)c1ccc(N(C)C)cc1 ZINC000124010349 1043486766 /nfs/dbraw/zinc/48/67/66/1043486766.db2.gz MQERDDZLDYVSQY-ZDUSSCGKSA-N 1 0 320.383 4.205 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2sc(C)nc2C)cc1C ZINC000873062558 1043514940 /nfs/dbraw/zinc/51/49/40/1043514940.db2.gz SUMHYJIQNKITFL-UHFFFAOYSA-N 1 0 304.459 4.147 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1ccc(N(C)C)cc1 ZINC000124408916 1043520426 /nfs/dbraw/zinc/52/04/26/1043520426.db2.gz RDJVBSXIWNCJKI-CHWSQXEVSA-N 1 0 304.384 4.443 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(OC(F)F)c1 ZINC000074336405 1043556405 /nfs/dbraw/zinc/55/64/05/1043556405.db2.gz IDPODLZWGQHNQD-CYBMUJFWSA-N 1 0 320.383 4.205 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)c1cc2cnccc2o1 ZINC000825710356 1043566973 /nfs/dbraw/zinc/56/69/73/1043566973.db2.gz MTCOAPYTTXTSFO-AWEZNQCLSA-N 1 0 309.413 4.264 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1O ZINC000874082696 1043568043 /nfs/dbraw/zinc/56/80/43/1043568043.db2.gz YQEKSPBVZMNNCM-GFCCVEGCSA-N 1 0 321.367 4.180 20 10 DICDRO COc1ccc2oc(C[NH2+]Cc3ccc(N(C)C)cc3C)cc2c1 ZINC000125577247 1043637442 /nfs/dbraw/zinc/63/74/42/1043637442.db2.gz XDTAHBACLWHYGO-UHFFFAOYSA-N 1 0 324.424 4.106 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)on1 ZINC000125604008 1043642263 /nfs/dbraw/zinc/64/22/63/1043642263.db2.gz ZKYJOXMNHDAUMK-INIZCTEOSA-N 1 0 313.445 4.214 20 10 DICDRO COc1ccc(N2CCC([NH2+]Cc3cc(C)cc(C)c3)CC2)cc1 ZINC000237260304 1043654596 /nfs/dbraw/zinc/65/45/96/1043654596.db2.gz SSZIVZGZYZKJDU-UHFFFAOYSA-N 1 0 324.468 4.071 20 10 DICDRO C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cc(Cl)ccc1O ZINC000926921575 1043657982 /nfs/dbraw/zinc/65/79/82/1043657982.db2.gz VPPXHLQRNCNMKJ-SNVBAGLBSA-N 1 0 322.861 4.232 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2[C@@H](c3ccccc3)C2(F)F)c(O)c1 ZINC000926974524 1043665572 /nfs/dbraw/zinc/66/55/72/1043665572.db2.gz TZJOOACCBGEYBA-FDQGKXFDSA-N 1 0 317.379 4.400 20 10 DICDRO CC[C@@H]([NH2+]CCc1cccc2oc(C)nc21)c1ccccc1O ZINC000926976469 1043666004 /nfs/dbraw/zinc/66/60/04/1043666004.db2.gz VOYXBJSIBFAWIP-MRXNPFEDSA-N 1 0 310.397 4.125 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1[C@@H](c3ccccc3)C1(F)F)CC2 ZINC000926977676 1043666809 /nfs/dbraw/zinc/66/68/09/1043666809.db2.gz PAZYQBBDOLJQBG-RVKKMQEKSA-N 1 0 315.363 4.018 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cccnc32)cc1 ZINC000927059545 1043675903 /nfs/dbraw/zinc/67/59/03/1043675903.db2.gz IGEBPKAUJSZFEK-DNVCBOLYSA-N 1 0 309.457 4.266 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3cccnc32)c2c1c(F)ccc2O ZINC000927061438 1043676090 /nfs/dbraw/zinc/67/60/90/1043676090.db2.gz OAUCJDLOWKJBHR-KCPJHIHWSA-N 1 0 312.388 4.142 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCCc3cccnc32)cc1 ZINC000927062514 1043677194 /nfs/dbraw/zinc/67/71/94/1043677194.db2.gz IGEBPKAUJSZFEK-KXBFYZLASA-N 1 0 309.457 4.266 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1O ZINC000895414075 1043680287 /nfs/dbraw/zinc/68/02/87/1043680287.db2.gz JZRNZYMOWYDSOV-MRXNPFEDSA-N 1 0 317.816 4.140 20 10 DICDRO C[C@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1ccc2ccccc2c1O ZINC000927107074 1043687701 /nfs/dbraw/zinc/68/77/01/1043687701.db2.gz BKLDMAWXZSJBGM-ZDUSSCGKSA-N 1 0 321.424 4.007 20 10 DICDRO Oc1ccccc1C[N@H+](CCC[C@@H]1CCO1)C1CCCCC1 ZINC000876522434 1043690971 /nfs/dbraw/zinc/69/09/71/1043690971.db2.gz QTJBOBFNGDPPDB-GOSISDBHSA-N 1 0 303.446 4.096 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cc(Cl)cc2c1OCC2 ZINC000927142682 1043699620 /nfs/dbraw/zinc/69/96/20/1043699620.db2.gz VLENRTNOTPAQTG-VXGBXAGGSA-N 1 0 317.816 4.392 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000876657293 1043702040 /nfs/dbraw/zinc/70/20/40/1043702040.db2.gz COILZCUNWQJQOH-UHFFFAOYSA-N 1 0 303.446 4.014 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)c(O)c1 ZINC000876913031 1043723133 /nfs/dbraw/zinc/72/31/33/1043723133.db2.gz NKQCVGQJJVBCNJ-GFCCVEGCSA-N 1 0 307.340 4.153 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(F)cc2C(F)(F)F)c(O)c1 ZINC000876932461 1043725933 /nfs/dbraw/zinc/72/59/33/1043725933.db2.gz MUFDUHXKEQHAJW-UHFFFAOYSA-N 1 0 313.294 4.148 20 10 DICDRO Cc1cccc(O)c1C[NH2+]C1CCN([C@@H](C)c2ccccc2)CC1 ZINC000877038781 1043735730 /nfs/dbraw/zinc/73/57/30/1043735730.db2.gz YAJNSBVDFPOEOF-KRWDZBQOSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1ccc(C[NH2+]C23CCC(C(F)(F)F)(CC2)CC3)c(O)c1 ZINC000877483073 1043765531 /nfs/dbraw/zinc/76/55/31/1043765531.db2.gz JKFIOVGDABJCDJ-UHFFFAOYSA-N 1 0 313.363 4.446 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c(O)c1 ZINC000877482426 1043766048 /nfs/dbraw/zinc/76/60/48/1043766048.db2.gz IOOJUTUSEYCCHE-VIFPVBQESA-N 1 0 316.348 4.027 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1OC(C)C ZINC000877756476 1043793162 /nfs/dbraw/zinc/79/31/62/1043793162.db2.gz KTXYXTRUOMDDAD-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(F)c(C(F)(F)F)c1)c1ccccc1O ZINC000877757061 1043793395 /nfs/dbraw/zinc/79/33/95/1043793395.db2.gz DLACKMHCDDGKRF-JTQLQIEISA-N 1 0 313.294 4.401 20 10 DICDRO CCCn1c(C[NH2+][C@@H](C)c2ccccc2O)nc2ccccc21 ZINC000877757131 1043793937 /nfs/dbraw/zinc/79/39/37/1043793937.db2.gz IHDSSOXLTOZWDV-AWEZNQCLSA-N 1 0 309.413 4.003 20 10 DICDRO C[C@H]([NH2+]Cc1cscc1C(F)(F)F)c1ccccc1O ZINC000877758231 1043795289 /nfs/dbraw/zinc/79/52/89/1043795289.db2.gz OKQDZVVHOGKIRC-VIFPVBQESA-N 1 0 301.333 4.323 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(CC(F)(F)F)cc1)c1ccccc1O ZINC000877758320 1043795553 /nfs/dbraw/zinc/79/55/53/1043795553.db2.gz SUMOTOASFASWLL-LBPRGKRZSA-N 1 0 309.331 4.348 20 10 DICDRO Cc1cccc(C[NH2+]Cc2ccc(C(F)(F)F)s2)c1O ZINC000877804838 1043800959 /nfs/dbraw/zinc/80/09/59/1043800959.db2.gz FEMMIPYKYRCKRW-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO CCc1onc(C)c1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000929636099 1043830865 /nfs/dbraw/zinc/83/08/65/1043830865.db2.gz PZUOEYRNYRMOEY-UHFFFAOYSA-N 1 0 314.429 4.196 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@@H](C)Oc3ccccc32)cc1Cl ZINC000826043968 1043898279 /nfs/dbraw/zinc/89/82/79/1043898279.db2.gz WZWZZEUPAFRLRB-MLGOLLRUSA-N 1 0 317.816 4.356 20 10 DICDRO Cc1cccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000127195437 1043900702 /nfs/dbraw/zinc/90/07/02/1043900702.db2.gz ICDXLHLZANXWLB-QGZVFWFLSA-N 1 0 309.457 4.231 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)cc1 ZINC000127301187 1043916102 /nfs/dbraw/zinc/91/61/02/1043916102.db2.gz BOXCUWBNNRNSOW-FUHWJXTLSA-N 1 0 316.489 4.285 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cccc(Cl)c1 ZINC000290209566 1043928251 /nfs/dbraw/zinc/92/82/51/1043928251.db2.gz HGCHSVPTDVAKCQ-MLGOLLRUSA-N 1 0 305.805 4.084 20 10 DICDRO CCCC[C@@H](CC)[NH2+]Cc1cc(Br)ccc1O ZINC001257413019 1043965215 /nfs/dbraw/zinc/96/52/15/1043965215.db2.gz QSPBSJCCZKVARB-CYBMUJFWSA-N 1 0 300.240 4.213 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccncc2)c(C)n1-c1ccccc1 ZINC000320343487 1044026092 /nfs/dbraw/zinc/02/60/92/1044026092.db2.gz OSQGJOXYLYJWLP-INIZCTEOSA-N 1 0 305.425 4.340 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2ccc(OC)c(C)c2)C(C)C)cc1 ZINC000237270838 1044032781 /nfs/dbraw/zinc/03/27/81/1044032781.db2.gz GYWAFYAIDYDLTM-HXUWFJFHSA-N 1 0 313.441 4.499 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@@H]2OCCc3sccc32)c1 ZINC000291945162 1044116834 /nfs/dbraw/zinc/11/68/34/1044116834.db2.gz QEKHYEFUFIXRHO-LXIYXOSZSA-N 1 0 317.454 4.115 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H]1OCCc2sccc21)c1ccccc1O ZINC000291974892 1044120783 /nfs/dbraw/zinc/12/07/83/1044120783.db2.gz UMQAPURIGBHPCK-HNJNHCNJSA-N 1 0 317.454 4.197 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccc(F)c(Br)c1 ZINC000130426901 1044200345 /nfs/dbraw/zinc/20/03/45/1044200345.db2.gz HPWZAPNGPUQVKT-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO COc1cccc(C[N@H+](C)[C@@H](C)c2cccc(Cl)c2)c1O ZINC000130366420 1044200859 /nfs/dbraw/zinc/20/08/59/1044200859.db2.gz HAUMAHFEBLPMFO-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(Cl)c(F)c1 ZINC000213539598 1044204960 /nfs/dbraw/zinc/20/49/60/1044204960.db2.gz PVESSUVVSVHVHQ-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO CCn1cc(C[NH2+][C@@H](C)c2ccccc2O)c(-c2ccccc2)n1 ZINC000883226300 1044240093 /nfs/dbraw/zinc/24/00/93/1044240093.db2.gz VTHVDSVXWKWTPO-HNNXBMFYSA-N 1 0 321.424 4.126 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000883266173 1044252273 /nfs/dbraw/zinc/25/22/73/1044252273.db2.gz UHIJMRPXZUVLSF-LBPRGKRZSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c(Cl)n1 ZINC000883302020 1044263914 /nfs/dbraw/zinc/26/39/14/1044263914.db2.gz OKKQATMUWOUQHG-JTQLQIEISA-N 1 0 311.212 4.253 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)[C@@H]1CCCOC1 ZINC000883353400 1044281196 /nfs/dbraw/zinc/28/11/96/1044281196.db2.gz UDCDWYOMWYMJDH-GMBSWORKSA-N 1 0 313.441 4.401 20 10 DICDRO C[C@@H]([NH2+]C1CCC2(COC2)CC1)c1ccc2ccccc2c1O ZINC000883380844 1044292825 /nfs/dbraw/zinc/29/28/25/1044292825.db2.gz BGBKSZNHZBXOHH-CQSZACIVSA-N 1 0 311.425 4.155 20 10 DICDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000192744801 1044305858 /nfs/dbraw/zinc/30/58/58/1044305858.db2.gz JEDPQZDWGAQRAN-UONOGXRCSA-N 1 0 312.413 4.071 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cc(OC)ccc1OC)c1ccccc1O ZINC000192789553 1044308569 /nfs/dbraw/zinc/30/85/69/1044308569.db2.gz AHJKLJQRJXEBJO-CXAGYDPISA-N 1 0 315.413 4.211 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1OC)c1ccccc1O ZINC000192789525 1044308745 /nfs/dbraw/zinc/30/87/45/1044308745.db2.gz AHJKLJQRJXEBJO-SUMWQHHRSA-N 1 0 315.413 4.211 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000192809863 1044315622 /nfs/dbraw/zinc/31/56/22/1044315622.db2.gz XSVDBJHGFSFOFA-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1OC)c1ccccc1O ZINC000192808346 1044316949 /nfs/dbraw/zinc/31/69/49/1044316949.db2.gz VLHPRYYWDPCKKZ-LRDDRELGSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1ncsc1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000132324454 1044322684 /nfs/dbraw/zinc/32/26/84/1044322684.db2.gz FWSSJWHCJIMWGF-AWEZNQCLSA-N 1 0 315.486 4.293 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000067501656 1044337098 /nfs/dbraw/zinc/33/70/98/1044337098.db2.gz HSVOCITUKGYOJJ-SFHVURJKSA-N 1 0 300.833 4.183 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)CCOC)c1ccc(C(F)(F)F)cc1O ZINC000840836493 1044356432 /nfs/dbraw/zinc/35/64/32/1044356432.db2.gz ZEXRLHCGMNMQLQ-BXUZGUMPSA-N 1 0 319.367 4.124 20 10 DICDRO COCC[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000840838632 1044369686 /nfs/dbraw/zinc/36/96/86/1044369686.db2.gz SASIETVGQGKZBL-IAGOWNOFSA-N 1 0 304.478 4.000 20 10 DICDRO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000133613407 1044427745 /nfs/dbraw/zinc/42/77/45/1044427745.db2.gz COKGMTHUWHLXSW-KRWDZBQOSA-N 1 0 309.457 4.265 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCC23CCOCC3)c(O)c1C ZINC000282904386 1044479754 /nfs/dbraw/zinc/47/97/54/1044479754.db2.gz WYOXEDDSFZJUSQ-WBVHZDCISA-N 1 0 303.446 4.009 20 10 DICDRO CCOCCC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CCC1 ZINC000840909755 1044511810 /nfs/dbraw/zinc/51/18/10/1044511810.db2.gz VLHKRDWGVHBDKT-UHFFFAOYSA-N 1 0 311.853 4.041 20 10 DICDRO COc1ccc([C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)C2CC2)cc1 ZINC000296017544 1044582391 /nfs/dbraw/zinc/58/23/91/1044582391.db2.gz PDQMHPIVKIGVTB-XLIONFOSSA-N 1 0 309.409 4.129 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)CC2 ZINC000296289575 1044604507 /nfs/dbraw/zinc/60/45/07/1044604507.db2.gz DATDPRDZXVQMTG-CQSZACIVSA-N 1 0 309.743 4.101 20 10 DICDRO CC1CCN(c2ccc(C[NH2+][C@@H]3CCc4cccnc43)cc2)CC1 ZINC000886525151 1044653703 /nfs/dbraw/zinc/65/37/03/1044653703.db2.gz YLDGVOMOLJJTKG-HXUWFJFHSA-N 1 0 321.468 4.095 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cc(C3CC3)no2)c1O ZINC000886683914 1044679283 /nfs/dbraw/zinc/67/92/83/1044679283.db2.gz ALKVEWDROZVIED-JTQLQIEISA-N 1 0 306.793 4.070 20 10 DICDRO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc2ccccc2c1O ZINC000886684425 1044679410 /nfs/dbraw/zinc/67/94/10/1044679410.db2.gz LDPILNVHZPATJU-LBPRGKRZSA-N 1 0 308.381 4.262 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c1 ZINC000886774794 1044696735 /nfs/dbraw/zinc/69/67/35/1044696735.db2.gz VVMUIGUQXVAEBG-MAUKXSAKSA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C)c1ccccc1O ZINC000155888014 1044738287 /nfs/dbraw/zinc/73/82/87/1044738287.db2.gz LBVOHKARDHSOIW-HFTRVMKXSA-N 1 0 305.462 4.274 20 10 DICDRO COc1cc(C)cc(C[NH+]2CCC(c3ccccc3)CC2)c1O ZINC000887559281 1044854264 /nfs/dbraw/zinc/85/42/64/1044854264.db2.gz JGLOBFYPOZGPTA-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCN(Cc3ccccc3)C2)c(O)c1 ZINC000301386431 1044883038 /nfs/dbraw/zinc/88/30/38/1044883038.db2.gz ZAZPEMKRDVTFAT-PKOBYXMFSA-N 1 0 324.468 4.016 20 10 DICDRO CCCOc1ccc(C[NH2+][C@](C)(CC)c2nccs2)c(O)c1 ZINC000152655269 1045046955 /nfs/dbraw/zinc/04/69/55/1045046955.db2.gz SMWQGWKWCMIDBD-QGZVFWFLSA-N 1 0 320.458 4.053 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccc1)C1CCOCC1)c1ccccc1O ZINC000374677401 1045082761 /nfs/dbraw/zinc/08/27/61/1045082761.db2.gz JAEQSWZQUSRWER-QRWLVFNGSA-N 1 0 311.425 4.211 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000778999243 1045115104 /nfs/dbraw/zinc/11/51/04/1045115104.db2.gz BIEBXWMCAVTBHZ-MRXNPFEDSA-N 1 0 306.409 4.253 20 10 DICDRO Cc1cc(CC[NH2+][C@H](C)c2c[nH]nc2C)c(C)n1-c1ccccc1 ZINC000779001269 1045115996 /nfs/dbraw/zinc/11/59/96/1045115996.db2.gz DGMRUZDKZLGNEJ-OAHLLOKOSA-N 1 0 322.456 4.019 20 10 DICDRO Cc1cc(Br)cc([C@@H](C)[NH2+]C(C2CC2)C2CC2)c1O ZINC000779008126 1045123075 /nfs/dbraw/zinc/12/30/75/1045123075.db2.gz FHSLLZJBSXVDLJ-SNVBAGLBSA-N 1 0 324.262 4.302 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccs2)c(O)cc1C ZINC000159492485 1045195784 /nfs/dbraw/zinc/19/57/84/1045195784.db2.gz CUCAXPUWGJQKMF-CQSZACIVSA-N 1 0 303.427 4.108 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@@H](c3ccccn3)C3CCC3)ccc21 ZINC000924873740 1045207312 /nfs/dbraw/zinc/20/73/12/1045207312.db2.gz YIOFKQGFGVWNEB-OAQYLSRUSA-N 1 0 321.468 4.095 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1ccns1 ZINC000925010215 1045219190 /nfs/dbraw/zinc/21/91/90/1045219190.db2.gz FDLHYAUNPKGYAD-OAHLLOKOSA-N 1 0 315.486 4.230 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccc(N(C)C)cc1 ZINC000779053888 1045219879 /nfs/dbraw/zinc/21/98/79/1045219879.db2.gz MSQLGIUWQFNTFL-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)Cc2ccsc2)cc1 ZINC000048557322 1045240045 /nfs/dbraw/zinc/24/00/45/1045240045.db2.gz XMZCRKDZKAUUBY-HNNXBMFYSA-N 1 0 302.487 4.315 20 10 DICDRO CO[C@@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cccc(C)c1O ZINC000779150255 1045324565 /nfs/dbraw/zinc/32/45/65/1045324565.db2.gz SKQRQMIHVBIOFK-SCLBCKFNSA-N 1 0 319.832 4.220 20 10 DICDRO COc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000188796064 1045339525 /nfs/dbraw/zinc/33/95/25/1045339525.db2.gz UPDCFVVZQQTGEB-KGLIPLIRSA-N 1 0 322.408 4.361 20 10 DICDRO CSCc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000188725689 1045339565 /nfs/dbraw/zinc/33/95/65/1045339565.db2.gz NUEPEPZLHYZYLH-CQSZACIVSA-N 1 0 301.455 4.414 20 10 DICDRO C[C@H]([NH2+]CCc1ccccc1)c1cc(Br)ccc1O ZINC000783647954 1045350287 /nfs/dbraw/zinc/35/02/87/1045350287.db2.gz WMZFYEFWBBTMHU-LBPRGKRZSA-N 1 0 320.230 4.048 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCc3ccc(C(C)C)cc32)c1O ZINC000189616223 1045358907 /nfs/dbraw/zinc/35/89/07/1045358907.db2.gz PGCBTAQKKOVKNR-SFHVURJKSA-N 1 0 311.425 4.301 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccc(Cl)nc1)C1CCCC1 ZINC000113506139 1045560911 /nfs/dbraw/zinc/56/09/11/1045560911.db2.gz DFYSHCQIKFUERC-UHFFFAOYSA-N 1 0 316.832 4.385 20 10 DICDRO CC(C)Oc1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000113320089 1045561777 /nfs/dbraw/zinc/56/17/77/1045561777.db2.gz CLZXTDOZIARGDW-UHFFFAOYSA-N 1 0 305.805 4.123 20 10 DICDRO CCC[N@H+](Cc1cc(-c2ccccc2)no1)Cc1ccccc1O ZINC000750875517 1045565920 /nfs/dbraw/zinc/56/59/20/1045565920.db2.gz SOEBNWFJKOYXRJ-UHFFFAOYSA-N 1 0 322.408 4.459 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)[C@H]2CC3CCC2CC3)c1O ZINC000381911010 1045584887 /nfs/dbraw/zinc/58/48/87/1045584887.db2.gz NIBJYOMSDAFEIC-PBMMVSLJSA-N 1 0 303.446 4.095 20 10 DICDRO CCOc1ccc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)c(O)c1 ZINC000751148308 1045585275 /nfs/dbraw/zinc/58/52/75/1045585275.db2.gz SOHFABYDQDBURD-UHFFFAOYSA-N 1 0 321.367 4.094 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000800238830 1045590888 /nfs/dbraw/zinc/59/08/88/1045590888.db2.gz JXFYWXGAFPMOHO-FXAWDEMLSA-N 1 0 323.484 4.272 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](c1ccc(F)cn1)C(C)C ZINC000779349202 1045620509 /nfs/dbraw/zinc/62/05/09/1045620509.db2.gz WXNXHWUODBOGCS-LJQANCHMSA-N 1 0 315.436 4.082 20 10 DICDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000751600133 1045620779 /nfs/dbraw/zinc/62/07/79/1045620779.db2.gz GXKABYRFLJOWRQ-QAPCUYQASA-N 1 0 318.420 4.318 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC23CCOCC3)c2c1c(F)ccc2O ZINC000800498443 1045635314 /nfs/dbraw/zinc/63/53/14/1045635314.db2.gz KJCMPHRVWNGOFH-IVMMDQJWSA-N 1 0 319.420 4.019 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCOc2cccc(F)c2C1 ZINC000800856276 1045658828 /nfs/dbraw/zinc/65/88/28/1045658828.db2.gz YHGJVWKFWPJGNM-UHFFFAOYSA-N 1 0 323.367 4.079 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC(C)(C)C(F)(F)F)cc1 ZINC000800888464 1045662596 /nfs/dbraw/zinc/66/25/96/1045662596.db2.gz FCXDVEICPOLRDS-UHFFFAOYSA-N 1 0 302.384 4.211 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000752264314 1045669014 /nfs/dbraw/zinc/66/90/14/1045669014.db2.gz BGNNUZITVHGSIN-GJZGRUSLSA-N 1 0 314.395 4.211 20 10 DICDRO Cc1cc(C)cc([C@@H](O)C[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000800992853 1045678366 /nfs/dbraw/zinc/67/83/66/1045678366.db2.gz UIYWYPDUZYJPRY-ACJLOTCBSA-N 1 0 319.832 4.047 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2cc(F)c(OC)cc21)c1ccccc1O ZINC000800994508 1045680326 /nfs/dbraw/zinc/68/03/26/1045680326.db2.gz VGBJADWFOICRRB-DLBZAZTESA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)c1O ZINC000752986657 1045718318 /nfs/dbraw/zinc/71/83/18/1045718318.db2.gz LXNHBEXASHSDCM-FUHWJXTLSA-N 1 0 311.425 4.217 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](C)c2ccsc2)c1O ZINC000801570740 1045744586 /nfs/dbraw/zinc/74/45/86/1045744586.db2.gz UTGWNEQPHICZIM-VIFPVBQESA-N 1 0 309.818 4.161 20 10 DICDRO CCCC[N@H+](Cc1nc(C)c(C)s1)Cc1ccccc1O ZINC000801596496 1045749454 /nfs/dbraw/zinc/74/94/54/1045749454.db2.gz BNUXGBWWZDFIGT-UHFFFAOYSA-N 1 0 304.459 4.268 20 10 DICDRO CCCC[N@H+](Cc1noc2c1CCCC2)Cc1ccccc1O ZINC000801597108 1045751957 /nfs/dbraw/zinc/75/19/57/1045751957.db2.gz BEXJTOZPVPASSB-UHFFFAOYSA-N 1 0 314.429 4.061 20 10 DICDRO CCCC[N@H+](Cc1cccc(Cl)n1)Cc1ccccc1O ZINC000801599593 1045752890 /nfs/dbraw/zinc/75/28/90/1045752890.db2.gz VOIZEEJQOWIXJR-UHFFFAOYSA-N 1 0 304.821 4.243 20 10 DICDRO C[C@@H](C1CC1)[N@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000753536982 1045759377 /nfs/dbraw/zinc/75/93/77/1045759377.db2.gz QVQUZMBEWRFXQO-HNNXBMFYSA-N 1 0 311.425 4.202 20 10 DICDRO C[C@H](C1CC1)[N@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000753536986 1045759668 /nfs/dbraw/zinc/75/96/68/1045759668.db2.gz QVQUZMBEWRFXQO-OAHLLOKOSA-N 1 0 311.425 4.202 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@@H](c3ccc(C)cc3)C2)c1O ZINC000753591639 1045771303 /nfs/dbraw/zinc/77/13/03/1045771303.db2.gz RADOYKKIIFRHQD-QGZVFWFLSA-N 1 0 311.425 4.089 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H](C)c2nccs2)cc1 ZINC000753595435 1045772763 /nfs/dbraw/zinc/77/27/63/1045772763.db2.gz PGHMXFUAFLCDNE-HNNXBMFYSA-N 1 0 317.502 4.225 20 10 DICDRO C[C@@H](CCC(F)(F)F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000753617291 1045777540 /nfs/dbraw/zinc/77/75/40/1045777540.db2.gz RVYPLXHFMLAWHT-ZDUSSCGKSA-N 1 0 300.368 4.107 20 10 DICDRO CCOc1cccc(C[NH2+]CC2CC(c3ccccc3)C2)c1O ZINC000801731228 1045784802 /nfs/dbraw/zinc/78/48/02/1045784802.db2.gz VYJRXORULFVFNQ-UHFFFAOYSA-N 1 0 311.425 4.074 20 10 DICDRO C[C@@H]([NH2+]CC[C@@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000753762579 1045801003 /nfs/dbraw/zinc/80/10/03/1045801003.db2.gz WRDCTWISMJNGLP-QZTJIDSGSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@@H]([NH2+]CC[C@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000753762578 1045802174 /nfs/dbraw/zinc/80/21/74/1045802174.db2.gz WRDCTWISMJNGLP-MSOLQXFVSA-N 1 0 316.489 4.144 20 10 DICDRO Cc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)ccc1N1CCCCC1 ZINC000828551264 1045916234 /nfs/dbraw/zinc/91/62/34/1045916234.db2.gz ZTZCRCSERRBQKP-UHFFFAOYSA-N 1 0 320.427 4.216 20 10 DICDRO COc1ccc([C@@H]2CC[N@H+](Cc3cc(C)cc(C)c3O)C2)cc1 ZINC000754729946 1045919842 /nfs/dbraw/zinc/91/98/42/1045919842.db2.gz HFYHAVAQGDZADF-QGZVFWFLSA-N 1 0 311.425 4.007 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2C[C@H](c3ccccc3)C[C@H]2C)c1O ZINC000754725841 1045919885 /nfs/dbraw/zinc/91/98/85/1045919885.db2.gz BSVLHKVYDNUTCE-NVXWUHKLSA-N 1 0 311.425 4.087 20 10 DICDRO COc1cc(C)cc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)c1O ZINC000754728267 1045920811 /nfs/dbraw/zinc/92/08/11/1045920811.db2.gz ZYLHRIBNAWJCHZ-LJQANCHMSA-N 1 0 323.436 4.361 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@H]2C)c1O ZINC000754725843 1045921857 /nfs/dbraw/zinc/92/18/57/1045921857.db2.gz BSVLHKVYDNUTCE-WBVHZDCISA-N 1 0 311.425 4.087 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1O ZINC000754740927 1045922414 /nfs/dbraw/zinc/92/24/14/1045922414.db2.gz JNOMEUQVMALMDI-MRXNPFEDSA-N 1 0 317.816 4.310 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2cccnc2)ccc1N1CCCCC1 ZINC000828629618 1045922990 /nfs/dbraw/zinc/92/29/90/1045922990.db2.gz RYRJYULJVRAYBV-KRWDZBQOSA-N 1 0 309.457 4.231 20 10 DICDRO CCC[N@H+](Cc1cc(C)cc(C)c1O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000754742651 1045923909 /nfs/dbraw/zinc/92/39/09/1045923909.db2.gz VXAIAAMSAXITAY-QXAKKESOSA-N 1 0 317.473 4.035 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1F ZINC001137677414 1045930894 /nfs/dbraw/zinc/93/08/94/1045930894.db2.gz QDFFPKUDSKJJKT-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)[C@@H]1C[C@H]1c1ccccc1 ZINC000802303205 1045946299 /nfs/dbraw/zinc/94/62/99/1045946299.db2.gz ZVBOLBOZABLURV-KBMXLJTQSA-N 1 0 318.511 4.407 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000193009366 1045960098 /nfs/dbraw/zinc/96/00/98/1045960098.db2.gz TYESMMHSDMZPGS-ZIAGYGMSSA-N 1 0 316.420 4.312 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](C)CCCC(F)(F)F)c1 ZINC000755223973 1045963945 /nfs/dbraw/zinc/96/39/45/1045963945.db2.gz WMLFVGYMZAUPNM-LLVKDONJSA-N 1 0 305.340 4.002 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3ccncc3C2)c(C)n1-c1ccccc1 ZINC001137857973 1045987677 /nfs/dbraw/zinc/98/76/77/1045987677.db2.gz QXHJQDNXQHNCKK-UHFFFAOYSA-N 1 0 317.436 4.047 20 10 DICDRO Cc1cc(C[N@H+]2CC[C@@H](OC(C)C)C2)c(C)n1-c1ccccc1 ZINC001137858961 1045987896 /nfs/dbraw/zinc/98/78/96/1045987896.db2.gz BWECJUAJQRHMSZ-HXUWFJFHSA-N 1 0 312.457 4.093 20 10 DICDRO C[N@H+](Cc1cc2oc3ccccc3c2cc1O)[C@H]1CCSC1 ZINC000755794896 1046016595 /nfs/dbraw/zinc/01/65/95/1046016595.db2.gz RUHPBHKROWSQSO-ZDUSSCGKSA-N 1 0 313.422 4.229 20 10 DICDRO CCCC[N@H+](Cc1coc(C2CC2)n1)Cc1ccccc1O ZINC000802657473 1046027650 /nfs/dbraw/zinc/02/76/50/1046027650.db2.gz FYBJQSRNBGACSY-UHFFFAOYSA-N 1 0 300.402 4.060 20 10 DICDRO CCCC[N@H+](Cc1cnc(CC)s1)Cc1ccccc1O ZINC000802657618 1046027699 /nfs/dbraw/zinc/02/76/99/1046027699.db2.gz LBTVHRUPILYOAN-UHFFFAOYSA-N 1 0 304.459 4.213 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCc2ccc(F)cc2)c2c1c(F)ccc2O ZINC000756339520 1046066889 /nfs/dbraw/zinc/06/68/89/1046066889.db2.gz BCBDEVRMYBJMOF-ABAIWWIYSA-N 1 0 303.352 4.051 20 10 DICDRO C[C@H](CCc1ccco1)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756356647 1046069455 /nfs/dbraw/zinc/06/94/55/1046069455.db2.gz HDPOQMOPGHRGJK-ZOWXZIJZSA-N 1 0 303.377 4.284 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCOC2CCCCC2)c(O)c1C ZINC000756358688 1046070444 /nfs/dbraw/zinc/07/04/44/1046070444.db2.gz MGSJZFJBYRGTQK-MRXNPFEDSA-N 1 0 305.462 4.399 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](c2cccs2)C2CC2)c1 ZINC000756362731 1046070641 /nfs/dbraw/zinc/07/06/41/1046070641.db2.gz CGGLALDXXWVFAV-GTNSWQLSSA-N 1 0 303.427 4.264 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)cc1F ZINC000756376666 1046073036 /nfs/dbraw/zinc/07/30/36/1046073036.db2.gz GWDQERFECBCGTF-HZMBPMFUSA-N 1 0 319.351 4.017 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2cccs2)N(C)C)c(O)c1C ZINC000756374196 1046073135 /nfs/dbraw/zinc/07/31/35/1046073135.db2.gz YSIMCXNXJPPWJU-HOCLYGCPSA-N 1 0 318.486 4.024 20 10 DICDRO C[C@H](Cc1ccco1)[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000756379305 1046075043 /nfs/dbraw/zinc/07/50/43/1046075043.db2.gz NCHKTSQWDAOSPM-GHMZBOCLSA-N 1 0 324.218 4.030 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN(c3ccccc3)C2)c(O)c1C ZINC000756400782 1046075666 /nfs/dbraw/zinc/07/56/66/1046075666.db2.gz FFLXCISNYHKZTH-MSOLQXFVSA-N 1 0 324.468 4.186 20 10 DICDRO CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000756398844 1046077127 /nfs/dbraw/zinc/07/71/27/1046077127.db2.gz ZMFKIPVPEXBVQE-NSHDSACASA-N 1 0 319.276 4.080 20 10 DICDRO COCc1cccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756420267 1046078459 /nfs/dbraw/zinc/07/84/59/1046078459.db2.gz HYYTUZIIINCBEL-WBMJQRKESA-N 1 0 315.388 4.016 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCOc2ccccc2F)c(O)c1C ZINC000756410335 1046079248 /nfs/dbraw/zinc/07/92/48/1046079248.db2.gz HEGFSKSYMAYWBB-OAHLLOKOSA-N 1 0 317.404 4.268 20 10 DICDRO COCc1cccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756420261 1046080240 /nfs/dbraw/zinc/08/02/40/1046080240.db2.gz HYYTUZIIINCBEL-MLGOLLRUSA-N 1 0 315.388 4.016 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(O)c3ccccc23)cc1 ZINC001138062409 1046080775 /nfs/dbraw/zinc/08/07/75/1046080775.db2.gz LBHJRONMOFXAED-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO C[C@H]([NH2+][C@@H](Cn1ccnc1)C(C)(C)C)c1cc(Cl)ccc1O ZINC000756440752 1046080873 /nfs/dbraw/zinc/08/08/73/1046080873.db2.gz GTFVWINQHXGNLV-LRDDRELGSA-N 1 0 321.852 4.008 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)COc2ccc(F)cc2F)c1 ZINC000756454758 1046083542 /nfs/dbraw/zinc/08/35/42/1046083542.db2.gz NUCJUWAOSWGXIX-QWHCGFSZSA-N 1 0 321.367 4.097 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2COC(C)C)c(O)c1 ZINC000756463766 1046083679 /nfs/dbraw/zinc/08/36/79/1046083679.db2.gz CXUGSPYXSGEQBB-MRXNPFEDSA-N 1 0 313.441 4.476 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)cc1 ZINC000756455677 1046083905 /nfs/dbraw/zinc/08/39/05/1046083905.db2.gz KMHVEVWKEPIZII-LRDDRELGSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2COC(C)C)c1 ZINC000756463878 1046085455 /nfs/dbraw/zinc/08/54/55/1046085455.db2.gz FIYGEBDUMOXOLL-MRXNPFEDSA-N 1 0 313.441 4.476 20 10 DICDRO CC(C)COc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000756455391 1046085549 /nfs/dbraw/zinc/08/55/49/1046085549.db2.gz SKLFVAYDLKJDIC-AWEZNQCLSA-N 1 0 317.404 4.417 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CC=CCC1)c1cc(Br)ccc1O ZINC000756474407 1046086526 /nfs/dbraw/zinc/08/65/26/1046086526.db2.gz IGGZZWMLVIQLRW-NWDGAFQWSA-N 1 0 310.235 4.162 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOc2ccc(F)cc21)c1cc(F)ccc1O ZINC000756483775 1046088765 /nfs/dbraw/zinc/08/87/65/1046088765.db2.gz XMFDJVHTSVRLPO-BZNIZROVSA-N 1 0 319.351 4.235 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)c1 ZINC000756483507 1046089639 /nfs/dbraw/zinc/08/96/39/1046089639.db2.gz RVQQXMFRFJBFSN-GUYCJALGSA-N 1 0 315.388 4.404 20 10 DICDRO COc1ccccc1C(C)(C)C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756494769 1046090545 /nfs/dbraw/zinc/09/05/45/1046090545.db2.gz GSHAYIWORYRFRO-ZDUSSCGKSA-N 1 0 317.404 4.168 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc3cccnc32)c(O)c1C ZINC000756497407 1046090781 /nfs/dbraw/zinc/09/07/81/1046090781.db2.gz UJGVXUGKWBSJJO-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO COc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000756502904 1046091359 /nfs/dbraw/zinc/09/13/59/1046091359.db2.gz HVIBDCKGMLPFAB-HZPDHXFCSA-N 1 0 313.441 4.381 20 10 DICDRO C[C@H](COc1ccccc1)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756493434 1046092027 /nfs/dbraw/zinc/09/20/27/1046092027.db2.gz DPHUSKUTVJXTIY-ZENOOKHLSA-N 1 0 315.388 4.137 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1 ZINC000756498696 1046092538 /nfs/dbraw/zinc/09/25/38/1046092538.db2.gz YREJAOMMPVFTTB-BFQNTYOBSA-N 1 0 315.388 4.439 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1cc2c(cc1O)CCCC2 ZINC000756496187 1046092759 /nfs/dbraw/zinc/09/27/59/1046092759.db2.gz OPJXWQZNDKSWOM-GFCCVEGCSA-N 1 0 317.379 4.400 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)c2ccccc2F)c1 ZINC000756513620 1046093893 /nfs/dbraw/zinc/09/38/93/1046093893.db2.gz PCSAZVWPRDACFG-CYBMUJFWSA-N 1 0 317.404 4.168 20 10 DICDRO COc1ccccc1C1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CC1 ZINC000756518352 1046094979 /nfs/dbraw/zinc/09/49/79/1046094979.db2.gz SYGRZHBCISPWCU-HNNXBMFYSA-N 1 0 311.425 4.092 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN([C@@H](C)c3ccccc3)C2)c(O)c1 ZINC000756535943 1046095951 /nfs/dbraw/zinc/09/59/51/1046095951.db2.gz SSUGPVIYRPHYBO-LNLFQRSKSA-N 1 0 324.468 4.187 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2c[nH]c3cccc(C)c23)c(O)c1 ZINC000756531604 1046096083 /nfs/dbraw/zinc/09/60/83/1046096083.db2.gz AGTPRHMAIQHRSR-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)CCc2ccc(O)cc2)c(O)c1C ZINC000756532184 1046096998 /nfs/dbraw/zinc/09/69/98/1046096998.db2.gz FBTOXWYINRPHJC-ZBFHGGJFSA-N 1 0 313.441 4.387 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(O)c1 ZINC000756535941 1046097100 /nfs/dbraw/zinc/09/71/00/1046097100.db2.gz SSUGPVIYRPHYBO-JENIJYKNSA-N 1 0 324.468 4.187 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCc3c2cccc3O)c2c1c(F)ccc2O ZINC000756549952 1046097967 /nfs/dbraw/zinc/09/79/67/1046097967.db2.gz PPEYBSDHOGLDGX-ONERCXAPSA-N 1 0 313.372 4.062 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](Nc2ccccc2)C(C)C)c(O)c1 ZINC000756554955 1046098471 /nfs/dbraw/zinc/09/84/71/1046098471.db2.gz KZCMMWGOHMIOFF-APWZRJJASA-N 1 0 312.457 4.488 20 10 DICDRO C[C@H]([NH2+]Cc1cccc2c1OCO2)c1ccc2ccccc2c1O ZINC000194401243 1046098839 /nfs/dbraw/zinc/09/88/39/1046098839.db2.gz PZSCIQYMXQQMKX-ZDUSSCGKSA-N 1 0 321.376 4.125 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](Nc2ccccc2)C(C)C)c(O)c1 ZINC000756554966 1046099346 /nfs/dbraw/zinc/09/93/46/1046099346.db2.gz KZCMMWGOHMIOFF-QFBILLFUSA-N 1 0 312.457 4.488 20 10 DICDRO CCN1CCCC[C@H]1C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756563030 1046099825 /nfs/dbraw/zinc/09/98/25/1046099825.db2.gz LAZKFDODJIVUHV-RDJZCZTQSA-N 1 0 312.457 4.070 20 10 DICDRO CCN1CCCC[C@H]1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756563033 1046101253 /nfs/dbraw/zinc/10/12/53/1046101253.db2.gz LAZKFDODJIVUHV-WBVHZDCISA-N 1 0 312.457 4.070 20 10 DICDRO Cc1noc(C)c1[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756575465 1046101801 /nfs/dbraw/zinc/10/18/01/1046101801.db2.gz UGXMZSRERZEVLT-RVBZMBCESA-N 1 0 304.365 4.035 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCSc2nccs2)c(O)c1C ZINC000756584623 1046104305 /nfs/dbraw/zinc/10/43/05/1046104305.db2.gz GRNXATVUDGWJPT-ZDUSSCGKSA-N 1 0 322.499 4.299 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCCNc2ccccc2)c2c1c(F)ccc2O ZINC000756589830 1046104490 /nfs/dbraw/zinc/10/44/90/1046104490.db2.gz NCUVFKMDDAQHOM-XJKSGUPXSA-N 1 0 314.404 4.171 20 10 DICDRO CS[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC000756587515 1046104662 /nfs/dbraw/zinc/10/46/62/1046104662.db2.gz ASSCDKHKOUGVRL-CIQGVGRVSA-N 1 0 309.450 4.343 20 10 DICDRO C[C@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1O ZINC000756588791 1046104691 /nfs/dbraw/zinc/10/46/91/1046104691.db2.gz IWXUEQJUBQFMSD-NSHDSACASA-N 1 0 316.351 4.045 20 10 DICDRO Cc1cccc2c(CC[NH2+][C@H](C)c3cc(F)ccc3O)c[nH]c21 ZINC000756597062 1046105876 /nfs/dbraw/zinc/10/58/76/1046105876.db2.gz JTWZGAWRNKTKOQ-CYBMUJFWSA-N 1 0 312.388 4.214 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)Oc1ccccc1F ZINC000756609740 1046109601 /nfs/dbraw/zinc/10/96/01/1046109601.db2.gz NGIFLBQEDUPTQT-RYUDHWBXSA-N 1 0 323.795 4.303 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)C12CCC2 ZINC000756613719 1046109870 /nfs/dbraw/zinc/10/98/70/1046109870.db2.gz QJYYNJFVLNNRLD-SHPPOPEUSA-N 1 0 319.420 4.017 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1c(C)nn(C)c1C ZINC000756617923 1046110730 /nfs/dbraw/zinc/11/07/30/1046110730.db2.gz QRJHNCLRNTVTCQ-GUYCJALGSA-N 1 0 315.461 4.161 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccc(F)cc1F ZINC000756620801 1046111854 /nfs/dbraw/zinc/11/18/54/1046111854.db2.gz NCLIRUYSFPEPQJ-QWRGUYRKSA-N 1 0 309.331 4.264 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cc2c(cc1O)CCCC2)C1CCOCC1 ZINC000756627309 1046111898 /nfs/dbraw/zinc/11/18/98/1046111898.db2.gz HEOLJYPHSLZNIN-AUUYWEPGSA-N 1 0 317.473 4.127 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)C(C)(C)C ZINC000756627120 1046111905 /nfs/dbraw/zinc/11/19/05/1046111905.db2.gz QTDLBGISAOKOCW-CXAGYDPISA-N 1 0 301.430 4.257 20 10 DICDRO C[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1ccc(F)cc1F ZINC000756620803 1046111929 /nfs/dbraw/zinc/11/19/29/1046111929.db2.gz NCLIRUYSFPEPQJ-WDEREUQCSA-N 1 0 309.331 4.264 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2SCCc3ccccc32)c1 ZINC000756634239 1046114178 /nfs/dbraw/zinc/11/41/78/1046114178.db2.gz MGAVVZJVUBCZKD-IFXJQAMLSA-N 1 0 313.466 4.382 20 10 DICDRO CC[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)Oc1ccccc1F ZINC000756639406 1046114331 /nfs/dbraw/zinc/11/43/31/1046114331.db2.gz YIRIVKFGIVUULW-HUUCEWRRSA-N 1 0 317.404 4.348 20 10 DICDRO CC[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1O)Oc1ccccc1F ZINC000756637287 1046114795 /nfs/dbraw/zinc/11/47/95/1046114795.db2.gz IWUZRVFBNDYUGV-CABCVRRESA-N 1 0 317.404 4.348 20 10 DICDRO COC1CCC(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000756643168 1046115594 /nfs/dbraw/zinc/11/55/94/1046115594.db2.gz SSJVQMDKXFDXAL-UQPPLGOBSA-N 1 0 313.441 4.401 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756647565 1046115773 /nfs/dbraw/zinc/11/57/73/1046115773.db2.gz PRGQLXKQYLJEEL-IUODEOHRSA-N 1 0 315.388 4.186 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756647560 1046116261 /nfs/dbraw/zinc/11/62/61/1046116261.db2.gz PRGQLXKQYLJEEL-DOMZBBRYSA-N 1 0 315.388 4.186 20 10 DICDRO C[C@H]([NH2+][C@@H](CCO)C1CCCCC1)c1cc(Cl)ccc1O ZINC000756661746 1046117909 /nfs/dbraw/zinc/11/79/09/1046117909.db2.gz VEZYNWWXTIUZGO-LRDDRELGSA-N 1 0 311.853 4.028 20 10 DICDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000756681444 1046119666 /nfs/dbraw/zinc/11/96/66/1046119666.db2.gz BPVOLNWWUFUZTL-YJBOKZPZSA-N 1 0 311.425 4.410 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756672836 1046119717 /nfs/dbraw/zinc/11/97/17/1046119717.db2.gz UHHKUYGQLRMQCS-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO FC(F)[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138219728 1046120420 /nfs/dbraw/zinc/12/04/20/1046120420.db2.gz MXDBDDRRKMPOPZ-INIZCTEOSA-N 1 0 308.416 4.154 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756683109 1046120539 /nfs/dbraw/zinc/12/05/39/1046120539.db2.gz FQDHUFRVARNVMP-YVEFUNNKSA-N 1 0 315.388 4.268 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000756687390 1046120789 /nfs/dbraw/zinc/12/07/89/1046120789.db2.gz WBQZZJKPPOKZJI-KSSFIOAISA-N 1 0 311.425 4.437 20 10 DICDRO Fc1ccc2c(c1)CN(Cc1ccc(N3CCCCC3)cc1)C2 ZINC001138219586 1046120947 /nfs/dbraw/zinc/12/09/47/1046120947.db2.gz HTPBFTKEDWAAPL-UHFFFAOYSA-N 1 0 310.416 4.332 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cccc(F)c2F)c(O)c1C ZINC000756713727 1046122611 /nfs/dbraw/zinc/12/26/11/1046122611.db2.gz YAHVVSYSXILNBN-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1cccc(Cl)c1 ZINC000756734656 1046123937 /nfs/dbraw/zinc/12/39/37/1046123937.db2.gz XZRJEMBGSHOTFI-PIGZYNQJSA-N 1 0 323.795 4.223 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)Oc1ccccc1Cl ZINC000756734719 1046124711 /nfs/dbraw/zinc/12/47/11/1046124711.db2.gz YUQGVOGNNAQGGO-VXGBXAGGSA-N 1 0 323.795 4.303 20 10 DICDRO CC(C)[C@H]1OCCC[C@H]1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756737623 1046125696 /nfs/dbraw/zinc/12/56/96/1046125696.db2.gz WPYDPHRRXGMPMP-GDZNZVCISA-N 1 0 311.853 4.147 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)c1 ZINC000756757385 1046125994 /nfs/dbraw/zinc/12/59/94/1046125994.db2.gz MZTKWMZULLVBDM-XHDPSFHLSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)c(O)c1 ZINC000756744380 1046126015 /nfs/dbraw/zinc/12/60/15/1046126015.db2.gz AMCLLQXELMOCLT-UJKGCTCZSA-N 1 0 311.425 4.304 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)c(O)c1C ZINC000756756194 1046126161 /nfs/dbraw/zinc/12/61/61/1046126161.db2.gz FYNVYTACZADZOT-MLGOLLRUSA-N 1 0 317.816 4.447 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](Cc2ccccc2)C2CC2)c1 ZINC000756739707 1046126363 /nfs/dbraw/zinc/12/63/63/1046126363.db2.gz WZHOSAZDISEHQS-KUHUBIRLSA-N 1 0 311.425 4.073 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2COc3c2cccc3Cl)c(O)c1 ZINC000756757485 1046126541 /nfs/dbraw/zinc/12/65/41/1046126541.db2.gz OGQYBXKUZQWCAI-NHYWBVRUSA-N 1 0 303.789 4.138 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC(C)(C)[C@@H]2CCCCO2)c2c1c(F)ccc2O ZINC000756757229 1046128380 /nfs/dbraw/zinc/12/83/80/1046128380.db2.gz MHUGQYYRXFIDCU-XPKDYRNWSA-N 1 0 321.436 4.265 20 10 DICDRO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cc(Cl)ccc1O ZINC000756757744 1046128545 /nfs/dbraw/zinc/12/85/45/1046128545.db2.gz BJCXBNQDCDMTEO-XPTSAGLGSA-N 1 0 324.207 4.483 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@H]2c2cccnc2)c2ccccc2n1C ZINC001138252521 1046129263 /nfs/dbraw/zinc/12/92/63/1046129263.db2.gz JUZCIRNKSZEORN-IBGZPJMESA-N 1 0 305.425 4.219 20 10 DICDRO COc1ccc2c(c1)CC[N@@H+](Cc1c(C)n(C)c3ccccc31)C2 ZINC001138252481 1046129704 /nfs/dbraw/zinc/12/97/04/1046129704.db2.gz IHOHESUYKIKTDE-UHFFFAOYSA-N 1 0 320.436 4.054 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756767972 1046129856 /nfs/dbraw/zinc/12/98/56/1046129856.db2.gz HLJDBMIMBMCKMO-LRDDRELGSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c2ccccc2n1C ZINC001138252506 1046130116 /nfs/dbraw/zinc/13/01/16/1046130116.db2.gz JEZJWNBAUGVIAF-INIZCTEOSA-N 1 0 310.363 4.056 20 10 DICDRO Cc1c(C[NH+]2CCC(c3ccccn3)CC2)c2ccccc2n1C ZINC001138257142 1046131358 /nfs/dbraw/zinc/13/13/58/1046131358.db2.gz XRUTXTSOVOJBQO-UHFFFAOYSA-N 1 0 319.452 4.261 20 10 DICDRO COc1ccccc1CC[N@H+](C)Cc1c2ccccc2n(C)c1C ZINC001138257859 1046131440 /nfs/dbraw/zinc/13/14/40/1046131440.db2.gz APVNGIWVPDUOTI-UHFFFAOYSA-N 1 0 322.452 4.170 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)c(O)c1 ZINC000756775429 1046131492 /nfs/dbraw/zinc/13/14/92/1046131492.db2.gz QBGOJZXZEJHGNR-AWEZNQCLSA-N 1 0 314.429 4.124 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1cc(Cl)ccc1O ZINC000756778768 1046131550 /nfs/dbraw/zinc/13/15/50/1046131550.db2.gz PLHFLPFLQIPMLD-GHJWDPDVSA-N 1 0 311.853 4.290 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC2(c3ccc(F)cc3F)CC2)c1 ZINC000756777014 1046131590 /nfs/dbraw/zinc/13/15/90/1046131590.db2.gz FSCVKDKGCJWDFZ-CYBMUJFWSA-N 1 0 317.379 4.361 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)c2c1c(F)ccc2O ZINC000756779219 1046131870 /nfs/dbraw/zinc/13/18/70/1046131870.db2.gz RLGYESLJALBBKU-HLSYRSCKSA-N 1 0 321.436 4.263 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1c(C)noc1C ZINC000756776317 1046131927 /nfs/dbraw/zinc/13/19/27/1046131927.db2.gz OIMNHWHKWFCXRO-BLLLJJGKSA-N 1 0 302.418 4.416 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)c2c1c(F)ccc2O ZINC000756779220 1046131972 /nfs/dbraw/zinc/13/19/72/1046131972.db2.gz RLGYESLJALBBKU-TWJWRFFLSA-N 1 0 321.436 4.263 20 10 DICDRO Cc1c(C[N@H+](C2CCC2)C2CCOCC2)c2ccccc2n1C ZINC001138259116 1046132033 /nfs/dbraw/zinc/13/20/33/1046132033.db2.gz BSAALSBWOBRMOC-UHFFFAOYSA-N 1 0 312.457 4.020 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000756781600 1046132143 /nfs/dbraw/zinc/13/21/43/1046132143.db2.gz HIWAQZKUZXOPDI-NJSLBKSFSA-N 1 0 317.404 4.267 20 10 DICDRO C[C@H]1C[C@H]([NH2+]C2(c3ccc(F)cc3)CC2)c2c1c(F)ccc2O ZINC000756827377 1046140177 /nfs/dbraw/zinc/14/01/77/1046140177.db2.gz SHBXLCLZNHEQKX-NHYWBVRUSA-N 1 0 315.363 4.498 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2(c3ccc(F)cc3)CCC2)c1 ZINC000756818929 1046140514 /nfs/dbraw/zinc/14/05/14/1046140514.db2.gz QHWULWYWXCJJRP-ZDUSSCGKSA-N 1 0 315.388 4.270 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)c(O)c1C ZINC000756864411 1046146067 /nfs/dbraw/zinc/14/60/67/1046146067.db2.gz MIVMSGVZYJVOFJ-BBWFWOEESA-N 1 0 305.462 4.253 20 10 DICDRO CC(C)(C)OCCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000756880224 1046147788 /nfs/dbraw/zinc/14/77/88/1046147788.db2.gz RCFAMWJRAUIDEY-UHFFFAOYSA-N 1 0 305.462 4.342 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)cc1 ZINC000779966458 1046178929 /nfs/dbraw/zinc/17/89/29/1046178929.db2.gz FFGARQWQGTXEOK-UHFFFAOYSA-N 1 0 322.408 4.428 20 10 DICDRO C[C@@H]([NH2+]Cc1nccc2c1CCCC2)c1cc(Cl)ccc1O ZINC000903183007 1046185822 /nfs/dbraw/zinc/18/58/22/1046185822.db2.gz XDLOHEULZMNBRV-GFCCVEGCSA-N 1 0 316.832 4.170 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)c1cc(F)cc(F)c1O ZINC000757615843 1046192912 /nfs/dbraw/zinc/19/29/12/1046192912.db2.gz ZKPHQHBTSCKACM-LBPRGKRZSA-N 1 0 320.383 4.214 20 10 DICDRO COCC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)c1ccco1 ZINC000757639266 1046194969 /nfs/dbraw/zinc/19/49/69/1046194969.db2.gz QIVGHQOUZOSBJV-FPMFFAJLSA-N 1 0 319.376 4.040 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2cc(F)c(F)c(F)c2)c1 ZINC000757637445 1046195631 /nfs/dbraw/zinc/19/56/31/1046195631.db2.gz HWLPNKSTPJCBTR-NSHDSACASA-N 1 0 309.331 4.011 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(F)c(F)c2F)c(O)c1 ZINC000757657153 1046197837 /nfs/dbraw/zinc/19/78/37/1046197837.db2.gz MFXQLQUJYRCCRG-NSHDSACASA-N 1 0 309.331 4.011 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000757674159 1046199897 /nfs/dbraw/zinc/19/98/97/1046199897.db2.gz QILLJAKPVARMGO-GIPNMCIBSA-N 1 0 320.433 4.238 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(F)c(F)c2F)c(O)c1C ZINC000757659742 1046200095 /nfs/dbraw/zinc/20/00/95/1046200095.db2.gz ZVNSICCTPSSDOV-LBPRGKRZSA-N 1 0 323.358 4.320 20 10 DICDRO CC(C)OCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000757686587 1046201876 /nfs/dbraw/zinc/20/18/76/1046201876.db2.gz JCABSWYIVMGFPM-KRWDZBQOSA-N 1 0 304.478 4.143 20 10 DICDRO CC[C@@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1ccc(C)cc1O ZINC000903322448 1046236329 /nfs/dbraw/zinc/23/63/29/1046236329.db2.gz CVEXFXDKFOVMJA-NLGTXKQRSA-N 1 0 303.446 4.089 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1ccc2ccccc2c1O ZINC000903324257 1046238637 /nfs/dbraw/zinc/23/86/37/1046238637.db2.gz CXPHWCBHNFCEKD-SCLBCKFNSA-N 1 0 319.408 4.137 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc(Cl)cc1O ZINC000903336091 1046249021 /nfs/dbraw/zinc/24/90/21/1046249021.db2.gz VWIIFCCVLQBSIG-PIGZYNQJSA-N 1 0 302.805 4.243 20 10 DICDRO C[C@@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000245627330 1046249438 /nfs/dbraw/zinc/24/94/38/1046249438.db2.gz YTSMWWLFASZMEK-BRWVUGGUSA-N 1 0 316.489 4.284 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)cc1 ZINC000903338203 1046251032 /nfs/dbraw/zinc/25/10/32/1046251032.db2.gz GXIDBYVPFLPGOI-FOIQADDNSA-N 1 0 309.457 4.340 20 10 DICDRO C[C@H]([NH2+]C[C@]12C[C@H]1COC21CCC1)c1ccc2ccccc2c1O ZINC000903363798 1046256650 /nfs/dbraw/zinc/25/66/50/1046256650.db2.gz QHVQBAFCNSDSBA-DKICVRJWSA-N 1 0 323.436 4.155 20 10 DICDRO C[C@@H]([NH2+]C[C@]12C[C@H]1COC21CCC1)c1ccc2ccccc2c1O ZINC000903363799 1046256942 /nfs/dbraw/zinc/25/69/42/1046256942.db2.gz QHVQBAFCNSDSBA-PTSWNOGYSA-N 1 0 323.436 4.155 20 10 DICDRO CC[C@H]([NH2+]C[C@]12C[C@H]1COC21CCC1)c1cc(Cl)ccc1O ZINC000903364154 1046257893 /nfs/dbraw/zinc/25/78/93/1046257893.db2.gz UWMAFHUAGATXKT-YLQAJVPDSA-N 1 0 321.848 4.046 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(C(F)(F)F)s2)cc1 ZINC000758303729 1046260967 /nfs/dbraw/zinc/26/09/67/1046260967.db2.gz XITAWBQSSYYHKY-UHFFFAOYSA-N 1 0 314.376 4.123 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000903430364 1046280245 /nfs/dbraw/zinc/28/02/45/1046280245.db2.gz ZBWQZTLUUZMSFM-QKKBWIMNSA-N 1 0 322.452 4.468 20 10 DICDRO CC[C@H]([NH2+][C@H](COC)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000089668346 1046297573 /nfs/dbraw/zinc/29/75/73/1046297573.db2.gz XYCVSJHSCTZCAJ-VQTJNVASSA-N 1 0 312.457 4.181 20 10 DICDRO C[N@H+](Cc1c[nH]c2c1cccc2Cl)Cc1ccccc1O ZINC001138834263 1046308605 /nfs/dbraw/zinc/30/86/05/1046308605.db2.gz ZMLJMKYRFUDAFP-UHFFFAOYSA-N 1 0 300.789 4.159 20 10 DICDRO CCOc1ccc(Cl)cc1C[N@H+](CC)Cc1ccccc1O ZINC001139012174 1046355316 /nfs/dbraw/zinc/35/53/16/1046355316.db2.gz YCKRMJDLXFKPQL-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO CCn1ccc2ccc(C[N@H+](C)Cc3ccc(N(C)C)cc3)cc21 ZINC001139120247 1046388830 /nfs/dbraw/zinc/38/88/30/1046388830.db2.gz NSOJVFNGTAWKSG-UHFFFAOYSA-N 1 0 321.468 4.359 20 10 DICDRO Oc1ccc(F)cc1C[N@H+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000780768172 1046403423 /nfs/dbraw/zinc/40/34/23/1046403423.db2.gz OTYKTXSPZCXNHK-UHFFFAOYSA-N 1 0 322.383 4.302 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2ccn(C)c2c1 ZINC001139208905 1046413378 /nfs/dbraw/zinc/41/33/78/1046413378.db2.gz ZLHNJHSRNCPXCT-UHFFFAOYSA-N 1 0 321.468 4.266 20 10 DICDRO CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 ZINC001202913399 1046419365 /nfs/dbraw/zinc/41/93/65/1046419365.db2.gz KDRRUSRONVYBCS-FGTMMUONSA-N 1 0 316.489 4.080 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)C1CCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000749130018 1046431937 /nfs/dbraw/zinc/43/19/37/1046431937.db2.gz OZBZAOKKVWHVIY-DLBZAZTESA-N 1 0 316.489 4.143 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc3cc(O)ccc3c2)cc1 ZINC001139341947 1046432364 /nfs/dbraw/zinc/43/23/64/1046432364.db2.gz MKSNIBIPHCRWIC-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ccc(N(C)C)cc1 ZINC000781923377 1046487970 /nfs/dbraw/zinc/48/79/70/1046487970.db2.gz NBIJLOSEPRVQQB-UGSOOPFHSA-N 1 0 301.409 4.089 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001139672402 1046496375 /nfs/dbraw/zinc/49/63/75/1046496375.db2.gz WNONUAPDWIQSDK-FQEVSTJZSA-N 1 0 324.468 4.407 20 10 DICDRO COc1cccc([C@@H]2CC[N@H+](Cc3ccc(N(C)C)c(C)c3)C2)c1 ZINC001139673925 1046496426 /nfs/dbraw/zinc/49/64/26/1046496426.db2.gz NMXJFXZMPBEAJZ-LJQANCHMSA-N 1 0 324.468 4.059 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)ccc1N(C)C ZINC001139673567 1046496913 /nfs/dbraw/zinc/49/69/13/1046496913.db2.gz SREOAQYEAKJLQZ-SFHVURJKSA-N 1 0 312.432 4.190 20 10 DICDRO COc1cccc([C@H]2CC[N@H+](Cc3ccc(N(C)C)c(C)c3)C2)c1 ZINC001139673924 1046497715 /nfs/dbraw/zinc/49/77/15/1046497715.db2.gz NMXJFXZMPBEAJZ-IBGZPJMESA-N 1 0 324.468 4.059 20 10 DICDRO Cc1cc(C[NH+]2CCC(c3ccc(O)cc3)CC2)ccc1N(C)C ZINC001139673434 1046497768 /nfs/dbraw/zinc/49/77/68/1046497768.db2.gz GYFCHQVTDIDZLK-UHFFFAOYSA-N 1 0 324.468 4.146 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000782291611 1046513640 /nfs/dbraw/zinc/51/36/40/1046513640.db2.gz WTKMNMLRUDOVPX-QGZVFWFLSA-N 1 0 318.420 4.005 20 10 DICDRO COCCCC[N@H+](Cc1ccccc1)Cc1cc(C)ccc1O ZINC000092507085 1046522993 /nfs/dbraw/zinc/52/29/93/1046522993.db2.gz XAOHRZIYBWIUPN-UHFFFAOYSA-N 1 0 313.441 4.129 20 10 DICDRO CC[N@H+](Cc1cccc(OC)c1)Cc1ccc(N(C)C)c(C)c1 ZINC001139672731 1046525703 /nfs/dbraw/zinc/52/57/03/1046525703.db2.gz DDSYLRZURKUKMA-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO CC[N@H+](Cc1cc2ccccc2n1C)Cc1ccc(N(C)C)cc1 ZINC001139872762 1046538124 /nfs/dbraw/zinc/53/81/24/1046538124.db2.gz WOOMXCRZOCHKKS-UHFFFAOYSA-N 1 0 321.468 4.266 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccc(F)c1 ZINC000783229271 1046565599 /nfs/dbraw/zinc/56/55/99/1046565599.db2.gz DLYBDWWVCODTOA-LJQANCHMSA-N 1 0 312.432 4.449 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1cccc(F)c1 ZINC000783243707 1046567439 /nfs/dbraw/zinc/56/74/39/1046567439.db2.gz BBMOKXJBKMCNKS-LJQANCHMSA-N 1 0 300.421 4.441 20 10 DICDRO Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2ccc(N(C)C)cc2)c1C ZINC000729681715 1046576476 /nfs/dbraw/zinc/57/64/76/1046576476.db2.gz IPVTUPGZQOVJLT-UHFFFAOYSA-N 1 0 321.468 4.449 20 10 DICDRO COc1ccc(C(C)(C)C[NH2+]Cc2ccc(OC)c(C)c2)cc1 ZINC000729683326 1046576876 /nfs/dbraw/zinc/57/68/76/1046576876.db2.gz ZYEHSXSHVZSZEA-UHFFFAOYSA-N 1 0 313.441 4.080 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(c2ccc(F)cc2F)CC1 ZINC001140056465 1046577212 /nfs/dbraw/zinc/57/72/12/1046577212.db2.gz YAOJDJNEBVTATM-UHFFFAOYSA-N 1 0 321.342 4.189 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](CC(F)(F)F)C(C)C)c1 ZINC000783329581 1046582960 /nfs/dbraw/zinc/58/29/60/1046582960.db2.gz HSRXRHVHPRSULX-GWCFXTLKSA-N 1 0 305.340 4.028 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000237092466 1046595244 /nfs/dbraw/zinc/59/52/44/1046595244.db2.gz WIQVAUQRUMSTOQ-HXUWFJFHSA-N 1 0 323.392 4.263 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(C(F)(F)F)cc1)c1ccccc1O ZINC000783489218 1046598259 /nfs/dbraw/zinc/59/82/59/1046598259.db2.gz BCTSTNHHCPLKEL-GFCCVEGCSA-N 1 0 309.331 4.304 20 10 DICDRO COc1cc(C[NH2+][C@H](C)c2ccccc2O)ccc1OC(C)C ZINC000783500284 1046600236 /nfs/dbraw/zinc/60/02/36/1046600236.db2.gz UQBQEUYSUZMUCE-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO C[C@@H]([NH2+]CCc1c[nH]c2cc(Cl)ccc12)c1ccccc1O ZINC000783504705 1046602056 /nfs/dbraw/zinc/60/20/56/1046602056.db2.gz JMNNCWQIQBTBOG-GFCCVEGCSA-N 1 0 314.816 4.420 20 10 DICDRO Cc1ccc(N2CCC[C@H]([NH2+][C@@H](C)c3ccccc3O)C2)cc1 ZINC000783516773 1046604064 /nfs/dbraw/zinc/60/40/64/1046604064.db2.gz IXBMMUHBTJFMNH-IRXDYDNUSA-N 1 0 310.441 4.020 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1O ZINC000783521462 1046604138 /nfs/dbraw/zinc/60/41/38/1046604138.db2.gz YNFYONBODUPUMS-XQQFMLRXSA-N 1 0 301.352 4.412 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841746848 1046607961 /nfs/dbraw/zinc/60/79/61/1046607961.db2.gz LOPVZAYMXYFYDX-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@@H](O)c2ccc(F)cc2)c(O)c1 ZINC000248494117 1046618761 /nfs/dbraw/zinc/61/87/61/1046618761.db2.gz KJBPZMNJVAYOCC-QWQRMKEZSA-N 1 0 317.404 4.003 20 10 DICDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(Cl)ccc2O)s1 ZINC000093275195 1046619033 /nfs/dbraw/zinc/61/90/33/1046619033.db2.gz SEVHBUHGFALTGJ-JTQLQIEISA-N 1 0 310.850 4.312 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(C)ccc2O)CCO1 ZINC000248520912 1046620848 /nfs/dbraw/zinc/62/08/48/1046620848.db2.gz RGOLTODVSCZZHD-ALKREAHSSA-N 1 0 305.462 4.335 20 10 DICDRO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc(N(C)C)cc1)CCC2 ZINC000093364818 1046625055 /nfs/dbraw/zinc/62/50/55/1046625055.db2.gz UPWYCZBKIHHKTP-QGZVFWFLSA-N 1 0 315.486 4.027 20 10 DICDRO Cc1c2cc(F)ccc2oc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834533934 1046626377 /nfs/dbraw/zinc/62/63/77/1046626377.db2.gz CJYCYRITEDLCFM-HNNXBMFYSA-N 1 0 311.356 4.363 20 10 DICDRO Cc1c(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cccc1[N+](=O)[O-] ZINC000841754023 1046638484 /nfs/dbraw/zinc/63/84/84/1046638484.db2.gz YQFBUZQPFICUPC-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO CO[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1cccc(Cl)c1 ZINC000834673051 1046648446 /nfs/dbraw/zinc/64/84/46/1046648446.db2.gz MARWVERIRGXHAJ-DOTOQJQBSA-N 1 0 317.816 4.010 20 10 DICDRO Cc1cccc([C@H]2CC[N@H+](Cc3c(O)ccc4ccncc43)C2)c1 ZINC000784025855 1046652635 /nfs/dbraw/zinc/65/26/35/1046652635.db2.gz QDAIDJKBOLKUPC-SFHVURJKSA-N 1 0 318.420 4.238 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@H](c3ccc(C)cc3)C2)c1O ZINC000784027713 1046652880 /nfs/dbraw/zinc/65/28/80/1046652880.db2.gz XIXFXXMZDXOKTQ-KRWDZBQOSA-N 1 0 311.425 4.007 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]C1(CCOCc3ccccc3)CC1)CC2 ZINC000834733745 1046658449 /nfs/dbraw/zinc/65/84/49/1046658449.db2.gz UTPTWRFDITWDGT-SFHVURJKSA-N 1 0 323.436 4.109 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H](C)c2ccc(Cl)cc2O)o1 ZINC000841757267 1046664988 /nfs/dbraw/zinc/66/49/88/1046664988.db2.gz NANNIWXGXINPAC-SNVBAGLBSA-N 1 0 308.809 4.145 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)o1 ZINC000841757265 1046665106 /nfs/dbraw/zinc/66/51/06/1046665106.db2.gz NANNIWXGXINPAC-JTQLQIEISA-N 1 0 308.809 4.145 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCCc3c(F)cc(F)cc31)CC2 ZINC000834814179 1046673895 /nfs/dbraw/zinc/67/38/95/1046673895.db2.gz FZHSPAMZTJXKIK-IRXDYDNUSA-N 1 0 315.363 4.325 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC=C(c2ccncc2)C1 ZINC000795738110 1046674971 /nfs/dbraw/zinc/67/49/71/1046674971.db2.gz OPOVJLNYYUKUFR-UHFFFAOYSA-N 1 0 316.404 4.230 20 10 DICDRO C[C@@H]([NH2+]CCCC(C)(F)F)c1ccc(Br)cc1O ZINC000834818443 1046675710 /nfs/dbraw/zinc/67/57/10/1046675710.db2.gz LTKIZFTURLIKKI-SECBINFHSA-N 1 0 322.193 4.241 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CSc2ccccc21)c1cc(F)ccc1O ZINC000834819076 1046676036 /nfs/dbraw/zinc/67/60/36/1046676036.db2.gz SEEAQBVWUDTWGX-NWDGAFQWSA-N 1 0 303.402 4.071 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCc2ccccc2Cl)c1 ZINC000784264997 1046678618 /nfs/dbraw/zinc/67/86/18/1046678618.db2.gz GSLKDZRMLVANEU-CYBMUJFWSA-N 1 0 319.832 4.338 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CC1=CCOCC1 ZINC000834860786 1046689090 /nfs/dbraw/zinc/68/90/90/1046689090.db2.gz UEJZUMJZAATKEZ-HXUWFJFHSA-N 1 0 323.436 4.002 20 10 DICDRO Cc1ncsc1CC[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000834881677 1046695387 /nfs/dbraw/zinc/69/53/87/1046695387.db2.gz VEAVTBNRDJPGCP-SNVBAGLBSA-N 1 0 310.850 4.012 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CC(C)(C)O)c1ccc(N2CCCCCC2)cc1 ZINC000834880214 1046695661 /nfs/dbraw/zinc/69/56/61/1046695661.db2.gz OFCMHPVYBCTVML-DLBZAZTESA-N 1 0 318.505 4.267 20 10 DICDRO Cc1cccnc1CCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000834883310 1046696429 /nfs/dbraw/zinc/69/64/29/1046696429.db2.gz IRVIVTORBGQEHI-CJNGLKHVSA-N 1 0 314.404 4.005 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c(O)c1C ZINC000834883351 1046696478 /nfs/dbraw/zinc/69/64/78/1046696478.db2.gz QAEJAXKRZCUOES-HZPDHXFCSA-N 1 0 303.446 4.009 20 10 DICDRO Cc1cccnc1CC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000834885348 1046698239 /nfs/dbraw/zinc/69/82/39/1046698239.db2.gz IUCOFAVHNDGGAG-SFHVURJKSA-N 1 0 323.484 4.274 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)cc1 ZINC000834883972 1046698509 /nfs/dbraw/zinc/69/85/09/1046698509.db2.gz VMHVERWCJSMLJN-IAGOWNOFSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834889554 1046702420 /nfs/dbraw/zinc/70/24/20/1046702420.db2.gz AYRBBDMXSWOBRY-FZMZJTMJSA-N 1 0 302.245 4.325 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834889555 1046703166 /nfs/dbraw/zinc/70/31/66/1046703166.db2.gz AYRBBDMXSWOBRY-RISCZKNCSA-N 1 0 302.245 4.325 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c(O)c1 ZINC000834897241 1046706564 /nfs/dbraw/zinc/70/65/64/1046706564.db2.gz RPUIHAOFNRTNMK-YGRLFVJLSA-N 1 0 321.342 4.456 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@]2(C)CC2(Cl)Cl)c1 ZINC000834895279 1046706679 /nfs/dbraw/zinc/70/66/79/1046706679.db2.gz XRPKNEIOTHMBIA-SMDDNHRTSA-N 1 0 302.245 4.325 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c(O)c1 ZINC000834897234 1046707245 /nfs/dbraw/zinc/70/72/45/1046707245.db2.gz RPUIHAOFNRTNMK-HZMBPMFUSA-N 1 0 321.342 4.456 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+][C@H](C)c3cc(F)ccc3O)C2)c1 ZINC000834902799 1046711508 /nfs/dbraw/zinc/71/15/08/1046711508.db2.gz GIJYOZZUIBMELH-XNRPHZJLSA-N 1 0 315.388 4.137 20 10 DICDRO CCc1ncc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)o1 ZINC000834901169 1046712235 /nfs/dbraw/zinc/71/22/35/1046712235.db2.gz XVRWNVAAYHSEMG-HNNXBMFYSA-N 1 0 313.445 4.078 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cnn(CC)c1)c1cc(Cl)ccc1O ZINC000834902138 1046713917 /nfs/dbraw/zinc/71/39/17/1046713917.db2.gz DUEIYPKGWSEGHI-ABAIWWIYSA-N 1 0 307.825 4.064 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+][C@H](C)c3ccc(C)cc3O)C2)c1 ZINC000834906388 1046716221 /nfs/dbraw/zinc/71/62/21/1046716221.db2.gz ZKESCFBWFYKCDI-DJIMGWMZSA-N 1 0 311.425 4.306 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1cc(F)ccc1O ZINC000834904073 1046716749 /nfs/dbraw/zinc/71/67/49/1046716749.db2.gz NGAULBSYDMCYNB-DYVFJYSZSA-N 1 0 314.404 4.153 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1ccccc1O ZINC000834911124 1046718695 /nfs/dbraw/zinc/71/86/95/1046718695.db2.gz XXTDWZJOQWYQFH-FRFSOERESA-N 1 0 317.454 4.415 20 10 DICDRO CC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1[O-] ZINC000796696746 1046718967 /nfs/dbraw/zinc/71/89/67/1046718967.db2.gz UFWIVOMTTKXWJR-QAPCUYQASA-N 1 0 322.468 4.084 20 10 DICDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2O)c1 ZINC001140466141 1046737604 /nfs/dbraw/zinc/73/76/04/1046737604.db2.gz YNBNMGQDNCHHOB-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001140466628 1046737842 /nfs/dbraw/zinc/73/78/42/1046737842.db2.gz INSUKAPFFJZBHK-QGZVFWFLSA-N 1 0 317.816 4.089 20 10 DICDRO COc1cccc([C@@H]2CC[N@H+](Cc3ccc(Cl)cc3O)C2)c1 ZINC001140464643 1046737895 /nfs/dbraw/zinc/73/78/95/1046737895.db2.gz YLDGKHGQEKXNFX-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2O)cn1 ZINC001140465154 1046738373 /nfs/dbraw/zinc/73/83/73/1046738373.db2.gz HROBTNMCVORJCS-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO CCCO[C@@H]1CCC[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835028515 1046744957 /nfs/dbraw/zinc/74/49/57/1046744957.db2.gz KXYZGBKJPRLSFV-ZEZYUPADSA-N 1 0 316.489 4.047 20 10 DICDRO CC[C@@H](CC(F)(F)F)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835047325 1046748537 /nfs/dbraw/zinc/74/85/37/1046748537.db2.gz QTIDULUENSJYNW-GXMNPTEKSA-N 1 0 300.368 4.086 20 10 DICDRO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835048155 1046749431 /nfs/dbraw/zinc/74/94/31/1046749431.db2.gz MJVQUZSGYFMBMF-RAIXIZIVSA-N 1 0 321.468 4.244 20 10 DICDRO CC[C@H](c1ccncc1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835054442 1046750679 /nfs/dbraw/zinc/75/06/79/1046750679.db2.gz VNPJXHIRBQVXDC-ROUKRRSUSA-N 1 0 309.457 4.244 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835054443 1046751264 /nfs/dbraw/zinc/75/12/64/1046751264.db2.gz VNPJXHIRBQVXDC-YJJPMGAVSA-N 1 0 309.457 4.244 20 10 DICDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)[C@H]1CCOC(C)(C)C1 ZINC000835055412 1046752195 /nfs/dbraw/zinc/75/21/95/1046752195.db2.gz IXUKXNRWSXVKMA-UCFODXPJSA-N 1 0 316.489 4.045 20 10 DICDRO CC[C@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccc(F)cc1O ZINC000796923028 1046759408 /nfs/dbraw/zinc/75/94/08/1046759408.db2.gz KFEJWFCGHLCLDY-KRWDZBQOSA-N 1 0 320.383 4.295 20 10 DICDRO Cc1cccc(CCC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC000797015042 1046770487 /nfs/dbraw/zinc/77/04/87/1046770487.db2.gz GHMAVCMYWNGKCR-LRDDRELGSA-N 1 0 314.404 4.005 20 10 DICDRO CC[C@H]([NH2+]Cc1c(F)cccc1SC)c1ccccc1O ZINC000797008629 1046771117 /nfs/dbraw/zinc/77/11/17/1046771117.db2.gz JASQVTPJFBATHB-HNNXBMFYSA-N 1 0 305.418 4.494 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)Oc1cc(F)cc(F)c1)c1ccccc1O ZINC000797009000 1046771469 /nfs/dbraw/zinc/77/14/69/1046771469.db2.gz KZQQAILXOXHZCY-GFCCVEGCSA-N 1 0 321.367 4.179 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCc2cccc(C)n2)cc1 ZINC000797020535 1046773002 /nfs/dbraw/zinc/77/30/02/1046773002.db2.gz ZUUVWJCCSWYFOO-QGZVFWFLSA-N 1 0 311.473 4.130 20 10 DICDRO CC[C@H]([NH2+]CCCc1cccc(C)n1)c1cc(Cl)ccc1O ZINC000797017023 1046773365 /nfs/dbraw/zinc/77/33/65/1046773365.db2.gz NDYOJYYRIOIDPV-KRWDZBQOSA-N 1 0 318.848 4.423 20 10 DICDRO C[C@@H]([NH2+]Cc1cnn2ccccc12)c1ccc2ccccc2c1O ZINC000797051848 1046779334 /nfs/dbraw/zinc/77/93/34/1046779334.db2.gz FGDIHHQCXMSVQF-CQSZACIVSA-N 1 0 317.392 4.044 20 10 DICDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000797058782 1046781625 /nfs/dbraw/zinc/78/16/25/1046781625.db2.gz GWLJMWRINDOAIQ-JXXFODFXSA-N 1 0 313.441 4.090 20 10 DICDRO C[C@H]([NH2+][C@@H]1CSC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000797065907 1046784726 /nfs/dbraw/zinc/78/47/26/1046784726.db2.gz NUKXYWURRCARFI-RLFYNMQTSA-N 1 0 304.503 4.079 20 10 DICDRO C[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1cc2c(cc1O)CCCC2 ZINC000797072064 1046786051 /nfs/dbraw/zinc/78/60/51/1046786051.db2.gz WHFJWMOAZUSHSR-LLVKDONJSA-N 1 0 313.363 4.264 20 10 DICDRO [O-]c1cc(F)cc(F)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001140582774 1046793856 /nfs/dbraw/zinc/79/38/56/1046793856.db2.gz MPXMTCKTORETBC-MRXNPFEDSA-N 1 0 307.315 4.147 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001140623217 1046815575 /nfs/dbraw/zinc/81/55/75/1046815575.db2.gz LQKFKQJVMCUVLI-INIZCTEOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1ccc(O[C@@H]2CCC[N@H+](Cc3cc(C)ccc3O)C2)cc1 ZINC001140620853 1046816213 /nfs/dbraw/zinc/81/62/13/1046816213.db2.gz AJPFSSZHWVJJKY-LJQANCHMSA-N 1 0 311.425 4.052 20 10 DICDRO COc1cccc([C@@H]2CCC[N@H+](Cc3cc(C)ccc3O)C2)c1 ZINC001140623920 1046816911 /nfs/dbraw/zinc/81/69/11/1046816911.db2.gz XEUUWMYVAPQVAV-QGZVFWFLSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCSC[C@@H]2c2ccc(F)cc2)c1 ZINC001140623354 1046819256 /nfs/dbraw/zinc/81/92/56/1046819256.db2.gz OKWXJFNFLJPTJJ-QGZVFWFLSA-N 1 0 317.429 4.130 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1 ZINC001140623546 1046819362 /nfs/dbraw/zinc/81/93/62/1046819362.db2.gz UTBMBFMZTQYAKX-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC001140623543 1046819903 /nfs/dbraw/zinc/81/99/03/1046819903.db2.gz URDPHEZPRAEAOV-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO Clc1ccc(SCC[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000303011949 1046847708 /nfs/dbraw/zinc/84/77/08/1046847708.db2.gz XDTZIXLDVOHWHP-UHFFFAOYSA-N 1 0 319.857 4.157 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2CC(C)(C)Cc3oc(C)cc32)c1 ZINC000237362660 1046870908 /nfs/dbraw/zinc/87/09/08/1046870908.db2.gz UJVBOMHQUVIHJL-MRXNPFEDSA-N 1 0 315.413 4.106 20 10 DICDRO COc1ccc(C[NH2+]CCCc2c[nH]c3ccccc23)cc1C ZINC000237381164 1046881660 /nfs/dbraw/zinc/88/16/60/1046881660.db2.gz AFLNXIVZUMQXMR-UHFFFAOYSA-N 1 0 308.425 4.207 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1O ZINC001140745589 1046882105 /nfs/dbraw/zinc/88/21/05/1046882105.db2.gz LVGSPRHRXQQGSL-MRXNPFEDSA-N 1 0 317.816 4.397 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c1O ZINC001140747643 1046884406 /nfs/dbraw/zinc/88/44/06/1046884406.db2.gz HKZLRFNXDMGGTN-INIZCTEOSA-N 1 0 317.816 4.397 20 10 DICDRO Cc1cc(C)cc([C@@H]2CCC[N@@H+]2Cc2ccc(O)c(C)c2O)c1 ZINC001140750012 1046884671 /nfs/dbraw/zinc/88/46/71/1046884671.db2.gz SHBKTGQNPAOGRI-SFHVURJKSA-N 1 0 311.425 4.360 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c1O ZINC001140747442 1046884975 /nfs/dbraw/zinc/88/49/75/1046884975.db2.gz DCOFZLRIYYJXTR-ZDUSSCGKSA-N 1 0 317.816 4.049 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1O ZINC001140747644 1046885350 /nfs/dbraw/zinc/88/53/50/1046885350.db2.gz HKZLRFNXDMGGTN-MRXNPFEDSA-N 1 0 317.816 4.397 20 10 DICDRO Cc1c(O)ccc(C[N@H+](C)Cc2ccc3ccccc3c2)c1O ZINC001140747972 1046885554 /nfs/dbraw/zinc/88/55/54/1046885554.db2.gz PTBBWFMCBHBFLD-UHFFFAOYSA-N 1 0 307.393 4.191 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1ccc(N(C)C)cc1 ZINC000797999500 1046918408 /nfs/dbraw/zinc/91/84/08/1046918408.db2.gz WKGGVDQIZKORCG-DJIMGWMZSA-N 1 0 312.432 4.489 20 10 DICDRO CC[C@H]1CCCC[N@@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000827354886 1046928776 /nfs/dbraw/zinc/92/87/76/1046928776.db2.gz UUCHLYLPVBQSFJ-SFHVURJKSA-N 1 0 316.489 4.066 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c(O)c1 ZINC001140855519 1046930869 /nfs/dbraw/zinc/93/08/69/1046930869.db2.gz CYPANBNAQUFZRQ-CRAIPNDOSA-N 1 0 302.462 4.003 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccccc2F)c(O)c1 ZINC001140855187 1046931425 /nfs/dbraw/zinc/93/14/25/1046931425.db2.gz QQECDUSVIRMFSQ-UHFFFAOYSA-N 1 0 316.420 4.010 20 10 DICDRO Cc1cc([C@H]2CCCN2Cc2ccc(N(C)C)cc2Cl)no1 ZINC001140921926 1046951524 /nfs/dbraw/zinc/95/15/24/1046951524.db2.gz WEODTIABIOEQSI-QGZVFWFLSA-N 1 0 319.836 4.040 20 10 DICDRO COc1ccc(C2CC[NH+](Cc3ccc(C)cc3O)CC2)cc1 ZINC001140950190 1046959745 /nfs/dbraw/zinc/95/97/45/1046959745.db2.gz UTCQWTBXAXTPKM-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c(O)c1 ZINC001140950953 1046960557 /nfs/dbraw/zinc/96/05/57/1046960557.db2.gz QKRBTJNVEMROMU-CQSZACIVSA-N 1 0 301.817 4.344 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCc3cccnc32)cc1 ZINC000798926604 1046987422 /nfs/dbraw/zinc/98/74/22/1046987422.db2.gz LNMVWWJNMKUEQM-LJQANCHMSA-N 1 0 309.457 4.095 20 10 DICDRO CC(C)N(Cc1csc(Cl)n1)Cc1ccc(N(C)C)cc1 ZINC000827442835 1046991083 /nfs/dbraw/zinc/99/10/83/1046991083.db2.gz ROEFPPGZBUDYLG-UHFFFAOYSA-N 1 0 323.893 4.273 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H](c3ccccn3)C2)c(O)c(C(C)(C)C)c1 ZINC000799160170 1047006728 /nfs/dbraw/zinc/00/67/28/1047006728.db2.gz PHMWYWMLGLROCQ-MRXNPFEDSA-N 1 0 324.468 4.383 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2c(O)ccc3ccncc32)cc1 ZINC000799393177 1047025248 /nfs/dbraw/zinc/02/52/48/1047025248.db2.gz SXTJTAPEPVGUOD-UHFFFAOYSA-N 1 0 306.409 4.135 20 10 DICDRO CN1CCOc2cc(C[N@H+](Cc3ccccc3)C3CCC3)ccc21 ZINC001141145440 1047027148 /nfs/dbraw/zinc/02/71/48/1047027148.db2.gz CTZVGMHIINXQNG-UHFFFAOYSA-N 1 0 322.452 4.070 20 10 DICDRO Oc1ccc(O)c(C[NH+]2CCC(c3cccc(Cl)c3)CC2)c1 ZINC001141156468 1047028893 /nfs/dbraw/zinc/02/88/93/1047028893.db2.gz LGRZBIRPFVTVIR-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO C[C@H](c1cccc2ccccc21)[N@H+](C)Cc1cc(O)ccc1O ZINC001141162488 1047032618 /nfs/dbraw/zinc/03/26/18/1047032618.db2.gz UMOGYFMPSCNKNJ-CQSZACIVSA-N 1 0 307.393 4.444 20 10 DICDRO CSCC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001203106386 1047055395 /nfs/dbraw/zinc/05/53/95/1047055395.db2.gz XIIVKGNICMBKTI-UHFFFAOYSA-N 1 0 309.519 4.440 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc3[nH]ccc3c2)c(O)c1C ZINC000799728183 1047058369 /nfs/dbraw/zinc/05/83/69/1047058369.db2.gz HNRULERWBNCWQJ-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2c[nH]nc21 ZINC001116439599 1047140806 /nfs/dbraw/zinc/14/08/06/1047140806.db2.gz IYORDCDXIJALEW-UHFFFAOYSA-N 1 0 322.456 4.040 20 10 DICDRO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116444162 1047142046 /nfs/dbraw/zinc/14/20/46/1047142046.db2.gz TUSGBXJQIGQUIR-INIZCTEOSA-N 1 0 310.441 4.185 20 10 DICDRO CN(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC001116489388 1047148200 /nfs/dbraw/zinc/14/82/00/1047148200.db2.gz YHTLFPAMJNQKFG-WOJBJXKFSA-N 1 0 324.468 4.022 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001116489171 1047148234 /nfs/dbraw/zinc/14/82/34/1047148234.db2.gz CVZMBCHBBBAPKV-INIZCTEOSA-N 1 0 309.457 4.095 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)c1ccc(F)cc1 ZINC001116567505 1047157911 /nfs/dbraw/zinc/15/79/11/1047157911.db2.gz GBTFKMITNTXCET-RDTXWAMCSA-N 1 0 317.404 4.186 20 10 DICDRO COc1cccc2cc(C[NH2+][C@@H](C)c3ccc(C)cc3O)oc21 ZINC001116585377 1047160307 /nfs/dbraw/zinc/16/03/07/1047160307.db2.gz YZNJWLDPURTOFY-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC1([C@H](C)CCO)CCC1 ZINC001116589326 1047160471 /nfs/dbraw/zinc/16/04/71/1047160471.db2.gz UEOLGRYOMXGMOS-BZUAXINKSA-N 1 0 317.473 4.027 20 10 DICDRO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001116865421 1047183655 /nfs/dbraw/zinc/18/36/55/1047183655.db2.gz OERODSTWRNJYEV-XJKSGUPXSA-N 1 0 312.379 4.060 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)COc1ccccc1F)c1ccc(C)cc1O ZINC001116889995 1047186716 /nfs/dbraw/zinc/18/67/16/1047186716.db2.gz MECXPZJIPIQZMB-RHSMWYFYSA-N 1 0 317.404 4.348 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH+]1CC(CC(F)(F)F)C1 ZINC000839137690 1047196087 /nfs/dbraw/zinc/19/60/87/1047196087.db2.gz HIWCNVXJWNHKJO-UHFFFAOYSA-N 1 0 321.342 4.443 20 10 DICDRO C[C@@H](CCCc1cccnc1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000839150976 1047199132 /nfs/dbraw/zinc/19/91/32/1047199132.db2.gz PLAXYAIGESEUNL-YOCVDRLZSA-N 1 0 323.484 4.162 20 10 DICDRO COc1cccc(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)c1 ZINC000325685867 1047205814 /nfs/dbraw/zinc/20/58/14/1047205814.db2.gz BMAPIFFWPMVEID-OAHLLOKOSA-N 1 0 321.420 4.447 20 10 DICDRO C[N@H+](Cc1cc(F)cc(F)c1)Cc1ccc2ccccc2c1O ZINC001117721936 1047239285 /nfs/dbraw/zinc/23/92/85/1047239285.db2.gz CXRBENUMQVFPQN-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CCO[C@H](C(C)C)C1 ZINC001117779642 1047245102 /nfs/dbraw/zinc/24/51/02/1047245102.db2.gz UIPFILNWVZLWKW-CBZIJGRNSA-N 1 0 317.473 4.290 20 10 DICDRO Cc1ccc2ncc(C[NH2+][C@@H](C)c3ccc(N(C)C)cc3)cc2c1 ZINC000839564209 1047249027 /nfs/dbraw/zinc/24/90/27/1047249027.db2.gz SHPZPIOHQWQJDU-INIZCTEOSA-N 1 0 319.452 4.460 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H]2C)c(O)c1 ZINC000383865762 1047271731 /nfs/dbraw/zinc/27/17/31/1047271731.db2.gz ZUYJVKSQENUQPV-ABSDTBQOSA-N 1 0 324.468 4.014 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)[C@H]2C)c(O)c1 ZINC000383865771 1047272975 /nfs/dbraw/zinc/27/29/75/1047272975.db2.gz ZUYJVKSQENUQPV-ZWOKBUDYSA-N 1 0 324.468 4.014 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000388481525 1047286890 /nfs/dbraw/zinc/28/68/90/1047286890.db2.gz BCFRFRVFSDIHTK-MRXNPFEDSA-N 1 0 317.816 4.174 20 10 DICDRO CCc1cccc(CNc2cccc(C[NH+]3CCCC3)c2)c1O ZINC001118401905 1047287830 /nfs/dbraw/zinc/28/78/30/1047287830.db2.gz ZVIXSSJKXBBRRU-UHFFFAOYSA-N 1 0 310.441 4.163 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1O ZINC000840139245 1047288120 /nfs/dbraw/zinc/28/81/20/1047288120.db2.gz KGIXVZWPVFINKB-SFHVURJKSA-N 1 0 313.397 4.029 20 10 DICDRO C[C@@H]1CC2(CC([NH2+]Cc3cc(-c4ccccc4)ccc3O)C2)CO1 ZINC000897781079 1047291150 /nfs/dbraw/zinc/29/11/50/1047291150.db2.gz OJMDDMUVQRFHFY-BSFYPJFYSA-N 1 0 323.436 4.106 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CCOCc1ccccc1)c1ccccc1O ZINC000389952063 1047292955 /nfs/dbraw/zinc/29/29/55/1047292955.db2.gz XJGKZDWVCJWALP-LPHOPBHVSA-N 1 0 313.441 4.428 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)COCc2ccccc2)c(O)c1 ZINC000389898448 1047293217 /nfs/dbraw/zinc/29/32/17/1047293217.db2.gz ABMDTAIMNQOPTE-IAGOWNOFSA-N 1 0 313.441 4.204 20 10 DICDRO COCc1csc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001118430432 1047295834 /nfs/dbraw/zinc/29/58/34/1047295834.db2.gz IBTOZVYGPFPMLI-SWLSCSKDSA-N 1 0 317.454 4.247 20 10 DICDRO COc1cc(C[NH2+][C@H](C)c2cncs2)c(O)c(C(C)(C)C)c1 ZINC000897930706 1047298192 /nfs/dbraw/zinc/29/81/92/1047298192.db2.gz RTVQLGICFQFFLV-LLVKDONJSA-N 1 0 320.458 4.006 20 10 DICDRO C[C@H]([NH2+]CC1(CO)CCCCC1)c1ccc2ccccc2c1O ZINC000391191204 1047303536 /nfs/dbraw/zinc/30/35/36/1047303536.db2.gz YSDRJLUVLIFZQB-HNNXBMFYSA-N 1 0 313.441 4.139 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000392231561 1047308281 /nfs/dbraw/zinc/30/82/81/1047308281.db2.gz XALCXZRZRHEDHF-PXNSSMCTSA-N 1 0 324.468 4.188 20 10 DICDRO Cc1cccnc1[C@@H]([NH2+]Cc1cc(F)ccc1O)C(C)(C)C ZINC000897996325 1047310111 /nfs/dbraw/zinc/31/01/11/1047310111.db2.gz ZMMIUONZOCWEBZ-QGZVFWFLSA-N 1 0 302.393 4.112 20 10 DICDRO Cc1ccccc1[C@@H]1CC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000725781081 1047314703 /nfs/dbraw/zinc/31/47/03/1047314703.db2.gz XRQTYDUSSIYWCU-GOSISDBHSA-N 1 0 307.437 4.179 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c(C)c1 ZINC000840714853 1047318307 /nfs/dbraw/zinc/31/83/07/1047318307.db2.gz ZKVLLVXGEIBPKI-QGZVFWFLSA-N 1 0 324.468 4.455 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(C)c1 ZINC000840720236 1047321724 /nfs/dbraw/zinc/32/17/24/1047321724.db2.gz LVTPVSZGQKUEHL-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO CSCC1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000395373252 1047326023 /nfs/dbraw/zinc/32/60/23/1047326023.db2.gz ISRQONAJFRUYCC-UHFFFAOYSA-N 1 0 318.530 4.298 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CCCN1Cc1ccccc1)c1ccccc1O ZINC000398011074 1047327528 /nfs/dbraw/zinc/32/75/28/1047327528.db2.gz LSPNQGSMROYKMU-LAUBAEHRSA-N 1 0 324.468 4.098 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)cc(OC)c1O)c1ccc(F)cc1 ZINC001119445544 1047333038 /nfs/dbraw/zinc/33/30/38/1047333038.db2.gz MRDKTXCXIWOVTQ-INIZCTEOSA-N 1 0 303.377 4.089 20 10 DICDRO Cc1ncc(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)o1 ZINC000840795484 1047334605 /nfs/dbraw/zinc/33/46/05/1047334605.db2.gz HCMJOXLEZTWMSP-OAHLLOKOSA-N 1 0 313.445 4.214 20 10 DICDRO COCC[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000840839466 1047343066 /nfs/dbraw/zinc/34/30/66/1047343066.db2.gz XBDYZXIYKVBSKB-HOTGVXAUSA-N 1 0 322.468 4.139 20 10 DICDRO C[C@@H]([NH2+]Cc1cnccc1C(C)(C)C)c1cc(F)ccc1O ZINC000840855066 1047345671 /nfs/dbraw/zinc/34/56/71/1047345671.db2.gz CLMFACHTLQWWSK-GFCCVEGCSA-N 1 0 302.393 4.075 20 10 DICDRO C[C@H]([NH2+]C[C@H]1C[C@@H](C)O[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000840872651 1047349653 /nfs/dbraw/zinc/34/96/53/1047349653.db2.gz LWINJEOCIGDNBS-SFNKJDCFSA-N 1 0 316.489 4.141 20 10 DICDRO COCC1CCC([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000840880006 1047350104 /nfs/dbraw/zinc/35/01/04/1047350104.db2.gz IDGLZISVAQCTFY-SYJJWHGVSA-N 1 0 317.473 4.127 20 10 DICDRO COCC1CCC([NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000840880001 1047350841 /nfs/dbraw/zinc/35/08/41/1047350841.db2.gz IDGLZISVAQCTFY-KSTDHSDQSA-N 1 0 317.473 4.127 20 10 DICDRO C[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)CC(F)(F)F ZINC000840874357 1047351977 /nfs/dbraw/zinc/35/19/77/1047351977.db2.gz YPHWBEABRZEPEI-IQJOONFLSA-N 1 0 305.315 4.258 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)CCC(F)(F)F ZINC000840895480 1047357251 /nfs/dbraw/zinc/35/72/51/1047357251.db2.gz YNSZRRGDRQYWRI-UONOGXRCSA-N 1 0 316.411 4.313 20 10 DICDRO CC[C@H]([NH2+]Cc1c(O)cc(C)cc1Cl)c1nc(C)cs1 ZINC000840892262 1047357618 /nfs/dbraw/zinc/35/76/18/1047357618.db2.gz PBLSTJZPYDNQSX-ZDUSSCGKSA-N 1 0 310.850 4.360 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@H](CC(C)C)C2)c(Cl)c1 ZINC000840936616 1047360181 /nfs/dbraw/zinc/36/01/81/1047360181.db2.gz MRASLDCJJAURCJ-UONOGXRCSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+]Cc1c(O)cc(C)cc1Cl)CCC2 ZINC000840937358 1047360617 /nfs/dbraw/zinc/36/06/17/1047360617.db2.gz RSABXGIVFUPMAK-ZDUSSCGKSA-N 1 0 322.861 4.286 20 10 DICDRO CC[C@](C)([NH2+]Cc1ccc(N(C)C)cc1C)c1nc(C)cs1 ZINC000840934930 1047361534 /nfs/dbraw/zinc/36/15/34/1047361534.db2.gz ZTDBPPBKNPBAHP-SFHVURJKSA-N 1 0 317.502 4.241 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000840948264 1047362532 /nfs/dbraw/zinc/36/25/32/1047362532.db2.gz SNBVFPPUARQRPK-IBGZPJMESA-N 1 0 309.457 4.039 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@@H](C)Oc3ccccc32)c(Cl)c1 ZINC000840950850 1047364056 /nfs/dbraw/zinc/36/40/56/1047364056.db2.gz PGHYRQWOZKTEBB-MLGOLLRUSA-N 1 0 317.816 4.356 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)C[C@H](C)c2nccs2)c(Cl)c1 ZINC000840940364 1047364306 /nfs/dbraw/zinc/36/43/06/1047364306.db2.gz ZCXLGDCGPJFWTL-NSHDSACASA-N 1 0 310.850 4.046 20 10 DICDRO Cc1ccc(Br)c(C[NH2+]Cc2cccc(C)c2O)c1 ZINC000840962970 1047365452 /nfs/dbraw/zinc/36/54/52/1047365452.db2.gz HNYXQVAYINGAOH-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2=Cc3ccccc3OC2)cc1 ZINC000726607325 1047371759 /nfs/dbraw/zinc/37/17/59/1047371759.db2.gz QRMADQGLMMQNBS-UHFFFAOYSA-N 1 0 322.452 4.098 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000841058411 1047376986 /nfs/dbraw/zinc/37/69/86/1047376986.db2.gz GJRVQGUCGFAPFJ-FNEOHHHZSA-N 1 0 321.468 4.015 20 10 DICDRO Cc1cc2cc(C[NH2+]Cc3cc(Cl)ccc3O)ccc2[nH]1 ZINC000796528569 1047378398 /nfs/dbraw/zinc/37/83/98/1047378398.db2.gz WAQCEYDFYHFEJH-UHFFFAOYSA-N 1 0 300.789 4.125 20 10 DICDRO C[NH2+]Cc1ccc(NCc2ccc(N3CCCCC3)cc2)cc1 ZINC000841071580 1047378963 /nfs/dbraw/zinc/37/89/63/1047378963.db2.gz PZTZNVSAOQKKAF-UHFFFAOYSA-N 1 0 309.457 4.008 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cccc3c2CCCN3)c(Cl)c1 ZINC000841082012 1047380520 /nfs/dbraw/zinc/38/05/20/1047380520.db2.gz AYAFANWJIARAKT-UHFFFAOYSA-N 1 0 316.832 4.002 20 10 DICDRO Oc1ccccc1C[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000726868161 1047385540 /nfs/dbraw/zinc/38/55/40/1047385540.db2.gz MGQUGOFTCFODHQ-UHFFFAOYSA-N 1 0 308.208 4.478 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCCC23CCCCC3)cc1F ZINC001203118413 1047393230 /nfs/dbraw/zinc/39/32/30/1047393230.db2.gz GQJYPUUWLHYIHJ-SFHVURJKSA-N 1 0 304.453 4.484 20 10 DICDRO C[C@@H](Cc1ccncc1)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000749297152 1047409248 /nfs/dbraw/zinc/40/92/48/1047409248.db2.gz TZWOJHBZGJUINV-INIZCTEOSA-N 1 0 318.420 4.175 20 10 DICDRO COc1ccc(C[NH2+]CC(C)(C)c2ccccc2F)cc1C ZINC000749919540 1047446839 /nfs/dbraw/zinc/44/68/39/1047446839.db2.gz VBKUSNLPICRSFJ-UHFFFAOYSA-N 1 0 301.405 4.210 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1[O-] ZINC000841748198 1047448181 /nfs/dbraw/zinc/44/81/81/1047448181.db2.gz IHRXTRSAYCCMLL-OCCSQVGLSA-N 1 0 309.837 4.188 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccc2c(c1)OCO2 ZINC000841745491 1047448735 /nfs/dbraw/zinc/44/87/35/1047448735.db2.gz YYPKYHQUYSYTJI-QWRGUYRKSA-N 1 0 319.788 4.186 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1O ZINC000841750877 1047450164 /nfs/dbraw/zinc/45/01/64/1047450164.db2.gz KAXHMYJPMZWAIR-GHMZBOCLSA-N 1 0 320.776 4.366 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)ccc1C ZINC000841747776 1047450383 /nfs/dbraw/zinc/45/03/83/1047450383.db2.gz SXUKHLHFVXRFGQ-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO CCCCn1cc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c(C)n1 ZINC000841752990 1047451444 /nfs/dbraw/zinc/45/14/44/1047451444.db2.gz WUYUDTGOYMZMKM-CYBMUJFWSA-N 1 0 321.852 4.201 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccc(C)o1 ZINC000841753826 1047452404 /nfs/dbraw/zinc/45/24/04/1047452404.db2.gz NQZUHZXAWPACLP-DOMZBBRYSA-N 1 0 323.820 4.375 20 10 DICDRO C[C@H]([NH2+][C@@H]1COCc2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000841760378 1047453558 /nfs/dbraw/zinc/45/35/58/1047453558.db2.gz KDJXSRRWSYLPDX-VBKZILBWSA-N 1 0 323.436 4.193 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841760597 1047454035 /nfs/dbraw/zinc/45/40/35/1047454035.db2.gz SYCCRRZIVDXZAP-BDJLRTHQSA-N 1 0 317.816 4.392 20 10 DICDRO C[C@H]([NH2+]C1Cc2ccccc2C1)c1ccc2ccccc2c1O ZINC000323170472 1047475132 /nfs/dbraw/zinc/47/51/32/1047475132.db2.gz WIDVNXLYEIOPBF-AWEZNQCLSA-N 1 0 303.405 4.363 20 10 DICDRO C[C@@H]([NH2+]C1Cc2ccccc2C1)c1ccc2ccccc2c1O ZINC000323170473 1047475389 /nfs/dbraw/zinc/47/53/89/1047475389.db2.gz WIDVNXLYEIOPBF-CQSZACIVSA-N 1 0 303.405 4.363 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)CC(F)F ZINC000842728366 1047499938 /nfs/dbraw/zinc/49/99/38/1047499938.db2.gz FVASVASWTQNJIV-SNVBAGLBSA-N 1 0 324.337 4.152 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2(c3ccccc3Cl)CC2)c1 ZINC000842886012 1047511038 /nfs/dbraw/zinc/51/10/38/1047511038.db2.gz GDSXZRNPUNBGAA-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO C[C@@H](C[NH2+][C@H](C)c1cc(Br)ccc1O)CC(F)F ZINC000842890857 1047511691 /nfs/dbraw/zinc/51/16/91/1047511691.db2.gz UKUMYQHSZUSZRG-RKDXNWHRSA-N 1 0 322.193 4.097 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](C)CC(F)F)c1ccc(Br)cc1O ZINC000842889814 1047511859 /nfs/dbraw/zinc/51/18/59/1047511859.db2.gz HISIZQMCVDWDIN-DTWKUNHWSA-N 1 0 322.193 4.097 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](C)CC(F)F)c1cc(Br)ccc1O ZINC000842890855 1047512541 /nfs/dbraw/zinc/51/25/41/1047512541.db2.gz UKUMYQHSZUSZRG-DTWKUNHWSA-N 1 0 322.193 4.097 20 10 DICDRO COc1ccccc1C1([NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000842900049 1047512674 /nfs/dbraw/zinc/51/26/74/1047512674.db2.gz DJNJCLZQAGMKGR-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCO)c1ccccc1F)c1ccc(C)cc1O ZINC000842924661 1047513810 /nfs/dbraw/zinc/51/38/10/1047513810.db2.gz RQMKCOWDSFEDAN-QZTJIDSGSA-N 1 0 317.404 4.004 20 10 DICDRO C[N@H+](Cc1cccc(-c2cccnc2)c1)Cc1ccccc1O ZINC000091956730 1047526024 /nfs/dbraw/zinc/52/60/24/1047526024.db2.gz UOPNBVHKXNHVRO-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO [NH3+]Cc1ccc2c(c1)CCCN2Cc1ccc(C(F)F)cc1 ZINC000843058659 1047527254 /nfs/dbraw/zinc/52/72/54/1047527254.db2.gz ZPZZYFFNYTXCOJ-UHFFFAOYSA-N 1 0 302.368 4.036 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H](c3ccccn3)C2)c1O ZINC001143110623 1047532161 /nfs/dbraw/zinc/53/21/61/1047532161.db2.gz LUJDGDAWPQBPRJ-OAHLLOKOSA-N 1 0 310.441 4.074 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2cccc(C(C)(C)C)c2O)cc1 ZINC001143105353 1047532454 /nfs/dbraw/zinc/53/24/54/1047532454.db2.gz RVTHBKLJYJXQPY-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)cc1F ZINC000192795710 1047632410 /nfs/dbraw/zinc/63/24/10/1047632410.db2.gz XQHIRBLVWAULGG-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccnn1C1CCC1 ZINC000924648088 1047643663 /nfs/dbraw/zinc/64/36/63/1047643663.db2.gz KSRMRAXKNZALNY-MRXNPFEDSA-N 1 0 324.472 4.059 20 10 DICDRO Cc1cc2ccccc2c(N(C)Cc2ccc(N(C)C)cc2)[nH+]1 ZINC001156920753 1047727451 /nfs/dbraw/zinc/72/74/51/1047727451.db2.gz LFTPKCQHLXWAQG-UHFFFAOYSA-N 1 0 305.425 4.246 20 10 DICDRO Cc1c[nH+]c(NCc2cc(Cl)c3cccnc3c2O)c(C)c1 ZINC001157726747 1047751788 /nfs/dbraw/zinc/75/17/88/1047751788.db2.gz XACZQKXCZMIZHB-UHFFFAOYSA-N 1 0 313.788 4.218 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2C[C@H](OC(C)(C)C)C23CCC3)c1O ZINC001182902605 1047860148 /nfs/dbraw/zinc/86/01/48/1047860148.db2.gz OCCNRKOIXOLUJN-SJORKVTESA-N 1 0 317.473 4.171 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2C[C@@H](OC(C)(C)C)C23CCC3)c1O ZINC001182902603 1047860164 /nfs/dbraw/zinc/86/01/64/1047860164.db2.gz OCCNRKOIXOLUJN-IAGOWNOFSA-N 1 0 317.473 4.171 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[N@@H+]2CC[C@H]3C[C@H]3C2)cc1 ZINC001183009753 1047874467 /nfs/dbraw/zinc/87/44/67/1047874467.db2.gz DCEIYHUUKNABMT-IRXDYDNUSA-N 1 0 312.482 4.226 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)cc1 ZINC001183009752 1047875326 /nfs/dbraw/zinc/87/53/26/1047875326.db2.gz DCEIYHUUKNABMT-IAGOWNOFSA-N 1 0 312.482 4.226 20 10 DICDRO COc1cc(C)c(C[NH2+]C2CCC(C3CCC3)CC2)c(O)c1 ZINC001182977295 1047876764 /nfs/dbraw/zinc/87/67/64/1047876764.db2.gz DHWVVVCQFZOXNV-UHFFFAOYSA-N 1 0 303.446 4.158 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]CC(C)(C)CC(F)(F)F ZINC001183036897 1047878664 /nfs/dbraw/zinc/87/86/64/1047878664.db2.gz UVNAUSNZYCFCSA-UHFFFAOYSA-N 1 0 302.384 4.129 20 10 DICDRO COc1cccc(C2([NH2+]Cc3ccc(N(C)C)cc3C)CCC2)c1 ZINC001183037260 1047879246 /nfs/dbraw/zinc/87/92/46/1047879246.db2.gz WCUBPPYDFNZOHW-UHFFFAOYSA-N 1 0 324.468 4.239 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@]1(c2ccccc2)CC1(C)C ZINC001183065924 1047887729 /nfs/dbraw/zinc/88/77/29/1047887729.db2.gz RRVFJHNOSIZNLT-NRFANRHFSA-N 1 0 308.469 4.476 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000479434602 1047888389 /nfs/dbraw/zinc/88/83/89/1047888389.db2.gz DGBLZCIKYQQDFW-GOSISDBHSA-N 1 0 308.400 4.403 20 10 DICDRO COc1ccsc1[C@@H](C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000479454972 1047898286 /nfs/dbraw/zinc/89/82/86/1047898286.db2.gz MJRYJSMSGYEOCF-CYBMUJFWSA-N 1 0 314.454 4.408 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH+]2CC(C)(C)C2)cc1 ZINC001183355825 1047920114 /nfs/dbraw/zinc/92/01/14/1047920114.db2.gz VSTZMIRRZKFISK-UHFFFAOYSA-N 1 0 300.471 4.226 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+]Cc2cc(Cl)c(C)cc2O)nc1 ZINC001206672525 1047934470 /nfs/dbraw/zinc/93/44/70/1047934470.db2.gz OGIJDIOVXWSVCN-UHFFFAOYSA-N 1 0 318.848 4.125 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000775834568 1047943437 /nfs/dbraw/zinc/94/34/37/1047943437.db2.gz VAGQPZDIHRYCKA-OXQOHEQNSA-N 1 0 312.457 4.181 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)cc1 ZINC001198271959 1047944431 /nfs/dbraw/zinc/94/44/31/1047944431.db2.gz YXQXMLWJOGCAOD-VPFXQZGESA-N 1 0 306.453 4.430 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C2(c3cccc(OC)c3)CCC2)cc1 ZINC001174828373 1047985772 /nfs/dbraw/zinc/98/57/72/1047985772.db2.gz YCTLMFALAMTIKV-UHFFFAOYSA-N 1 0 324.468 4.320 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+](CC(C)C)C(C)C)c1O ZINC000160962881 1048025427 /nfs/dbraw/zinc/02/54/27/1048025427.db2.gz GLKGSFJOKFAFOV-UHFFFAOYSA-N 1 0 314.267 4.330 20 10 DICDRO Cc1ccc(OC2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)cc1 ZINC001203933732 1048061233 /nfs/dbraw/zinc/06/12/33/1048061233.db2.gz HIIDFONKZOIMIN-UHFFFAOYSA-N 1 0 324.468 4.104 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cc1 ZINC001203934651 1048063931 /nfs/dbraw/zinc/06/39/31/1048063931.db2.gz YSMYRWFGEMXKJH-LJQANCHMSA-N 1 0 316.395 4.368 20 10 DICDRO CC(C)c1cccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001199505420 1048072602 /nfs/dbraw/zinc/07/26/02/1048072602.db2.gz HDUUJZNIKSIRQZ-UHFFFAOYSA-N 1 0 323.484 4.174 20 10 DICDRO CCCOc1ccc(C[NH2+]CCOc2ccccc2C)cc1C ZINC001199629236 1048082322 /nfs/dbraw/zinc/08/23/22/1048082322.db2.gz DLFYLLNISMLSSA-UHFFFAOYSA-N 1 0 313.441 4.261 20 10 DICDRO COc1cccc(C[N@H+](Cc2cccc(C)c2C)C2CC2)c1O ZINC001203601592 1048101659 /nfs/dbraw/zinc/10/16/59/1048101659.db2.gz BTGRDPVNEDZYHA-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)CC(C)(C)C1 ZINC001199831002 1048107818 /nfs/dbraw/zinc/10/78/18/1048107818.db2.gz VRRUSYZGMJQNBM-MAUKXSAKSA-N 1 0 300.490 4.373 20 10 DICDRO FC1(F)CC[C@@H](C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000797467912 1048134022 /nfs/dbraw/zinc/13/40/22/1048134022.db2.gz BVDYFJMINBMDFS-MRXNPFEDSA-N 1 0 308.416 4.202 20 10 DICDRO CCOc1cccc(C[N@H+](CC)Cc2ccc(Cl)cc2)c1O ZINC001203613575 1048155787 /nfs/dbraw/zinc/15/57/87/1048155787.db2.gz AUJTYJANMCYCIM-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO c1ccc(CC2([NH2+]Cc3ccc4c(c3)CCCO4)CCC2)cc1 ZINC001200971285 1048163401 /nfs/dbraw/zinc/16/34/01/1048163401.db2.gz JHYOVXJEPIPQFD-UHFFFAOYSA-N 1 0 307.437 4.267 20 10 DICDRO CCO[C@H](CC[NH2+]Cc1ccc(OC)c(C)c1)C1CCCC1 ZINC001200961566 1048163869 /nfs/dbraw/zinc/16/38/69/1048163869.db2.gz XYCWKFACXJSEES-LJQANCHMSA-N 1 0 305.462 4.079 20 10 DICDRO Clc1oc2ccccc2c1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000776154259 1048237050 /nfs/dbraw/zinc/23/70/50/1048237050.db2.gz QRYYUXXKWAFNMP-UHFFFAOYSA-N 1 0 313.784 4.311 20 10 DICDRO CCCC1(C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC001201380506 1048254905 /nfs/dbraw/zinc/25/49/05/1048254905.db2.gz PUMYXVYKRBZPIZ-UHFFFAOYSA-N 1 0 305.462 4.368 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]C2(c3ccc(F)cc3)CC2)c1O ZINC000776174009 1048269273 /nfs/dbraw/zinc/26/92/73/1048269273.db2.gz WJIMWTALVROFEL-UHFFFAOYSA-N 1 0 305.780 4.272 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2c(O)cccc2Cl)cc1[N+](=O)[O-] ZINC000776222538 1048391484 /nfs/dbraw/zinc/39/14/84/1048391484.db2.gz NZBPODLIZBAMFH-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCC[C@H]2CCCCO2)cc1F ZINC001201911536 1048399089 /nfs/dbraw/zinc/39/90/89/1048399089.db2.gz NSVIEHQMXRDZHV-QGZVFWFLSA-N 1 0 322.468 4.111 20 10 DICDRO COc1ccc(C[NH2+]C[C@H](C)Oc2ccc(Cl)cc2)cc1C ZINC001201980641 1048403843 /nfs/dbraw/zinc/40/38/43/1048403843.db2.gz GGMDMPIAGWZGMG-AWEZNQCLSA-N 1 0 319.832 4.214 20 10 DICDRO CNc1ccccc1N[C@H]1CC2(CC[NH2+]CC2)c2ccc(C)cc21 ZINC001163036476 1048405361 /nfs/dbraw/zinc/40/53/61/1048405361.db2.gz HUVFVUARFUGELZ-FQEVSTJZSA-N 1 0 321.468 4.215 20 10 DICDRO Cc1cccc(C[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)c1O ZINC000776230788 1048413180 /nfs/dbraw/zinc/41/31/80/1048413180.db2.gz MHTTZOJVOVTULY-JSGCOSHPSA-N 1 0 301.352 4.159 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]CC(C)(C)[C@@H]2CCCCO2)c1O ZINC000776247235 1048463718 /nfs/dbraw/zinc/46/37/18/1048463718.db2.gz BDPKRCGLVXOOBF-HNNXBMFYSA-N 1 0 311.853 4.039 20 10 DICDRO Cc1c[nH+]c(N[C@@H]2c3c(c(C)cc(C)c3O)CC2(C)C)c(N)c1 ZINC001163487589 1048477607 /nfs/dbraw/zinc/47/76/07/1048477607.db2.gz POIMETSUHGKTFO-QGZVFWFLSA-N 1 0 311.429 4.030 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c1 ZINC001203678926 1048484293 /nfs/dbraw/zinc/48/42/93/1048484293.db2.gz VLYYHLWLBCMKCF-ZDUSSCGKSA-N 1 0 317.816 4.044 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ccc(OC)c(C)c2)cc1 ZINC001175991864 1048521455 /nfs/dbraw/zinc/52/14/55/1048521455.db2.gz KKQWHMBNWORXIB-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)[C@@H]1CCCOC1 ZINC000780747336 1048590008 /nfs/dbraw/zinc/59/00/08/1048590008.db2.gz XDVIBUVQIUBXGH-YQVWRLOYSA-N 1 0 316.489 4.143 20 10 DICDRO COc1cc(C[NH2+]Cc2cccc(F)c2)c(O)c(C(C)(C)C)c1 ZINC000850021164 1048610301 /nfs/dbraw/zinc/61/03/01/1048610301.db2.gz CBJDLOPCFZXBDQ-UHFFFAOYSA-N 1 0 317.404 4.127 20 10 DICDRO Cc1ccc2cc(C[NH2+]CCCSc3nccs3)[nH]c2c1 ZINC000850146960 1048619527 /nfs/dbraw/zinc/61/95/27/1048619527.db2.gz UNWVPKPWFUNZMM-UHFFFAOYSA-N 1 0 317.483 4.205 20 10 DICDRO COc1cccc(C[NH2+][C@@H](c2ccccc2F)C(C)C)c1O ZINC000850362566 1048638018 /nfs/dbraw/zinc/63/80/18/1048638018.db2.gz PDZDRIKNFNFFSL-QGZVFWFLSA-N 1 0 303.377 4.027 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000850391642 1048646390 /nfs/dbraw/zinc/64/63/90/1048646390.db2.gz VZSDDHVXLFZKHY-UHFFFAOYSA-N 1 0 301.764 4.103 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)cc1C ZINC000850429725 1048654681 /nfs/dbraw/zinc/65/46/81/1048654681.db2.gz HQUFRXCOHHQIAZ-OAHLLOKOSA-N 1 0 311.425 4.179 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1ccc2ccccc2c1O ZINC000850491888 1048670655 /nfs/dbraw/zinc/67/06/55/1048670655.db2.gz BBCZSSGOKFTYBF-ZBFHGGJFSA-N 1 0 312.457 4.069 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)Cc2ccc(F)cc2C)c1O ZINC000850495196 1048671340 /nfs/dbraw/zinc/67/13/40/1048671340.db2.gz YEEFIZNXVMXQQX-ZIAGYGMSSA-N 1 0 317.404 4.130 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2noc3ccccc23)c(O)c1 ZINC000850482868 1048671361 /nfs/dbraw/zinc/67/13/61/1048671361.db2.gz LTDKZLHQSDBYHT-CQSZACIVSA-N 1 0 310.397 4.044 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccnc3ccccc23)c(O)c1 ZINC000850506319 1048672254 /nfs/dbraw/zinc/67/22/54/1048672254.db2.gz INNBXDFSUCKDAH-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO CSCC1(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000850506122 1048672607 /nfs/dbraw/zinc/67/26/07/1048672607.db2.gz FWJHEKFTMMTRKE-YPMHNXCESA-N 1 0 309.450 4.203 20 10 DICDRO CSCC1(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000850506119 1048673330 /nfs/dbraw/zinc/67/33/30/1048673330.db2.gz FWJHEKFTMMTRKE-AAEUAGOBSA-N 1 0 309.450 4.203 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc2c(cc1O)CCCC2 ZINC000850512233 1048674458 /nfs/dbraw/zinc/67/44/58/1048674458.db2.gz YUQOPAVSJYISBH-NEPJUHHUSA-N 1 0 302.443 4.139 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cc(F)ccc1O ZINC000850521642 1048677320 /nfs/dbraw/zinc/67/73/20/1048677320.db2.gz ZVLWZYXSDMVQKF-NSHDSACASA-N 1 0 319.351 4.062 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)COc2c(F)cccc2F)c(O)c1 ZINC000850522382 1048677591 /nfs/dbraw/zinc/67/75/91/1048677591.db2.gz ARUJZUUATVECKG-OLZOCXBDSA-N 1 0 321.367 4.097 20 10 DICDRO C[C@H]([NH2+]CCCOC(C)(C)C)c1ccc2ccccc2c1O ZINC000850526626 1048681183 /nfs/dbraw/zinc/68/11/83/1048681183.db2.gz RFLCHJGHMLSOBD-AWEZNQCLSA-N 1 0 301.430 4.401 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(COC)cs1)c1ccc(N(C)C)cc1 ZINC000850532723 1048684459 /nfs/dbraw/zinc/68/44/59/1048684459.db2.gz OBGCTUALIRCJRD-SFHVURJKSA-N 1 0 318.486 4.201 20 10 DICDRO COCc1csc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000850533406 1048685097 /nfs/dbraw/zinc/68/50/97/1048685097.db2.gz XKSPFCBOVCTSMW-JTQLQIEISA-N 1 0 311.834 4.104 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(O)cc32)c2c1c(F)ccc2O ZINC000850543482 1048686627 /nfs/dbraw/zinc/68/66/27/1048686627.db2.gz KJTWDOICMNULJS-HPEXNQPKSA-N 1 0 313.372 4.062 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)cc1 ZINC000850543627 1048687522 /nfs/dbraw/zinc/68/75/22/1048687522.db2.gz NJSDKLCSZQPXHB-JLTOFOAXSA-N 1 0 310.441 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H](O)C(C)C)c(O)c1 ZINC000850557168 1048690277 /nfs/dbraw/zinc/69/02/77/1048690277.db2.gz UUVWAOSYFPVAAI-BEVDRBHNSA-N 1 0 313.441 4.109 20 10 DICDRO COc1cccc(C2([NH2+][C@@H](C)c3cc(C)ccc3O)CCC2)c1 ZINC000850565977 1048694569 /nfs/dbraw/zinc/69/45/69/1048694569.db2.gz IUXYDKTZDCMQGH-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)c(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000775365746 1048707938 /nfs/dbraw/zinc/70/79/38/1048707938.db2.gz WSIWNBKHUXXRAY-NSHDSACASA-N 1 0 308.347 4.021 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCc3ccccc32)c1 ZINC000775369907 1048713652 /nfs/dbraw/zinc/71/36/52/1048713652.db2.gz BYQPBCFBOSBHBM-HOCLYGCPSA-N 1 0 311.425 4.172 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2csc3ccccc23)c1 ZINC000775373407 1048717109 /nfs/dbraw/zinc/71/71/09/1048717109.db2.gz RXACBBDFBFMFCJ-GFCCVEGCSA-N 1 0 313.422 4.466 20 10 DICDRO COc1ccc(N2CCC[N@@H+]([C@@H]3C=CCCCCC3)CC2)cc1 ZINC001190448112 1048742065 /nfs/dbraw/zinc/74/20/65/1048742065.db2.gz XJCJRUGYBARHBE-GOSISDBHSA-N 1 0 314.473 4.096 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)c1 ZINC001206715510 1048753067 /nfs/dbraw/zinc/75/30/67/1048753067.db2.gz SWXPGLQMQLARSX-UHFFFAOYSA-N 1 0 314.187 4.436 20 10 DICDRO C[C@@H](c1ccccc1)[N@H+](CCOC(F)F)Cc1ccccc1O ZINC000851880279 1048806719 /nfs/dbraw/zinc/80/67/19/1048806719.db2.gz WGESXSNVQPXESX-AWEZNQCLSA-N 1 0 321.367 4.195 20 10 DICDRO CSc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000851950384 1048816043 /nfs/dbraw/zinc/81/60/43/1048816043.db2.gz OEQBFSZRQUVULI-CQSZACIVSA-N 1 0 300.471 4.325 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CCCC2CCCCC2)cc1F ZINC001177249561 1048854809 /nfs/dbraw/zinc/85/48/09/1048854809.db2.gz DCTPNUFHBZCSLB-UHFFFAOYSA-N 1 0 310.432 4.481 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccc2c(c1)CCCO2 ZINC000853094750 1048882336 /nfs/dbraw/zinc/88/23/36/1048882336.db2.gz MQIBXTBUXVBSAZ-GFCCVEGCSA-N 1 0 317.816 4.221 20 10 DICDRO CC[C@@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccc(C)cc1O ZINC000853240168 1048890371 /nfs/dbraw/zinc/89/03/71/1048890371.db2.gz HCEVQBNWBLNBEZ-OAHLLOKOSA-N 1 0 324.346 4.355 20 10 DICDRO CC[C@H](C[NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1 ZINC001177529676 1048908966 /nfs/dbraw/zinc/90/89/66/1048908966.db2.gz STVGSPLTJLRTKM-GOSISDBHSA-N 1 0 308.469 4.352 20 10 DICDRO CC[C@@H](C[NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1 ZINC001177529677 1048909455 /nfs/dbraw/zinc/90/94/55/1048909455.db2.gz STVGSPLTJLRTKM-SFHVURJKSA-N 1 0 308.469 4.352 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC3(CCC3)[C@H]1c1ccncc1)CCC2 ZINC000853629398 1048911869 /nfs/dbraw/zinc/91/18/69/1048911869.db2.gz JLXAWSYBSCPCOY-HXUWFJFHSA-N 1 0 320.436 4.003 20 10 DICDRO CC[C@@H]1C[C@@H](C[N@H+](C)Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000780755537 1048913203 /nfs/dbraw/zinc/91/32/03/1048913203.db2.gz WQRCIGGGLHOMQA-AZUAARDMSA-N 1 0 318.505 4.170 20 10 DICDRO CCCC[C@H]1CCC[C@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177641945 1048921411 /nfs/dbraw/zinc/92/14/11/1048921411.db2.gz PLABDBHATFFCRW-SUMWQHHRSA-N 1 0 310.432 4.479 20 10 DICDRO Cc1ccccc1CC(C)(C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177729593 1048933094 /nfs/dbraw/zinc/93/30/94/1048933094.db2.gz QNFRSTFSAPVFGT-UHFFFAOYSA-N 1 0 309.453 4.431 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c1O ZINC001203609463 1048938758 /nfs/dbraw/zinc/93/87/58/1048938758.db2.gz UPOUEPFNTSOWFM-KRWDZBQOSA-N 1 0 315.388 4.267 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c(O)c1 ZINC001203634776 1048944301 /nfs/dbraw/zinc/94/43/01/1048944301.db2.gz UUKWTWMIBKWXFO-MRXNPFEDSA-N 1 0 319.351 4.016 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c(O)c1 ZINC001203628013 1048944827 /nfs/dbraw/zinc/94/48/27/1048944827.db2.gz VTULENFTBYXQKE-ZDUSSCGKSA-N 1 0 317.816 4.044 20 10 DICDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)c(C)c1 ZINC001177844762 1048954014 /nfs/dbraw/zinc/95/40/14/1048954014.db2.gz VOFWIEFFETWMLV-QGZVFWFLSA-N 1 0 309.453 4.349 20 10 DICDRO CS[C@@H]1CCC[C@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC001177860137 1048955723 /nfs/dbraw/zinc/95/57/23/1048955723.db2.gz RTIQJDJSFUONFX-BGYNLAARSA-N 1 0 304.503 4.030 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccccc1C(F)(F)F ZINC001203693633 1048964237 /nfs/dbraw/zinc/96/42/37/1048964237.db2.gz HIBXQIQHNKMORE-UHFFFAOYSA-N 1 0 309.331 4.433 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCc2c(C)cccc2C)c(Cl)c1 ZINC001178003124 1048973159 /nfs/dbraw/zinc/97/31/59/1048973159.db2.gz KSWIMLBNICPRHI-UHFFFAOYSA-N 1 0 303.833 4.303 20 10 DICDRO Cc1c2ccccc2n(C)c1CNc1ccc2c(c1)C[N@@H+](C)C2 ZINC001178095095 1048988209 /nfs/dbraw/zinc/98/82/09/1048988209.db2.gz ZYWKQAWNHFNICV-UHFFFAOYSA-N 1 0 305.425 4.044 20 10 DICDRO C[C@@H]1COC[C@H]1[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001203769985 1048993113 /nfs/dbraw/zinc/99/31/13/1048993113.db2.gz BFKARQNAAWIXHB-CXAGYDPISA-N 1 0 319.489 4.112 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC2(C)Cc3ccccc3C2)c(Cl)c1 ZINC001178188244 1048995655 /nfs/dbraw/zinc/99/56/55/1048995655.db2.gz QYORUCZXUOAVKF-UHFFFAOYSA-N 1 0 315.844 4.249 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)OCO2)c1cc(Cl)ccc1O ZINC000775483114 1049002843 /nfs/dbraw/zinc/00/28/43/1049002843.db2.gz LHBMUVPOWRWFKP-AWEZNQCLSA-N 1 0 319.788 4.015 20 10 DICDRO CCN(C)c1ccc(C[NH+]2CCC(OCCC(C)C)CC2)cc1 ZINC000773732189 1049003655 /nfs/dbraw/zinc/00/36/55/1049003655.db2.gz ZGYPHPQVFQKFPA-UHFFFAOYSA-N 1 0 318.505 4.170 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCC3(CC3)C2)cc1F ZINC001203829376 1049012236 /nfs/dbraw/zinc/01/22/36/1049012236.db2.gz CMRBACNZGSCKPD-INIZCTEOSA-N 1 0 304.453 4.484 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc2ccccc2n1)c1ccccc1O ZINC000775495849 1049026286 /nfs/dbraw/zinc/02/62/86/1049026286.db2.gz DGPILLZHSBUSOX-GOSISDBHSA-N 1 0 306.409 4.224 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(OC)c(C)c1 ZINC001203898605 1049027231 /nfs/dbraw/zinc/02/72/31/1049027231.db2.gz HSTAELMOWQGGMV-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1C[C@H](OC(C)C)C1(C)C ZINC001178430137 1049028359 /nfs/dbraw/zinc/02/83/59/1049028359.db2.gz AAMGDNSRIFNXFY-OALUTQOASA-N 1 0 314.473 4.168 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@H](OC(C)C)C1(C)C ZINC001178430136 1049029518 /nfs/dbraw/zinc/02/95/18/1049029518.db2.gz AAMGDNSRIFNXFY-MOPGFXCFSA-N 1 0 314.473 4.168 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCOc2ccc(F)cc21)c1ccccc1O ZINC000775496687 1049031053 /nfs/dbraw/zinc/03/10/53/1049031053.db2.gz JBLIDGZAFVXSQP-IRXDYDNUSA-N 1 0 315.388 4.486 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000113315420 1049031438 /nfs/dbraw/zinc/03/14/38/1049031438.db2.gz ZFYKTRBXHYZUNI-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO C[C@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC001178436648 1049031930 /nfs/dbraw/zinc/03/19/30/1049031930.db2.gz ODMMNULWISUVCR-YCRPNKLZSA-N 1 0 307.437 4.425 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)ccc1OC ZINC001178448722 1049033476 /nfs/dbraw/zinc/03/34/76/1049033476.db2.gz ACUUITIEVSMLTA-RLFYNMQTSA-N 1 0 305.462 4.146 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccccc2OC2CCCC2)c1 ZINC000113324287 1049034296 /nfs/dbraw/zinc/03/42/96/1049034296.db2.gz FINBBBDJARZZMA-UHFFFAOYSA-N 1 0 311.425 4.312 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccccc2OC)cc1 ZINC001203939332 1049035285 /nfs/dbraw/zinc/03/52/85/1049035285.db2.gz ORCVBRQRWHOPIU-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)cc1 ZINC001203939400 1049035671 /nfs/dbraw/zinc/03/56/71/1049035671.db2.gz PWDFZOYYJHDOKE-LJQANCHMSA-N 1 0 323.484 4.307 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCN([C@H](C)c2ccccc2)C1)c1ccccc1O ZINC000775499745 1049036509 /nfs/dbraw/zinc/03/65/09/1049036509.db2.gz VECVSRQQVPVPQZ-POAQFYNOSA-N 1 0 324.468 4.268 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CN(C)Cc3ccccc32)cc1C ZINC001178425809 1049037544 /nfs/dbraw/zinc/03/75/44/1049037544.db2.gz IJQJWBGYEYYEMZ-HXUWFJFHSA-N 1 0 324.468 4.060 20 10 DICDRO CCc1nc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)cs1 ZINC000775500915 1049040665 /nfs/dbraw/zinc/04/06/65/1049040665.db2.gz AVRUXXRFDYMKDD-ZDUSSCGKSA-N 1 0 310.850 4.305 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C2CCC2)C2CCOCC2)cc1 ZINC001203945972 1049041717 /nfs/dbraw/zinc/04/17/17/1049041717.db2.gz QPNFSQODGDHYGO-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO CC[C@H]([NH2+]CCCOC1CCCC1)c1cc(Cl)ccc1O ZINC000775500460 1049043306 /nfs/dbraw/zinc/04/33/06/1049043306.db2.gz PNJWNFUOVSIPDO-INIZCTEOSA-N 1 0 311.853 4.436 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775508915 1049049424 /nfs/dbraw/zinc/04/94/24/1049049424.db2.gz YIGHGJWWXQZIJD-XPTSAGLGSA-N 1 0 308.809 4.452 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775508904 1049049616 /nfs/dbraw/zinc/04/96/16/1049049616.db2.gz YIGHGJWWXQZIJD-LKFCYVNXSA-N 1 0 308.809 4.452 20 10 DICDRO CC[C@H]([NH2+]C[C@H](CCO)CC(C)C)c1cc(Cl)ccc1O ZINC000775513592 1049049813 /nfs/dbraw/zinc/04/98/13/1049049813.db2.gz PZHLESWVJKRWQF-CJNGLKHVSA-N 1 0 313.869 4.131 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c2c(n1)CCCC2 ZINC001178524942 1049050185 /nfs/dbraw/zinc/05/01/85/1049050185.db2.gz QXQDZLVHIKJQJE-MRXNPFEDSA-N 1 0 323.484 4.186 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)Cc1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775509403 1049051485 /nfs/dbraw/zinc/05/14/85/1049051485.db2.gz LREXEUVQOQVAPX-MGPLVRAMSA-N 1 0 322.836 4.322 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCCO[C@H]2C1(C)C)c1cc(Cl)ccc1O ZINC000775509627 1049052474 /nfs/dbraw/zinc/05/24/74/1049052474.db2.gz SYCVNZQQPURUOT-JWZBEHFJSA-N 1 0 323.864 4.290 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](CC)c2ccccc2O)C12CCCC2 ZINC000775512517 1049056866 /nfs/dbraw/zinc/05/68/66/1049056866.db2.gz LPCAIRWCDBOMJP-KBAYOESNSA-N 1 0 303.446 4.171 20 10 DICDRO CC[C@H]([NH2+]CCc1nc(C)c(C)s1)c1cc(Cl)ccc1O ZINC000775513112 1049057614 /nfs/dbraw/zinc/05/76/14/1049057614.db2.gz GASUTERXZFNQRN-AWEZNQCLSA-N 1 0 324.877 4.402 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1SCCc2ccccc21)c1ccccc1O ZINC000775512984 1049057950 /nfs/dbraw/zinc/05/79/50/1049057950.db2.gz VHBNPQXKZFYPQK-MJGOQNOKSA-N 1 0 313.466 4.464 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]C2CC(c3ccccc3)C2)cc1F ZINC001178566363 1049062850 /nfs/dbraw/zinc/06/28/50/1049062850.db2.gz ZLSMGZXTJFTIQW-UHFFFAOYSA-N 1 0 316.395 4.067 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)cc1 ZINC000773758850 1049065632 /nfs/dbraw/zinc/06/56/32/1049065632.db2.gz WEVPWIFYEVOBEO-OAQYLSRUSA-N 1 0 324.468 4.106 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)s1 ZINC001204032974 1049066017 /nfs/dbraw/zinc/06/60/17/1049066017.db2.gz AWNKDAJAQFYQHF-UHFFFAOYSA-N 1 0 300.471 4.289 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000775521805 1049078085 /nfs/dbraw/zinc/07/80/85/1049078085.db2.gz BCGNBGSHQCYHNW-UKRRQHHQSA-N 1 0 309.837 4.188 20 10 DICDRO COc1ccc(N2CCC([NH2+]CC(C)(C)C3CCC3)CC2)cc1 ZINC001178736952 1049078533 /nfs/dbraw/zinc/07/85/33/1049078533.db2.gz KXWIYRQRBXQALX-UHFFFAOYSA-N 1 0 316.489 4.080 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C1CCC(OC(F)F)CC1 ZINC001178736633 1049079420 /nfs/dbraw/zinc/07/94/20/1049079420.db2.gz FETFNPSWNRUCFM-UHFFFAOYSA-N 1 0 322.399 4.127 20 10 DICDRO CC(C)(c1ccccc1)C1([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC001178713173 1049079457 /nfs/dbraw/zinc/07/94/57/1049079457.db2.gz KSIZPZJYLOEKHX-UHFFFAOYSA-N 1 0 307.437 4.222 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@]2(C)CC2(Cl)Cl)c(Cl)c1 ZINC001178747296 1049080886 /nfs/dbraw/zinc/08/08/86/1049080886.db2.gz KYIIIBDVKHYMKT-LBPRGKRZSA-N 1 0 308.636 4.028 20 10 DICDRO CCC1([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CC1 ZINC001178768992 1049086626 /nfs/dbraw/zinc/08/66/26/1049086626.db2.gz GXKPCUZYRVMIQP-UHFFFAOYSA-N 1 0 300.471 4.417 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@](C)(CC)c2nccs2)cc1 ZINC000773771095 1049089243 /nfs/dbraw/zinc/08/92/43/1049089243.db2.gz GAFZJBWVENLPRR-QGZVFWFLSA-N 1 0 303.475 4.014 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@](C)(CC)c2nccs2)cc1 ZINC000773771089 1049089435 /nfs/dbraw/zinc/08/94/35/1049089435.db2.gz GAFZJBWVENLPRR-KRWDZBQOSA-N 1 0 303.475 4.014 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)cc(OC)c1)c1cc(Cl)ccc1O ZINC000775526351 1049095216 /nfs/dbraw/zinc/09/52/16/1049095216.db2.gz QYZIMNGCJBOUDB-MRXNPFEDSA-N 1 0 323.795 4.434 20 10 DICDRO CC[C@H]([NH2+][C@@H](CO)C1CCCCC1)c1cc(Cl)ccc1O ZINC000775527686 1049096699 /nfs/dbraw/zinc/09/66/99/1049096699.db2.gz SMVYBSWEISVLDL-HOTGVXAUSA-N 1 0 311.853 4.028 20 10 DICDRO CC[C@H]([NH2+]CC1(CO)CCCCC1)c1cc(Cl)ccc1O ZINC000775527852 1049097916 /nfs/dbraw/zinc/09/79/16/1049097916.db2.gz VFHVRIBYKUPFDL-HNNXBMFYSA-N 1 0 311.853 4.029 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc[nH]1)c1cc(Br)ccc1O ZINC000775527413 1049099453 /nfs/dbraw/zinc/09/94/53/1049099453.db2.gz XJWPZDMCFLOCRO-ZWNOBZJWSA-N 1 0 323.234 4.285 20 10 DICDRO CC[C@H](Cc1ccc(C)cc1)[N@H+](C)Cc1cc(F)ccc1O ZINC001204212505 1049111703 /nfs/dbraw/zinc/11/17/03/1049111703.db2.gz KKNJUELNSPSIQO-GOSISDBHSA-N 1 0 301.405 4.293 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(F)c(F)c1 ZINC001204226727 1049113482 /nfs/dbraw/zinc/11/34/82/1049113482.db2.gz MTFJLSSFYVYEGA-UHFFFAOYSA-N 1 0 304.384 4.053 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(F)(F)CC2)c2ccccc21 ZINC001204232464 1049116387 /nfs/dbraw/zinc/11/63/87/1049116387.db2.gz FDWWRUZGPJKMJO-UHFFFAOYSA-N 1 0 304.384 4.137 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c2ccccc21 ZINC001204242173 1049118184 /nfs/dbraw/zinc/11/81/84/1049118184.db2.gz LUVGDXVMPSTFDF-AWEZNQCLSA-N 1 0 322.374 4.290 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCc3occc3C2)c2ccccc21 ZINC001204239639 1049118957 /nfs/dbraw/zinc/11/89/57/1049118957.db2.gz AYFAVPYZYWFMLB-UHFFFAOYSA-N 1 0 306.409 4.057 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c2ccccc21 ZINC001204243384 1049120830 /nfs/dbraw/zinc/12/08/30/1049120830.db2.gz YUOZASNAFCVTLV-GOSISDBHSA-N 1 0 316.395 4.137 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](Cc2ccccc2)C2CC2)cc1 ZINC001192606155 1049121831 /nfs/dbraw/zinc/12/18/31/1049121831.db2.gz ZTOBMTDYYLPQSP-NRFANRHFSA-N 1 0 308.469 4.254 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000857081709 1049125782 /nfs/dbraw/zinc/12/57/82/1049125782.db2.gz QNXIJJILGSCAHP-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000857081198 1049125998 /nfs/dbraw/zinc/12/59/98/1049125998.db2.gz NCHYMPQUNYGAGP-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2ccc(O)cc2O)cc1C ZINC001204278133 1049126421 /nfs/dbraw/zinc/12/64/21/1049126421.db2.gz VKDQQRZPMKCNJC-IBGZPJMESA-N 1 0 311.425 4.442 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)c(O)c1C ZINC000857083612 1049127085 /nfs/dbraw/zinc/12/70/85/1049127085.db2.gz YGZXAQAOSJDVNY-NEPJUHHUSA-N 1 0 302.245 4.244 20 10 DICDRO CC[C@@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccccc1O ZINC000775548400 1049140209 /nfs/dbraw/zinc/14/02/09/1049140209.db2.gz YPXVCPBKLYHIAP-QGZVFWFLSA-N 1 0 302.393 4.156 20 10 DICDRO COCC[N@H+](Cc1ccc(Cl)cc1O)[C@H](C)c1ccccc1 ZINC001204315251 1049140870 /nfs/dbraw/zinc/14/08/70/1049140870.db2.gz TZKMVJMCAOMZRL-CQSZACIVSA-N 1 0 319.832 4.255 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2CCC(OC(C)C)CC2)cc1 ZINC001179211117 1049141606 /nfs/dbraw/zinc/14/16/06/1049141606.db2.gz TUBFZNNGCFHTAV-UHFFFAOYSA-N 1 0 318.505 4.359 20 10 DICDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(N3CCCC3)cc2)cn1 ZINC001204328321 1049141769 /nfs/dbraw/zinc/14/17/69/1049141769.db2.gz HDASZFOLRWSUSM-NRFANRHFSA-N 1 0 321.468 4.327 20 10 DICDRO FC1CC2(C1)CCC[N@H+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001204321607 1049141778 /nfs/dbraw/zinc/14/17/78/1049141778.db2.gz JECODSSPCAAQEX-UHFFFAOYSA-N 1 0 316.464 4.391 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@H]1CCc2ccccc21 ZINC001204329054 1049142234 /nfs/dbraw/zinc/14/22/34/1049142234.db2.gz DJZQROZUTDNLQJ-NRFANRHFSA-N 1 0 306.453 4.406 20 10 DICDRO Cc1cccc2c1CC[N@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001204323174 1049142854 /nfs/dbraw/zinc/14/28/54/1049142854.db2.gz FMZKYHZGVUIMLF-UHFFFAOYSA-N 1 0 306.453 4.154 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cccc(OC)c1 ZINC001204321047 1049142943 /nfs/dbraw/zinc/14/29/43/1049142943.db2.gz FNFDNOWBRXJANW-UHFFFAOYSA-N 1 0 324.468 4.318 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](OC)C2CCCC2)cc1C ZINC001179243870 1049147139 /nfs/dbraw/zinc/14/71/39/1049147139.db2.gz UXPVHDXHNWAFLS-LJQANCHMSA-N 1 0 305.462 4.079 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C1CCC(F)CC1 ZINC001179259139 1049148994 /nfs/dbraw/zinc/14/89/94/1049148994.db2.gz ROORXEDPUBGHHU-LKSINWNRSA-N 1 0 314.395 4.037 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2cccc(F)c2F)cc1 ZINC000773809951 1049150805 /nfs/dbraw/zinc/15/08/05/1049150805.db2.gz FGVBUMGKIIQMBS-CYBMUJFWSA-N 1 0 304.384 4.272 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C2CCC2)[C@H]2CCOC2)cc1C ZINC001179390612 1049162968 /nfs/dbraw/zinc/16/29/68/1049162968.db2.gz KVNSFPSWKPMGRC-AZUAARDMSA-N 1 0 317.473 4.079 20 10 DICDRO [O-]c1cc(F)c(F)cc1C[N@@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001204460165 1049166632 /nfs/dbraw/zinc/16/66/32/1049166632.db2.gz JUPMCQDVNCVYDV-OAHLLOKOSA-N 1 0 317.379 4.125 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2([C@@H]3CCCCO3)CCC2)cc1 ZINC001179425438 1049166904 /nfs/dbraw/zinc/16/69/04/1049166904.db2.gz FYVYLNAEQNUPQB-IBGZPJMESA-N 1 0 316.489 4.114 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc(N(C)CC)cc2)c1 ZINC000773815205 1049168498 /nfs/dbraw/zinc/16/84/98/1049168498.db2.gz ZZMSXCARLBNRFW-INIZCTEOSA-N 1 0 312.457 4.392 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@@]2(C)CC2(C)C)c(C(F)(F)F)c1 ZINC001179468437 1049168534 /nfs/dbraw/zinc/16/85/34/1049168534.db2.gz BNXOWUPCSTVASW-MRXNPFEDSA-N 1 0 314.395 4.297 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](c2cccs2)C2CC2)cc1 ZINC000773816211 1049171908 /nfs/dbraw/zinc/17/19/08/1049171908.db2.gz DSFDZMOPCJJNHU-SFHVURJKSA-N 1 0 300.471 4.445 20 10 DICDRO Cc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(C)n1 ZINC000775571545 1049182146 /nfs/dbraw/zinc/18/21/46/1049182146.db2.gz IFVYSPZLUCGZTI-UHFFFAOYSA-N 1 0 311.473 4.175 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)C2CCCCCC2)c1O ZINC001193252195 1049192089 /nfs/dbraw/zinc/19/20/89/1049192089.db2.gz XUFJLRUIBPUVAT-LBPRGKRZSA-N 1 0 307.409 4.182 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCOC12CCCCC2 ZINC001179717084 1049198642 /nfs/dbraw/zinc/19/86/42/1049198642.db2.gz NIJIDCKSCAAFAE-IBGZPJMESA-N 1 0 312.457 4.068 20 10 DICDRO c1ccc(C[C@@H]2C[C@H]2CC[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001179728552 1049199657 /nfs/dbraw/zinc/19/96/57/1049199657.db2.gz HAXWHSYLIZRYKY-TZIWHRDSSA-N 1 0 321.464 4.370 20 10 DICDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2ccc(C)cc2O)C12CCCCC2 ZINC001204616371 1049200462 /nfs/dbraw/zinc/20/04/62/1049200462.db2.gz VJTKKKCXZZPTJB-MOPGFXCFSA-N 1 0 317.473 4.260 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)CC)cc1)c1ccc(OC)cc1 ZINC000773825984 1049205268 /nfs/dbraw/zinc/20/52/68/1049205268.db2.gz YHAZPRJDFILVPW-FQEVSTJZSA-N 1 0 312.457 4.392 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCOCC23CCCC3)cc1C ZINC001179810202 1049209775 /nfs/dbraw/zinc/20/97/75/1049209775.db2.gz LWZSWGUPBULPPN-IBGZPJMESA-N 1 0 317.473 4.223 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H](c2ccccn2)C2CCC2)cc1 ZINC000858239610 1049229284 /nfs/dbraw/zinc/22/92/84/1049229284.db2.gz UVBRTESNPTYUKZ-IRUYWQDXSA-N 1 0 321.468 4.292 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C(F)(F)F)s2)c1 ZINC000858240028 1049229353 /nfs/dbraw/zinc/22/93/53/1049229353.db2.gz ZASJMHHSFPYLQJ-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cc(F)cc(C(F)(F)F)c2)c1 ZINC000858238162 1049229469 /nfs/dbraw/zinc/22/94/69/1049229469.db2.gz WNNYWEOJAPOFAC-UHFFFAOYSA-N 1 0 313.294 4.148 20 10 DICDRO COc1ccc(N2CCC([NH2+]CC[C@@H]3CC=CCC3)CC2)cc1 ZINC000858272876 1049234924 /nfs/dbraw/zinc/23/49/24/1049234924.db2.gz WITPQZBHJPOBAT-QGZVFWFLSA-N 1 0 314.473 4.000 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000858276215 1049235704 /nfs/dbraw/zinc/23/57/04/1049235704.db2.gz SKWSSUOMRNEOFP-SJLPKXTDSA-N 1 0 311.425 4.375 20 10 DICDRO Cn1ccc2c1cc[nH+]c2-c1ccc(OCc2ccccc2)nc1 ZINC001204725022 1049242253 /nfs/dbraw/zinc/24/22/53/1049242253.db2.gz GQRLQFCVAYFVHC-UHFFFAOYSA-N 1 0 315.376 4.214 20 10 DICDRO CC(C)CC[N@H+](Cc1c(O)cccc1Br)C1CC1 ZINC001179984684 1049242820 /nfs/dbraw/zinc/24/28/20/1049242820.db2.gz SZXYXSMNJMGUHO-UHFFFAOYSA-N 1 0 312.251 4.165 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)CCc2cccc3ccccc32)c1 ZINC001179988464 1049245369 /nfs/dbraw/zinc/24/53/69/1049245369.db2.gz DYNFCPKURRSJLA-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1ccc(OC)cc1CC ZINC001204757071 1049254998 /nfs/dbraw/zinc/25/49/98/1049254998.db2.gz RDYPSLVCQRDSGP-UHFFFAOYSA-N 1 0 313.441 4.375 20 10 DICDRO Cc1csc([C@H](C)[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)n1 ZINC000858426837 1049256221 /nfs/dbraw/zinc/25/62/21/1049256221.db2.gz UFMASLXOKZBGFI-ZFWWWQNUSA-N 1 0 317.502 4.108 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1O ZINC000858583110 1049282848 /nfs/dbraw/zinc/28/28/48/1049282848.db2.gz WWRYJHLCJMUPQU-BDJLRTHQSA-N 1 0 317.816 4.392 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1(c2nccs2)CCCC1 ZINC000116374545 1049297650 /nfs/dbraw/zinc/29/76/50/1049297650.db2.gz QVHMDCAISLKFAS-UHFFFAOYSA-N 1 0 308.834 4.061 20 10 DICDRO CCC[C@]1(C)CCC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001180203159 1049306824 /nfs/dbraw/zinc/30/68/24/1049306824.db2.gz KZVQBVRSNDAYCQ-GOSISDBHSA-N 1 0 310.432 4.433 20 10 DICDRO CC1(C)CC[C@H](C[N@H+](Cc2ccccc2O)C2CCCC2)O1 ZINC000775601727 1049320766 /nfs/dbraw/zinc/32/07/66/1049320766.db2.gz XQAPOWFSEBPVTJ-QGZVFWFLSA-N 1 0 303.446 4.094 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)C[C@H](C)c2nccs2)c1 ZINC001180304761 1049327421 /nfs/dbraw/zinc/32/74/21/1049327421.db2.gz AQTIDNHFLYFSRC-ZDUSSCGKSA-N 1 0 304.459 4.208 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccc2c(n1)CCC2)C1CCCC1 ZINC001180292795 1049337971 /nfs/dbraw/zinc/33/79/71/1049337971.db2.gz PKUHPFWCDVLGGK-UHFFFAOYSA-N 1 0 322.452 4.221 20 10 DICDRO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2cc(C(C)C)ccc2O)CCO1 ZINC001180326686 1049344873 /nfs/dbraw/zinc/34/48/73/1049344873.db2.gz OUMRUHNQRFXFAI-ROUUACIJSA-N 1 0 305.462 4.199 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1c2ccccc2CC[C@@H]1C ZINC001180326739 1049345049 /nfs/dbraw/zinc/34/50/49/1049345049.db2.gz PWZHKGDQKQZMDZ-BTYIYWSLSA-N 1 0 308.469 4.474 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@]2(C)CCCS2)cc1 ZINC001205023649 1049346599 /nfs/dbraw/zinc/34/65/99/1049346599.db2.gz FZBATZADOZONBI-SFHVURJKSA-N 1 0 306.519 4.250 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)cc1F ZINC001205081783 1049369476 /nfs/dbraw/zinc/36/94/76/1049369476.db2.gz KVZXPLLEJZNKAV-KBPBESRZSA-N 1 0 308.416 4.043 20 10 DICDRO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2cc(C(C)C)ccc2O)C1(C)C ZINC001205268928 1049421687 /nfs/dbraw/zinc/42/16/87/1049421687.db2.gz BUOALRQAPZUKLR-ZWKOTPCHSA-N 1 0 305.462 4.197 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cc1Cl ZINC001205292023 1049429086 /nfs/dbraw/zinc/42/90/86/1049429086.db2.gz VKZCSZAZYUCAGU-SJCJKPOMSA-N 1 0 316.832 4.332 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]CCCCCc1ccc(F)cc1 ZINC001181053459 1049431577 /nfs/dbraw/zinc/43/15/77/1049431577.db2.gz BFRMCTFENRVJBM-UHFFFAOYSA-N 1 0 305.368 4.173 20 10 DICDRO Oc1c(C[N@@H+]2CCc3cc(F)ccc3C2)ccc2ccccc21 ZINC001205380175 1049453688 /nfs/dbraw/zinc/45/36/88/1049453688.db2.gz OZUAPFDYGLWWTG-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)cc1Cl ZINC001181350747 1049466580 /nfs/dbraw/zinc/46/65/80/1049466580.db2.gz UOCXMOMJNYXVPM-MWLCHTKSSA-N 1 0 307.743 4.127 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)c1O ZINC000775633285 1049471100 /nfs/dbraw/zinc/47/11/00/1049471100.db2.gz HOTKUHRBIOHMMA-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CCCN(C[C@@H](C)c1cc(F)cc(F)c1)c1ccc(C[NH3+])cc1 ZINC001181444911 1049476869 /nfs/dbraw/zinc/47/68/69/1049476869.db2.gz ICJJJOUJLRJSGH-CQSZACIVSA-N 1 0 318.411 4.444 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)C1CC(F)(F)C1 ZINC000862394184 1049492099 /nfs/dbraw/zinc/49/20/99/1049492099.db2.gz DBXOQKROCLZODJ-UONOGXRCSA-N 1 0 310.432 4.015 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2CCC(OC3CCCC3)CC2)c1 ZINC000862478184 1049496199 /nfs/dbraw/zinc/49/61/99/1049496199.db2.gz DOSATWWQWMMQHE-UHFFFAOYSA-N 1 0 303.446 4.061 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2ccccc2C(F)(F)F)c1O ZINC000775647979 1049499413 /nfs/dbraw/zinc/49/94/13/1049499413.db2.gz KXPPXJBIBQAJNB-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)c2cccc(Cl)c2)c1 ZINC000775649039 1049507765 /nfs/dbraw/zinc/50/77/65/1049507765.db2.gz JVVPNVBSOQRNCR-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO Cc1cc(C[N@H+]2C[C@H](C)[C@H](C)[C@H]2C)ccc1N1CCCCC1 ZINC001195288730 1049510172 /nfs/dbraw/zinc/51/01/72/1049510172.db2.gz GSVHEMRGKCFJJB-OKZBNKHCSA-N 1 0 300.490 4.462 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC000775652222 1049514683 /nfs/dbraw/zinc/51/46/83/1049514683.db2.gz VLHMSEIJXCWQIT-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)Cc1cccc(C)c1O ZINC000775652274 1049519935 /nfs/dbraw/zinc/51/99/35/1049519935.db2.gz WXIXGDOQVXBPRY-IBGZPJMESA-N 1 0 311.425 4.219 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C(C)(C)c2cccc(Cl)c2)c1 ZINC000119370481 1049552110 /nfs/dbraw/zinc/55/21/10/1049552110.db2.gz QFPSCLJSYNXNMN-UHFFFAOYSA-N 1 0 319.832 4.469 20 10 DICDRO CC(C)[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)[C@H]1C(C)C ZINC001205788748 1049564079 /nfs/dbraw/zinc/56/40/79/1049564079.db2.gz GBQLCFKCKPFZHB-RLFQVEEXSA-N 1 0 300.490 4.378 20 10 DICDRO COc1cc(C)c(C[NH2+]CCc2ccc(Cl)c(C)c2)c(O)c1 ZINC001182055032 1049566834 /nfs/dbraw/zinc/56/68/34/1049566834.db2.gz XKZBZYFPKCAGQX-UHFFFAOYSA-N 1 0 319.832 4.003 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]C1(Cc2cccc(Cl)c2)CC1 ZINC001205831408 1049578779 /nfs/dbraw/zinc/57/87/79/1049578779.db2.gz IMRCIZNLBUNYMV-UHFFFAOYSA-N 1 0 305.780 4.050 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC000119590602 1049588715 /nfs/dbraw/zinc/58/87/15/1049588715.db2.gz YTWDBKBHBSONRB-SFHVURJKSA-N 1 0 304.384 4.272 20 10 DICDRO C[N@H+](Cc1cc(F)c(F)cc1[O-])[C@H]1CCC[C@@H]1c1ccccc1 ZINC001182273013 1049598968 /nfs/dbraw/zinc/59/89/68/1049598968.db2.gz YUOKYJMHKAKDSD-QAPCUYQASA-N 1 0 317.379 4.439 20 10 DICDRO C[N@H+](Cc1cc(F)c(F)cc1[O-])[C@@H]1CCC[C@H]1c1ccccc1 ZINC001182273012 1049599446 /nfs/dbraw/zinc/59/94/46/1049599446.db2.gz YUOKYJMHKAKDSD-MAUKXSAKSA-N 1 0 317.379 4.439 20 10 DICDRO c1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000163591409 1049604992 /nfs/dbraw/zinc/60/49/92/1049604992.db2.gz AEFBPIRIQSEMBU-HXUWFJFHSA-N 1 0 324.493 4.017 20 10 DICDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)cc(C)c2O)n1 ZINC000775697355 1049630333 /nfs/dbraw/zinc/63/03/33/1049630333.db2.gz AIEUOWPQNBWVPI-QGZVFWFLSA-N 1 0 316.832 4.395 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)c1 ZINC000775706354 1049636904 /nfs/dbraw/zinc/63/69/04/1049636904.db2.gz OVCWAKCEDXWENZ-ACJLOTCBSA-N 1 0 315.388 4.123 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@@]12C[C@@H]1CCCC2 ZINC000864052928 1049639043 /nfs/dbraw/zinc/63/90/43/1049639043.db2.gz DETHPOAVGGGRCK-XAYKYTGQSA-N 1 0 308.416 4.089 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC(C)(C)C[C@@H]1C ZINC001182423747 1049642048 /nfs/dbraw/zinc/64/20/48/1049642048.db2.gz INPVTMMSLWFRGR-TXPKVOOTSA-N 1 0 302.506 4.406 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCCN1C1CC1)c1ccc2ccccc2c1O ZINC000774380799 1049653675 /nfs/dbraw/zinc/65/36/75/1049653675.db2.gz UJISLVFGITVKBW-CRAIPNDOSA-N 1 0 324.468 4.213 20 10 DICDRO CC(C)[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccnc1 ZINC000774383158 1049655172 /nfs/dbraw/zinc/65/51/72/1049655172.db2.gz GGPGKELUVJSQAB-FQEVSTJZSA-N 1 0 309.457 4.169 20 10 DICDRO COCC1(C[NH2+]Cc2ccc3ccccc3c2O)CCCCC1 ZINC001206108977 1049655516 /nfs/dbraw/zinc/65/55/16/1049655516.db2.gz MECMZITYBAXGQG-UHFFFAOYSA-N 1 0 313.441 4.232 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CC(C)(C)[C@H]2C2CC2)c1O ZINC001206116362 1049657224 /nfs/dbraw/zinc/65/72/24/1049657224.db2.gz NSDSBKQUGNOCNE-OAHLLOKOSA-N 1 0 324.262 4.084 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@H](C(C)(C)C)C[C@H]2C)c(O)c1OC ZINC001206116397 1049657940 /nfs/dbraw/zinc/65/79/40/1049657940.db2.gz OEHLKAGZVHPEAK-HIFRSBDPSA-N 1 0 321.461 4.056 20 10 DICDRO c1csc(SCCC[NH2+][C@H](c2ccccc2)C2CC2)n1 ZINC000774420037 1049659874 /nfs/dbraw/zinc/65/98/74/1049659874.db2.gz AYOMKLBTYMFNNV-OAHLLOKOSA-N 1 0 304.484 4.366 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cc1 ZINC000774441673 1049662768 /nfs/dbraw/zinc/66/27/68/1049662768.db2.gz KCQUGEHDSFIVMA-INIZCTEOSA-N 1 0 323.484 4.267 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@H](CSc3ccccc3)C2)c1O ZINC000775722823 1049666676 /nfs/dbraw/zinc/66/66/76/1049666676.db2.gz DKUSMKZOQDMYKQ-INIZCTEOSA-N 1 0 313.466 4.315 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)c1O ZINC000775734120 1049676727 /nfs/dbraw/zinc/67/67/27/1049676727.db2.gz LAFNGRWRARURDP-HNNXBMFYSA-N 1 0 317.816 4.007 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCN(Cc2ccccc2)C1)c1ccc(C)cc1O ZINC000794795503 1049695095 /nfs/dbraw/zinc/69/50/95/1049695095.db2.gz PWQMGNVPBNYNCA-UYAOXDASSA-N 1 0 324.468 4.016 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)Oc1ccccc1F)c1ccc(C)cc1O ZINC000794799953 1049696205 /nfs/dbraw/zinc/69/62/05/1049696205.db2.gz APWPCVUIXNDNKD-RHSMWYFYSA-N 1 0 317.404 4.348 20 10 DICDRO CC[C@H]([NH2+]CCc1nc2c(cccc2C)o1)c1ccc(C)cc1O ZINC000794800039 1049697194 /nfs/dbraw/zinc/69/71/94/1049697194.db2.gz BJSDFCIRSCGYBX-INIZCTEOSA-N 1 0 324.424 4.434 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)N1CCCCC1)c1ccc(C)cc1O ZINC000794792883 1049698470 /nfs/dbraw/zinc/69/84/70/1049698470.db2.gz GUBZTRIBYVSWCF-QGZVFWFLSA-N 1 0 304.478 4.006 20 10 DICDRO CC[C@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(C)cc1O ZINC000794795507 1049698776 /nfs/dbraw/zinc/69/87/76/1049698776.db2.gz PXBFHKQWFKCPJD-SFHVURJKSA-N 1 0 308.425 4.465 20 10 DICDRO CC[C@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1ccc(C)cc1O ZINC000794794324 1049699318 /nfs/dbraw/zinc/69/93/18/1049699318.db2.gz LSVGKZDTTUOMLK-JKSUJKDBSA-N 1 0 318.486 4.106 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]C1(c2ccccc2Cl)CCC1 ZINC001182693550 1049700651 /nfs/dbraw/zinc/70/06/51/1049700651.db2.gz JLFRMHKZDVTFSL-UHFFFAOYSA-N 1 0 305.780 4.354 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)Cc2coc3ccccc23)cc1 ZINC001182726301 1049708989 /nfs/dbraw/zinc/70/89/89/1049708989.db2.gz QOGVPVMATXBBCZ-UHFFFAOYSA-N 1 0 324.424 4.010 20 10 DICDRO CCc1cccc(C[NH2+][C@](C)(Cc2ccccc2)C2CC2)c1O ZINC001206314896 1049710044 /nfs/dbraw/zinc/71/00/44/1049710044.db2.gz UOYZCQMJWLPTQL-OAQYLSRUSA-N 1 0 309.453 4.456 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1 ZINC001206319989 1049711796 /nfs/dbraw/zinc/71/17/96/1049711796.db2.gz GHCZVOOWEWNTQH-SLUIBLPYSA-N 1 0 300.490 4.016 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Cl)c2cccnc12)c1ccccc1O ZINC001197004413 1049713267 /nfs/dbraw/zinc/71/32/67/1049713267.db2.gz QVZDDJWMAPWDTA-LBPRGKRZSA-N 1 0 312.800 4.445 20 10 DICDRO COc1cc(C)c(C[NH+]2CCC3(CCCCC3)CC2)c(O)c1 ZINC001206590090 1049763706 /nfs/dbraw/zinc/76/37/06/1049763706.db2.gz INXIQEOVMFHNBJ-UHFFFAOYSA-N 1 0 303.446 4.256 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+]C[C@@H](C)C3CCCCC3)C2)cc1 ZINC001206645105 1049774658 /nfs/dbraw/zinc/77/46/58/1049774658.db2.gz LVVZUISHYKTZEW-AEFFLSMTSA-N 1 0 316.489 4.080 20 10 DICDRO C/C=C/C[C@H]1CCC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001206999001 1049819424 /nfs/dbraw/zinc/81/94/24/1049819424.db2.gz BSMBGLGEBJAEJD-NNTXTVRGSA-N 1 0 308.416 4.209 20 10 DICDRO C/C=C\C[C@@H]1CCC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001206999003 1049819967 /nfs/dbraw/zinc/81/99/67/1049819967.db2.gz BSMBGLGEBJAEJD-ZRUQZJFASA-N 1 0 308.416 4.209 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]Cc1csc(C(F)(F)F)c1 ZINC001207026638 1049822134 /nfs/dbraw/zinc/82/21/34/1049822134.db2.gz SVPOHCKBSXNTCN-UHFFFAOYSA-N 1 0 321.751 4.416 20 10 DICDRO Oc1cccc2c1C[N@H+](CCCc1cccc(Cl)c1)CC2 ZINC001207593645 1049914174 /nfs/dbraw/zinc/91/41/74/1049914174.db2.gz KQKXRVUNUSNCTN-UHFFFAOYSA-N 1 0 301.817 4.037 20 10 DICDRO Cc1cc(F)c(C[NH2+]Cc2ccc3ccccc3c2O)c(F)c1 ZINC001207655345 1049921867 /nfs/dbraw/zinc/92/18/67/1049921867.db2.gz UAKGUFIXEAYWGO-UHFFFAOYSA-N 1 0 313.347 4.422 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000760712191 1050004044 /nfs/dbraw/zinc/00/40/44/1050004044.db2.gz CSOMZRWJYWDDPG-SFHLNBCPSA-N 1 0 323.436 4.106 20 10 DICDRO CC[C@@H]([NH2+]CCc1csc(C(C)(C)C)n1)c1ccccc1O ZINC000156985414 1050035052 /nfs/dbraw/zinc/03/50/52/1050035052.db2.gz GIVPEKOUXDRFKD-OAHLLOKOSA-N 1 0 318.486 4.430 20 10 DICDRO C[C@@H]([NH2+]CCC(F)(F)F)c1ccc(N2CCCCC2)cc1 ZINC000165467998 1050051553 /nfs/dbraw/zinc/05/15/53/1050051553.db2.gz NHQGEUOHCWYGFO-CYBMUJFWSA-N 1 0 300.368 4.280 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)cc1 ZINC001209516445 1050064611 /nfs/dbraw/zinc/06/46/11/1050064611.db2.gz GTAHLCBOEKTNHX-FPOVZHCZSA-N 1 0 324.468 4.095 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@]3(C2)CCCCO3)cc1 ZINC001209516659 1050065278 /nfs/dbraw/zinc/06/52/78/1050065278.db2.gz LFVOGHPHPDWVJU-NRFANRHFSA-N 1 0 324.468 4.239 20 10 DICDRO CO[C@@H]1CC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)[C@@H](C)C1 ZINC001209519698 1050066220 /nfs/dbraw/zinc/06/62/20/1050066220.db2.gz FRULZFSNGDXZMP-FXAWDEMLSA-N 1 0 312.457 4.093 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCc3cnccc3C2)cc1 ZINC001209517208 1050066244 /nfs/dbraw/zinc/06/62/44/1050066244.db2.gz AXNHKGXESPFYPC-UHFFFAOYSA-N 1 0 317.436 4.047 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000770509525 1050163156 /nfs/dbraw/zinc/16/31/56/1050163156.db2.gz CTWCVMUTQLYFJG-INIZCTEOSA-N 1 0 319.857 4.336 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000770510026 1050163210 /nfs/dbraw/zinc/16/32/10/1050163210.db2.gz VQBHGAHCWWIQHD-XLIONFOSSA-N 1 0 324.468 4.050 20 10 DICDRO CSCC1CCC([NH2+]CCCSc2nccs2)CC1 ZINC000823937933 1050169813 /nfs/dbraw/zinc/16/98/13/1050169813.db2.gz NRJXMOLDRBRMQE-UHFFFAOYSA-N 1 0 316.561 4.137 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000770747881 1050192362 /nfs/dbraw/zinc/19/23/62/1050192362.db2.gz RGZJIOSWNPILJY-LIRRHRJNSA-N 1 0 317.404 4.014 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1CSc2ccccc21 ZINC000824484047 1050212919 /nfs/dbraw/zinc/21/29/19/1050212919.db2.gz YVDBAOSEACJPHJ-GFCCVEGCSA-N 1 0 305.830 4.025 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C[C@H]1CSc2ccccc21 ZINC000824483086 1050213359 /nfs/dbraw/zinc/21/33/59/1050213359.db2.gz HLCVZZUPYZBEOL-NSHDSACASA-N 1 0 305.830 4.025 20 10 DICDRO CC[C@@H]([NH2+]CCC(C)(F)F)c1ccc(C(F)(F)F)cc1O ZINC000824483246 1050213501 /nfs/dbraw/zinc/21/35/01/1050213501.db2.gz KFQYLINKZWJWDX-LLVKDONJSA-N 1 0 311.294 4.497 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3c(F)cccc32)c1 ZINC000824468185 1050215117 /nfs/dbraw/zinc/21/51/17/1050215117.db2.gz FKMDWHSKLNUAIM-SGTLLEGYSA-N 1 0 315.388 4.268 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3c(F)cccc32)c1 ZINC000824468183 1050216031 /nfs/dbraw/zinc/21/60/31/1050216031.db2.gz FKMDWHSKLNUAIM-KPZWWZAWSA-N 1 0 315.388 4.268 20 10 DICDRO Fc1cc(F)c2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCO3)CCC2 ZINC000824468762 1050217595 /nfs/dbraw/zinc/21/75/95/1050217595.db2.gz NMAJYJHDLYUSDG-GOSISDBHSA-N 1 0 315.363 4.067 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccnc(C)c1)c1ccc(C(F)(F)F)cc1O ZINC000824596051 1050227807 /nfs/dbraw/zinc/22/78/07/1050227807.db2.gz FRAABMSTMVYIIG-OAHLLOKOSA-N 1 0 324.346 4.355 20 10 DICDRO Oc1ccccc1C[N@H+](C/C=C\c1ccccc1)C[C@H]1CCCO1 ZINC000734148927 1050232625 /nfs/dbraw/zinc/23/26/25/1050232625.db2.gz QOVYRKIDVADSCU-ATYVUACHSA-N 1 0 323.436 4.087 20 10 DICDRO Oc1ccccc1C[NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000824696213 1050233979 /nfs/dbraw/zinc/23/39/79/1050233979.db2.gz IJAWPZIPFHMLTH-KRWDZBQOSA-N 1 0 305.780 4.426 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCC[C@H]2CCCCO2)c2c1c(F)ccc2O ZINC000760907903 1050239467 /nfs/dbraw/zinc/23/94/67/1050239467.db2.gz UUBGECOQZFYKST-UMVBOHGHSA-N 1 0 307.409 4.019 20 10 DICDRO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000824798521 1050244476 /nfs/dbraw/zinc/24/44/76/1050244476.db2.gz DCPCMQFCVQGFTK-KXBFYZLASA-N 1 0 313.441 4.086 20 10 DICDRO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000824798385 1050245202 /nfs/dbraw/zinc/24/52/02/1050245202.db2.gz DCPCMQFCVQGFTK-BEFAXECRSA-N 1 0 313.441 4.086 20 10 DICDRO Cc1cccnc1CCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000824783222 1050246620 /nfs/dbraw/zinc/24/66/20/1050246620.db2.gz HRGOOTIYSPFPNC-UHFFFAOYSA-N 1 0 323.484 4.103 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)c2nccn21 ZINC000825017099 1050268829 /nfs/dbraw/zinc/26/88/29/1050268829.db2.gz LLXYNXKOMTUXQI-KDOFPFPSSA-N 1 0 319.408 4.051 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1O ZINC000825104087 1050270028 /nfs/dbraw/zinc/27/00/28/1050270028.db2.gz MRRTYNLUWZWTJF-SFHVURJKSA-N 1 0 313.397 4.111 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@H](c2cccc(OC)c2)C1)c1ccccc1O ZINC000825090850 1050277160 /nfs/dbraw/zinc/27/71/60/1050277160.db2.gz KLSIBOQAMFNIQO-BXWFABGCSA-N 1 0 311.425 4.388 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCN(C)c2ccccc21)c1ccccc1O ZINC000825117687 1050277441 /nfs/dbraw/zinc/27/74/41/1050277441.db2.gz JRKHGCMLQTXKNA-QZTJIDSGSA-N 1 0 310.441 4.404 20 10 DICDRO COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000747099751 1050278843 /nfs/dbraw/zinc/27/88/43/1050278843.db2.gz KMKNTTMFFDFDKX-CVEARBPZSA-N 1 0 312.457 4.043 20 10 DICDRO CCOc1ccccc1C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825130846 1050279818 /nfs/dbraw/zinc/27/98/18/1050279818.db2.gz GZYQCKSGAHNQFY-UHFFFAOYSA-N 1 0 305.805 4.043 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H](c2ccccc2)C2CCOCC2)cc1 ZINC000734509091 1050279997 /nfs/dbraw/zinc/27/99/97/1050279997.db2.gz GWEKGUVQFGUAKM-NRFANRHFSA-N 1 0 324.468 4.010 20 10 DICDRO C[C@@H](CCc1cccc(F)c1)[NH2+]Cc1cc(Cl)ccc1O ZINC000734510693 1050280831 /nfs/dbraw/zinc/28/08/31/1050280831.db2.gz YNAOPMPKYSOXJD-LBPRGKRZSA-N 1 0 307.796 4.296 20 10 DICDRO c1csc(SCCC[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)n1 ZINC000760956068 1050281873 /nfs/dbraw/zinc/28/18/73/1050281873.db2.gz UOGFRBYNNHNGHD-LSDHHAIUSA-N 1 0 304.484 4.019 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1ccc(-c2ccccc2)cc1F ZINC000771840171 1050283969 /nfs/dbraw/zinc/28/39/69/1050283969.db2.gz NCPYNZXPYXPHLJ-UHFFFAOYSA-N 1 0 307.368 4.488 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCOc3ccccc32)cc1Cl ZINC000825191122 1050286175 /nfs/dbraw/zinc/28/61/75/1050286175.db2.gz WTAXTLISDPMAGX-MRXNPFEDSA-N 1 0 317.816 4.358 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2nc(C(C)C)cs2)cc1Cl ZINC000825357148 1050298202 /nfs/dbraw/zinc/29/82/02/1050298202.db2.gz ABMIVVAOBYLKFZ-UHFFFAOYSA-N 1 0 310.850 4.224 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)cc1Cl ZINC000825391566 1050302071 /nfs/dbraw/zinc/30/20/71/1050302071.db2.gz YEMGBWHQXOHOEN-CJNGLKHVSA-N 1 0 311.853 4.037 20 10 DICDRO CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccc(OC)cc1O ZINC000734849314 1050321723 /nfs/dbraw/zinc/32/17/23/1050321723.db2.gz AZCYCDSIHIUGCZ-INIZCTEOSA-N 1 0 319.832 4.165 20 10 DICDRO Cc1ccc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000734847824 1050325325 /nfs/dbraw/zinc/32/53/25/1050325325.db2.gz WMDIUBLLFPQYFG-UHFFFAOYSA-N 1 0 308.469 4.318 20 10 DICDRO CC1(C[NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)CCC1 ZINC000766213016 1050340102 /nfs/dbraw/zinc/34/01/02/1050340102.db2.gz CJCJMENOQAJSTE-UHFFFAOYSA-N 1 0 324.415 4.037 20 10 DICDRO CC(C)n1ccc(C[N@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000735078303 1050344987 /nfs/dbraw/zinc/34/49/87/1050344987.db2.gz IIAATFSELRCNOU-UHFFFAOYSA-N 1 0 313.445 4.114 20 10 DICDRO CC[C@H]([NH2+]Cc1ccnc(SC)c1)c1ccc(N(C)C)cc1 ZINC000772467603 1050362012 /nfs/dbraw/zinc/36/20/12/1050362012.db2.gz ANZHVCOXVXXLCZ-KRWDZBQOSA-N 1 0 315.486 4.110 20 10 DICDRO CN(Cc1ccccc1O)Cc1c(F)ccc(Cl)c1Cl ZINC001143866956 1050386032 /nfs/dbraw/zinc/38/60/32/1050386032.db2.gz REGFFECGISUGHR-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H]3CCC[C@H](C)CC3)CC2)cc1 ZINC000785570426 1050395800 /nfs/dbraw/zinc/39/58/00/1050395800.db2.gz QZZAIUSCPHYMMN-IRXDYDNUSA-N 1 0 316.489 4.222 20 10 DICDRO CC[C@H](Nc1cc(C)cc(C[NH+](C)C)c1)c1ccc(F)cc1O ZINC000796890994 1050401890 /nfs/dbraw/zinc/40/18/90/1050401890.db2.gz IMWSFNUOXNUXBQ-SFHVURJKSA-N 1 0 316.420 4.465 20 10 DICDRO CCN(Cc1ccccc1O)Cc1c(Cl)ccc(F)c1F ZINC001143959038 1050417300 /nfs/dbraw/zinc/41/73/00/1050417300.db2.gz YLPFXHBURLYWHO-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H](Nc2ccccc2)C(C)C)cc1C ZINC000735676595 1050420715 /nfs/dbraw/zinc/42/07/15/1050420715.db2.gz UMSWSVIMLHTLNB-LJQANCHMSA-N 1 0 312.457 4.230 20 10 DICDRO COc1ccc(C[NH2+]CC(C)(C)c2cccc(F)c2)cc1C ZINC000735678547 1050420991 /nfs/dbraw/zinc/42/09/91/1050420991.db2.gz XPFXLNBSRYXHQY-UHFFFAOYSA-N 1 0 301.405 4.210 20 10 DICDRO C/C(=C\c1ccccc1)C[NH2+]CCCSc1nccs1 ZINC000735925593 1050439183 /nfs/dbraw/zinc/43/91/83/1050439183.db2.gz LEKNMSHQOXJMIF-WYMLVPIESA-N 1 0 304.484 4.318 20 10 DICDRO Cc1cc(C(F)(F)F)ccc1C[N@@H+](C)Cc1ccccc1O ZINC000785978615 1050439793 /nfs/dbraw/zinc/43/97/93/1050439793.db2.gz YNLKNXNXPUTQEK-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1 ZINC001171133416 1050452577 /nfs/dbraw/zinc/45/25/77/1050452577.db2.gz KYDLYTDBIBXFLT-LJQANCHMSA-N 1 0 316.395 4.368 20 10 DICDRO Oc1ccccc1C[NH2+][C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171139872 1050467910 /nfs/dbraw/zinc/46/79/10/1050467910.db2.gz SAMXTBGCRSFLNC-AWEZNQCLSA-N 1 0 322.235 4.346 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccccc1O ZINC000786431509 1050481231 /nfs/dbraw/zinc/48/12/31/1050481231.db2.gz QZBQVCHWYUEYJW-RDJZCZTQSA-N 1 0 303.446 4.315 20 10 DICDRO C[NH2+]Cc1cccc(Nc2ccc(Cc3ccc(N)cc3)cc2)c1 ZINC001211139430 1050493594 /nfs/dbraw/zinc/49/35/94/1050493594.db2.gz DXLGWKUCIVISMV-UHFFFAOYSA-N 1 0 317.436 4.323 20 10 DICDRO CC[C@@H]([NH2+]Cc1cn(C)nc1-c1ccccc1)c1ccccc1O ZINC000157937413 1050493738 /nfs/dbraw/zinc/49/37/38/1050493738.db2.gz HCFYYKUALXQHRJ-GOSISDBHSA-N 1 0 321.424 4.034 20 10 DICDRO CC[C@@H]([NH2+]CCc1sc(C)nc1C)c1ccc(N(C)C)cc1 ZINC000157949298 1050495535 /nfs/dbraw/zinc/49/55/35/1050495535.db2.gz MPYBYXJVAXRNKT-QGZVFWFLSA-N 1 0 317.502 4.109 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@@H]1CCSC1)C1CCCCC1 ZINC000787049467 1050545478 /nfs/dbraw/zinc/54/54/78/1050545478.db2.gz ADJIQPVCLGIWGP-HNNXBMFYSA-N 1 0 305.487 4.280 20 10 DICDRO CCC[N@H+](Cc1ccc2cnccc2c1)Cc1ccccc1O ZINC000787138085 1050554677 /nfs/dbraw/zinc/55/46/77/1050554677.db2.gz PKMAQMWXXJLWPS-UHFFFAOYSA-N 1 0 306.409 4.353 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](c3ccc(C)cc3)C[C@@H]2C)c1O ZINC000787326431 1050591151 /nfs/dbraw/zinc/59/11/51/1050591151.db2.gz DPDZPKMHQPGWLY-MAUKXSAKSA-N 1 0 311.425 4.087 20 10 DICDRO CCCc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000746692716 1050611794 /nfs/dbraw/zinc/61/17/94/1050611794.db2.gz AKQCBUMSKZAPCP-UHFFFAOYSA-N 1 0 300.421 4.134 20 10 DICDRO Cc1cc(C)c(C[NH2+]Cc2ccc3c(c2)CCCN3C)cc1C ZINC000746693463 1050611883 /nfs/dbraw/zinc/61/18/83/1050611883.db2.gz ZRXZOMRYIWFYCU-UHFFFAOYSA-N 1 0 308.469 4.284 20 10 DICDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000129848949 1050618501 /nfs/dbraw/zinc/61/85/01/1050618501.db2.gz VNHRKBOVVYNUIM-CYBMUJFWSA-N 1 0 317.816 4.044 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccsc2)c(C(F)(F)F)c1 ZINC000792881416 1050619491 /nfs/dbraw/zinc/61/94/91/1050619491.db2.gz IJESFVYBJCIRLS-UHFFFAOYSA-N 1 0 314.376 4.123 20 10 DICDRO CCC[N@H+](Cc1cc(C)c(C)cc1O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000740859932 1050632430 /nfs/dbraw/zinc/63/24/30/1050632430.db2.gz WENPKIDWWUMCGT-QRQLOZEOSA-N 1 0 317.473 4.035 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCC3)c1 ZINC000845971234 1050638496 /nfs/dbraw/zinc/63/84/96/1050638496.db2.gz ISZHANBIGZIIHA-CQSZACIVSA-N 1 0 311.425 4.130 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)C2CCC(F)(F)CC2)c1 ZINC000845972166 1050638591 /nfs/dbraw/zinc/63/85/91/1050638591.db2.gz PGUQMCRZNNFBNF-NEPJUHHUSA-N 1 0 313.388 4.265 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCc2ccsc2)c1 ZINC000845970847 1050639335 /nfs/dbraw/zinc/63/93/35/1050639335.db2.gz DEUVRGQFCIMRJZ-OLZOCXBDSA-N 1 0 305.443 4.134 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)c3ncccc3c2)c1 ZINC000845973341 1050639406 /nfs/dbraw/zinc/63/94/06/1050639406.db2.gz ZEPUEGKUXLMLAR-AWEZNQCLSA-N 1 0 322.408 4.108 20 10 DICDRO CC[C@@H](Cc1cccs1)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000845970855 1050639505 /nfs/dbraw/zinc/63/95/05/1050639505.db2.gz DHKUABNBDCQBER-STQMWFEESA-N 1 0 305.443 4.134 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc3cc(C)ccc3o2)c1 ZINC000845972589 1050639879 /nfs/dbraw/zinc/63/98/79/1050639879.db2.gz PCGWGULVILSKDJ-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO COc1cccc(C[N@H+](C)[C@@H](C)CSc2ccccc2)c1O ZINC000846000718 1050646320 /nfs/dbraw/zinc/64/63/20/1050646320.db2.gz UDASLQBLNGBKOU-AWEZNQCLSA-N 1 0 317.454 4.013 20 10 DICDRO CCOc1cccc(C[NH2+]C2(c3ccccc3C)CCC2)c1O ZINC000845995330 1050648504 /nfs/dbraw/zinc/64/85/04/1050648504.db2.gz SZRQUXARMMHXLV-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](CC)c2ccccc2F)c(O)c1 ZINC000846043970 1050657864 /nfs/dbraw/zinc/65/78/64/1050657864.db2.gz DXKSWGCQMQVVFP-KRWDZBQOSA-N 1 0 303.377 4.171 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000846055842 1050659875 /nfs/dbraw/zinc/65/98/75/1050659875.db2.gz QDOCDTQZOPLCDT-CXAGYDPISA-N 1 0 316.832 4.257 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000846055843 1050660659 /nfs/dbraw/zinc/66/06/59/1050660659.db2.gz QDOCDTQZOPLCDT-DYVFJYSZSA-N 1 0 316.832 4.257 20 10 DICDRO Oc1c(C[NH+]2CCC3(CC3(F)F)CC2)ccc2ccccc21 ZINC000846056017 1050662875 /nfs/dbraw/zinc/66/28/75/1050662875.db2.gz ZDMZCHHAQCVMDL-UHFFFAOYSA-N 1 0 303.352 4.167 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@H](SC)C2)cc1 ZINC000227378492 1050666458 /nfs/dbraw/zinc/66/64/58/1050666458.db2.gz USCVCQVTWDQJEU-WMZOPIPTSA-N 1 0 306.519 4.297 20 10 DICDRO Cc1cccc([C@H](C)C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000741254712 1050669030 /nfs/dbraw/zinc/66/90/30/1050669030.db2.gz CVPSMPWOXONGEE-OAHLLOKOSA-N 1 0 300.421 4.093 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)Cc2ccc(C)s2)c1O ZINC000846148467 1050672551 /nfs/dbraw/zinc/67/25/51/1050672551.db2.gz ZVODTDCYQZLJPU-AAEUAGOBSA-N 1 0 305.443 4.053 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(Br)ccc1O)c1ccccc1 ZINC000227441997 1050673916 /nfs/dbraw/zinc/67/39/16/1050673916.db2.gz KYAMTBYBNRMTBK-OAHLLOKOSA-N 1 0 320.230 4.396 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1cc(F)ccc1F ZINC000846153359 1050674449 /nfs/dbraw/zinc/67/44/49/1050674449.db2.gz GLYSCOZEYOEIGF-MEDUHNTESA-N 1 0 321.367 4.481 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(Cc3ccccc3)CCC2)c1O ZINC000846159932 1050677113 /nfs/dbraw/zinc/67/71/13/1050677113.db2.gz KUWOGEIGLFHAMW-HNNXBMFYSA-N 1 0 311.425 4.217 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(c3cccc(Cl)c3)CC2)c1O ZINC000846164239 1050678871 /nfs/dbraw/zinc/67/88/71/1050678871.db2.gz SZDHLYPRJLYMJR-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1O ZINC000846168138 1050681076 /nfs/dbraw/zinc/68/10/76/1050681076.db2.gz RDGXNMOGLABHDW-JYJNAYRXSA-N 1 0 311.425 4.306 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2cccc(OC)c2O)cc1 ZINC000846140575 1050681710 /nfs/dbraw/zinc/68/17/10/1050681710.db2.gz AUCRTOBPTFGHJW-CQSZACIVSA-N 1 0 315.413 4.040 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccccc1OC ZINC000846138760 1050682095 /nfs/dbraw/zinc/68/20/95/1050682095.db2.gz GPVQAZZIBHRUTH-BBRMVZONSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCSc2ccc(C)cc2)c1O ZINC000846135196 1050682112 /nfs/dbraw/zinc/68/21/12/1050682112.db2.gz CAVCXGKHVUNEJB-AWEZNQCLSA-N 1 0 317.454 4.152 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccccc1OC ZINC000846138764 1050682284 /nfs/dbraw/zinc/68/22/84/1050682284.db2.gz GPVQAZZIBHRUTH-XJKSGUPXSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c1O ZINC000846138198 1050682445 /nfs/dbraw/zinc/68/24/45/1050682445.db2.gz UWPWBKYJLCZENK-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)c1O ZINC000846137835 1050682488 /nfs/dbraw/zinc/68/24/88/1050682488.db2.gz REZIPUVBRAZTFZ-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCCn2ccc3ccccc32)c1O ZINC000846138699 1050682536 /nfs/dbraw/zinc/68/25/36/1050682536.db2.gz XQLKQLPOLJGCSC-OAHLLOKOSA-N 1 0 324.424 4.096 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCc3c2cccc3Cl)c1O ZINC000846141947 1050682733 /nfs/dbraw/zinc/68/27/33/1050682733.db2.gz OLRKHGVWERINIA-BZNIZROVSA-N 1 0 317.816 4.392 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCc2c[nH]c3cccc(C)c23)c1O ZINC000846144804 1050684248 /nfs/dbraw/zinc/68/42/48/1050684248.db2.gz KGHFOCQMZPATQV-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C[C@H](C)c2ccc(F)cc2F)c1O ZINC000846145508 1050684511 /nfs/dbraw/zinc/68/45/11/1050684511.db2.gz LBADKYPHDZZWJE-NWDGAFQWSA-N 1 0 321.367 4.133 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC(C)(C)c2cccs2)c1O ZINC000846147472 1050686730 /nfs/dbraw/zinc/68/67/30/1050686730.db2.gz VLXYNUYZGWVELT-GFCCVEGCSA-N 1 0 305.443 4.091 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C2CC2)C2CCOCC2)c1O ZINC000846187615 1050690378 /nfs/dbraw/zinc/69/03/78/1050690378.db2.gz LKZWRCQFVPNSIT-SJCJKPOMSA-N 1 0 323.864 4.210 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c(O)c1 ZINC000846216544 1050696618 /nfs/dbraw/zinc/69/66/18/1050696618.db2.gz SQJBBNLZGCZNAY-VXGBXAGGSA-N 1 0 302.245 4.325 20 10 DICDRO C[C@@H]([NH2+]CCC[C@H]1CC1(Cl)Cl)c1cc(F)ccc1O ZINC000846215734 1050696948 /nfs/dbraw/zinc/69/69/48/1050696948.db2.gz OLPAUNPHYBRQLO-ZJUUUORDSA-N 1 0 306.208 4.156 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c1O ZINC000846211919 1050703888 /nfs/dbraw/zinc/70/38/88/1050703888.db2.gz DCVBHUGGJVIWRO-MNOVXSKESA-N 1 0 318.244 4.025 20 10 DICDRO CCCOc1ncccc1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000788564429 1050705168 /nfs/dbraw/zinc/70/51/68/1050705168.db2.gz RMJWGPFHVPEXOA-OAHLLOKOSA-N 1 0 314.429 4.044 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c1O ZINC000846211921 1050705198 /nfs/dbraw/zinc/70/51/98/1050705198.db2.gz DCVBHUGGJVIWRO-QWRGUYRKSA-N 1 0 318.244 4.025 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000788531990 1050706387 /nfs/dbraw/zinc/70/63/87/1050706387.db2.gz JTOVMFBZLXZNQQ-UHFFFAOYSA-N 1 0 318.150 4.267 20 10 DICDRO C[C@]12CC[N@H+](Cc3cc(Cl)ccc3O)C[C@H]1C2(Cl)Cl ZINC000793612821 1050709806 /nfs/dbraw/zinc/70/98/06/1050709806.db2.gz LJOSOBAVGMFPNX-OLZOCXBDSA-N 1 0 320.647 4.061 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](C)Oc2ccccc2F)c(O)c1 ZINC000788616134 1050715400 /nfs/dbraw/zinc/71/54/00/1050715400.db2.gz XJBYWOMKANTMID-CABCVRRESA-N 1 0 317.404 4.266 20 10 DICDRO Cc1nc2ccccc2n1CC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000788646778 1050715544 /nfs/dbraw/zinc/71/55/44/1050715544.db2.gz RZBQXGLLPIACHL-HNNXBMFYSA-N 1 0 323.440 4.018 20 10 DICDRO CC[C@H]([NH2+][C@@H](C(C)C)[C@H](O)c1ccccc1)c1ccccc1O ZINC000788618489 1050717617 /nfs/dbraw/zinc/71/76/17/1050717617.db2.gz ARAPRACEKLOJLT-YSIASYRMSA-N 1 0 313.441 4.191 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000788620980 1050718182 /nfs/dbraw/zinc/71/81/82/1050718182.db2.gz SSQVCOMHAILGTE-ROUUACIJSA-N 1 0 324.468 4.268 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cc(F)ccc1O ZINC000788619689 1050718351 /nfs/dbraw/zinc/71/83/51/1050718351.db2.gz KRFYMZDNZMPVSG-MRVPVSSYSA-N 1 0 315.722 4.314 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C(C)C)[C@H](O)c2ccccc2)c1 ZINC000788624696 1050721248 /nfs/dbraw/zinc/72/12/48/1050721248.db2.gz CMYLLKQWHWMJLP-CWFSZBLJSA-N 1 0 313.441 4.109 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCOc2ccc(F)c(F)c2)c(O)c1 ZINC000788638440 1050723025 /nfs/dbraw/zinc/72/30/25/1050723025.db2.gz GTUDHQIXNZZKLA-ZDUSSCGKSA-N 1 0 321.367 4.017 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)c(O)c1 ZINC000788687557 1050724782 /nfs/dbraw/zinc/72/47/82/1050724782.db2.gz RDAPDKOWNTUSKE-ZOBUZTSGSA-N 1 0 305.462 4.253 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)c(O)c1 ZINC000788687549 1050725425 /nfs/dbraw/zinc/72/54/25/1050725425.db2.gz RDAPDKOWNTUSKE-UXLLHSPISA-N 1 0 305.462 4.253 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](Cc2ccccc2)C2CC2)c1O ZINC000761191356 1050768416 /nfs/dbraw/zinc/76/84/16/1050768416.db2.gz OQQPGRAJMCZSRG-UHFFFAOYSA-N 1 0 317.816 4.219 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CCC(F)(F)CC1 ZINC000788987608 1050773984 /nfs/dbraw/zinc/77/39/84/1050773984.db2.gz MAKHITTYBUGTRW-LBPRGKRZSA-N 1 0 314.395 4.195 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)[C@H](C)c2ccccc2F)c1O ZINC000761191418 1050774301 /nfs/dbraw/zinc/77/43/01/1050774301.db2.gz UOIHJCSPDMGVJM-LLVKDONJSA-N 1 0 323.795 4.386 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)[C@@H](C)c2ccccc2F)c1O ZINC000761191419 1050775086 /nfs/dbraw/zinc/77/50/86/1050775086.db2.gz UOIHJCSPDMGVJM-NSHDSACASA-N 1 0 323.795 4.386 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c1O ZINC000761198548 1050775189 /nfs/dbraw/zinc/77/51/89/1050775189.db2.gz QGLAXXHTIJXAPD-YGRLFVJLSA-N 1 0 321.804 4.060 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)c1O ZINC000761202376 1050777880 /nfs/dbraw/zinc/77/78/80/1050777880.db2.gz DOFPPIFGJRACQC-SJCJKPOMSA-N 1 0 317.816 4.247 20 10 DICDRO COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]Cc1ccc(N(C)C)cc1 ZINC000788978585 1050779090 /nfs/dbraw/zinc/77/90/90/1050779090.db2.gz UVPAFXUSCIJDOC-FQEVSTJZSA-N 1 0 324.468 4.273 20 10 DICDRO CC[C@H]([NH2+]Cc1oc2ccccc2c1OC)c1ccccc1O ZINC000788980956 1050779831 /nfs/dbraw/zinc/77/98/31/1050779831.db2.gz PXXKBKHJXTUKET-HNNXBMFYSA-N 1 0 311.381 4.388 20 10 DICDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000772956220 1050780881 /nfs/dbraw/zinc/78/08/81/1050780881.db2.gz AIGYXLNDLFTESH-DNVCBOLYSA-N 1 0 310.441 4.154 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCCN(c3ccc(C)cc3)C2)cc1C ZINC000742380982 1050825152 /nfs/dbraw/zinc/82/51/52/1050825152.db2.gz UEZHZWHBPBTCDV-IBGZPJMESA-N 1 0 324.468 4.071 20 10 DICDRO C[C@@H](C[NH2+]Cc1c(O)cccc1Cl)Sc1ccccc1 ZINC000742383302 1050827936 /nfs/dbraw/zinc/82/79/36/1050827936.db2.gz YLVCCEXMYZWSQE-LBPRGKRZSA-N 1 0 307.846 4.316 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)cc1Cl ZINC000742371445 1050834555 /nfs/dbraw/zinc/83/45/55/1050834555.db2.gz XSXBCGGQAZABPF-UHFFFAOYSA-N 1 0 318.848 4.013 20 10 DICDRO COc1ccc([C@H](C)CC[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000742373412 1050836003 /nfs/dbraw/zinc/83/60/03/1050836003.db2.gz BZNKOWYALIBYHJ-CYBMUJFWSA-N 1 0 319.832 4.338 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)ccc1OC ZINC000742378212 1050837601 /nfs/dbraw/zinc/83/76/01/1050837601.db2.gz DTSSPTSBFNWVQU-ZHALLVOQSA-N 1 0 317.473 4.290 20 10 DICDRO COc1ccc([C@H](C)CC[NH2+]Cc2ccc(OC)c(C)c2)cc1 ZINC000742374286 1050837854 /nfs/dbraw/zinc/83/78/54/1050837854.db2.gz UVUINXLPARNBLV-OAHLLOKOSA-N 1 0 313.441 4.296 20 10 DICDRO COc1ccc(C[NH2+]C2CC(c3cccc(Cl)c3)C2)c(O)c1 ZINC000742376887 1050838193 /nfs/dbraw/zinc/83/81/93/1050838193.db2.gz CLBXWVUTFGEZOB-UHFFFAOYSA-N 1 0 317.816 4.090 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)cc1 ZINC000790483454 1050962407 /nfs/dbraw/zinc/96/24/07/1050962407.db2.gz GCEGXPQFJGFXLG-UHFFFAOYSA-N 1 0 324.399 4.442 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCSC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000790496818 1050964644 /nfs/dbraw/zinc/96/46/44/1050964644.db2.gz OBBMFKPGRDKYIQ-LSDHHAIUSA-N 1 0 322.493 4.220 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@](C)(O)C2CCCCC2)c2c1c(F)ccc2O ZINC000790704041 1050986214 /nfs/dbraw/zinc/98/62/14/1050986214.db2.gz XDLBGCXHBPVWPD-YFROIQMUSA-N 1 0 321.436 4.001 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1cc(F)ccc1O ZINC000790714662 1050988613 /nfs/dbraw/zinc/98/86/13/1050988613.db2.gz GZVHMINCKKDQCX-UKRRQHHQSA-N 1 0 307.409 4.064 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC3(CCCCC3)O2)c1 ZINC000790716573 1050989074 /nfs/dbraw/zinc/98/90/74/1050989074.db2.gz WGCQOLFDLIBXEH-CVEARBPZSA-N 1 0 303.446 4.233 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cc1F ZINC000772996598 1050989324 /nfs/dbraw/zinc/98/93/24/1050989324.db2.gz FSJJCFOBCVVPRI-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(OCC2CC2)cc1)c1ccc(N(C)C)cc1 ZINC000790989254 1051012631 /nfs/dbraw/zinc/01/26/31/1051012631.db2.gz ALDPZQHYYVDEDO-INIZCTEOSA-N 1 0 324.468 4.392 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)c1 ZINC000772999438 1051012858 /nfs/dbraw/zinc/01/28/58/1051012858.db2.gz LDYMYNAFRJUUGI-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C[C@H]1CCC2(CCCCC2)O1 ZINC000790994996 1051014876 /nfs/dbraw/zinc/01/48/76/1051014876.db2.gz GSFVHXQOPRPPBV-OAHLLOKOSA-N 1 0 309.837 4.017 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1ccccc1OC ZINC000772999515 1051015607 /nfs/dbraw/zinc/01/56/07/1051015607.db2.gz LPRJGQLYGUJAKV-GOSISDBHSA-N 1 0 312.457 4.311 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1ccc(OC)cc1 ZINC000772999540 1051015692 /nfs/dbraw/zinc/01/56/92/1051015692.db2.gz MIBZSARHRHGPHP-LJQANCHMSA-N 1 0 312.457 4.311 20 10 DICDRO C[C@@H]([NH2+]CCCC(C)(C)C)c1ccc(N2CCOCC2)cc1 ZINC000773010402 1051018902 /nfs/dbraw/zinc/01/89/02/1051018902.db2.gz JNDNUKPQNKZHSL-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC4(CCCC4)C3)c2c1 ZINC000743389580 1051020927 /nfs/dbraw/zinc/02/09/27/1051020927.db2.gz FVRJOUAJZLMDCQ-UHFFFAOYSA-N 1 0 311.425 4.320 20 10 DICDRO CC(C)[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCS1 ZINC000743394877 1051022442 /nfs/dbraw/zinc/02/24/42/1051022442.db2.gz DBJIIKKNPNBQDW-GOSISDBHSA-N 1 0 301.455 4.119 20 10 DICDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2c(O)ccc3ccncc32)C1 ZINC000743398719 1051023720 /nfs/dbraw/zinc/02/37/20/1051023720.db2.gz JZVBZYPGPFZUIJ-HUUCEWRRSA-N 1 0 316.470 4.046 20 10 DICDRO CC[C@H](C)C[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000773022849 1051027033 /nfs/dbraw/zinc/02/70/33/1051027033.db2.gz FFAGLOOZLSHWSZ-JYJNAYRXSA-N 1 0 322.468 4.138 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCSC1)c1ccc(N2CCCCCC2)cc1 ZINC000773030567 1051030318 /nfs/dbraw/zinc/03/03/18/1051030318.db2.gz TUZYSWUECKHNAO-NVXWUHKLSA-N 1 0 304.503 4.223 20 10 DICDRO COc1ccc(N2CCC([NH2+]CC3(C)CCCCC3)CC2)cc1 ZINC000773041984 1051033424 /nfs/dbraw/zinc/03/34/24/1051033424.db2.gz VAQHXEWEOMZQAO-UHFFFAOYSA-N 1 0 316.489 4.224 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(OC)cc2F)cc1 ZINC000773039454 1051036082 /nfs/dbraw/zinc/03/60/82/1051036082.db2.gz HJDYHAIUFTWHOH-CQSZACIVSA-N 1 0 316.420 4.141 20 10 DICDRO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(N(C)C)cc1 ZINC000773039418 1051036631 /nfs/dbraw/zinc/03/66/31/1051036631.db2.gz GKZLQTDKDYXNBI-SJKOYZFVSA-N 1 0 316.832 4.190 20 10 DICDRO C[C@H]([NH2+][C@@H](CO)CC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000773075318 1051051785 /nfs/dbraw/zinc/05/17/85/1051051785.db2.gz IRQIBHGQFSESNJ-FUHWJXTLSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@H]([NH2+][C@H](CO)CC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000773075325 1051052710 /nfs/dbraw/zinc/05/27/10/1051052710.db2.gz IRQIBHGQFSESNJ-WMZOPIPTSA-N 1 0 318.505 4.125 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC[C@@H]2CCCC[C@@H]2O)cc1 ZINC000773080878 1051054546 /nfs/dbraw/zinc/05/45/46/1051054546.db2.gz NXNSJGIQPMUZTO-QRFRQXIXSA-N 1 0 318.505 4.125 20 10 DICDRO CC[C@H]([NH2+]CCC[C@H]1CCCC[C@H]1O)c1ccc(N(C)C)cc1 ZINC000773081906 1051056985 /nfs/dbraw/zinc/05/69/85/1051056985.db2.gz SJBWMTTWGSMDKO-YZGWKJHDSA-N 1 0 318.505 4.125 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)C1CC1 ZINC000773090871 1051061597 /nfs/dbraw/zinc/06/15/97/1051061597.db2.gz GHIFWVYVBOZYLI-UZLBHIALSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@H]([NH2+][C@H]1CC[C@H](O)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000773102412 1051062582 /nfs/dbraw/zinc/06/25/82/1051062582.db2.gz MORMPWRMLJDODZ-QRFRQXIXSA-N 1 0 316.489 4.021 20 10 DICDRO C[C@@H](CO)CCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773114840 1051066915 /nfs/dbraw/zinc/06/69/15/1051066915.db2.gz KTSCZRMVCMPZPF-QZTJIDSGSA-N 1 0 318.505 4.126 20 10 DICDRO C[C@H](CO)CCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773114842 1051067877 /nfs/dbraw/zinc/06/78/77/1051067877.db2.gz KTSCZRMVCMPZPF-ROUUACIJSA-N 1 0 318.505 4.126 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(Cl)n1 ZINC000743841028 1051069841 /nfs/dbraw/zinc/06/98/41/1051069841.db2.gz CBSMZCNGMFUAQH-UHFFFAOYSA-N 1 0 317.864 4.212 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(C)cn2)c(C)n1-c1ccccc1 ZINC000400905772 1051084945 /nfs/dbraw/zinc/08/49/45/1051084945.db2.gz VVHXWRMLMGDWAF-UHFFFAOYSA-N 1 0 305.425 4.087 20 10 DICDRO CC[C@@H]1C[C@H]([NH2+][C@H]2c3c(c(C)cc(C)c3O)CC2(C)C)CCO1 ZINC001170201535 1051155962 /nfs/dbraw/zinc/15/59/62/1051155962.db2.gz DBGMPKGLJLVSCX-CLCXKQKWSA-N 1 0 317.473 4.180 20 10 DICDRO CC(C)([NH2+]Cc1ccc(Br)cc1O)c1ccccc1 ZINC000691413249 1051168405 /nfs/dbraw/zinc/16/84/05/1051168405.db2.gz GPTQSJUTQLCZFC-UHFFFAOYSA-N 1 0 320.230 4.180 20 10 DICDRO CO[C@@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)C(C)(C)C ZINC000744447766 1051178481 /nfs/dbraw/zinc/17/84/81/1051178481.db2.gz BWBKTVRNUWEJOH-IBGZPJMESA-N 1 0 313.441 4.210 20 10 DICDRO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC001649138776 1051228252 /nfs/dbraw/zinc/22/82/52/1051228252.db2.gz JTNRBSPDVJNAMG-OAHLLOKOSA-N 1 0 300.421 4.359 20 10 DICDRO CC[C@@H](CSC)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000793038733 1051239287 /nfs/dbraw/zinc/23/92/87/1051239287.db2.gz SPYXNSFUGVIXJD-LBPRGKRZSA-N 1 0 320.424 4.003 20 10 DICDRO Cc1cccc(CC[NH2+]Cc2cc(-c3ccccc3)ccc2O)n1 ZINC000793202306 1051256422 /nfs/dbraw/zinc/25/64/22/1051256422.db2.gz GEKGYXIXMQILHJ-UHFFFAOYSA-N 1 0 318.420 4.095 20 10 DICDRO C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@H](C2CC2)O1 ZINC000793214801 1051260022 /nfs/dbraw/zinc/26/00/22/1051260022.db2.gz RHKXYUZWZXHZCG-QVKFZJNVSA-N 1 0 323.436 4.059 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)c1O ZINC000793230021 1051263729 /nfs/dbraw/zinc/26/37/29/1051263729.db2.gz CLBWGRVCCGQXQX-BXKDBHETSA-N 1 0 307.743 4.127 20 10 DICDRO COCCCC[C@@H]([NH2+]Cc1cccc(C)c1O)c1ccccc1 ZINC000793233603 1051265728 /nfs/dbraw/zinc/26/57/28/1051265728.db2.gz WGOPHZXUSRLKOL-LJQANCHMSA-N 1 0 313.441 4.348 20 10 DICDRO CCC[C@@H]([NH2+]Cc1cc(C)c(C)cc1O)[C@@H](O)c1ccccc1 ZINC000793236754 1051267626 /nfs/dbraw/zinc/26/76/26/1051267626.db2.gz DJYIYBXYQGSGPH-QUCCMNQESA-N 1 0 313.441 4.001 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@](C)(OC)CC2)cc1F ZINC000793339827 1051281132 /nfs/dbraw/zinc/28/11/32/1051281132.db2.gz NBXKTCVAUQAGOF-LJQANCHMSA-N 1 0 322.468 4.063 20 10 DICDRO COCCC1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCC1 ZINC000793329172 1051283899 /nfs/dbraw/zinc/28/38/99/1051283899.db2.gz JXNNHOWUAJXOAP-UHFFFAOYSA-N 1 0 311.425 4.108 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H]2c2ccc(C)cc2)c(O)c1 ZINC000793386088 1051293549 /nfs/dbraw/zinc/29/35/49/1051293549.db2.gz IVCYNKULQFLKRG-RBUKOAKNSA-N 1 0 311.425 4.135 20 10 DICDRO CC1(C)CC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000793528167 1051309823 /nfs/dbraw/zinc/30/98/23/1051309823.db2.gz SDTZIDKYZSCPJD-MRXNPFEDSA-N 1 0 324.415 4.035 20 10 DICDRO CC1(C)CC[C@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000793536696 1051311552 /nfs/dbraw/zinc/31/15/52/1051311552.db2.gz ULNHCZYBWRWNOP-CZUORRHYSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)cc1C(C)C ZINC000793531171 1051321314 /nfs/dbraw/zinc/32/13/14/1051321314.db2.gz PGUQGXQZOSBGNF-SJORKVTESA-N 1 0 309.400 4.301 20 10 DICDRO CCC[N@H+](Cc1ccc(OC)cc1)Cc1ccc(N(C)C)cc1 ZINC000746136626 1051326009 /nfs/dbraw/zinc/32/60/09/1051326009.db2.gz BIBUWDOBBQDLCI-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCOC[C@H](C3CCC3)C2)cc1C(C)C ZINC000793741397 1051337504 /nfs/dbraw/zinc/33/75/04/1051337504.db2.gz IDTFFCTVNRUIEV-GOSISDBHSA-N 1 0 317.473 4.073 20 10 DICDRO CC[C@@H](C)OCC[C@@H](C)[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001172346403 1051365249 /nfs/dbraw/zinc/36/52/49/1051365249.db2.gz JAYXUJAFGKUVMC-IAGOWNOFSA-N 1 0 306.494 4.168 20 10 DICDRO CC[C@H](CC(C)C)[NH2+]Cc1cc(Br)ccc1O ZINC001172391889 1051394521 /nfs/dbraw/zinc/39/45/21/1051394521.db2.gz KJQPZMJLKXOSCI-CYBMUJFWSA-N 1 0 300.240 4.069 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)CCOCC(C)C ZINC001172478544 1051401900 /nfs/dbraw/zinc/40/19/00/1051401900.db2.gz BBLZQWHUAHFAGO-KRWDZBQOSA-N 1 0 306.494 4.026 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H](C)CCOC(C)C ZINC001172441160 1051407784 /nfs/dbraw/zinc/40/77/84/1051407784.db2.gz TYLBAVMKHTZVRZ-DNVCBOLYSA-N 1 0 319.489 4.426 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)C ZINC000766364876 1051409670 /nfs/dbraw/zinc/40/96/70/1051409670.db2.gz BHNUGRORKUXNGH-HNAYVOBHSA-N 1 0 322.468 4.138 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C(C)(C)C ZINC000766370410 1051411879 /nfs/dbraw/zinc/41/18/79/1051411879.db2.gz TYOMNJGUUJDWOX-LPHOPBHVSA-N 1 0 318.505 4.389 20 10 DICDRO CC(C)COCC[C@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001172462456 1051414552 /nfs/dbraw/zinc/41/45/52/1051414552.db2.gz HAUYTBXAPDBZKQ-HNNXBMFYSA-N 1 0 301.430 4.086 20 10 DICDRO CSc1ccc(CC[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000797998241 1051419380 /nfs/dbraw/zinc/41/93/80/1051419380.db2.gz DBYDCEBXMAVVFX-CQSZACIVSA-N 1 0 301.455 4.316 20 10 DICDRO C[C@H](CC(F)(F)F)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000766477617 1051433716 /nfs/dbraw/zinc/43/37/16/1051433716.db2.gz DKGZMIYVTXGNAD-GFCCVEGCSA-N 1 0 309.331 4.490 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)C1CC(C)(C)OC(C)(C)C1 ZINC001172660804 1051474624 /nfs/dbraw/zinc/47/46/24/1051474624.db2.gz YDVVWEPGEAXVRW-UHFFFAOYSA-N 1 0 318.505 4.311 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172722929 1051483664 /nfs/dbraw/zinc/48/36/64/1051483664.db2.gz CXTKGNYJEIZLON-KRWDZBQOSA-N 1 0 301.817 4.035 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@H]2Cc3ccc(Cl)cc3C2)cc1 ZINC001172724660 1051484251 /nfs/dbraw/zinc/48/42/51/1051484251.db2.gz PHGWTDHHHGVESO-IBGZPJMESA-N 1 0 314.860 4.005 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172713916 1051497452 /nfs/dbraw/zinc/49/74/52/1051497452.db2.gz RSBPHRXNGLZLRJ-LJQANCHMSA-N 1 0 323.823 4.456 20 10 DICDRO C[C@H](C[C@H]1CCOC1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766581511 1051513485 /nfs/dbraw/zinc/51/34/85/1051513485.db2.gz LYHBLKRDGWGHEW-FGTMMUONSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@H](C[C@@H]1CCOC1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766581520 1051515282 /nfs/dbraw/zinc/51/52/82/1051515282.db2.gz LYHBLKRDGWGHEW-SQNIBIBYSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2OC)c1ccc(N(C)C)cc1 ZINC000766593711 1051531232 /nfs/dbraw/zinc/53/12/32/1051531232.db2.gz WQNRKROPCQADBS-VQTJNVASSA-N 1 0 324.468 4.489 20 10 DICDRO C[C@H](Cc1c(F)cccc1Cl)[NH2+]Cc1ccc(N(C)C)cc1 ZINC001172851151 1051536234 /nfs/dbraw/zinc/53/62/34/1051536234.db2.gz GISHQYWCEIWVPK-CYBMUJFWSA-N 1 0 320.839 4.266 20 10 DICDRO C[C@H](Cc1ccc(F)cc1Cl)[NH2+][C@H](C)c1ccccc1O ZINC001172855800 1051541502 /nfs/dbraw/zinc/54/15/02/1051541502.db2.gz HHSIOLDVUBFURO-VXGBXAGGSA-N 1 0 307.796 4.467 20 10 DICDRO CO[C@@H]1CCC[C@@H]([NH2+][C@@H]2c3c(c(C)cc(C)c3O)CC2(C)C)C1 ZINC001172930491 1051575822 /nfs/dbraw/zinc/57/58/22/1051575822.db2.gz IZEMYOQCFIZJKD-SPYBWZPUSA-N 1 0 317.473 4.180 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2)cc1 ZINC001169367243 1051591807 /nfs/dbraw/zinc/59/18/07/1051591807.db2.gz QKNFVQHIOBMCBX-FPOVZHCZSA-N 1 0 308.469 4.254 20 10 DICDRO CC[C@@H]1CC[C@H]([N@@H+]2CCc3c(c4cc(OC)ccc4n3C)C2)C1 ZINC001173286015 1051690633 /nfs/dbraw/zinc/69/06/33/1051690633.db2.gz CEXLQWUSVGNPSE-CABCVRRESA-N 1 0 312.457 4.124 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H]3CC[C@@H]3C(C)(C)C)CC2)cc1 ZINC000806137854 1051736587 /nfs/dbraw/zinc/73/65/87/1051736587.db2.gz SQAPSQXFTFAZNH-OALUTQOASA-N 1 0 316.489 4.078 20 10 DICDRO CCC[NH+]1CCC(C[NH2+][C@H](CC)c2cccc(Cl)c2[O-])CC1 ZINC000806136703 1051736734 /nfs/dbraw/zinc/73/67/34/1051736734.db2.gz BNQCHLOWXDEGMD-QGZVFWFLSA-N 1 0 324.896 4.208 20 10 DICDRO CCC[NH+]1CCC(C[NH2+][C@@H](CC)c2cccc(Cl)c2[O-])CC1 ZINC000806136701 1051736912 /nfs/dbraw/zinc/73/69/12/1051736912.db2.gz BNQCHLOWXDEGMD-KRWDZBQOSA-N 1 0 324.896 4.208 20 10 DICDRO CC[C@H]([NH2+]CCCC[NH+](C)C)c1cc(Cl)cc(Cl)c1[O-] ZINC000806136309 1051738237 /nfs/dbraw/zinc/73/82/37/1051738237.db2.gz WLIYLUQZPBFKET-AWEZNQCLSA-N 1 0 319.276 4.082 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2CCC[C@@H](CC)C2)ccc1OC ZINC000740899072 1051744991 /nfs/dbraw/zinc/74/49/91/1051744991.db2.gz PFUMLJVSLDIALR-QAPCUYQASA-N 1 0 305.462 4.290 20 10 DICDRO C[C@H]([NH2+]CCC1(F)CCC1)c1ccc(Br)cc1O ZINC000806173861 1051745913 /nfs/dbraw/zinc/74/59/13/1051745913.db2.gz NIUJBGRZOCGWKT-JTQLQIEISA-N 1 0 316.214 4.088 20 10 DICDRO CC[C@@H]1CC[C@@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000806141092 1051747797 /nfs/dbraw/zinc/74/77/97/1051747797.db2.gz FZRLXIGEKZAWRD-KEYYUXOJSA-N 1 0 324.415 4.035 20 10 DICDRO CC[C@@H]([NH2+]CCC1CC[NH+](CC)CC1)c1cccc(Cl)c1[O-] ZINC000806142029 1051749468 /nfs/dbraw/zinc/74/94/68/1051749468.db2.gz NEVKGQXGNADHAJ-QGZVFWFLSA-N 1 0 324.896 4.208 20 10 DICDRO CC[C@@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1cccc(Cl)c1[O-] ZINC000806157498 1051760559 /nfs/dbraw/zinc/76/05/59/1051760559.db2.gz GDUMEDGADRQVCE-RHSMWYFYSA-N 1 0 324.896 4.351 20 10 DICDRO CC[C@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1cccc(Cl)c1[O-] ZINC000806157497 1051761178 /nfs/dbraw/zinc/76/11/78/1051761178.db2.gz GDUMEDGADRQVCE-PBHICJAKSA-N 1 0 324.896 4.351 20 10 DICDRO CC[C@@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1cccc(Cl)c1[O-] ZINC000806163674 1051766344 /nfs/dbraw/zinc/76/63/44/1051766344.db2.gz USFCOYVCYWQQDP-OAHLLOKOSA-N 1 0 323.864 4.029 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCSC1)c1cc2c(cc1O)CCCC2 ZINC000806179674 1051772651 /nfs/dbraw/zinc/77/26/51/1051772651.db2.gz UJBCUEMWDVPWNI-KGLIPLIRSA-N 1 0 305.487 4.065 20 10 DICDRO COc1ccc(C[NH2+]CCc2ccc(C(F)(F)F)cc2)cc1C ZINC000806678098 1051840257 /nfs/dbraw/zinc/84/02/57/1051840257.db2.gz ASRQQUNGVNLHMJ-UHFFFAOYSA-N 1 0 323.358 4.355 20 10 DICDRO Cc1ncccc1C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC000768131810 1051886705 /nfs/dbraw/zinc/88/67/05/1051886705.db2.gz AABNOHBYIANPKO-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccccc2)[C@@H](C)C2CC2)c1O ZINC000768153811 1051889096 /nfs/dbraw/zinc/88/90/96/1051889096.db2.gz KTMZRNUBJAPLTJ-HNNXBMFYSA-N 1 0 311.425 4.202 20 10 DICDRO Cc1ccc(O)c(C[N@H+](C)Cc2ccc(Br)cc2)c1 ZINC000768169792 1051892678 /nfs/dbraw/zinc/89/26/78/1051892678.db2.gz KOMPNQYEMIIHAH-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc3c[nH]nc3c2)cc1 ZINC000768208574 1051897127 /nfs/dbraw/zinc/89/71/27/1051897127.db2.gz UFMPWPNNXINTFP-UHFFFAOYSA-N 1 0 322.456 4.041 20 10 DICDRO Oc1ccc(C2=CC[N@H+](Cc3cc(Cl)ccc3O)CC2)cc1 ZINC000768215367 1051902828 /nfs/dbraw/zinc/90/28/28/1051902828.db2.gz DYSGLBUOHFAAMJ-UHFFFAOYSA-N 1 0 315.800 4.041 20 10 DICDRO CCOc1ccc(O)c(C[NH+]2CCC(c3ccccc3)CC2)c1 ZINC000768234206 1051906830 /nfs/dbraw/zinc/90/68/30/1051906830.db2.gz WXVNFLAMGPMEQY-UHFFFAOYSA-N 1 0 311.425 4.171 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)c(O)c1 ZINC000768231047 1051907003 /nfs/dbraw/zinc/90/70/03/1051907003.db2.gz UDCNPVAWIXOOKU-GFCCVEGCSA-N 1 0 321.367 4.262 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000768236782 1051907282 /nfs/dbraw/zinc/90/72/82/1051907282.db2.gz LLCZIMMLWDTVDO-CQSZACIVSA-N 1 0 316.420 4.093 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2cccc3[nH]ccc32)C2CC2)cc1 ZINC000768258137 1051908480 /nfs/dbraw/zinc/90/84/80/1051908480.db2.gz PYWPYLXCRZQLHM-UHFFFAOYSA-N 1 0 319.452 4.399 20 10 DICDRO COc1cccc(O)c1C[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000768258133 1051909802 /nfs/dbraw/zinc/90/98/02/1051909802.db2.gz PULACCXDOJWHEY-UHFFFAOYSA-N 1 0 317.816 4.219 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2ccco2)C2CCCC2)c1O ZINC000768269711 1051911580 /nfs/dbraw/zinc/91/15/80/1051911580.db2.gz LDISICPGJUUKEX-UHFFFAOYSA-N 1 0 315.413 4.329 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2F)c(O)c1 ZINC000768264532 1051911711 /nfs/dbraw/zinc/91/17/11/1051911711.db2.gz RAELIOZZUNSOGY-ZDUSSCGKSA-N 1 0 303.377 4.123 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](Cc2ccco2)C2CCCC2)c1 ZINC000768269725 1051911820 /nfs/dbraw/zinc/91/18/20/1051911820.db2.gz MIZNFMMUOWOTFM-UHFFFAOYSA-N 1 0 315.413 4.329 20 10 DICDRO Cc1ccc([C@@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000768263601 1051912468 /nfs/dbraw/zinc/91/24/68/1051912468.db2.gz VPLCAGVTJPWJIA-GOSISDBHSA-N 1 0 324.468 4.025 20 10 DICDRO C[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000768271742 1051912593 /nfs/dbraw/zinc/91/25/93/1051912593.db2.gz NPUJZCOPPGBRSB-MNOVXSKESA-N 1 0 301.352 4.263 20 10 DICDRO C[C@H](CC(F)(F)F)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000768271741 1051912715 /nfs/dbraw/zinc/91/27/15/1051912715.db2.gz NPUJZCOPPGBRSB-GHMZBOCLSA-N 1 0 301.352 4.263 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000768319540 1051917220 /nfs/dbraw/zinc/91/72/20/1051917220.db2.gz PNQULRITOJSLCW-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)c1 ZINC000743473735 1051940178 /nfs/dbraw/zinc/94/01/78/1051940178.db2.gz QIVHTDJNVBYRBZ-ZWKOTPCHSA-N 1 0 324.468 4.243 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)ccc1Br ZINC000768873613 1051974497 /nfs/dbraw/zinc/97/44/97/1051974497.db2.gz RPLWWMPKHRPMOF-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CCOc1ccc(C[N@H+](CC)[C@@H](C)c2cccc(O)c2)c(O)c1 ZINC000768874019 1051975003 /nfs/dbraw/zinc/97/50/03/1051975003.db2.gz YHEFEYIKVYVDMN-AWEZNQCLSA-N 1 0 315.413 4.080 20 10 DICDRO CCOc1ccc(C[N@H+](CC)[C@H](C)c2cccc(O)c2)c(O)c1 ZINC000768874021 1051975095 /nfs/dbraw/zinc/97/50/95/1051975095.db2.gz YHEFEYIKVYVDMN-CQSZACIVSA-N 1 0 315.413 4.080 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)c(F)c1)[C@@H](C)c1cccc(O)c1 ZINC000768872935 1051975285 /nfs/dbraw/zinc/97/52/85/1051975285.db2.gz MDLXAZVZCIBNMX-AWEZNQCLSA-N 1 0 316.420 4.180 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2c2cc(C)no2)cc1 ZINC000768879791 1051976008 /nfs/dbraw/zinc/97/60/08/1051976008.db2.gz XQQBDIGAWPBWEE-SFHVURJKSA-N 1 0 313.445 4.166 20 10 DICDRO CC[N@H+](Cc1c(O)cccc1Cl)[C@@H](C)c1cccc(O)c1 ZINC000768874017 1051976157 /nfs/dbraw/zinc/97/61/57/1051976157.db2.gz YFOWXCJHDWOEQI-LBPRGKRZSA-N 1 0 305.805 4.334 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](Cc2ccccn2)C(C)C)cc1 ZINC000768925355 1051981243 /nfs/dbraw/zinc/98/12/43/1051981243.db2.gz GJVJJPCBNRAORN-UHFFFAOYSA-N 1 0 311.473 4.338 20 10 DICDRO CC[N@H+](CCc1ccccn1)Cc1ccc(N2CCCCC2)cc1 ZINC000769033788 1051990897 /nfs/dbraw/zinc/99/08/97/1051990897.db2.gz NQFYEPWNMCMXBZ-UHFFFAOYSA-N 1 0 323.484 4.137 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1nccc2ccccc21 ZINC000769200995 1052008769 /nfs/dbraw/zinc/00/87/69/1052008769.db2.gz MUOZLPOXEGJCDE-UHFFFAOYSA-N 1 0 306.409 4.353 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccc(Oc2cccnc2)cc1 ZINC000808436119 1052020389 /nfs/dbraw/zinc/02/03/89/1052020389.db2.gz NDNAUQUJPQWWNT-OAHLLOKOSA-N 1 0 320.392 4.430 20 10 DICDRO COc1ccc(C[NH2+]C[C@H]2CC[C@H](c3ccccc3)O2)cc1C ZINC000808451139 1052025833 /nfs/dbraw/zinc/02/58/33/1052025833.db2.gz HNZGCNWMIUUCRO-UYAOXDASSA-N 1 0 311.425 4.014 20 10 DICDRO CCCO[C@H]1CCC[N@H+](Cc2ccc(N(CC)CC)cc2)CC1 ZINC000769385307 1052036074 /nfs/dbraw/zinc/03/60/74/1052036074.db2.gz VRAHSCNHTXXCKB-FQEVSTJZSA-N 1 0 318.505 4.314 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccc2c(c1)COC2)C1CCCC1 ZINC000769385466 1052036125 /nfs/dbraw/zinc/03/61/25/1052036125.db2.gz XRHNLBNHCNGWPK-UHFFFAOYSA-N 1 0 323.436 4.367 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c1O ZINC000769426921 1052044523 /nfs/dbraw/zinc/04/45/23/1052044523.db2.gz KUNVMIOAJKVPHF-LJQANCHMSA-N 1 0 301.430 4.113 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000769426231 1052045712 /nfs/dbraw/zinc/04/57/12/1052045712.db2.gz OIRACQABEUHMHX-KRWDZBQOSA-N 1 0 319.857 4.336 20 10 DICDRO CCCN(CCC)c1ccc(C[NH+]2CCC(O)(CC)CC2)cc1 ZINC000769486715 1052053581 /nfs/dbraw/zinc/05/35/81/1052053581.db2.gz VLTVFMMFQFKCHR-UHFFFAOYSA-N 1 0 318.505 4.050 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)c1O ZINC000769457033 1052057775 /nfs/dbraw/zinc/05/77/75/1052057775.db2.gz NGZZMBFOBHISRE-DYVFJYSZSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)c1O ZINC000808691748 1052063302 /nfs/dbraw/zinc/06/33/02/1052063302.db2.gz NMADTSRSKUNWFG-STQMWFEESA-N 1 0 319.832 4.341 20 10 DICDRO Cc1nc(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cs1 ZINC000808675056 1052064808 /nfs/dbraw/zinc/06/48/08/1052064808.db2.gz VIUGDDAQQSUHIJ-SNVBAGLBSA-N 1 0 310.850 4.012 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)c1ccccc1 ZINC000808679682 1052066645 /nfs/dbraw/zinc/06/66/45/1052066645.db2.gz WXMOSVQKVUFTTF-GUYCJALGSA-N 1 0 319.832 4.392 20 10 DICDRO COCc1cccc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808676756 1052067861 /nfs/dbraw/zinc/06/78/61/1052067861.db2.gz KWFKFTQJQKGOBV-ZDUSSCGKSA-N 1 0 319.832 4.351 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808709356 1052071705 /nfs/dbraw/zinc/07/17/05/1052071705.db2.gz DWEGNAYSEYHCMO-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO Cc1ncc(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808708399 1052071234 /nfs/dbraw/zinc/07/12/34/1052071234.db2.gz LTJNWXYWABFBAS-SNVBAGLBSA-N 1 0 310.850 4.012 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](C)c2nccs2)c1O ZINC000808713632 1052073264 /nfs/dbraw/zinc/07/32/64/1052073264.db2.gz JFVYCPPCVRXMCP-WDEREUQCSA-N 1 0 310.850 4.265 20 10 DICDRO COc1cnccc1[C@@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808714742 1052075607 /nfs/dbraw/zinc/07/56/07/1052075607.db2.gz BLIQTMJDAZZQBB-VXGBXAGGSA-N 1 0 320.820 4.169 20 10 DICDRO COc1cnccc1[C@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808714738 1052075846 /nfs/dbraw/zinc/07/58/46/1052075846.db2.gz BLIQTMJDAZZQBB-NWDGAFQWSA-N 1 0 320.820 4.169 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)[C@H](O)c2ccccc2)c1O ZINC000808720656 1052077412 /nfs/dbraw/zinc/07/74/12/1052077412.db2.gz BMKAKEYHBZMKEY-JCGVRSQUSA-N 1 0 319.832 4.127 20 10 DICDRO Cc1nc(C)c(CC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808694061 1052083213 /nfs/dbraw/zinc/08/32/13/1052083213.db2.gz ZTLAGYOLYLGABH-JTQLQIEISA-N 1 0 324.877 4.321 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1ccccc1O ZINC000808727611 1052083236 /nfs/dbraw/zinc/08/32/36/1052083236.db2.gz JTMFXMJESIBILU-YVWKXTFCSA-N 1 0 311.425 4.353 20 10 DICDRO Cc1cc(C[NH2+][C@H]2CCO[C@@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000769711610 1052097845 /nfs/dbraw/zinc/09/78/45/1052097845.db2.gz REUCPTVOBLEYSW-LPHOPBHVSA-N 1 0 312.457 4.060 20 10 DICDRO Cc1cc(C[NH2+][C@H]2CCO[C@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000769711579 1052097950 /nfs/dbraw/zinc/09/79/50/1052097950.db2.gz REUCPTVOBLEYSW-APWZRJJASA-N 1 0 312.457 4.060 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccc(N(C)C)cc1 ZINC000769788054 1052110163 /nfs/dbraw/zinc/11/01/63/1052110163.db2.gz GOFXIBJPSHBRLC-GFCCVEGCSA-N 1 0 323.362 4.017 20 10 DICDRO C[C@@H]1C[NH2+]C[C@@H]1Oc1ccc(/N=N/c2ccc(N(C)C)cc2)cc1 ZINC001217967186 1052178000 /nfs/dbraw/zinc/17/80/00/1052178000.db2.gz DKFUBOFBECZQHG-OYYKLEPFSA-N 1 0 324.428 4.155 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2CCCC[NH2+]C2)=C1 ZINC001217973934 1052179896 /nfs/dbraw/zinc/17/98/96/1052179896.db2.gz LASLNOGNGCALBT-BZROSYFNSA-N 1 0 311.385 4.329 20 10 DICDRO C[C@@H]1C[C@@H](OC2=CC(=O)C=CC2=NNc2ccccc2)CC[NH2+]1 ZINC001218052302 1052189229 /nfs/dbraw/zinc/18/92/29/1052189229.db2.gz APTMYXYVSAJGFL-CYKZGBLISA-N 1 0 311.385 4.327 20 10 DICDRO c1ccc(/N=N/c2c(OC3C[NH2+]C3)ccc3ccccc32)nc1 ZINC001218050200 1052190107 /nfs/dbraw/zinc/19/01/07/1052190107.db2.gz QOGGNPMMOKVPNJ-QURGRASLSA-N 1 0 304.353 4.001 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(OC2CC3(CC[NH2+]3)C2)=C1 ZINC001218247170 1052211443 /nfs/dbraw/zinc/21/14/43/1052211443.db2.gz ZSWPNJVAPHXRTL-QZQOTICOSA-N 1 0 309.369 4.081 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2C[C@H]3[NH2+]CC[C@H]3C2)=C1 ZINC001218249604 1052212714 /nfs/dbraw/zinc/21/27/14/1052212714.db2.gz KACSUIWQQPLIHV-IDXPZVDFSA-N 1 0 323.396 4.327 20 10 DICDRO CN(C)c1ccc(/N=N/c2ccc(O[C@H]3CCC[NH2+]C3)cc2)cc1 ZINC001218286505 1052218086 /nfs/dbraw/zinc/21/80/86/1052218086.db2.gz UXNHTSCFDGQKOC-XJUMHSELSA-N 1 0 324.428 4.299 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@@H]1C[NH2+][C@H]1C ZINC001218392225 1052233440 /nfs/dbraw/zinc/23/34/40/1052233440.db2.gz OXMXPGWWVFWDHO-SCLBCKFNSA-N 1 0 310.401 4.189 20 10 DICDRO C[C@@H]1CC[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)C[NH2+]1 ZINC001218404565 1052234286 /nfs/dbraw/zinc/23/42/86/1052234286.db2.gz JQJVPPBEHXOETG-OKHLRRJLSA-N 1 0 311.385 4.327 20 10 DICDRO C[C@@H]1C[NH2+]CC[C@@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001218425695 1052237074 /nfs/dbraw/zinc/23/70/74/1052237074.db2.gz ULHRAOMIIYQETB-ACJLOTCBSA-N 1 0 311.385 4.184 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1Cc2ccccc2O1)c1ccc2ccccc2c1O ZINC000324389255 1052307830 /nfs/dbraw/zinc/30/78/30/1052307830.db2.gz PPKXUAOBSOMOTK-PBHICJAKSA-N 1 0 319.404 4.200 20 10 DICDRO COc1cc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)c(O)cc1C ZINC000762119176 1052309531 /nfs/dbraw/zinc/30/95/31/1052309531.db2.gz KMUXMSMTCHNZHE-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO Cc1cnc(C2CC[NH+](Cc3cc(C)cc(C)c3O)CC2)s1 ZINC000762170590 1052325386 /nfs/dbraw/zinc/32/53/86/1052325386.db2.gz OBJYCOOBCRLWQW-UHFFFAOYSA-N 1 0 316.470 4.154 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1ccc(F)c(Cl)c1Cl ZINC000762442014 1052384183 /nfs/dbraw/zinc/38/41/83/1052384183.db2.gz DYGJTULHPBMHPH-UHFFFAOYSA-N 1 0 300.160 4.128 20 10 DICDRO COc1ccc(O)c(C[NH2+]Cc2csc(Cl)c2Cl)c1 ZINC000762442020 1052383911 /nfs/dbraw/zinc/38/39/11/1052383911.db2.gz FFNYWHDMYHEJLG-UHFFFAOYSA-N 1 0 318.225 4.059 20 10 DICDRO COc1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cc1C ZINC000762628440 1052408742 /nfs/dbraw/zinc/40/87/42/1052408742.db2.gz MWXYKLCSKJWYGN-UHFFFAOYSA-N 1 0 317.379 4.451 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2cccc(OC(C)C)c2)c1O ZINC000237230573 1052437569 /nfs/dbraw/zinc/43/75/69/1052437569.db2.gz JBCNOWWFNOYRRZ-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO COc1cc(C[N@H+](C)Cc2ccccc2)c(O)c(C(C)(C)C)c1 ZINC000915789733 1052477500 /nfs/dbraw/zinc/47/75/00/1052477500.db2.gz IQVBVAGLOBMLCN-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO Nc1ccc(C[NH+]2CCC3(CCCc4ccccc43)CC2)cc1 ZINC001222614169 1052518574 /nfs/dbraw/zinc/51/85/74/1052518574.db2.gz BFOBMUUZUGQAFB-UHFFFAOYSA-N 1 0 306.453 4.139 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2ccc(Cl)cc2)c1 ZINC000915876451 1052525332 /nfs/dbraw/zinc/52/53/32/1052525332.db2.gz WEPWOHPLUSCZDJ-STQMWFEESA-N 1 0 319.832 4.336 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000324574734 1052554153 /nfs/dbraw/zinc/55/41/53/1052554153.db2.gz XVAXKKJQLBFBEV-MRXNPFEDSA-N 1 0 324.468 4.237 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](O)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000153873363 1052591941 /nfs/dbraw/zinc/59/19/41/1052591941.db2.gz ANBGMKBOKTXYRW-DYESRHJHSA-N 1 0 324.468 4.061 20 10 DICDRO Cc1cccc(OCC[NH2+]Cc2ccc(N3CCCCC3)cc2)c1 ZINC000324712646 1052665056 /nfs/dbraw/zinc/66/50/56/1052665056.db2.gz DAACRFWGMRNUCN-UHFFFAOYSA-N 1 0 324.468 4.154 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2C[C@@H]3CNc4ccccc4[C@H]3C2)c(O)c1 ZINC001224262227 1052683105 /nfs/dbraw/zinc/68/31/05/1052683105.db2.gz COBROGKWPIZYTC-HKUYNNGSSA-N 1 0 322.452 4.157 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(F)c(F)c1 ZINC000917074645 1052691415 /nfs/dbraw/zinc/69/14/15/1052691415.db2.gz FGBQBEIMZMOKRC-UHFFFAOYSA-N 1 0 318.411 4.441 20 10 DICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC1(Cl)Cl ZINC000917075518 1052691479 /nfs/dbraw/zinc/69/14/79/1052691479.db2.gz YJBCNQRPWWXETN-AWEZNQCLSA-N 1 0 315.288 4.157 20 10 DICDRO Cc1cc(C[N@@H+]2CCO[C@@H]3CCCC[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC000917473601 1052729351 /nfs/dbraw/zinc/72/93/51/1052729351.db2.gz QYVYJKPHTNGGMH-ZWKOTPCHSA-N 1 0 317.473 4.142 20 10 DICDRO CC1CCC([N@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000917456691 1052729812 /nfs/dbraw/zinc/72/98/12/1052729812.db2.gz SNDGLNFOTXPAMX-UHFFFAOYSA-N 1 0 305.462 4.406 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)C2Cc3ccccc3C2)cc1C(C)C ZINC000919950174 1052905506 /nfs/dbraw/zinc/90/55/06/1052905506.db2.gz HJMOWROJAYOYKD-UHFFFAOYSA-N 1 0 309.453 4.423 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(OC(C)(C)C)cc2)cc1 ZINC000920415446 1052938327 /nfs/dbraw/zinc/93/83/27/1052938327.db2.gz VXTLHHUBXFSGMT-UHFFFAOYSA-N 1 0 312.457 4.220 20 10 DICDRO Fc1ccc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCCC2)cc1 ZINC000237830497 1053031108 /nfs/dbraw/zinc/03/11/08/1053031108.db2.gz JYFPMCKFRYUOJJ-UHFFFAOYSA-N 1 0 311.400 4.320 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Br)c(F)c1)c1ccccc1O ZINC000179900075 1053033128 /nfs/dbraw/zinc/03/31/28/1053033128.db2.gz DDPUJZQKUQRWTP-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)cc(Br)c1)c1ccccc1O ZINC000179896015 1053033549 /nfs/dbraw/zinc/03/35/49/1053033549.db2.gz CZPHNTWBYTZSOP-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO Cc1cccc2c(CC[NH2+]Cc3cc(C)c(C)cc3O)c[nH]c21 ZINC000237860833 1053034046 /nfs/dbraw/zinc/03/40/46/1053034046.db2.gz UQGDPXOOUOELPV-UHFFFAOYSA-N 1 0 308.425 4.131 20 10 DICDRO Cc1cccc2[nH]cc(CC[NH2+]Cc3cc(C)c(C)cc3O)c21 ZINC000237860911 1053034190 /nfs/dbraw/zinc/03/41/90/1053034190.db2.gz IIKUDPDIEGRZAL-UHFFFAOYSA-N 1 0 308.425 4.131 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2cccc(N)c2)cc1 ZINC000849350874 1053088876 /nfs/dbraw/zinc/08/88/76/1053088876.db2.gz ZYNLKDIMJFFVQT-UHFFFAOYSA-N 1 0 311.473 4.185 20 10 DICDRO C[C@H](C[N+](C)(C)C)Oc1ccccc1NN=C1C=CC=CC1=O ZINC001228420867 1053099817 /nfs/dbraw/zinc/09/98/17/1053099817.db2.gz ZQRPESRGMDSWJY-CQSZACIVSA-O 1 0 314.409 4.281 20 10 DICDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(N3CCCC3)cc2)n1 ZINC001319712664 1053265673 /nfs/dbraw/zinc/26/56/73/1053265673.db2.gz RISXGFAQTNEUMO-OAQYLSRUSA-N 1 0 321.468 4.327 20 10 DICDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC001319828921 1053277076 /nfs/dbraw/zinc/27/70/76/1053277076.db2.gz ORNGVCUQYPZICV-RBUKOAKNSA-N 1 0 316.514 4.147 20 10 DICDRO c1cc2c(s1)CCC[N@@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001319949629 1053288620 /nfs/dbraw/zinc/28/86/20/1053288620.db2.gz ATKYFVOIXIHFMI-UHFFFAOYSA-N 1 0 312.482 4.297 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)cc1 ZINC001320121425 1053307850 /nfs/dbraw/zinc/30/78/50/1053307850.db2.gz AVMKENWDYXPWFP-PBHICJAKSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](CCO)C1CCCCC1 ZINC001320124815 1053307863 /nfs/dbraw/zinc/30/78/63/1053307863.db2.gz MOSRYFVXIFNIAF-OIISXLGYSA-N 1 0 317.473 4.170 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@](C)(O)CCC(C)C ZINC001320119101 1053308195 /nfs/dbraw/zinc/30/81/95/1053308195.db2.gz WNRGKRIZIKZGDX-CLCXKQKWSA-N 1 0 305.462 4.026 20 10 DICDRO C[C@@H]([NH2+]CCc1c(F)cccc1Cl)c1cc(F)ccc1O ZINC001320130645 1053308756 /nfs/dbraw/zinc/30/87/56/1053308756.db2.gz AQOULZMUSMPKGC-SNVBAGLBSA-N 1 0 311.759 4.217 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+][C@H]1CCCc2nc(C)ncc21 ZINC001320410978 1053332418 /nfs/dbraw/zinc/33/24/18/1053332418.db2.gz JFWWYYCJWRCWRA-ZLIFDBKOSA-N 1 0 323.440 4.015 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@]1(C)CCO[C@H]1C1CC1 ZINC001320570300 1053346307 /nfs/dbraw/zinc/34/63/07/1053346307.db2.gz SDQDUSOKTVTVOP-NNSOFZPJSA-N 1 0 315.457 4.044 20 10 DICDRO C[C@H]([NH2+]CCCCCCO)c1ccc(N2CCCCCC2)cc1 ZINC000182144188 1053359966 /nfs/dbraw/zinc/35/99/66/1053359966.db2.gz RWCXVZBUEQOEBC-SFHVURJKSA-N 1 0 318.505 4.270 20 10 DICDRO CCOC1CC(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)C1 ZINC001320793842 1053362321 /nfs/dbraw/zinc/36/23/21/1053362321.db2.gz ZRIUVXZSQVOZOI-LBDPXKHJSA-N 1 0 303.446 4.044 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1cccc(N(C)C)c1 ZINC001321023701 1053383546 /nfs/dbraw/zinc/38/35/46/1053383546.db2.gz OIPJRIOGRQBWPY-YOEHRIQHSA-N 1 0 310.441 4.105 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](OC)c1ccc(F)cc1)c1ccc(C)cc1O ZINC001321235816 1053402841 /nfs/dbraw/zinc/40/28/41/1053402841.db2.gz NDARSJIOHOETHS-MJGOQNOKSA-N 1 0 317.404 4.268 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCCC12CCOCC2 ZINC001321239371 1053403503 /nfs/dbraw/zinc/40/35/03/1053403503.db2.gz KHLKITNNYRELKF-INMHGKMJSA-N 1 0 315.457 4.188 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCCC12CCOCC2 ZINC001321239372 1053403696 /nfs/dbraw/zinc/40/36/96/1053403696.db2.gz KHLKITNNYRELKF-VYDXJSESSA-N 1 0 315.457 4.188 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc2c(n1)CCCC2 ZINC001321280804 1053404825 /nfs/dbraw/zinc/40/48/25/1053404825.db2.gz BWYKIFYTUXIXBX-RDTXWAMCSA-N 1 0 322.452 4.313 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2C[NH+]3CCC2CC3)=C1 ZINC001229813799 1053408732 /nfs/dbraw/zinc/40/87/32/1053408732.db2.gz BCOAEGRQHBPQAU-GEXZYOHASA-N 1 0 323.396 4.281 20 10 DICDRO C[N@@H+]1CCC[C@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C1 ZINC001229813419 1053408899 /nfs/dbraw/zinc/40/88/99/1053408899.db2.gz HXYGHJBIMPCBEQ-QBNCKDSPSA-N 1 0 311.385 4.281 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCC1C[C@H](C)O[C@@H](C)C1 ZINC001321457405 1053413956 /nfs/dbraw/zinc/41/39/56/1053413956.db2.gz OQLVEEUUBPWTSO-AESZEHBQSA-N 1 0 317.473 4.432 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2csc(C(C)(C)C)n2)c1 ZINC000182429494 1053433442 /nfs/dbraw/zinc/43/34/42/1053433442.db2.gz UKVFEJQAIWVMDF-LLVKDONJSA-N 1 0 320.458 4.006 20 10 DICDRO Cc1cccc(CCC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC001321859189 1053438688 /nfs/dbraw/zinc/43/86/88/1053438688.db2.gz VUYXGRCAVXBVBV-YOEHRIQHSA-N 1 0 310.441 4.175 20 10 DICDRO Cc1cccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)c1O ZINC000182676357 1053494432 /nfs/dbraw/zinc/49/44/32/1053494432.db2.gz LRQXXHYPFSJQCH-UHFFFAOYSA-N 1 0 303.352 4.148 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2cc(C)cc(C)c2)c1O ZINC000182945052 1053558786 /nfs/dbraw/zinc/55/87/86/1053558786.db2.gz PKSFOPGLGWUIOF-CYBMUJFWSA-N 1 0 315.388 4.202 20 10 DICDRO CS[C@@H]1CC[C@H]([N@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC001323271110 1053569972 /nfs/dbraw/zinc/56/99/72/1053569972.db2.gz YLBCAILTEBGVMY-LSDHHAIUSA-N 1 0 323.502 4.111 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCOc2ccccc21 ZINC001200365312 1053594246 /nfs/dbraw/zinc/59/42/46/1053594246.db2.gz IPDMIFBCOSRUDJ-MRXNPFEDSA-N 1 0 320.436 4.143 20 10 DICDRO c1coc(C2=CCC[N@@H+](Cc3ccc(N4CCCC4)cc3)C2)c1 ZINC001323749055 1053599796 /nfs/dbraw/zinc/59/97/96/1053599796.db2.gz QYKSDCHNLWDRKK-UHFFFAOYSA-N 1 0 308.425 4.169 20 10 DICDRO Cc1csc(CCC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC001323828429 1053603668 /nfs/dbraw/zinc/60/36/68/1053603668.db2.gz AQHOTCCUGUZNCH-ZWNOBZJWSA-N 1 0 320.433 4.067 20 10 DICDRO CCOCCC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001323829887 1053603963 /nfs/dbraw/zinc/60/39/63/1053603963.db2.gz NDWLOLDSCIZYRO-HUUCEWRRSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)CCc1ccc(O)cc1 ZINC000326835243 1053619664 /nfs/dbraw/zinc/61/96/64/1053619664.db2.gz NCSUBFDOJZVJPK-OAHLLOKOSA-N 1 0 322.452 4.303 20 10 DICDRO CC[C@@H]([NH2+]CCc1cc(Cl)ccc1OC)c1ccccc1O ZINC001324135947 1053628845 /nfs/dbraw/zinc/62/88/45/1053628845.db2.gz IXJBZQMAXBDGMI-MRXNPFEDSA-N 1 0 319.832 4.338 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)c1ccc(F)cc1 ZINC001324239521 1053636030 /nfs/dbraw/zinc/63/60/30/1053636030.db2.gz IBCDPSXOJRPGPY-KDOFPFPSSA-N 1 0 317.404 4.186 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Br)o2)c(O)c1C ZINC001324337171 1053646683 /nfs/dbraw/zinc/64/66/83/1053646683.db2.gz YCMZFBKKGHRMTQ-LLVKDONJSA-N 1 0 324.218 4.215 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]C/C=C/C1CC1 ZINC001324554379 1053661135 /nfs/dbraw/zinc/66/11/35/1053661135.db2.gz LDJREIKIVQQGSN-QPJJXVBHSA-N 1 0 309.409 4.027 20 10 DICDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC001324676490 1053670849 /nfs/dbraw/zinc/67/08/49/1053670849.db2.gz KZMMFFJYDJZRIT-IBGZPJMESA-N 1 0 316.514 4.006 20 10 DICDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC001324676495 1053671628 /nfs/dbraw/zinc/67/16/28/1053671628.db2.gz KZMMFFJYDJZRIT-LJQANCHMSA-N 1 0 316.514 4.006 20 10 DICDRO C[C@H](NC(C)(C)C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000183512350 1053672661 /nfs/dbraw/zinc/67/26/61/1053672661.db2.gz AHMJLVAKHDFGOM-HOTGVXAUSA-N 1 0 312.457 4.172 20 10 DICDRO Cc1noc(C)c1CCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001325341674 1053715618 /nfs/dbraw/zinc/71/56/18/1053715618.db2.gz XXMADCUHIBCMBH-MLGOLLRUSA-N 1 0 314.429 4.076 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC[C@@H]1CCO[C@H](C)C1 ZINC001325357202 1053716238 /nfs/dbraw/zinc/71/62/38/1053716238.db2.gz PZWNMZZFSFVOHY-FPCVCCKLSA-N 1 0 303.446 4.044 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC[C@@H]1CCO[C@@H](C)C1 ZINC001325357205 1053716473 /nfs/dbraw/zinc/71/64/73/1053716473.db2.gz PZWNMZZFSFVOHY-QXSJWSMHSA-N 1 0 303.446 4.044 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccc(F)cc1 ZINC001325355854 1053716859 /nfs/dbraw/zinc/71/68/59/1053716859.db2.gz GNHVLXHYMIGAAW-DIFFPNOSSA-N 1 0 323.795 4.223 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccccc1N(C)C ZINC001325356780 1053717262 /nfs/dbraw/zinc/71/72/62/1053717262.db2.gz MJLKXOCHMOJFSM-ZBFHGGJFSA-N 1 0 310.441 4.105 20 10 DICDRO CC(C)(C)c1ccncc1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001325582107 1053722092 /nfs/dbraw/zinc/72/20/92/1053722092.db2.gz OALJEMGWLRFPOR-UHFFFAOYSA-N 1 0 323.484 4.269 20 10 DICDRO CC[N@@H+]1CC[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001231320610 1053727015 /nfs/dbraw/zinc/72/70/15/1053727015.db2.gz QPSQYEPYJXRHCX-SFHVURJKSA-N 1 0 311.385 4.281 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC001326035485 1053745548 /nfs/dbraw/zinc/74/55/48/1053745548.db2.gz JQULCIXUHXUSBD-XWIAVFTESA-N 1 0 322.452 4.498 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2cc3ccccc3[nH]2)ccc1N(C)C ZINC001326247729 1053767767 /nfs/dbraw/zinc/76/77/67/1053767767.db2.gz ITYXZNJGRXEKDC-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO Cc1cccc(C[NH+]2CCC3(C=Cc4ccccc43)CC2)c1O ZINC001231593111 1053791377 /nfs/dbraw/zinc/79/13/77/1053791377.db2.gz ZMJWRPVZDCADDI-UHFFFAOYSA-N 1 0 305.421 4.261 20 10 DICDRO Oc1ccc2ccccc2c1C[N@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001231587701 1053791539 /nfs/dbraw/zinc/79/15/39/1053791539.db2.gz YAXGSOFLWDYKTO-CJNGLKHVSA-N 1 0 303.352 4.023 20 10 DICDRO CCC[N@H+](CCc1ccccn1)Cc1c(O)ccc2ccccc21 ZINC001231590830 1053791983 /nfs/dbraw/zinc/79/19/83/1053791983.db2.gz NDNMFVWGIYVCFJ-UHFFFAOYSA-N 1 0 320.436 4.395 20 10 DICDRO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cccc(C)c1O ZINC001231594697 1053792527 /nfs/dbraw/zinc/79/25/27/1053792527.db2.gz NQWACUBILYKYEX-GOSISDBHSA-N 1 0 311.425 4.184 20 10 DICDRO C[N@H+](Cc1cccc(F)c1F)Cc1c(O)ccc2ccccc21 ZINC001231589545 1053792601 /nfs/dbraw/zinc/79/26/01/1053792601.db2.gz JZGMDWGTZVJBGT-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO COc1cccc([C@H]2CCC[N@H+](Cc3cccc(C)c3O)C2)c1 ZINC001231594353 1053793087 /nfs/dbraw/zinc/79/30/87/1053793087.db2.gz FROCAVJUDYTGJD-KRWDZBQOSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1cccc(C[NH+]2CCC(Sc3ccccc3)CC2)c1O ZINC001231594272 1053793265 /nfs/dbraw/zinc/79/32/65/1053793265.db2.gz CYLJEYKJHQDVPD-UHFFFAOYSA-N 1 0 313.466 4.457 20 10 DICDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CCC1(F)F ZINC001231588258 1053794203 /nfs/dbraw/zinc/79/42/03/1053794203.db2.gz NZTUABMBZMAWTF-ZDUSSCGKSA-N 1 0 305.368 4.413 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCCc1ncccc1C ZINC001326622967 1053795349 /nfs/dbraw/zinc/79/53/49/1053795349.db2.gz NORDZYGPCNQYCA-WBVHZDCISA-N 1 0 310.441 4.175 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1cc(F)cnc1Cl ZINC001326621998 1053796155 /nfs/dbraw/zinc/79/61/55/1053796155.db2.gz BSDJKLUZRYJFAP-ZWNOBZJWSA-N 1 0 320.795 4.226 20 10 DICDRO Nc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001327416142 1053859097 /nfs/dbraw/zinc/85/90/97/1053859097.db2.gz OSJNCXPJNABBGZ-OAQYLSRUSA-N 1 0 321.468 4.036 20 10 DICDRO COc1cccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c1C ZINC001327614499 1053867869 /nfs/dbraw/zinc/86/78/69/1053867869.db2.gz UWUIDBYIQUSGFF-BBRMVZONSA-N 1 0 311.425 4.356 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc(-c3ccccc3)o1)CC2 ZINC001231813753 1053872601 /nfs/dbraw/zinc/87/26/01/1053872601.db2.gz RNIWJXAMJDJDGB-UHFFFAOYSA-N 1 0 305.377 4.211 20 10 DICDRO COCC1(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC001327835694 1053881986 /nfs/dbraw/zinc/88/19/86/1053881986.db2.gz XUAOASPONHXWSG-GJZGRUSLSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1cc(C)c(C[NH+]2CCC(Oc3ccccc3)CC2)c(O)c1 ZINC001231841947 1053888400 /nfs/dbraw/zinc/88/84/00/1053888400.db2.gz HUJJTQISWGMGMT-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1c(C)cc(C)cc1O ZINC001231849955 1053889425 /nfs/dbraw/zinc/88/94/25/1053889425.db2.gz XYHIAPGGXJLYFB-INIZCTEOSA-N 1 0 313.441 4.081 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)cc1Cl ZINC001231867514 1053894554 /nfs/dbraw/zinc/89/45/54/1053894554.db2.gz LSPMOCJNHXOGCF-LLVKDONJSA-N 1 0 303.780 4.221 20 10 DICDRO CC[C@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000183989448 1053897834 /nfs/dbraw/zinc/89/78/34/1053897834.db2.gz KLEZIMRHMWZJCS-MOPGFXCFSA-N 1 0 304.478 4.143 20 10 DICDRO C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CCC1(F)F ZINC001231879485 1053901943 /nfs/dbraw/zinc/90/19/43/1053901943.db2.gz DUOMVKYKLCLRML-ZDUSSCGKSA-N 1 0 305.368 4.413 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@H]2c2nccs2)ccc2ccccc21 ZINC001231880305 1053902729 /nfs/dbraw/zinc/90/27/29/1053902729.db2.gz BLIMLGGLKOQHEX-INIZCTEOSA-N 1 0 310.422 4.339 20 10 DICDRO C[C@H]([NH2+]Cc1cnc(-c2ccccc2)o1)c1ccc(N(C)C)cc1 ZINC001354627836 1053927002 /nfs/dbraw/zinc/92/70/02/1053927002.db2.gz ZXGPKPOMKNVRAC-HNNXBMFYSA-N 1 0 321.424 4.258 20 10 DICDRO Cc1ccccc1O[C@@H](C)C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001200772620 1053962078 /nfs/dbraw/zinc/96/20/78/1053962078.db2.gz CYZQNCYWIATACH-CNRGFGOASA-N 1 0 324.468 4.131 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccnc(C(C)(C)C)c2)cc1 ZINC001232220614 1053996689 /nfs/dbraw/zinc/99/66/89/1053996689.db2.gz ODULATSDENHITG-UHFFFAOYSA-N 1 0 311.473 4.077 20 10 DICDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)c(O)cc2O)cc1 ZINC001232262054 1054005221 /nfs/dbraw/zinc/00/52/21/1054005221.db2.gz YQBAVTSTFQMSGF-MRXNPFEDSA-N 1 0 317.816 4.397 20 10 DICDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232262916 1054006286 /nfs/dbraw/zinc/00/62/86/1054006286.db2.gz VZIHUWGTBXSSSH-MRXNPFEDSA-N 1 0 317.816 4.261 20 10 DICDRO Cc1ccc(OC(C)C)c(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001232397770 1054039148 /nfs/dbraw/zinc/03/91/48/1054039148.db2.gz ATZZXSBDWBGEAN-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)CC1CC(F)(F)C1 ZINC001330592617 1054043854 /nfs/dbraw/zinc/04/38/54/1054043854.db2.gz NYKLZLJOGPDTLR-UHFFFAOYSA-N 1 0 307.340 4.033 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(OC(F)F)c1 ZINC000296182911 1054085480 /nfs/dbraw/zinc/08/54/80/1054085480.db2.gz YEUIPMAOAOAXTJ-IAQYHMDHSA-N 1 0 319.351 4.332 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@H](F)C1)c1ccc(Br)cc1O ZINC001332341534 1054114455 /nfs/dbraw/zinc/11/44/55/1054114455.db2.gz WVQQFBJCRHHDRH-DLOVCJGASA-N 1 0 316.214 4.086 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)c(O)c1 ZINC001232840162 1054127046 /nfs/dbraw/zinc/12/70/46/1054127046.db2.gz NNWJEFXXIGVKMY-GOSISDBHSA-N 1 0 324.468 4.228 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3[nH]ccc3c2)cc1 ZINC000848527718 1054126799 /nfs/dbraw/zinc/12/67/99/1054126799.db2.gz DWXRDASORYRQPP-UHFFFAOYSA-N 1 0 307.441 4.304 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](CC)c2ccccc2F)c1 ZINC000848557703 1054149662 /nfs/dbraw/zinc/14/96/62/1054149662.db2.gz JNVBPKSIFHFEEA-QGZVFWFLSA-N 1 0 303.377 4.171 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(Br)c2C)c1 ZINC000848561853 1054150841 /nfs/dbraw/zinc/15/08/41/1054150841.db2.gz DYOCKJUSNSTUOG-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)Cc2ccccn2)c1O ZINC000848565972 1054153541 /nfs/dbraw/zinc/15/35/41/1054153541.db2.gz VTEZZHCCGBKTNS-OLZOCXBDSA-N 1 0 304.821 4.031 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1O ZINC000848567629 1054155116 /nfs/dbraw/zinc/15/51/16/1054155116.db2.gz KEFBNCISHMPVGX-RYUDHWBXSA-N 1 0 313.388 4.265 20 10 DICDRO C[C@@H]([NH2+]Cc1noc2ccccc12)c1cc2c(cc1O)CCCC2 ZINC000848574780 1054157076 /nfs/dbraw/zinc/15/70/76/1054157076.db2.gz ICXJJRZVUKBVLK-CYBMUJFWSA-N 1 0 322.408 4.263 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2noc3ccccc32)c2c1c(F)ccc2O ZINC000848574206 1054157202 /nfs/dbraw/zinc/15/72/02/1054157202.db2.gz BYNHTOZWUOVBHZ-GWCFXTLKSA-N 1 0 312.344 4.011 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c(Cl)n1 ZINC001333595602 1054162804 /nfs/dbraw/zinc/16/28/04/1054162804.db2.gz LSKXYAXCNBJMOJ-SMDDNHRTSA-N 1 0 316.832 4.396 20 10 DICDRO C[N@H+](CCCC(F)(F)F)Cc1ccc(N2CCCCC2)cc1 ZINC001333650450 1054166421 /nfs/dbraw/zinc/16/64/21/1054166421.db2.gz KEIBZTWSCKOWGN-UHFFFAOYSA-N 1 0 314.395 4.451 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC001333766393 1054170528 /nfs/dbraw/zinc/17/05/28/1054170528.db2.gz JDZFVRWTZSIXFV-JLZZUVOBSA-N 1 0 308.425 4.108 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1O)c1cc(F)ccc1OC ZINC001334319917 1054187119 /nfs/dbraw/zinc/18/71/19/1054187119.db2.gz RJZGJMRZGXDVST-MRXNPFEDSA-N 1 0 303.377 4.089 20 10 DICDRO Nc1ccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)cc1 ZINC001334755087 1054197160 /nfs/dbraw/zinc/19/71/60/1054197160.db2.gz VFBLSZZHYFQLAB-UHFFFAOYSA-N 1 0 320.358 4.457 20 10 DICDRO Nc1ccc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)cc1 ZINC001335288843 1054212774 /nfs/dbraw/zinc/21/27/74/1054212774.db2.gz IDKDWEJCEVXUHF-KRWDZBQOSA-N 1 0 307.397 4.137 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001233286329 1054221850 /nfs/dbraw/zinc/22/18/50/1054221850.db2.gz OVMWTMVZKJBOJL-UHFFFAOYSA-N 1 0 311.425 4.214 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c1 ZINC001233286007 1054222181 /nfs/dbraw/zinc/22/21/81/1054222181.db2.gz APLRUZOPRDKBQP-SFHVURJKSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c1 ZINC001233283907 1054222481 /nfs/dbraw/zinc/22/24/81/1054222481.db2.gz AMMLGAWSMVKFKU-HNNXBMFYSA-N 1 0 315.379 4.259 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCc3ccsc3C2)c1 ZINC001233286275 1054222632 /nfs/dbraw/zinc/22/26/32/1054222632.db2.gz MXXQHGNSZILJEK-UHFFFAOYSA-N 1 0 301.455 4.310 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c1 ZINC001233286347 1054224362 /nfs/dbraw/zinc/22/43/62/1054224362.db2.gz PPUXKTWYJRVZLC-CYBMUJFWSA-N 1 0 301.352 4.074 20 10 DICDRO C[N@H+](Cc1nc2ccccc2o1)Cc1cc(C(C)(C)C)ccc1O ZINC001233287158 1054225319 /nfs/dbraw/zinc/22/53/19/1054225319.db2.gz YUINPSFPDQNBEE-UHFFFAOYSA-N 1 0 324.424 4.463 20 10 DICDRO [O-]c1ccc(F)c(F)c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001233332176 1054235395 /nfs/dbraw/zinc/23/53/95/1054235395.db2.gz BFOZMRAPAGYLEH-HNNXBMFYSA-N 1 0 307.315 4.147 20 10 DICDRO Cc1nc2ccccc2n1CCC[NH2+][C@H](C)c1cc(C)ccc1O ZINC000184869682 1054235808 /nfs/dbraw/zinc/23/58/08/1054235808.db2.gz PRPYTCWZOKFWDP-OAHLLOKOSA-N 1 0 323.440 4.100 20 10 DICDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001337042438 1054256597 /nfs/dbraw/zinc/25/65/97/1054256597.db2.gz MMEKOHARKIYNLA-RTBURBONSA-N 1 0 318.530 4.393 20 10 DICDRO C[N@H+](Cc1ccc(C(F)(F)F)cc1O)Cc1ccccc1F ZINC001233454034 1054277946 /nfs/dbraw/zinc/27/79/46/1054277946.db2.gz DFCLZHOCQDXXDB-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO Oc1cc(O)c(C[NH+](C2CCCCC2)C2CCCCC2)cc1O ZINC001233482620 1054281526 /nfs/dbraw/zinc/28/15/26/1054281526.db2.gz VFSQNVKHJLJQQA-UHFFFAOYSA-N 1 0 319.445 4.271 20 10 DICDRO CCc1cccc(C[NH2+]Cc2cccc(C(F)(F)F)c2)c1O ZINC000848890610 1054286838 /nfs/dbraw/zinc/28/68/38/1054286838.db2.gz JDJHPFVZKUJFSM-UHFFFAOYSA-N 1 0 309.331 4.263 20 10 DICDRO COC[C@H]([NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C)c1ccccc1 ZINC001337801576 1054287385 /nfs/dbraw/zinc/28/73/85/1054287385.db2.gz UQZSMXKFGOENCT-XIRDDKMYSA-N 1 0 311.425 4.226 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCSc3c(F)cccc32)c1O ZINC000848893021 1054288618 /nfs/dbraw/zinc/28/86/18/1054288618.db2.gz NGGSEAXLIIERMG-INIZCTEOSA-N 1 0 317.429 4.420 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2cn(C(C)(C)C)nc2C)c1O ZINC000848902695 1054291630 /nfs/dbraw/zinc/29/16/30/1054291630.db2.gz GMLKZKDXXOGDKP-CYBMUJFWSA-N 1 0 315.461 4.065 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)c1O ZINC001338250865 1054300709 /nfs/dbraw/zinc/30/07/09/1054300709.db2.gz VHTGOKDVUQAOCY-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO C[C@]1(F)CCC[N@H+](Cc2cccc(OC(F)(F)F)c2O)CC1 ZINC001233726218 1054344071 /nfs/dbraw/zinc/34/40/71/1054344071.db2.gz AIMNUEMTPRAJEG-AWEZNQCLSA-N 1 0 321.314 4.005 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)cccc1OC(F)(F)F ZINC001233761118 1054352780 /nfs/dbraw/zinc/35/27/80/1054352780.db2.gz QBFWVSUVCFCYKA-WCQYABFASA-N 1 0 315.335 4.055 20 10 DICDRO CC(C)C1CC[NH+](Cc2cccc(OC(F)(F)F)c2O)CC1 ZINC001233767470 1054355205 /nfs/dbraw/zinc/35/52/05/1054355205.db2.gz CPNOAPNTMFGQEF-UHFFFAOYSA-N 1 0 317.351 4.159 20 10 DICDRO CC[C@H](C)c1ccc(NC(=[NH2+])NCc2ccc(N(C)C)cc2)cc1 ZINC000849057042 1054365417 /nfs/dbraw/zinc/36/54/17/1054365417.db2.gz QCYPCDYPQMOWHD-HNNXBMFYSA-N 1 0 324.472 4.403 20 10 DICDRO CCN(CC)c1ccc(CNC(=[NH2+])Nc2cc(C)cc(C)c2)cc1 ZINC000849071443 1054374906 /nfs/dbraw/zinc/37/49/06/1054374906.db2.gz URLRQHXQXMKEIJ-UHFFFAOYSA-N 1 0 324.472 4.286 20 10 DICDRO CCCCOc1ncccc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185143709 1054412209 /nfs/dbraw/zinc/41/22/09/1054412209.db2.gz PMGJPSWAABRURA-OAHLLOKOSA-N 1 0 314.429 4.125 20 10 DICDRO CS[C@H](C[NH2+]Cc1ccc(N2CCCC2)cc1)C(C)(C)C ZINC001342229123 1054418530 /nfs/dbraw/zinc/41/85/30/1054418530.db2.gz OMSAVQFREAHPBS-QGZVFWFLSA-N 1 0 306.519 4.154 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CCc2c1cccc2O ZINC001342391529 1054420582 /nfs/dbraw/zinc/42/05/82/1054420582.db2.gz ZWRMCWLVVRMEHC-DAXOMENPSA-N 1 0 309.409 4.232 20 10 DICDRO CCOc1ccccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001342390452 1054420991 /nfs/dbraw/zinc/42/09/91/1054420991.db2.gz PWXBGNHOJKGZRS-GDBMZVCRSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@H]3C[C@H](C)c4c3c(O)ccc4C)nc2c1 ZINC001342405743 1054421523 /nfs/dbraw/zinc/42/15/23/1054421523.db2.gz GEOOVLBTOBGXKS-BBRMVZONSA-N 1 0 321.424 4.223 20 10 DICDRO CCO[C@H](C[NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccc1 ZINC001343922489 1054457306 /nfs/dbraw/zinc/45/73/06/1054457306.db2.gz HVJBSHFOKGSBDR-OAQYLSRUSA-N 1 0 324.468 4.154 20 10 DICDRO CCCC[N@H+](Cc1nc(C)sc1C)Cc1ccccc1O ZINC001344677096 1054477530 /nfs/dbraw/zinc/47/75/30/1054477530.db2.gz SJXYYQPARMGXDK-UHFFFAOYSA-N 1 0 304.459 4.268 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1cccc2c1CCCN2 ZINC001345483028 1054496061 /nfs/dbraw/zinc/49/60/61/1054496061.db2.gz PXHNYSHOESONFL-RDTXWAMCSA-N 1 0 322.452 4.397 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cc1O ZINC000185300814 1054513297 /nfs/dbraw/zinc/51/32/97/1054513297.db2.gz SMHKHLJOMUWRHB-ZDUSSCGKSA-N 1 0 323.392 4.110 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2nc(C(C)(C)C)cs2)c(O)c1 ZINC000185373906 1054533297 /nfs/dbraw/zinc/53/32/97/1054533297.db2.gz ORTLVJJENKFCSG-CYBMUJFWSA-N 1 0 318.486 4.348 20 10 DICDRO CC(C)[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000072786420 1054534987 /nfs/dbraw/zinc/53/49/87/1054534987.db2.gz BMEJABHDGZBFTG-OAQYLSRUSA-N 1 0 324.468 4.010 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc3ccccc3c2)c(O)c1 ZINC000185406820 1054540024 /nfs/dbraw/zinc/54/00/24/1054540024.db2.gz ZVDBCBUOUCIOKL-VFNWGFHPSA-N 1 0 321.420 4.238 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@@H](C(F)F)C3)c2c1 ZINC001234552625 1054546333 /nfs/dbraw/zinc/54/63/33/1054546333.db2.gz CGWHOFPNISAMJO-CYBMUJFWSA-N 1 0 321.367 4.031 20 10 DICDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccc3ccccc3c2O)cn1 ZINC000185421930 1054546500 /nfs/dbraw/zinc/54/65/00/1054546500.db2.gz VCVYDVFTVMTWRH-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000185451510 1054548087 /nfs/dbraw/zinc/54/80/87/1054548087.db2.gz YTJUVONIULFYDT-UHFFFAOYSA-N 1 0 300.471 4.154 20 10 DICDRO FC1(F)[C@@H]2CC[C@H]([NH2+]Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001346843218 1054550306 /nfs/dbraw/zinc/55/03/06/1054550306.db2.gz VRNGHPBWONGIDD-JQHSSLGASA-N 1 0 320.427 4.200 20 10 DICDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185501484 1054555784 /nfs/dbraw/zinc/55/57/84/1054555784.db2.gz YRLNNBWXNDJLSU-STQMWFEESA-N 1 0 324.424 4.432 20 10 DICDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185501500 1054556190 /nfs/dbraw/zinc/55/61/90/1054556190.db2.gz YRLNNBWXNDJLSU-CHWSQXEVSA-N 1 0 324.424 4.432 20 10 DICDRO c1oc2ccccc2c1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001347629359 1054573330 /nfs/dbraw/zinc/57/33/30/1054573330.db2.gz PXNPZELXRGDGAV-UHFFFAOYSA-N 1 0 306.409 4.323 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)c1 ZINC000185571245 1054582207 /nfs/dbraw/zinc/58/22/07/1054582207.db2.gz YSDDGTQUGZZDIS-AWEZNQCLSA-N 1 0 308.381 4.206 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)c2ccc(F)cc2F)c1 ZINC000185601460 1054595880 /nfs/dbraw/zinc/59/58/80/1054595880.db2.gz VOJVCNLSKWMYBV-NWDGAFQWSA-N 1 0 321.367 4.133 20 10 DICDRO c1cc(CC2C[NH+](Cc3ccc(N4CCCC4)cc3)C2)cs1 ZINC001347941190 1054596683 /nfs/dbraw/zinc/59/66/83/1054596683.db2.gz SLSIODOVRGQMOR-UHFFFAOYSA-N 1 0 312.482 4.023 20 10 DICDRO CCC(CC)(CCO)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185621017 1054600472 /nfs/dbraw/zinc/60/04/72/1054600472.db2.gz KJJVWIUHMAJNFL-OAHLLOKOSA-N 1 0 315.457 4.385 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(C)ccc2OC(F)F)c(O)c1 ZINC000185695427 1054625795 /nfs/dbraw/zinc/62/57/95/1054625795.db2.gz SQHJSLRDBPYFGO-ZDUSSCGKSA-N 1 0 321.367 4.461 20 10 DICDRO CCOc1cc(C)ccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185706880 1054627258 /nfs/dbraw/zinc/62/72/58/1054627258.db2.gz DXLLSKXRLLXWFD-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CCC1 ZINC000185753257 1054633611 /nfs/dbraw/zinc/63/36/11/1054633611.db2.gz MOFVQGQFHKNXAA-OAHLLOKOSA-N 1 0 317.473 4.128 20 10 DICDRO C[N@H+](Cc1ccncc1)Cc1cccc(-c2ccccc2)c1O ZINC001234991376 1054637449 /nfs/dbraw/zinc/63/74/49/1054637449.db2.gz MDSURBMEQHYOSP-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO CC[N@H+](Cc1ccccn1)Cc1cccc(-c2ccccc2)c1O ZINC001234996435 1054637478 /nfs/dbraw/zinc/63/74/78/1054637478.db2.gz HMSJHUUSZUVPLM-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO C[N@H+](CCc1ccncc1)Cc1cccc(-c2ccccc2)c1O ZINC001234996057 1054638054 /nfs/dbraw/zinc/63/80/54/1054638054.db2.gz UDVOLTWPCHNJSF-UHFFFAOYSA-N 1 0 318.420 4.129 20 10 DICDRO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1cccc(-c2ccccc2)c1O ZINC001234996376 1054638863 /nfs/dbraw/zinc/63/88/63/1054638863.db2.gz GQLQJIQBMSCYFX-HDICACEKSA-N 1 0 321.420 4.145 20 10 DICDRO CO[C@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)[C@@H](C)C1 ZINC001235000880 1054640422 /nfs/dbraw/zinc/64/04/22/1054640422.db2.gz QVMRIDZKQQUCEO-YJBOKZPZSA-N 1 0 311.425 4.059 20 10 DICDRO C[N@H+](Cc1cncs1)Cc1cccc(-c2ccccc2)c1O ZINC001234998738 1054640579 /nfs/dbraw/zinc/64/05/79/1054640579.db2.gz NKHUCAAAFYBNCR-UHFFFAOYSA-N 1 0 310.422 4.148 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1cccc(-c2ccccc2)c1O ZINC001234999454 1054640741 /nfs/dbraw/zinc/64/07/41/1054640741.db2.gz VMVARWYATZPXAU-UHFFFAOYSA-N 1 0 319.404 4.397 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)cccc1-c1ccccc1 ZINC001235000477 1054641017 /nfs/dbraw/zinc/64/10/17/1054641017.db2.gz IPSFNJHJEKJXGB-FXAWDEMLSA-N 1 0 323.436 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@]3(C2)CCCOC3)cccc1-c1ccccc1 ZINC001234997119 1054641655 /nfs/dbraw/zinc/64/16/55/1054641655.db2.gz SWJODDPAMWDVPY-NRFANRHFSA-N 1 0 323.436 4.062 20 10 DICDRO CO[C@@H]1CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001234997463 1054641903 /nfs/dbraw/zinc/64/19/03/1054641903.db2.gz ZSXOWNZDRGXAJS-GOSISDBHSA-N 1 0 311.425 4.060 20 10 DICDRO COCC1CCC([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001348493456 1054651276 /nfs/dbraw/zinc/65/12/76/1054651276.db2.gz PUDWIGLYBOPNHR-SLTXQBBLSA-N 1 0 303.446 4.044 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2cccc(C(F)F)c2)c1O ZINC001349571683 1054767595 /nfs/dbraw/zinc/76/75/95/1054767595.db2.gz ASTVSDACENBYGR-LLVKDONJSA-N 1 0 307.340 4.189 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c(O)c1 ZINC001235676067 1054770126 /nfs/dbraw/zinc/77/01/26/1054770126.db2.gz PICRLYWDRBIZHZ-OAHLLOKOSA-N 1 0 315.379 4.259 20 10 DICDRO CC(C)OC1CC[NH+](Cc2ccc(C(C)(C)C)cc2O)CC1 ZINC001235681635 1054774092 /nfs/dbraw/zinc/77/40/92/1054774092.db2.gz BALGCBXGOPAXOY-UHFFFAOYSA-N 1 0 305.462 4.079 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCc2ccc3[nH]ccc3c2)cc1 ZINC001474123150 1054785980 /nfs/dbraw/zinc/78/59/80/1054785980.db2.gz LDVMEJYYEGEBRT-ONEGZZNKSA-N 1 0 319.452 4.079 20 10 DICDRO c1ccc(C2CC(C[NH2+]Cc3ccc4c(c3)CCCO4)C2)cc1 ZINC001474122760 1054787040 /nfs/dbraw/zinc/78/70/40/1054787040.db2.gz GNGCXWCYPGCFOF-UHFFFAOYSA-N 1 0 307.437 4.295 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2c[nH]c3ccccc32)c(O)c1 ZINC001236192050 1054989765 /nfs/dbraw/zinc/98/97/65/1054989765.db2.gz NLLQGDMPOPPVBN-IBGZPJMESA-N 1 0 322.408 4.219 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1c[nH]c2ccccc21 ZINC001236192911 1054990339 /nfs/dbraw/zinc/99/03/39/1054990339.db2.gz QVNFMZMOTWXSDF-SFHVURJKSA-N 1 0 310.372 4.350 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2scnc2C2CC2)cc1 ZINC000785426015 1055101076 /nfs/dbraw/zinc/10/10/76/1055101076.db2.gz KEBPWFSPMSEEEK-UHFFFAOYSA-N 1 0 315.486 4.157 20 10 DICDRO Cc1ccc(C)n1-c1ccc(-c2cccc(C[NH+](C)C)c2)cn1 ZINC001236418972 1055105589 /nfs/dbraw/zinc/10/55/89/1055105589.db2.gz IOSVOISEGRZJMW-UHFFFAOYSA-N 1 0 305.425 4.218 20 10 DICDRO Cc1cccc([C@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000764140874 1055115293 /nfs/dbraw/zinc/11/52/93/1055115293.db2.gz QGXJLVAAQIXHHX-SFHVURJKSA-N 1 0 324.468 4.025 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)CCc2ccco2)cc1 ZINC000764606277 1055216807 /nfs/dbraw/zinc/21/68/07/1055216807.db2.gz HFMPDBCYUAJJTC-HZPDHXFCSA-N 1 0 300.446 4.408 20 10 DICDRO CC[C@@H]1CCC[N@H+](Cc2cc(C)cc(Br)c2[O-])C1 ZINC001236668353 1055221292 /nfs/dbraw/zinc/22/12/92/1055221292.db2.gz COQQRYWBCNILMX-GFCCVEGCSA-N 1 0 312.251 4.085 20 10 DICDRO CC(C)COCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000764692174 1055234027 /nfs/dbraw/zinc/23/40/27/1055234027.db2.gz MNDHPIJPJJUSPV-SFHVURJKSA-N 1 0 318.505 4.390 20 10 DICDRO CC(C)(C)C[N@H+](Cc1c([O-])cccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767877 1055251233 /nfs/dbraw/zinc/25/12/33/1055251233.db2.gz PERXOOCQRRRKAQ-HDJSIYSDSA-N 1 0 324.896 4.164 20 10 DICDRO CC[C@H]1CCC[N@@H+]1Cc1cc(OCc2ccccc2)ccc1O ZINC001236784907 1055257525 /nfs/dbraw/zinc/25/75/25/1055257525.db2.gz IREZJEGZTAQNHD-SFHVURJKSA-N 1 0 311.425 4.346 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[N@H+](CC1CC1)C1CC1 ZINC001236783086 1055259807 /nfs/dbraw/zinc/25/98/07/1055259807.db2.gz PNMLKHDBPCENQV-UHFFFAOYSA-N 1 0 323.436 4.346 20 10 DICDRO COc1cc(O)c(C[N@H+](C)C/C=C/c2ccccc2)c(Cl)c1 ZINC001236802178 1055267757 /nfs/dbraw/zinc/26/77/57/1055267757.db2.gz IDGSWFFZWWTZLS-RMKNXTFCSA-N 1 0 317.816 4.199 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCc3ccccc3[C@@H]2C)c(Cl)c1 ZINC001236798087 1055269026 /nfs/dbraw/zinc/26/90/26/1055269026.db2.gz LBCITSRNRFMGHY-LBPRGKRZSA-N 1 0 317.816 4.174 20 10 DICDRO COc1cc(C)c(C[NH+]2CCC(c3cccs3)CC2)c(O)c1 ZINC001236814617 1055272889 /nfs/dbraw/zinc/27/28/89/1055272889.db2.gz VKLQLBFLTHJGQW-UHFFFAOYSA-N 1 0 317.454 4.150 20 10 DICDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1c(C)cc(OC)cc1O ZINC001236821836 1055277414 /nfs/dbraw/zinc/27/74/14/1055277414.db2.gz USDLRAPKAUSCEZ-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO C[C@@H]1C(=O)CC[N@H+](Cc2cc3ccccc3cc2O)C12CCCC2 ZINC001236835433 1055282918 /nfs/dbraw/zinc/28/29/18/1055282918.db2.gz LDSYMKMBLATLSD-OAHLLOKOSA-N 1 0 323.436 4.269 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001236831486 1055284999 /nfs/dbraw/zinc/28/49/99/1055284999.db2.gz HREKOSTVOPOKGT-INIZCTEOSA-N 1 0 310.422 4.339 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC001236838240 1055287661 /nfs/dbraw/zinc/28/76/61/1055287661.db2.gz XMAQJMIYYNZHKI-UHFFFAOYSA-N 1 0 311.425 4.081 20 10 DICDRO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000764904106 1055289629 /nfs/dbraw/zinc/28/96/29/1055289629.db2.gz XXJHHCFWJBFYSS-KRWDZBQOSA-N 1 0 324.468 4.455 20 10 DICDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)o1 ZINC000764921658 1055295438 /nfs/dbraw/zinc/29/54/38/1055295438.db2.gz UKHFZQKZMMCECO-QGZVFWFLSA-N 1 0 312.457 4.472 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(F)c3ccoc32)cc1 ZINC001236900696 1055307196 /nfs/dbraw/zinc/30/71/96/1055307196.db2.gz CTTDRWSJGJIJQG-UHFFFAOYSA-N 1 0 312.388 4.270 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCSC1)c1ccc2ccccc2c1O ZINC000384179969 1055323094 /nfs/dbraw/zinc/32/30/94/1055323094.db2.gz WMCCOKGKBLOIIC-KBPBESRZSA-N 1 0 301.455 4.339 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCSC1)c1ccc2ccccc2c1O ZINC000384179974 1055323152 /nfs/dbraw/zinc/32/31/52/1055323152.db2.gz WMCCOKGKBLOIIC-ZIAGYGMSSA-N 1 0 301.455 4.339 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](OC)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000765261042 1055346999 /nfs/dbraw/zinc/34/69/99/1055346999.db2.gz LVAOJXWAWYWOJM-VQTJNVASSA-N 1 0 312.457 4.181 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(C)cc2)c(O)c1 ZINC001237042554 1055349173 /nfs/dbraw/zinc/34/91/73/1055349173.db2.gz XPSFFOMIYCILHU-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCN(C)C[C@@H]2c2ccccc2)c(O)c1 ZINC001237045816 1055350818 /nfs/dbraw/zinc/35/08/18/1055350818.db2.gz LGPLXQCKXAVYEC-HXUWFJFHSA-N 1 0 324.468 4.004 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCc3c(Cl)cccc3C2)c(O)c1 ZINC001237044734 1055351826 /nfs/dbraw/zinc/35/18/26/1055351826.db2.gz TZTTUMKGFQSCDR-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2)c(O)c1 ZINC001237043881 1055352344 /nfs/dbraw/zinc/35/23/44/1055352344.db2.gz JZQNFXGXPIVYPS-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC[C@H]2Cc2ccccn2)c(O)c1 ZINC001237053929 1055354639 /nfs/dbraw/zinc/35/46/39/1055354639.db2.gz RKQCYQKXOQESNH-IBGZPJMESA-N 1 0 310.441 4.118 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)c(O)c1 ZINC001237053930 1055354714 /nfs/dbraw/zinc/35/47/14/1055354714.db2.gz RKQCYQKXOQESNH-LJQANCHMSA-N 1 0 310.441 4.118 20 10 DICDRO CCOc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000765281046 1055355175 /nfs/dbraw/zinc/35/51/75/1055355175.db2.gz NBHWBCOHSQARCR-MRXNPFEDSA-N 1 0 312.457 4.392 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C(=O)c3ccccc3)C2)c(O)c1 ZINC001237056807 1055355542 /nfs/dbraw/zinc/35/55/42/1055355542.db2.gz ZVIMNTDKMNFGFC-LJQANCHMSA-N 1 0 323.436 4.220 20 10 DICDRO C[C@@H]1CCCCC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001237055501 1055355949 /nfs/dbraw/zinc/35/59/49/1055355949.db2.gz NNHDXULHKUGBCC-GFCCVEGCSA-N 1 0 317.351 4.098 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765343833 1055367478 /nfs/dbraw/zinc/36/74/78/1055367478.db2.gz NGOAYYBXIYZJQW-RDJZCZTQSA-N 1 0 320.452 4.036 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(O)cc1)c1ccc(N2CCCCC2)cc1 ZINC000765350513 1055372317 /nfs/dbraw/zinc/37/23/17/1055372317.db2.gz OXUKCMQTWAOXEM-QGZVFWFLSA-N 1 0 324.468 4.276 20 10 DICDRO Oc1cc2c(cc1O)C[N@H+](Cc1ccc(C3CCC3)cc1)CCC2 ZINC001237109215 1055376431 /nfs/dbraw/zinc/37/64/31/1055376431.db2.gz XQKCWEQCLUUSKQ-UHFFFAOYSA-N 1 0 323.436 4.314 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCCC(F)(F)CC1 ZINC001237137931 1055377882 /nfs/dbraw/zinc/37/78/82/1055377882.db2.gz RWFRGCIPWOTLJH-UHFFFAOYSA-N 1 0 309.278 4.032 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001237122713 1055381620 /nfs/dbraw/zinc/38/16/20/1055381620.db2.gz LAOSBBGSNYRFBD-WCQYABFASA-N 1 0 315.335 4.055 20 10 DICDRO COCCC[C@@H](C)[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000765443516 1055392312 /nfs/dbraw/zinc/39/23/12/1055392312.db2.gz GDOMPKFBGJZCFG-QGZVFWFLSA-N 1 0 318.505 4.360 20 10 DICDRO CCC(O)(CC)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765471366 1055400630 /nfs/dbraw/zinc/40/06/30/1055400630.db2.gz CGTNPMZWJIZOQB-OAHLLOKOSA-N 1 0 322.468 4.018 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000325478837 1055403761 /nfs/dbraw/zinc/40/37/61/1055403761.db2.gz BHWUFNPNMKTKQM-HXUWFJFHSA-N 1 0 319.452 4.401 20 10 DICDRO C[C@H]([NH2+][C@H](CO)C1CCCCC1)c1ccc2ccccc2c1O ZINC000386213624 1055435745 /nfs/dbraw/zinc/43/57/45/1055435745.db2.gz UIGLGKWTAAOFOZ-IFXJQAMLSA-N 1 0 313.441 4.137 20 10 DICDRO Cc1ccccc1O[C@@H]1CCC[N@H+](Cc2c(C)cccc2O)C1 ZINC001237488913 1055458178 /nfs/dbraw/zinc/45/81/78/1055458178.db2.gz AOOGXUZIQVLEJA-QGZVFWFLSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001237490134 1055458393 /nfs/dbraw/zinc/45/83/93/1055458393.db2.gz QBDMDKSUZNITOO-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cccc(O)c1C[N@H+](C)Cc1ccccc1Br ZINC001237484063 1055458747 /nfs/dbraw/zinc/45/87/47/1055458747.db2.gz ZYGMDENGFDFNMS-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001237487077 1055458801 /nfs/dbraw/zinc/45/88/01/1055458801.db2.gz GCPURTZWTQQZSB-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H](Sc2ccc(F)cc2)C1 ZINC001237490711 1055459366 /nfs/dbraw/zinc/45/93/66/1055459366.db2.gz DQDWRJBLTLOLLR-INIZCTEOSA-N 1 0 317.429 4.206 20 10 DICDRO COc1ccccc1C1CC[NH+](Cc2c(C)cccc2O)CC1 ZINC001237487871 1055459630 /nfs/dbraw/zinc/45/96/30/1055459630.db2.gz NYVUJRKYIVMSKT-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO C[C@@]1(CF)CC[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001237640293 1055491677 /nfs/dbraw/zinc/49/16/77/1055491677.db2.gz AAPCRMYCGMLIAB-IBGZPJMESA-N 1 0 317.379 4.380 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1C[C@@H]2C[C@H]1C[C@@H]2F ZINC001237646996 1055494423 /nfs/dbraw/zinc/49/44/23/1055494423.db2.gz QOQGEZCAIUDXGZ-WBAXXEDZSA-N 1 0 315.363 4.131 20 10 DICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(Cl)cc(C)c1O ZINC001237690719 1055504017 /nfs/dbraw/zinc/50/40/17/1055504017.db2.gz ZZBDHYCMDKNJLK-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cnc2ccsc2c1 ZINC000765609414 1055513001 /nfs/dbraw/zinc/51/30/01/1055513001.db2.gz NOBMMNOPCHIXJW-GFCCVEGCSA-N 1 0 310.422 4.082 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](C)c2ncc(C)s2)cc1C ZINC001620896369 1055520791 /nfs/dbraw/zinc/52/07/91/1055520791.db2.gz KGGBIPRXRWRHNB-AWEZNQCLSA-N 1 0 318.486 4.442 20 10 DICDRO CO[C@H](C)CC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765632211 1055529179 /nfs/dbraw/zinc/52/91/79/1055529179.db2.gz YCEHEETYGPGJCR-IAGOWNOFSA-N 1 0 304.478 4.143 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H]3[C@H](C)CCC[C@@H]3C)CC2)cc1 ZINC000765638747 1055530376 /nfs/dbraw/zinc/53/03/76/1055530376.db2.gz PKLQICLWDYLSMI-IGOJGBNBSA-N 1 0 316.489 4.078 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2c3ccccc3CCC[C@H]2C)c1 ZINC000765662965 1055537981 /nfs/dbraw/zinc/53/79/81/1055537981.db2.gz PNQCDXZOEJTAIN-VLIAUNLRSA-N 1 0 311.425 4.204 20 10 DICDRO c1ccc([C@H]2CCC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001620926727 1055546093 /nfs/dbraw/zinc/54/60/93/1055546093.db2.gz CCOJLCLCLJLBRQ-AZUAARDMSA-N 1 0 307.437 4.438 20 10 DICDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001237949260 1055563644 /nfs/dbraw/zinc/56/36/44/1055563644.db2.gz JEESECSSVZBFTR-GFCCVEGCSA-N 1 0 323.770 4.313 20 10 DICDRO C[N@H+](Cc1cc(F)c(Cl)cc1[O-])[C@@H]1CCc2ccccc21 ZINC001237940835 1055564913 /nfs/dbraw/zinc/56/49/13/1055564913.db2.gz DIRMPWKFRUHAQU-MRXNPFEDSA-N 1 0 305.780 4.304 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1O ZINC001238058322 1055596999 /nfs/dbraw/zinc/59/69/99/1055596999.db2.gz QMBDIEQPQZCSKE-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1O ZINC001238062842 1055597468 /nfs/dbraw/zinc/59/74/68/1055597468.db2.gz SQDRZNYPTLMODZ-KRWDZBQOSA-N 1 0 321.342 4.455 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)cc(C)c2O)cc1 ZINC001238062814 1055598119 /nfs/dbraw/zinc/59/81/19/1055598119.db2.gz SBVJLOKNFUNYHR-GOSISDBHSA-N 1 0 315.388 4.185 20 10 DICDRO Cc1cc(F)cc(C[NH+]2CCC(c3ccc(F)cc3)CC2)c1O ZINC001238063489 1055598452 /nfs/dbraw/zinc/59/84/52/1055598452.db2.gz WYLFWXJMGITMDK-UHFFFAOYSA-N 1 0 317.379 4.358 20 10 DICDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(F)cc(C)c1O ZINC001238071137 1055599746 /nfs/dbraw/zinc/59/97/46/1055599746.db2.gz SSZQSJAIXGMSOH-ZDUSSCGKSA-N 1 0 303.377 4.041 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(F)cc(C)c2O)cc1 ZINC001238071429 1055599887 /nfs/dbraw/zinc/59/98/87/1055599887.db2.gz XIDGGGQEKCDGAC-CYBMUJFWSA-N 1 0 303.377 4.041 20 10 DICDRO CC(C)Oc1c(F)ccc(C[N@H+](C)Cc2ccccc2O)c1F ZINC001238528115 1055681300 /nfs/dbraw/zinc/68/13/00/1055681300.db2.gz DABINGWIYUYVTE-UHFFFAOYSA-N 1 0 321.367 4.090 20 10 DICDRO CC[C@H](C[NH2+]Cc1cc(F)c(N(C)C)cc1F)CC(F)(F)F ZINC001620972649 1055783848 /nfs/dbraw/zinc/78/38/48/1055783848.db2.gz FXKYUDVZQWDBAW-JTQLQIEISA-N 1 0 324.337 4.099 20 10 DICDRO Cc1ccc(F)cc1C[NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C ZINC001620974187 1055811563 /nfs/dbraw/zinc/81/15/63/1055811563.db2.gz DRFWCBPKLZHKAD-INIZCTEOSA-N 1 0 314.448 4.229 20 10 DICDRO CCCOc1ccc(C[NH2+]CCCc2ccc(O)cc2)cc1C ZINC001620787921 1055963355 /nfs/dbraw/zinc/96/33/55/1055963355.db2.gz OSSNKYLYWFRDBK-UHFFFAOYSA-N 1 0 313.441 4.212 20 10 DICDRO Fc1ccc(C2([NH2+]Cc3ccc4c(c3)CCCO4)CCC2)cc1 ZINC001621016799 1055982126 /nfs/dbraw/zinc/98/21/26/1055982126.db2.gz ZFXMUNVPKLXBDA-UHFFFAOYSA-N 1 0 311.400 4.320 20 10 DICDRO CO[C@H](C[NH2+]Cc1c(C)c2ccccc2n1C)C1CCCCC1 ZINC001621018991 1055984962 /nfs/dbraw/zinc/98/49/62/1055984962.db2.gz UEEDASBAUVXSSE-HXUWFJFHSA-N 1 0 314.473 4.172 20 10 DICDRO CO[C@@H](C[NH2+]Cc1c(C)c2ccccc2n1C)C1CCCCC1 ZINC001621018990 1055985485 /nfs/dbraw/zinc/98/54/85/1055985485.db2.gz UEEDASBAUVXSSE-FQEVSTJZSA-N 1 0 314.473 4.172 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CC2SCCS2)cc1 ZINC001621019662 1055987754 /nfs/dbraw/zinc/98/77/54/1055987754.db2.gz ULUPFDSBDXJATA-UHFFFAOYSA-N 1 0 324.559 4.209 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCCC23CC3)cc1F ZINC001621025135 1055991179 /nfs/dbraw/zinc/99/11/79/1055991179.db2.gz BGPJTBUWNYPAHL-INIZCTEOSA-N 1 0 304.453 4.342 20 10 DICDRO c1c2ccccc2oc1CC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001620805650 1056000319 /nfs/dbraw/zinc/00/03/19/1056000319.db2.gz BRVIULGBTYQEIC-UHFFFAOYSA-N 1 0 320.436 4.365 20 10 DICDRO CN(C)c1ccc(C[NH2+]C(C)(C)CCc2ccccc2)cc1F ZINC001649112773 1056034967 /nfs/dbraw/zinc/03/49/67/1056034967.db2.gz XUUHOBVJBXAYCE-UHFFFAOYSA-N 1 0 314.448 4.393 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)c1cc(F)cc(F)c1[O-] ZINC000765819978 1056212524 /nfs/dbraw/zinc/21/25/24/1056212524.db2.gz KTDVEVCIJBAARJ-SECBINFHSA-N 1 0 313.294 4.459 20 10 DICDRO Cc1nc(C(C)(C)[NH2+]Cc2ccc3c(c2)CCCO3)sc1C ZINC000921762393 1056470185 /nfs/dbraw/zinc/47/01/85/1056470185.db2.gz YPNDUHHHDGWEEA-UHFFFAOYSA-N 1 0 316.470 4.110 20 10 DICDRO Cc1csc([C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)n1 ZINC000921782027 1056488456 /nfs/dbraw/zinc/48/84/56/1056488456.db2.gz CHVLGEIIZUNANG-QGZVFWFLSA-N 1 0 314.454 4.017 20 10 DICDRO CCC[C@](C)(O)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765939339 1056524975 /nfs/dbraw/zinc/52/49/75/1056524975.db2.gz AGUGSRAKOGMSHC-XLIONFOSSA-N 1 0 318.505 4.269 20 10 DICDRO CCC[C@@](C)(O)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765939337 1056525713 /nfs/dbraw/zinc/52/57/13/1056525713.db2.gz AGUGSRAKOGMSHC-FXAWDEMLSA-N 1 0 318.505 4.269 20 10 DICDRO C[C@H]([NH2+]CC1(O)CCCC1)c1ccc(N2CCCCCC2)cc1 ZINC000765952656 1056591308 /nfs/dbraw/zinc/59/13/08/1056591308.db2.gz UWBIKBRCEVLBRL-KRWDZBQOSA-N 1 0 316.489 4.023 20 10 DICDRO C[N@@H+](Cc1ccccc1O)C[C@@H]1CCC[C@@H](c2ccccc2)O1 ZINC001615930748 1056597196 /nfs/dbraw/zinc/59/71/96/1056597196.db2.gz DCKMKMXPWJCGRO-ICSRJNTNSA-N 1 0 311.425 4.134 20 10 DICDRO C[N@@H+](Cc1ccccc1O)C[C@H]1CCC[C@H](c2ccccc2)O1 ZINC001615930752 1056597494 /nfs/dbraw/zinc/59/74/94/1056597494.db2.gz DCKMKMXPWJCGRO-UYAOXDASSA-N 1 0 311.425 4.134 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]C2(C3CC3)CC2)cc1 ZINC001620832473 1056700745 /nfs/dbraw/zinc/70/07/45/1056700745.db2.gz DIWCOGKUGRWZOP-UHFFFAOYSA-N 1 0 312.482 4.417 20 10 DICDRO CCC[C@@H](C)CCC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC001616865657 1056730245 /nfs/dbraw/zinc/73/02/45/1056730245.db2.gz MSDDRTXHCCPDNH-QZTJIDSGSA-N 1 0 318.505 4.390 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c1O ZINC001143103366 1056763483 /nfs/dbraw/zinc/76/34/83/1056763483.db2.gz ATGUMDJLJRDAGG-CQSZACIVSA-N 1 0 315.379 4.259 20 10 DICDRO CC(C)Oc1ccc(N(C)C[C@@H]2CCCC[N@@H+]2C(C)C)cc1 ZINC001617190193 1056792012 /nfs/dbraw/zinc/79/20/12/1056792012.db2.gz FEWQNIHTMYZXJG-SFHVURJKSA-N 1 0 304.478 4.173 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)[C@@H](CC)C(=O)OC(C)(C)C ZINC001617538928 1056846495 /nfs/dbraw/zinc/84/64/95/1056846495.db2.gz PTPHFYCQKCVTRT-INIZCTEOSA-N 1 0 321.461 4.115 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)[C@H](C)c1nc(C2CC2)no1 ZINC000282336685 1056933262 /nfs/dbraw/zinc/93/32/62/1056933262.db2.gz BKYYQOYJTAIMFH-CYBMUJFWSA-N 1 0 315.417 4.016 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000479433702 1056982367 /nfs/dbraw/zinc/98/23/67/1056982367.db2.gz AVWQKNFACRBNLQ-SFHVURJKSA-N 1 0 308.400 4.403 20 10 DICDRO c1ccc([C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C2CC2)nc1 ZINC000922586320 1057036859 /nfs/dbraw/zinc/03/68/59/1057036859.db2.gz VREBGLLFXJJULS-NRFANRHFSA-N 1 0 321.468 4.313 20 10 DICDRO c1ccc([C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C2CC2)nc1 ZINC000922586321 1057037444 /nfs/dbraw/zinc/03/74/44/1057037444.db2.gz VREBGLLFXJJULS-OAQYLSRUSA-N 1 0 321.468 4.313 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1ccc2ccccc2c1O ZINC000282382698 1057064054 /nfs/dbraw/zinc/06/40/54/1057064054.db2.gz JEQCDLSKHDDQSN-ACJLOTCBSA-N 1 0 321.424 4.007 20 10 DICDRO Cc1ncc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)s1 ZINC000125684008 1057077854 /nfs/dbraw/zinc/07/78/54/1057077854.db2.gz FYYDECJSYNDZHS-UHFFFAOYSA-N 1 0 315.486 4.074 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccccc1OC ZINC000766028851 1057128870 /nfs/dbraw/zinc/12/88/70/1057128870.db2.gz HMNHPUDZSZXTES-LJQANCHMSA-N 1 0 312.457 4.311 20 10 DICDRO CSCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766071016 1057284864 /nfs/dbraw/zinc/28/48/64/1057284864.db2.gz HORMQXKHUGCWEB-CQSZACIVSA-N 1 0 310.482 4.220 20 10 DICDRO CCCOCc1ccccc1C[NH2+]Cc1c(O)cccc1Cl ZINC000113324080 1057349318 /nfs/dbraw/zinc/34/93/18/1057349318.db2.gz FHQFASWXADDSLZ-UHFFFAOYSA-N 1 0 319.832 4.262 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)C ZINC000766164020 1057529945 /nfs/dbraw/zinc/52/99/45/1057529945.db2.gz WPQSWFDGXDLJFE-YJBOKZPZSA-N 1 0 322.468 4.138 20 10 DICDRO Oc1ccccc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000728063468 1057684039 /nfs/dbraw/zinc/68/40/39/1057684039.db2.gz OIPGNGIMMZVZBK-UHFFFAOYSA-N 1 0 307.315 4.190 20 10 DICDRO C[N@H+](Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)[C@H]1CCOC1 ZINC000730259788 1057709506 /nfs/dbraw/zinc/70/95/06/1057709506.db2.gz DDMSURBSQSWPJO-INIZCTEOSA-N 1 0 319.489 4.208 20 10 DICDRO CN(c1ccc(-c2[nH+]ccc3c2ccn3C)cn1)C1CCCCC1 ZINC001243594134 1057727063 /nfs/dbraw/zinc/72/70/63/1057727063.db2.gz AQASCGFZNMUMCX-UHFFFAOYSA-N 1 0 320.440 4.404 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2nc(-c3ccccc3)cs2)c1 ZINC000733324946 1057812630 /nfs/dbraw/zinc/81/26/30/1057812630.db2.gz NFPYIVWHAXVSQY-UHFFFAOYSA-N 1 0 310.422 4.114 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(c3ccc(F)cc3)CCC2)cc1F ZINC000733326974 1057812818 /nfs/dbraw/zinc/81/28/18/1057812818.db2.gz HGHVLBVKGCFLMD-UHFFFAOYSA-N 1 0 316.395 4.200 20 10 DICDRO CC1(c2ccccc2)CC([NH2+]Cc2c(O)cccc2Cl)C1 ZINC000733326759 1057812972 /nfs/dbraw/zinc/81/29/72/1057812972.db2.gz YAURWHQSWHUTQM-UHFFFAOYSA-N 1 0 301.817 4.256 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(OC3CCCC3)cc2)c1 ZINC000733328641 1057813900 /nfs/dbraw/zinc/81/39/00/1057813900.db2.gz YDFDRRSBKLJYNH-UHFFFAOYSA-N 1 0 311.425 4.312 20 10 DICDRO Cc1ccc(C)n1-c1ccc(-c2ccc(C(C)(C)[NH3+])cc2)cn1 ZINC001245912318 1058616161 /nfs/dbraw/zinc/61/61/61/1058616161.db2.gz JRVBISQKRPLSCB-UHFFFAOYSA-N 1 0 305.425 4.350 20 10 DICDRO Nc1ccc(C[NH2+]C2CCC3(CCc4ccccc43)CC2)cc1 ZINC001246173212 1058715627 /nfs/dbraw/zinc/71/56/27/1058715627.db2.gz SZSAUMJJURAFRN-UHFFFAOYSA-N 1 0 306.453 4.185 20 10 DICDRO Cc1cc(C)nc(C[N@H+](Cc2ccccc2O)C2CCCC2)c1 ZINC001559529911 1059329911 /nfs/dbraw/zinc/32/99/11/1059329911.db2.gz DSJHYVSYJLSZJF-UHFFFAOYSA-N 1 0 310.441 4.349 20 10 DICDRO CCC[C@@H](O)C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC001559659037 1059489081 /nfs/dbraw/zinc/48/90/81/1059489081.db2.gz YOKAFZMGYDKLQL-QFBILLFUSA-N 1 0 313.441 4.116 20 10 DICDRO CCOc1ccc(N2CC[NH+](C[C@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC001559667084 1059496494 /nfs/dbraw/zinc/49/64/94/1059496494.db2.gz KKRZBPFCLPMMQX-MSOLQXFVSA-N 1 0 316.489 4.034 20 10 DICDRO CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001559761684 1059596691 /nfs/dbraw/zinc/59/66/91/1059596691.db2.gz DVRZKBGEWDQBEA-FUHWJXTLSA-N 1 0 306.519 4.215 20 10 DICDRO CCS[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001559761786 1059598065 /nfs/dbraw/zinc/59/80/65/1059598065.db2.gz DVRZKBGEWDQBEA-WMZOPIPTSA-N 1 0 306.519 4.215 20 10 DICDRO CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)CC)cc1 ZINC001559762909 1059601224 /nfs/dbraw/zinc/60/12/24/1059601224.db2.gz XEEWSMWBOUCNHE-QZTJIDSGSA-N 1 0 306.519 4.297 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)cs1 ZINC001248803091 1059987847 /nfs/dbraw/zinc/98/78/47/1059987847.db2.gz FTDLBAQQKBJXNU-UHFFFAOYSA-N 1 0 300.471 4.289 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCCc2ccccc2)cc1F ZINC001560249880 1060014859 /nfs/dbraw/zinc/01/48/59/1060014859.db2.gz NYTQJHLDSFZGPA-UHFFFAOYSA-N 1 0 314.448 4.394 20 10 DICDRO CC(=O)[C@@H]1CCC[N@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001248883740 1060038401 /nfs/dbraw/zinc/03/84/01/1060038401.db2.gz PIAQEDNEFJBGSK-CYBMUJFWSA-N 1 0 323.864 4.144 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](C)c2ccc(C)cc2)ccc1OC ZINC001560276017 1060052745 /nfs/dbraw/zinc/05/27/45/1060052745.db2.gz ZNIYIDHVAIIMQK-MRXNPFEDSA-N 1 0 313.441 4.391 20 10 DICDRO CC(C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC001560296888 1060081663 /nfs/dbraw/zinc/08/16/63/1060081663.db2.gz NAXCTZJPAYZWFU-IEBWSBKVSA-N 1 0 300.490 4.373 20 10 DICDRO CC[C@@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1 ZINC001560298553 1060082336 /nfs/dbraw/zinc/08/23/36/1060082336.db2.gz JWKXRJNWHFTRML-INIZCTEOSA-N 1 0 300.421 4.175 20 10 DICDRO CC[C@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1 ZINC001560298554 1060084028 /nfs/dbraw/zinc/08/40/28/1060084028.db2.gz JWKXRJNWHFTRML-MRXNPFEDSA-N 1 0 300.421 4.175 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)cc1 ZINC001560327444 1060115566 /nfs/dbraw/zinc/11/55/66/1060115566.db2.gz KGIJYEMQKCIXLW-MRXNPFEDSA-N 1 0 314.477 4.161 20 10 DICDRO CSc1ccc(F)cc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001560353858 1060139925 /nfs/dbraw/zinc/13/99/25/1060139925.db2.gz YXRAEAURXDWCMY-UHFFFAOYSA-N 1 0 322.424 4.043 20 10 DICDRO c1ccc(CN2CCc3cc(C[NH2+]CCC4CC4)ccc32)cc1 ZINC001560359498 1060145436 /nfs/dbraw/zinc/14/54/36/1060145436.db2.gz MNUKGHKXSHCKOI-UHFFFAOYSA-N 1 0 306.453 4.139 20 10 DICDRO Oc1cccc(Br)c1C[NH2+][C@@H]1C[C@H]1C1CCCCC1 ZINC001560359351 1060145751 /nfs/dbraw/zinc/14/57/51/1060145751.db2.gz JDQLEFYLYGHFRG-SWLSCSKDSA-N 1 0 324.262 4.213 20 10 DICDRO CCC1(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CCC1 ZINC001560369022 1060155432 /nfs/dbraw/zinc/15/54/32/1060155432.db2.gz LCPFPQSSTSEPKQ-UHFFFAOYSA-N 1 0 314.395 4.441 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001560379995 1060167672 /nfs/dbraw/zinc/16/76/72/1060167672.db2.gz MPLSXOVLHVRSOW-FQEVSTJZSA-N 1 0 322.452 4.073 20 10 DICDRO C[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)C1CCCCC1 ZINC001249224181 1060192574 /nfs/dbraw/zinc/19/25/74/1060192574.db2.gz TUJJXYQWSNOSSU-UHFFFAOYSA-N 1 0 301.430 4.341 20 10 DICDRO C[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001560415975 1060199630 /nfs/dbraw/zinc/19/96/30/1060199630.db2.gz HQYJHDNMKPYLPF-VFNWGFHPSA-N 1 0 307.437 4.425 20 10 DICDRO CC(C)=CC[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001560439635 1060228250 /nfs/dbraw/zinc/22/82/50/1060228250.db2.gz RSZWFAMOMWSXIS-UHFFFAOYSA-N 1 0 300.471 4.440 20 10 DICDRO C[C@@H](CC1CCCCC1)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001560461327 1060252196 /nfs/dbraw/zinc/25/21/96/1060252196.db2.gz IVYRYIUVAKPLIT-ZDUSSCGKSA-N 1 0 310.432 4.479 20 10 DICDRO CCC[C@H]([NH2+]C1CCN(c2ccc(OC)cc2)CC1)C(C)(C)C ZINC001560477100 1060266247 /nfs/dbraw/zinc/26/62/47/1060266247.db2.gz FLNBUICTBGIXGN-IBGZPJMESA-N 1 0 318.505 4.468 20 10 DICDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)ccc1F ZINC001560489393 1060283546 /nfs/dbraw/zinc/28/35/46/1060283546.db2.gz MQYQQDCVLDMUMT-CYBMUJFWSA-N 1 0 304.384 4.190 20 10 DICDRO Cc1c2ccccc2n(C)c1CNc1ccc(C[NH+](C)C)c(C)c1 ZINC001560501518 1060297417 /nfs/dbraw/zinc/29/74/17/1060297417.db2.gz KJWWNEBDMOPRNN-UHFFFAOYSA-N 1 0 321.468 4.469 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1ccc2[nH]ccc2c1 ZINC001560508574 1060306369 /nfs/dbraw/zinc/30/63/69/1060306369.db2.gz BBEDFFRBROZULG-INIZCTEOSA-N 1 0 321.468 4.263 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1ccc(F)cc1F ZINC001560508533 1060307559 /nfs/dbraw/zinc/30/75/59/1060307559.db2.gz ZRBRDGQBWCRFNM-CQSZACIVSA-N 1 0 318.411 4.060 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)CCc2ccccc2)c1 ZINC001560519456 1060319688 /nfs/dbraw/zinc/31/96/88/1060319688.db2.gz DBWLDSNNBKRANG-HZPDHXFCSA-N 1 0 313.441 4.320 20 10 DICDRO CC[C@@](C)([NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O)C1CC1 ZINC001560536590 1060341228 /nfs/dbraw/zinc/34/12/28/1060341228.db2.gz OWDONNJRGBMFMK-LJQANCHMSA-N 1 0 305.462 4.367 20 10 DICDRO CC[C@@H]1C[C@@H]([NH2+]Cc2cc(C)n(-c3ccccc3)c2C)CCO1 ZINC001560556416 1060367078 /nfs/dbraw/zinc/36/70/78/1060367078.db2.gz XBBBLBCFFVIASN-AZUAARDMSA-N 1 0 312.457 4.141 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]C[C@@H]2C=CCC2)cc1 ZINC001560571541 1060385093 /nfs/dbraw/zinc/38/50/93/1060385093.db2.gz XTMBBTHFNUDCNV-MRXNPFEDSA-N 1 0 312.482 4.440 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2C[C@H]2[C@@H]2C[C@H]2C)cc1 ZINC001560594777 1060408118 /nfs/dbraw/zinc/40/81/18/1060408118.db2.gz YUUPTVCWILFXIV-GEALJGNFSA-N 1 0 300.490 4.447 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H](C)C(C)(C)OC)cc1 ZINC001560598340 1060410688 /nfs/dbraw/zinc/41/06/88/1060410688.db2.gz WGRDMXRNJVZTJC-MRXNPFEDSA-N 1 0 306.494 4.216 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](C)C(C)(C)OC)cc1 ZINC001560598339 1060411149 /nfs/dbraw/zinc/41/11/49/1060411149.db2.gz WGRDMXRNJVZTJC-INIZCTEOSA-N 1 0 306.494 4.216 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CCC(C)(C)CO2)c(Cl)c1 ZINC001560604744 1060416582 /nfs/dbraw/zinc/41/65/82/1060416582.db2.gz BHLQRVGFBZNNOK-ZDUSSCGKSA-N 1 0 311.853 4.039 20 10 DICDRO C[C@H]1c2ccccc2CC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001560627886 1060437023 /nfs/dbraw/zinc/43/70/23/1060437023.db2.gz LUVIJPINIOVWFW-TUYSUELWSA-N 1 0 306.453 4.385 20 10 DICDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(C)cc(OC)c1O ZINC001560640287 1060455694 /nfs/dbraw/zinc/45/56/94/1060455694.db2.gz OETVKEZPLHLEIB-GOSISDBHSA-N 1 0 311.425 4.219 20 10 DICDRO CC[N@H+](Cc1ccc(OCc2ccccc2)cc1O)C1CCC1 ZINC001560677845 1060515016 /nfs/dbraw/zinc/51/50/16/1060515016.db2.gz MWICHCVJZLIDKJ-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2c(O)cc(C)cc2Cl)C1 ZINC001560676647 1060516530 /nfs/dbraw/zinc/51/65/30/1060516530.db2.gz IGSGAMGABYAALR-OLZOCXBDSA-N 1 0 313.894 4.460 20 10 DICDRO CO[C@H](CC(C)C)C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC001560702635 1060559289 /nfs/dbraw/zinc/55/92/89/1060559289.db2.gz YXHWDEYEQFECLM-GOSISDBHSA-N 1 0 305.462 4.198 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)C2CCC(C(C)(C)C)CC2)c1 ZINC001560717106 1060574355 /nfs/dbraw/zinc/57/43/55/1060574355.db2.gz BFENLCFEYSPMES-UHFFFAOYSA-N 1 0 305.462 4.438 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)C[C@@H](C)O2 ZINC001560724854 1060587127 /nfs/dbraw/zinc/58/71/27/1060587127.db2.gz YMBWCPSKWSHUMF-MRXNPFEDSA-N 1 0 324.468 4.098 20 10 DICDRO CCC1(CC)C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CCS1 ZINC001560734261 1060603581 /nfs/dbraw/zinc/60/35/81/1060603581.db2.gz GLCYDHRNLLLHSJ-BQYQJAHWSA-N 1 0 318.530 4.373 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@H](OC(C)C)C2(C)C)cc1Cl ZINC001560737117 1060606280 /nfs/dbraw/zinc/60/62/80/1060606280.db2.gz SQTWBPCLOVFDJR-HOTGVXAUSA-N 1 0 311.853 4.036 20 10 DICDRO COc1cccc2c1CC[N@H+](Cc1cc(C(C)C)ccc1O)C2 ZINC001560749973 1060615712 /nfs/dbraw/zinc/61/57/12/1060615712.db2.gz PDIHVCVPQXIBIQ-UHFFFAOYSA-N 1 0 311.425 4.083 20 10 DICDRO CCc1cccc(CN(C)C(C)(C)C[NH+]2CCCCCC2)c1O ZINC001560773392 1060637313 /nfs/dbraw/zinc/63/73/13/1060637313.db2.gz YNZZGPILYRNOAC-UHFFFAOYSA-N 1 0 318.505 4.041 20 10 DICDRO CCCN(Cc1cc2cc(OC)ccc2o1)c1ccc(C[NH3+])cc1 ZINC001560807881 1060667794 /nfs/dbraw/zinc/66/77/94/1060667794.db2.gz ATEVBIMHTUIRHD-UHFFFAOYSA-N 1 0 324.424 4.317 20 10 DICDRO CSC1(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)CCC1 ZINC001560815906 1060673889 /nfs/dbraw/zinc/67/38/89/1060673889.db2.gz VKJGHJFZJUAXCX-UHFFFAOYSA-N 1 0 304.503 4.004 20 10 DICDRO Cc1ccc2c(c1)CN(Cc1c(O)cc(C)cc1Cl)CCO2 ZINC001560825007 1060685254 /nfs/dbraw/zinc/68/52/54/1060685254.db2.gz YXGGAAGDONCXLB-UHFFFAOYSA-N 1 0 317.816 4.057 20 10 DICDRO COc1cc(C)c(C[NH2+]Cc2ccc3sccc3c2)c(O)c1 ZINC001560870772 1060729972 /nfs/dbraw/zinc/72/99/72/1060729972.db2.gz PHAGDFQWMORFIP-UHFFFAOYSA-N 1 0 313.422 4.214 20 10 DICDRO COc1cc(C)cc(C[NH+]2CCC(C)(CC(C)C)CC2)c1O ZINC001560871431 1060732146 /nfs/dbraw/zinc/73/21/46/1060732146.db2.gz IGGWABPPKRUJIX-UHFFFAOYSA-N 1 0 305.462 4.357 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1 ZINC001560874121 1060735966 /nfs/dbraw/zinc/73/59/66/1060735966.db2.gz MYXXVEWLTFCDDV-UKRRQHHQSA-N 1 0 323.845 4.117 20 10 DICDRO CSC(C)(C)CC[NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C ZINC001560891100 1060753086 /nfs/dbraw/zinc/75/30/86/1060753086.db2.gz YJULLYGWAUJLNB-HNNXBMFYSA-N 1 0 308.535 4.113 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)c1cc2cnccc2o1 ZINC001560913785 1060773386 /nfs/dbraw/zinc/77/33/86/1060773386.db2.gz QKTQMBUUMROEQT-SNVBAGLBSA-N 1 0 302.761 4.038 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC001560918984 1060779437 /nfs/dbraw/zinc/77/94/37/1060779437.db2.gz OHCQHGOYVCPGGF-YLJYHZDGSA-N 1 0 323.436 4.346 20 10 DICDRO Nc1ccc(Cc2ccccc2Nc2ccc3c[nH+]cn3c2)cc1 ZINC001250332047 1060784644 /nfs/dbraw/zinc/78/46/44/1060784644.db2.gz QLVBXACCPNKQNO-UHFFFAOYSA-N 1 0 314.392 4.251 20 10 DICDRO CCc1cccc(C[N@@H+]2CCc3[nH]c4ccc(C)cc4c3C2)c1O ZINC001560922285 1060785167 /nfs/dbraw/zinc/78/51/67/1060785167.db2.gz POMPGJONJIGNIZ-UHFFFAOYSA-N 1 0 320.436 4.303 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c(Cl)c1 ZINC001560939246 1060802596 /nfs/dbraw/zinc/80/25/96/1060802596.db2.gz BUELSWRUKRGVII-OAHLLOKOSA-N 1 0 317.816 4.007 20 10 DICDRO Cc1ccc(C[NH+]2CCC3(C=Cc4ccccc4O3)CC2)c(O)c1 ZINC001560950449 1060816904 /nfs/dbraw/zinc/81/69/04/1060816904.db2.gz CPMKSUXCPWOEDO-UHFFFAOYSA-N 1 0 321.420 4.141 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@H]1CCCC12CC2 ZINC001560961334 1060826942 /nfs/dbraw/zinc/82/69/42/1060826942.db2.gz FVDGTZARYHVZEM-FQEVSTJZSA-N 1 0 323.436 4.394 20 10 DICDRO CCN(CC)c1ccc(-c2nc3cc(C[NH+](C)C)ccc3[nH]2)cc1 ZINC001250468556 1060827022 /nfs/dbraw/zinc/82/70/22/1060827022.db2.gz CVOOBEJMJUPPQS-UHFFFAOYSA-N 1 0 322.456 4.138 20 10 DICDRO Oc1c(C[NH2+]Cc2ccc3cccnc3c2)ccc2ccccc21 ZINC001560965990 1060830650 /nfs/dbraw/zinc/83/06/50/1060830650.db2.gz IZEMZKNHOBRGTH-UHFFFAOYSA-N 1 0 314.388 4.383 20 10 DICDRO CC(C)(C)[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CCO1 ZINC001561052169 1060900513 /nfs/dbraw/zinc/90/05/13/1060900513.db2.gz TYSPGJNPICBXQB-SFHVURJKSA-N 1 0 313.441 4.182 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](OC)C1CCCCC1 ZINC001473196591 1060954648 /nfs/dbraw/zinc/95/46/48/1060954648.db2.gz ZPHCKKJHLRRCAK-LJQANCHMSA-N 1 0 305.462 4.200 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)[C@H]1COc2ccccc2C1 ZINC001462190902 1061012050 /nfs/dbraw/zinc/01/20/50/1061012050.db2.gz SNWRLUNLDGXJOK-VQIMIIECSA-N 1 0 324.468 4.002 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)[C@H]1COc2ccccc2C1 ZINC001462190899 1061013190 /nfs/dbraw/zinc/01/31/90/1061013190.db2.gz SNWRLUNLDGXJOK-QFBILLFUSA-N 1 0 324.468 4.002 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)c(O)c1 ZINC001462266653 1061061632 /nfs/dbraw/zinc/06/16/32/1061061632.db2.gz CRTSBHKTLXHMQJ-SHTZXODSSA-N 1 0 301.817 4.390 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH+]2CC(Cc3ccc(F)cc3)C2)cc1 ZINC001462319580 1061102990 /nfs/dbraw/zinc/10/29/90/1061102990.db2.gz FZQATMKFJZQHNX-ARJAWSKDSA-N 1 0 324.443 4.079 20 10 DICDRO Cc1ccc(C[NH+]2CC(Cc3c(F)cccc3Cl)C2)c(O)c1 ZINC001462322000 1061103986 /nfs/dbraw/zinc/10/39/86/1061103986.db2.gz OJYODQZQQWPIMD-UHFFFAOYSA-N 1 0 319.807 4.168 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CC3(CCCCC3)[C@H]2C(C)C)c(O)c1 ZINC001462327613 1061107032 /nfs/dbraw/zinc/10/70/32/1061107032.db2.gz BGJOGODLENZESP-LJQANCHMSA-N 1 0 317.473 4.500 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)c1O ZINC001462332182 1061110795 /nfs/dbraw/zinc/11/07/95/1061110795.db2.gz KUJXSXAGEZOLGG-CZUORRHYSA-N 1 0 319.807 4.393 20 10 DICDRO C[C@H]([NH2+]CCc1c(F)cccc1Cl)c1ccc(N(C)C)cc1 ZINC001473400323 1061137484 /nfs/dbraw/zinc/13/74/84/1061137484.db2.gz PJFCWUWOZVOHAS-ZDUSSCGKSA-N 1 0 320.839 4.438 20 10 DICDRO COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC001462392809 1061146430 /nfs/dbraw/zinc/14/64/30/1061146430.db2.gz HIIXVRZIGVHXCV-OLZOCXBDSA-N 1 0 319.832 4.336 20 10 DICDRO CC(C)[C@@H]1[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC12CC=CC2 ZINC001462395336 1061148092 /nfs/dbraw/zinc/14/80/92/1061148092.db2.gz NCNPLQQUMRSUMU-DUIUGDAFSA-N 1 0 310.485 4.442 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCC2(CCCC2)O1 ZINC001473424925 1061152561 /nfs/dbraw/zinc/15/25/61/1061152561.db2.gz UNURBUBNXSUKNX-GOSISDBHSA-N 1 0 317.473 4.486 20 10 DICDRO CC[C@](C)([NH2+]Cc1cc(Br)cc(C)c1O)C1CC1 ZINC001462433957 1061171722 /nfs/dbraw/zinc/17/17/22/1061171722.db2.gz BDNXMZJNJNSJKE-HNNXBMFYSA-N 1 0 312.251 4.131 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@@H]21 ZINC001462444368 1061177854 /nfs/dbraw/zinc/17/78/54/1061177854.db2.gz KMCBWUDESASCRB-HYVNUMGLSA-N 1 0 320.219 4.127 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@@]12C[C@@H]1CCCC2 ZINC001462508023 1061219736 /nfs/dbraw/zinc/21/97/36/1061219736.db2.gz YPXQDDBLXIFVKD-RXVVDRJESA-N 1 0 323.436 4.394 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@@H](Oc2ccccc2)C1(C)C)c1ccccc1O ZINC001462510336 1061221108 /nfs/dbraw/zinc/22/11/08/1061221108.db2.gz FLQGGBKUJMLRFJ-MDASCCDHSA-N 1 0 311.425 4.289 20 10 DICDRO C[C@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)c1ccccc1O ZINC001462513910 1061223641 /nfs/dbraw/zinc/22/36/41/1061223641.db2.gz PDXSUECEVFSMDX-JTQLQIEISA-N 1 0 302.761 4.038 20 10 DICDRO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001462560867 1061261430 /nfs/dbraw/zinc/26/14/30/1061261430.db2.gz FQGNTZSMYQCMSR-INIZCTEOSA-N 1 0 309.331 4.320 20 10 DICDRO C[C@H](COCC1CCCCC1)[NH2+]Cc1ccc(Cl)cc1O ZINC001462585836 1061277899 /nfs/dbraw/zinc/27/78/99/1061277899.db2.gz BVZCIKUHYPSGNG-CYBMUJFWSA-N 1 0 311.853 4.121 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC001462584684 1061278638 /nfs/dbraw/zinc/27/86/38/1061278638.db2.gz FYTLMLHXXOYFTH-FZMZJTMJSA-N 1 0 319.754 4.210 20 10 DICDRO CC1(C)CC[C@@H](CC[NH2+]Cc2ccc3ccccc3c2O)OC1 ZINC001462616954 1061298964 /nfs/dbraw/zinc/29/89/64/1061298964.db2.gz IKLMVJDZQCGPGM-KRWDZBQOSA-N 1 0 313.441 4.230 20 10 DICDRO c1ccc2c(c1)CCC[C@@H]2C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001251724223 1061458672 /nfs/dbraw/zinc/45/86/72/1061458672.db2.gz IYARPBQPVUGSTI-HXUWFJFHSA-N 1 0 320.480 4.497 20 10 DICDRO C[C@@H]1CC([NH2+]Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)C1 ZINC001473938387 1061484058 /nfs/dbraw/zinc/48/40/58/1061484058.db2.gz LAWKBQLEEPZRJI-HOTGVXAUSA-N 1 0 318.530 4.154 20 10 DICDRO COCC(C)(C)C[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC001473965043 1061508164 /nfs/dbraw/zinc/50/81/64/1061508164.db2.gz TWHSZBAKHAKLFZ-UHFFFAOYSA-N 1 0 318.505 4.218 20 10 DICDRO CN1CCCc2cc(C[NH2+]C/C=C/c3ccc(F)cc3)ccc21 ZINC001473963822 1061508526 /nfs/dbraw/zinc/50/85/26/1061508526.db2.gz SXFXHIQQNMGKJL-DUXPYHPUSA-N 1 0 310.416 4.011 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC1(c2ccc(F)cc2)CCC1 ZINC001473971365 1061516318 /nfs/dbraw/zinc/51/63/18/1061516318.db2.gz MHAMVFOPUQLLPX-UHFFFAOYSA-N 1 0 319.807 4.396 20 10 DICDRO CCC[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001473978961 1061522324 /nfs/dbraw/zinc/52/23/24/1061522324.db2.gz UKAPKSNANKNPNS-GUYCJALGSA-N 1 0 310.432 4.479 20 10 DICDRO c1ccc2cc(C[NH2+]Cc3ccc4c(c3)CCCO4)ccc2c1 ZINC001473982943 1061527353 /nfs/dbraw/zinc/52/73/53/1061527353.db2.gz NLUREKDCANRGSK-UHFFFAOYSA-N 1 0 303.405 4.455 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C/C=C\c1ccc(F)cc1F ZINC001473995354 1061536568 /nfs/dbraw/zinc/53/65/68/1061536568.db2.gz HJCJDBOKCJLAGI-PLNGDYQASA-N 1 0 316.395 4.142 20 10 DICDRO Cc1c(Cl)cccc1C[NH2+]CCCSc1nccs1 ZINC001474018226 1061558820 /nfs/dbraw/zinc/55/88/20/1061558820.db2.gz CRZIIMLURLKTJL-UHFFFAOYSA-N 1 0 312.891 4.377 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cccc(Cl)c2F)c(Cl)c1 ZINC001474031461 1061573438 /nfs/dbraw/zinc/57/34/38/1061573438.db2.gz MDHSITCPEIFRST-UHFFFAOYSA-N 1 0 314.187 4.436 20 10 DICDRO Cc1cc(F)ccc1CC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001474043811 1061589538 /nfs/dbraw/zinc/58/95/38/1061589538.db2.gz UHKZECQWKYNCJR-SNAWJCMRSA-N 1 0 312.432 4.046 20 10 DICDRO Cc1[nH+]c2cc(NC/C=C/c3ccc(N(C)C)cc3)ccc2n1C ZINC001474051636 1061598797 /nfs/dbraw/zinc/59/87/97/1061598797.db2.gz IURBKACUKARZPQ-AATRIKPKSA-N 1 0 320.440 4.073 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC(C)(C)OC2(C)C)cc1F ZINC001474089770 1061636974 /nfs/dbraw/zinc/63/69/74/1061636974.db2.gz JQZXLALITLMHRT-KRWDZBQOSA-N 1 0 322.468 4.108 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CC2CCC(C)(C)CC2)cc1F ZINC001474101644 1061648010 /nfs/dbraw/zinc/64/80/10/1061648010.db2.gz KSOFGYHHGQPOLY-UHFFFAOYSA-N 1 0 310.432 4.337 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC001474113563 1061661180 /nfs/dbraw/zinc/66/11/80/1061661180.db2.gz ROYVDNLTYRDTRX-KRWDZBQOSA-N 1 0 324.399 4.239 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2cccc3[nH]ccc32)cc1 ZINC001474125645 1061671325 /nfs/dbraw/zinc/67/13/25/1061671325.db2.gz RWKCHNIABXGZBI-UHFFFAOYSA-N 1 0 321.468 4.346 20 10 DICDRO CCCOc1ccc(C[NH2+]CC(C)(C)c2ccccn2)cc1C ZINC001474151394 1061695257 /nfs/dbraw/zinc/69/52/57/1061695257.db2.gz OQZFRSLPDPEJGM-UHFFFAOYSA-N 1 0 312.457 4.246 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CSc2ccccc21 ZINC001474157003 1061698395 /nfs/dbraw/zinc/69/83/95/1061698395.db2.gz DKWPAGBGRBVIKJ-HNNXBMFYSA-N 1 0 322.477 4.466 20 10 DICDRO COc1ccc(N2CC[C@@H](C[NH2+]CC(C(C)C)C(C)C)C2)cc1 ZINC001474187181 1061735142 /nfs/dbraw/zinc/73/51/42/1061735142.db2.gz GCRRJHZOBAOUEQ-KRWDZBQOSA-N 1 0 318.505 4.039 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)CC2 ZINC001474198032 1061747621 /nfs/dbraw/zinc/74/76/21/1061747621.db2.gz VBMLGLPJPQZIHN-KTBYTZPXSA-N 1 0 306.453 4.351 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]C2(C)CCC(C)(C)CC2)cc1F ZINC001474236934 1061797910 /nfs/dbraw/zinc/79/79/10/1061797910.db2.gz SFGBUIAYAOAIIQ-UHFFFAOYSA-N 1 0 310.432 4.479 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1noc2cc(F)ccc12 ZINC001474245787 1061813236 /nfs/dbraw/zinc/81/32/36/1061813236.db2.gz VHSWFXYTCXAXNP-UHFFFAOYSA-N 1 0 323.371 4.057 20 10 DICDRO COc1ccc(N2CCC([NH2+]CCC[C@H]3C=CCC3)CC2)cc1 ZINC001474254710 1061823938 /nfs/dbraw/zinc/82/39/38/1061823938.db2.gz HIUYPDHHENFCAU-KRWDZBQOSA-N 1 0 314.473 4.000 20 10 DICDRO CN(C)c1cc(F)c(CN(Cc2ccccc2)C2CC2)cc1F ZINC001474317583 1061894215 /nfs/dbraw/zinc/89/42/15/1061894215.db2.gz NFUGBWOUCQWNLO-UHFFFAOYSA-N 1 0 316.395 4.195 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@H](C)Cc2ccc(C)cc2)c1O ZINC001474324163 1061908185 /nfs/dbraw/zinc/90/81/85/1061908185.db2.gz MZKUJCNMAPSVDQ-MRXNPFEDSA-N 1 0 313.441 4.081 20 10 DICDRO COc1cc(C[NH+]2CCC(C)(C)CC2)c(O)c(C(C)(C)C)c1 ZINC001474343275 1061938478 /nfs/dbraw/zinc/93/84/78/1061938478.db2.gz MWIJHBLOJWKXQY-UHFFFAOYSA-N 1 0 305.462 4.320 20 10 DICDRO CC[C@@H](C)[C@H](C)[N@H+](Cc1cc(Cl)cc(OC)c1O)C1CC1 ZINC001474366994 1061997919 /nfs/dbraw/zinc/99/79/19/1061997919.db2.gz KLTXSJWSUFMUQZ-NEPJUHHUSA-N 1 0 311.853 4.453 20 10 DICDRO CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)CCc1cccs1 ZINC001474370578 1062005816 /nfs/dbraw/zinc/00/58/16/1062005816.db2.gz XETXXJYQKQPKON-FNORWQNLSA-N 1 0 314.498 4.392 20 10 DICDRO CCCO[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001254011113 1062011463 /nfs/dbraw/zinc/01/14/63/1062011463.db2.gz ULOQIIAEPPANQM-HXUWFJFHSA-N 1 0 316.489 4.068 20 10 DICDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(Cl)cc2O)s1 ZINC001474380177 1062027362 /nfs/dbraw/zinc/02/73/62/1062027362.db2.gz NBFKCEJONVXNKW-JTQLQIEISA-N 1 0 310.850 4.312 20 10 DICDRO CC[N@H+](CCc1ccc(F)cc1F)Cc1ccc(N(C)C)cc1 ZINC001474409034 1062072964 /nfs/dbraw/zinc/07/29/64/1062072964.db2.gz NIHGTMCQLKFDSE-UHFFFAOYSA-N 1 0 318.411 4.095 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1ccc(Cl)cc1O ZINC001474420182 1062091972 /nfs/dbraw/zinc/09/19/72/1062091972.db2.gz PBYGGEDDZFREBX-NSHDSACASA-N 1 0 321.852 4.156 20 10 DICDRO CCc1cccc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)c1O ZINC001474436517 1062111608 /nfs/dbraw/zinc/11/16/08/1062111608.db2.gz HRFYBTGKEDWICI-FZMZJTMJSA-N 1 0 301.352 4.117 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CCC(Cc3cccnc3)CC2)c1 ZINC001474434661 1062112765 /nfs/dbraw/zinc/11/27/65/1062112765.db2.gz FXQBOXJDECTBTI-UHFFFAOYSA-N 1 0 324.468 4.365 20 10 DICDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1cc(C(C)C)ccc1O ZINC001474465116 1062146281 /nfs/dbraw/zinc/14/62/81/1062146281.db2.gz YEQSMWLXSTVCDY-IEBWSBKVSA-N 1 0 305.462 4.199 20 10 DICDRO Cc1ccc([C@H]([NH2+]Cc2ccc(C)cc2O)c2ccccn2)cc1 ZINC001474493717 1062173907 /nfs/dbraw/zinc/17/39/07/1062173907.db2.gz XMOLACWSVZTVJV-NRFANRHFSA-N 1 0 318.420 4.283 20 10 DICDRO COc1cc(C)c(C[NH2+][C@@H]2CCCc3ccc(F)cc32)c(O)c1 ZINC001474494548 1062174197 /nfs/dbraw/zinc/17/41/97/1062174197.db2.gz ZYQQYPMQDAPMJF-GOSISDBHSA-N 1 0 315.388 4.016 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1C[C@@H](OC(C)(C)C)C1(C)C ZINC001474494970 1062176257 /nfs/dbraw/zinc/17/62/57/1062176257.db2.gz HEEUNYMRLKFMDJ-QZTJIDSGSA-N 1 0 318.505 4.344 20 10 DICDRO CCC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1C[C@@H](OCC)C1(C)C ZINC001459528417 1062185594 /nfs/dbraw/zinc/18/55/94/1062185594.db2.gz IROJBJQLAQUWNP-RTBURBONSA-N 1 0 318.505 4.168 20 10 DICDRO CC[C@H](CCC(F)(F)F)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC001474505170 1062186756 /nfs/dbraw/zinc/18/67/56/1062186756.db2.gz OIYYAEZICBAPIW-GHMZBOCLSA-N 1 0 305.340 4.173 20 10 DICDRO CC[C@@H](CCC(F)(F)F)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC001474505172 1062187994 /nfs/dbraw/zinc/18/79/94/1062187994.db2.gz OIYYAEZICBAPIW-QWRGUYRKSA-N 1 0 305.340 4.173 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCC(=C3CCC3)CC2)c1 ZINC001474505472 1062188815 /nfs/dbraw/zinc/18/88/15/1062188815.db2.gz SYEOHLIRKDJNPO-ZDUSSCGKSA-N 1 0 301.430 4.475 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]Cc2ccnc(C(F)(F)F)c2)c1 ZINC001474531510 1062214221 /nfs/dbraw/zinc/21/42/21/1062214221.db2.gz NHGTZUOZMHXQPU-UHFFFAOYSA-N 1 0 324.346 4.219 20 10 DICDRO COc1cc(C)c(C[NH2+]Cc2cc(C3CC3)ccc2F)c(O)c1 ZINC001474544474 1062240732 /nfs/dbraw/zinc/24/07/32/1062240732.db2.gz OVOHLJPGMFVZNW-UHFFFAOYSA-N 1 0 315.388 4.016 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]CC2=CCCCC2)c1O ZINC001474552427 1062251065 /nfs/dbraw/zinc/25/10/65/1062251065.db2.gz JOCKKRDBDCHLGQ-UHFFFAOYSA-N 1 0 310.235 4.053 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2sccc2[C@@H]1C ZINC001474560646 1062266444 /nfs/dbraw/zinc/26/64/44/1062266444.db2.gz LBKCDOXKPGGYOH-AWEZNQCLSA-N 1 0 300.471 4.242 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3ccco3)CC2)cc1Cl ZINC001474618895 1062338553 /nfs/dbraw/zinc/33/85/53/1062338553.db2.gz HMOGYGGHVKGWDI-UHFFFAOYSA-N 1 0 305.805 4.327 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC2C[C@H](C)C[C@@H](C)C2)c1O ZINC001474621902 1062344155 /nfs/dbraw/zinc/34/41/55/1062344155.db2.gz KTJJGOPSGOUJDY-VXGBXAGGSA-N 1 0 311.853 4.216 20 10 DICDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1cc(Br)cc(C)c1O ZINC001474627017 1062348293 /nfs/dbraw/zinc/34/82/93/1062348293.db2.gz YNSQZDJBNOTXQJ-LLVKDONJSA-N 1 0 314.267 4.377 20 10 DICDRO C[C@@H](C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1)C(C)(C)C ZINC001459743607 1062354153 /nfs/dbraw/zinc/35/41/53/1062354153.db2.gz XYINWHZICAEBTO-RDJZCZTQSA-N 1 0 305.462 4.055 20 10 DICDRO CCC(CC)CCC[N@H+](C)Cc1cc(OC)c(OC)cc1O ZINC001474634330 1062356535 /nfs/dbraw/zinc/35/65/35/1062356535.db2.gz DCCCLWRDRCHFII-UHFFFAOYSA-N 1 0 309.450 4.058 20 10 DICDRO Cc1cc(C[NH2+][C@H]2CSC[C@@H]2C)c(C)n1-c1cccc(C)c1 ZINC001474662550 1062395778 /nfs/dbraw/zinc/39/57/78/1062395778.db2.gz CMNVXDCGKDFJSD-LIRRHRJNSA-N 1 0 314.498 4.244 20 10 DICDRO C[C@H]([NH2+]C1CC(c2cc(F)cc(F)c2)C1)c1ccccc1O ZINC001474669418 1062398563 /nfs/dbraw/zinc/39/85/63/1062398563.db2.gz CRBGSIJCMFIKOA-XOMBGVMMSA-N 1 0 303.352 4.267 20 10 DICDRO CCSc1ccc(C[NH2+]Cc2c(C)cc(OC)cc2O)cc1 ZINC001474684400 1062415598 /nfs/dbraw/zinc/41/55/98/1062415598.db2.gz JZMJPMQFIXZPNA-UHFFFAOYSA-N 1 0 317.454 4.111 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(Cl)ccc1F ZINC001459816902 1062423069 /nfs/dbraw/zinc/42/30/69/1062423069.db2.gz KNWOHPYOBJRPEM-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC001255719220 1062540438 /nfs/dbraw/zinc/54/04/38/1062540438.db2.gz CHORTTDCINTCLH-GDBMZVCRSA-N 1 0 314.395 4.306 20 10 DICDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccccc2SC)cc1 ZINC001460045160 1062597862 /nfs/dbraw/zinc/59/78/62/1062597862.db2.gz CFSJNTVBYIHSFB-UHFFFAOYSA-N 1 0 314.498 4.497 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC001256819614 1063000816 /nfs/dbraw/zinc/00/08/16/1063000816.db2.gz DOKLIQCILTYKCC-UYAOXDASSA-N 1 0 311.425 4.134 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@@H]2CCO[C@@H](c3ccccc3)C2)cc1 ZINC001256820930 1063003068 /nfs/dbraw/zinc/00/30/68/1063003068.db2.gz LSDSQDDOYNQBRN-NHCUHLMSSA-N 1 0 324.468 4.105 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+]C1C[C@H](C)O[C@@H](C)C1 ZINC001257086212 1063110146 /nfs/dbraw/zinc/11/01/46/1063110146.db2.gz FTKCTJUNAALOEY-NJSLBKSFSA-N 1 0 317.473 4.178 20 10 DICDRO COc1cc(C[NH2+][C@@H]2CCCC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001461002120 1063178214 /nfs/dbraw/zinc/17/82/14/1063178214.db2.gz QQSDHYVXZFBKER-SUMWQHHRSA-N 1 0 305.462 4.367 20 10 DICDRO Cc1cccc(OCCC[NH2+]Cc2c(O)cc(C)cc2Cl)c1 ZINC001461011137 1063185558 /nfs/dbraw/zinc/18/55/58/1063185558.db2.gz CFBJLAMLVJOJSI-UHFFFAOYSA-N 1 0 319.832 4.221 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H](C)N(C)c1ccccc1 ZINC001461043717 1063211391 /nfs/dbraw/zinc/21/13/91/1063211391.db2.gz HUYDEJDBMLZMMR-INIZCTEOSA-N 1 0 321.468 4.101 20 10 DICDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC001461051916 1063219776 /nfs/dbraw/zinc/21/97/76/1063219776.db2.gz BNZGCSZUWBNOPR-SJLPKXTDSA-N 1 0 318.530 4.156 20 10 DICDRO C[C@H](Cc1ccsc1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001461091258 1063248298 /nfs/dbraw/zinc/24/82/98/1063248298.db2.gz JJNDYTMVICJHRD-FOSCPCJNSA-N 1 0 300.471 4.048 20 10 DICDRO CN1CCCc2cc(C[NH2+]C[C@H]3CCCC(C)(C)C3)ccc21 ZINC001461112410 1063262411 /nfs/dbraw/zinc/26/24/11/1063262411.db2.gz MSRWRDDZNSCCOK-KRWDZBQOSA-N 1 0 300.490 4.375 20 10 DICDRO Cc1oc2ccccc2c1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001461114660 1063264598 /nfs/dbraw/zinc/26/45/98/1063264598.db2.gz YTCZCINHFVQUSS-UHFFFAOYSA-N 1 0 320.436 4.413 20 10 DICDRO COc1ccc(C[NH2+][C@H](c2ccccc2)[C@@H]2CCCO2)cc1C ZINC001461118251 1063267479 /nfs/dbraw/zinc/26/74/79/1063267479.db2.gz ZRGANVWIMPXYAZ-VQTJNVASSA-N 1 0 311.425 4.014 20 10 DICDRO Fc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001461156291 1063298733 /nfs/dbraw/zinc/29/87/33/1063298733.db2.gz SKEHWJVWKPNVFX-FQEVSTJZSA-N 1 0 310.416 4.203 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC001461194349 1063324831 /nfs/dbraw/zinc/32/48/31/1063324831.db2.gz MRUIKGBKDGQZOE-UHFFFAOYSA-N 1 0 321.468 4.151 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)CCc2cccn2C)cc1C ZINC001461209537 1063335996 /nfs/dbraw/zinc/33/59/96/1063335996.db2.gz MMGMTHLEFLKSKO-QGZVFWFLSA-N 1 0 314.473 4.233 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@H]2Cc2ccccc2)cc1 ZINC001461221813 1063344523 /nfs/dbraw/zinc/34/45/23/1063344523.db2.gz JYVIOKFLBGIQCB-CTNGQTDRSA-N 1 0 308.469 4.254 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc2c(c1)CCCO2)Sc1ccccc1 ZINC001461260731 1063374895 /nfs/dbraw/zinc/37/48/95/1063374895.db2.gz VQXCQRYVLSVIPC-HNNXBMFYSA-N 1 0 313.466 4.282 20 10 DICDRO Cc1ccc(C[NH2+]Cc2c(O)cccc2Cl)c(OC(C)C)c1 ZINC001461280410 1063386470 /nfs/dbraw/zinc/38/64/70/1063386470.db2.gz GAXPEBMNEVDDDV-UHFFFAOYSA-N 1 0 319.832 4.431 20 10 DICDRO CC(C)CSCCC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001473115449 1063415846 /nfs/dbraw/zinc/41/58/46/1063415846.db2.gz OUDGXFRDEFMYCR-UHFFFAOYSA-N 1 0 320.546 4.496 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC2(C)Cc3ccccc3C2)cc1 ZINC001461350753 1063434052 /nfs/dbraw/zinc/43/40/52/1063434052.db2.gz XAIQCMODZKYACH-VOTSOKGWSA-N 1 0 320.480 4.161 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@@H](OC)C2(CC)CC)cc1 ZINC001461372958 1063455380 /nfs/dbraw/zinc/45/53/80/1063455380.db2.gz HWTYZVPMTIXARL-RBUKOAKNSA-N 1 0 318.505 4.216 20 10 DICDRO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001473150529 1063457073 /nfs/dbraw/zinc/45/70/73/1063457073.db2.gz OCKPUGWEOJHOEJ-FQEVSTJZSA-N 1 0 324.468 4.488 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CC(C)(C)OC2(C)C)cc1C ZINC001461388292 1063467224 /nfs/dbraw/zinc/46/72/24/1063467224.db2.gz MXZVWMJQOHKJHM-QGZVFWFLSA-N 1 0 305.462 4.220 20 10 DICDRO CC(C)=CCC[C@@H](C)[NH2+]Cc1ccc(Br)cc1O ZINC001258083697 1063506577 /nfs/dbraw/zinc/50/65/77/1063506577.db2.gz NHIOADUMFMVZFU-GFCCVEGCSA-N 1 0 312.251 4.379 20 10 DICDRO CC(C)=CCC[C@H](C)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258086100 1063511907 /nfs/dbraw/zinc/51/19/07/1063511907.db2.gz QXFHORXJQJNTQM-KRWDZBQOSA-N 1 0 316.489 4.081 20 10 DICDRO C[C@H]1CC[C@@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001461480983 1063528737 /nfs/dbraw/zinc/52/87/37/1063528737.db2.gz QBMXJULGDZAEBE-QWHCGFSZSA-N 1 0 314.395 4.297 20 10 DICDRO Clc1cccc(CC2([NH2+]Cc3ccc4c(c3)CCO4)CC2)c1 ZINC001461511338 1063546526 /nfs/dbraw/zinc/54/65/26/1063546526.db2.gz IFNRMGGSHHKBSY-UHFFFAOYSA-N 1 0 313.828 4.140 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H](C)Cc1ccco1 ZINC001258186060 1063551927 /nfs/dbraw/zinc/55/19/27/1063551927.db2.gz VMTCDSRJKQUODB-KUHUBIRLSA-N 1 0 313.441 4.446 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCCCC2(F)F)cc1 ZINC001461531845 1063563360 /nfs/dbraw/zinc/56/33/60/1063563360.db2.gz XUCFLGOSCZXNRL-SQRWCISFSA-N 1 0 308.416 4.181 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@]2(C)C[C@@]2(F)Cl)cc1 ZINC001461616571 1063615081 /nfs/dbraw/zinc/61/50/81/1063615081.db2.gz QEULFHXDMRZSFS-SJORKVTESA-N 1 0 312.860 4.327 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)CC(C)(C)SC ZINC001258348293 1063621732 /nfs/dbraw/zinc/62/17/32/1063621732.db2.gz HJDXCOLNWBHVTC-HNNXBMFYSA-N 1 0 308.535 4.495 20 10 DICDRO COc1ccc(CC[C@@H](C)[NH2+]Cc2c(C)cc(C)cc2O)cc1 ZINC001258395219 1063635239 /nfs/dbraw/zinc/63/52/39/1063635239.db2.gz SFQLTBBJZUYTOR-MRXNPFEDSA-N 1 0 313.441 4.129 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@H]2CC2(Cl)Cl)cc1 ZINC001461651999 1063636143 /nfs/dbraw/zinc/63/61/43/1063636143.db2.gz GYSGXABSTGEFNS-AWEZNQCLSA-N 1 0 315.288 4.206 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CCCC2(F)F)cc1 ZINC001461709343 1063671048 /nfs/dbraw/zinc/67/10/48/1063671048.db2.gz MDDPXDPAOMFKAZ-INIZCTEOSA-N 1 0 310.432 4.448 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]CCC(F)F)cc1 ZINC001461819813 1063735743 /nfs/dbraw/zinc/73/57/43/1063735743.db2.gz LDRXGKWGLBMQDF-UHFFFAOYSA-N 1 0 310.413 4.129 20 10 DICDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)Cc1ccccc1F ZINC001461876547 1063765838 /nfs/dbraw/zinc/76/58/38/1063765838.db2.gz WRAZBLCECFMVNE-BQYQJAHWSA-N 1 0 312.432 4.427 20 10 DICDRO CCCCO[C@H]1C[C@@H]([N@H+](C)Cc2cccc(CC)c2O)C1(C)C ZINC001461881167 1063772542 /nfs/dbraw/zinc/77/25/42/1063772542.db2.gz LRSUQZZCIPZNCE-MSOLQXFVSA-N 1 0 319.489 4.370 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001461891768 1063780776 /nfs/dbraw/zinc/78/07/76/1063780776.db2.gz IDLRWQYPTTXWLT-UHFFFAOYSA-N 1 0 314.385 4.056 20 10 DICDRO CCCC[C@H](CCC)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258756814 1063802608 /nfs/dbraw/zinc/80/26/08/1063802608.db2.gz WJTJQENYRMIRNO-SFHVURJKSA-N 1 0 318.505 4.305 20 10 DICDRO CC[C@H](C)C[C@H](CC)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258785681 1063824600 /nfs/dbraw/zinc/82/46/00/1063824600.db2.gz WIRDGFUUHXLPKF-WMZOPIPTSA-N 1 0 318.505 4.161 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C[C@H]1C ZINC001461965023 1063844002 /nfs/dbraw/zinc/84/40/02/1063844002.db2.gz YWJCSLBNUVAKID-HDICACEKSA-N 1 0 320.480 4.337 20 10 DICDRO CC[C@H](C)C[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001461975572 1063854995 /nfs/dbraw/zinc/85/49/95/1063854995.db2.gz QKHAPFRDJBBAGS-LBPRGKRZSA-N 1 0 302.384 4.249 20 10 DICDRO COc1ccc(C[N@H+](C)C/C=C/c2ccc(N(C)C)cc2)cc1C ZINC001461980691 1063857570 /nfs/dbraw/zinc/85/75/70/1063857570.db2.gz DVHMIXBMZWLIJN-VOTSOKGWSA-N 1 0 324.468 4.215 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)Cc2ccc(O)cc2)cc1Cl ZINC001461984133 1063858693 /nfs/dbraw/zinc/85/86/93/1063858693.db2.gz SHNNYZZGDSODGI-CYBMUJFWSA-N 1 0 319.832 4.123 20 10 DICDRO C[N@H+](Cc1ccc(Cl)s1)Cc1cc(F)c(F)cc1[O-] ZINC001462021592 1063883619 /nfs/dbraw/zinc/88/36/19/1063883619.db2.gz UFHNNFZADQPKIQ-UHFFFAOYSA-N 1 0 303.761 4.017 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCOc2ccccc21 ZINC001462025720 1063886590 /nfs/dbraw/zinc/88/65/90/1063886590.db2.gz KPHBBWVFVHMTAA-GOSISDBHSA-N 1 0 324.468 4.141 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1COCc2ccccc21 ZINC001261374203 1063922413 /nfs/dbraw/zinc/92/24/13/1063922413.db2.gz BVYBFOBINRXBNC-KBRIMQKVSA-N 1 0 309.409 4.110 20 10 DICDRO C[N@H+](Cc1ccc(F)c(Cl)c1)Cc1ccc(Cl)cc1O ZINC001462099823 1063929261 /nfs/dbraw/zinc/92/92/61/1063929261.db2.gz XEVYBRYILLHXBY-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](C1CC1)C1CCOCC1 ZINC001261515262 1063930828 /nfs/dbraw/zinc/93/08/28/1063930828.db2.gz BCJRZEWCDVSKEF-AUJRIZCKSA-N 1 0 315.457 4.044 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H]2CC3CCC2CC3)c1O ZINC000381984352 1063996562 /nfs/dbraw/zinc/99/65/62/1063996562.db2.gz WWJUNTPQFKILPF-ITDKRANNSA-N 1 0 323.864 4.359 20 10 DICDRO COCc1ccccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000390973531 1064176808 /nfs/dbraw/zinc/17/68/08/1064176808.db2.gz PWNSFPITLTZMCY-RHSMWYFYSA-N 1 0 311.425 4.185 20 10 DICDRO CCC[C@H](CC)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000729682980 1064416504 /nfs/dbraw/zinc/41/65/04/1064416504.db2.gz LHKXUMHOWDUASZ-INIZCTEOSA-N 1 0 319.449 4.253 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000749295174 1065138954 /nfs/dbraw/zinc/13/89/54/1065138954.db2.gz LAXXXMPMSJCVDU-AWEZNQCLSA-N 1 0 314.385 4.071 20 10 DICDRO Cc1cc(C[NH2+][C@]2(C)CCCc3ccccc32)ccc1N(C)C ZINC001307607252 1065511275 /nfs/dbraw/zinc/51/12/75/1065511275.db2.gz CHRNWDFRMFXZCA-OAQYLSRUSA-N 1 0 308.469 4.402 20 10 DICDRO CCCC[N@H+](Cc1nc(C(C)(C)C)co1)Cc1ccccc1O ZINC001307721357 1065585415 /nfs/dbraw/zinc/58/54/15/1065585415.db2.gz JDDGJOIYXCQJKH-UHFFFAOYSA-N 1 0 316.445 4.480 20 10 DICDRO COc1ccc2c(c1)C[C@H](C(C)C)CN2C[C@H]1CCO[C@H](C)C1 ZINC001307864139 1065658895 /nfs/dbraw/zinc/65/88/95/1065658895.db2.gz PHKLZGCEPDBODL-RYRKJORJSA-N 1 0 317.473 4.145 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3ccccc3[C@@H](C)C2)ccc1N(C)C ZINC001307905976 1065675987 /nfs/dbraw/zinc/67/59/87/1065675987.db2.gz TVBOBKVHDXWFMG-KRWDZBQOSA-N 1 0 308.469 4.223 20 10 DICDRO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC001308206734 1065815622 /nfs/dbraw/zinc/81/56/22/1065815622.db2.gz TUCZYXDXAGRMNG-QAPCUYQASA-N 1 0 318.530 4.154 20 10 DICDRO Cc1cc(C)c(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)c(C)c1 ZINC001308230243 1065835627 /nfs/dbraw/zinc/83/56/27/1065835627.db2.gz WMAZIFPDJZTGIB-VOTSOKGWSA-N 1 0 308.469 4.481 20 10 DICDRO Cc1ccc(CC[NH2+]C/C=C\c2ccc(N(C)C)cc2)c(C)c1 ZINC001308229979 1065835874 /nfs/dbraw/zinc/83/58/74/1065835874.db2.gz PZUVWGSFYYHQAC-WAYWQWQTSA-N 1 0 308.469 4.215 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)c1cccc(Cl)c1 ZINC001308232095 1065837788 /nfs/dbraw/zinc/83/77/88/1065837788.db2.gz RAISQCLXBLBFGR-UHFFFAOYSA-N 1 0 315.844 4.342 20 10 DICDRO Clc1ccc(Cl)c(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC001308235902 1065843041 /nfs/dbraw/zinc/84/30/41/1065843041.db2.gz RDCQJZDKPBEPPN-UHFFFAOYSA-N 1 0 308.208 4.218 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCc3c2cccc3O)cc1C ZINC001308255680 1065858521 /nfs/dbraw/zinc/85/85/21/1065858521.db2.gz AMRBRDLVUJKEGE-GOSISDBHSA-N 1 0 311.425 4.267 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nc2ccccc2s1 ZINC001308273008 1065873128 /nfs/dbraw/zinc/87/31/28/1065873128.db2.gz WRUMLCMVUKQMCK-LBPRGKRZSA-N 1 0 310.422 4.082 20 10 DICDRO CCS[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001308299394 1065894284 /nfs/dbraw/zinc/89/42/84/1065894284.db2.gz CQUBJBQVEMBOSR-IEBWSBKVSA-N 1 0 318.530 4.441 20 10 DICDRO CCCCO[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1(C)C ZINC001308303370 1065898714 /nfs/dbraw/zinc/89/87/14/1065898714.db2.gz OGDUFBRBFMIYIK-OALUTQOASA-N 1 0 317.473 4.085 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC2(Cc3ccccc3)CC2)cc1 ZINC001308335981 1065921138 /nfs/dbraw/zinc/92/11/38/1065921138.db2.gz APXNOQARSRNIRN-RMKNXTFCSA-N 1 0 320.480 4.378 20 10 DICDRO CCCOc1ccc(C[NH2+]C2(C)Cc3ccccc3C2)cc1C ZINC001308335350 1065921920 /nfs/dbraw/zinc/92/19/20/1065921920.db2.gz HLZJLQZIGDPHPO-UHFFFAOYSA-N 1 0 309.453 4.431 20 10 DICDRO C[C@@H](O)C[C@@H](C)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001308345872 1065930352 /nfs/dbraw/zinc/93/03/52/1065930352.db2.gz XSAHQYYYBUTPPR-ZIAGYGMSSA-N 1 0 321.505 4.236 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](CCO)C2CCCCC2)cc1C ZINC001308360065 1065939386 /nfs/dbraw/zinc/93/93/86/1065939386.db2.gz JKCHNSWMCJODOG-LJQANCHMSA-N 1 0 319.489 4.205 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cc(C)cc(Cl)n2)cc1C ZINC001308381476 1065953581 /nfs/dbraw/zinc/95/35/81/1065953581.db2.gz LPHNZLQGYKPAMA-UHFFFAOYSA-N 1 0 318.848 4.430 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001308442318 1065990356 /nfs/dbraw/zinc/99/03/56/1065990356.db2.gz VNOOFWCKGXVXIY-MRXNPFEDSA-N 1 0 321.468 4.263 20 10 DICDRO CC1(C)C[C@@]1(C[NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1 ZINC001308473990 1066014191 /nfs/dbraw/zinc/01/41/91/1066014191.db2.gz XSWCJNJMXOJHBJ-JOCHJYFZSA-N 1 0 321.464 4.469 20 10 DICDRO Cc1oc(-c2cccs2)nc1C[NH2+][C@H](C)c1ccccc1O ZINC001308506464 1066033887 /nfs/dbraw/zinc/03/38/87/1066033887.db2.gz RYWFXLGFLMMKIJ-LLVKDONJSA-N 1 0 314.410 4.268 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCSC3(CCC3)C2)cc1 ZINC001308540631 1066057087 /nfs/dbraw/zinc/05/70/87/1066057087.db2.gz NQLBWQAHJDPLMY-IVZVJUQRSA-N 1 0 316.514 4.174 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCC2CCC(F)(F)CC2)cc1F ZINC001308547932 1066062262 /nfs/dbraw/zinc/06/22/62/1066062262.db2.gz STIJTGWWENFMAI-UHFFFAOYSA-N 1 0 314.395 4.197 20 10 DICDRO c1ccc(C[C@H]2C[C@@H]2C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001308551330 1066063857 /nfs/dbraw/zinc/06/38/57/1066063857.db2.gz GBZFEVMHEJVONW-LEWJYISDSA-N 1 0 320.480 4.255 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@]1(C)CCCCO1 ZINC001308558225 1066067901 /nfs/dbraw/zinc/06/79/01/1066067901.db2.gz LGWTUGAWMOCPME-FQEVSTJZSA-N 1 0 316.489 4.068 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCC[C@H](C(C)(C)C)CC2)cc1OC ZINC001308572955 1066085135 /nfs/dbraw/zinc/08/51/35/1066085135.db2.gz BBYMACBGFRMVOG-HNNXBMFYSA-N 1 0 321.461 4.058 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001308597140 1066108423 /nfs/dbraw/zinc/10/84/23/1066108423.db2.gz ONULDVRHOWAXNU-INIZCTEOSA-N 1 0 315.844 4.419 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1c(F)cc(C)cc1F ZINC001308618164 1066121003 /nfs/dbraw/zinc/12/10/03/1066121003.db2.gz SZLJKONZUDCCHG-UHFFFAOYSA-N 1 0 305.368 4.391 20 10 DICDRO CCc1cccc(C[NH+]2CCC(c3ccc(O)cc3)CC2)c1O ZINC001308625561 1066125118 /nfs/dbraw/zinc/12/51/18/1066125118.db2.gz JONVNDOHOZUOIG-UHFFFAOYSA-N 1 0 311.425 4.040 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)CC2(SC)CCC2)cc1 ZINC001308645687 1066134776 /nfs/dbraw/zinc/13/47/76/1066134776.db2.gz QLFGJTOBSZCYLW-UHFFFAOYSA-N 1 0 306.519 4.250 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccns1)C1CCCCC1 ZINC001308655041 1066139094 /nfs/dbraw/zinc/13/90/94/1066139094.db2.gz ARTHTNOLKGKIQK-UHFFFAOYSA-N 1 0 302.443 4.184 20 10 DICDRO CCC[C@H](C[N@H+](Cc1ccccc1O)C1CCCCC1)OC ZINC001308656242 1066139404 /nfs/dbraw/zinc/13/94/04/1066139404.db2.gz IVVNCAXWCNWITQ-GOSISDBHSA-N 1 0 305.462 4.342 20 10 DICDRO COc1cccc(Cl)c1C[NH2+]Cc1cc(C(C)C)ccc1O ZINC001308689102 1066181317 /nfs/dbraw/zinc/18/13/17/1066181317.db2.gz GHNNWKWIWTVAHQ-UHFFFAOYSA-N 1 0 319.832 4.467 20 10 DICDRO Cc1cccc2c1C[N@H+](C/C=C/c1ccc(N(C)C)cc1)CC2 ZINC001308687134 1066181382 /nfs/dbraw/zinc/18/13/82/1066181382.db2.gz NRSZHZHSSFQEKD-FNORWQNLSA-N 1 0 306.453 4.133 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(C3CC3)c(C3CC3)c2)c(O)c1 ZINC001308717023 1066195853 /nfs/dbraw/zinc/19/58/53/1066195853.db2.gz YPIHUILDRJUNPA-UHFFFAOYSA-N 1 0 323.436 4.445 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc(Cl)cc1O)[C@H](O)c1ccccc1 ZINC001308735985 1066211512 /nfs/dbraw/zinc/21/15/12/1066211512.db2.gz NBLFNTPPPJUWSQ-FUHWJXTLSA-N 1 0 319.832 4.038 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(Cc3ccc(F)cc3)CC2)cc1Cl ZINC001308764012 1066237025 /nfs/dbraw/zinc/23/70/25/1066237025.db2.gz CHZGPXVDLADQMG-UHFFFAOYSA-N 1 0 319.807 4.358 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@@]2(C)CC2(Cl)Cl)cc1Cl ZINC001308766639 1066240199 /nfs/dbraw/zinc/24/01/99/1066240199.db2.gz NJNWSXWONXTJOF-ZDUSSCGKSA-N 1 0 322.663 4.418 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)c1 ZINC001308778814 1066250221 /nfs/dbraw/zinc/25/02/21/1066250221.db2.gz KTFVQIAPZIDQKP-LJQANCHMSA-N 1 0 310.441 4.494 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2Cc3ccccc3O[C@H](C)C2)c(Cl)c1 ZINC001308791392 1066265825 /nfs/dbraw/zinc/26/58/25/1066265825.db2.gz FALWXVHUQCWOQZ-CYBMUJFWSA-N 1 0 317.816 4.137 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2ccc(C)cc2O)c2ccco2)cc1 ZINC001308820848 1066295422 /nfs/dbraw/zinc/29/54/22/1066295422.db2.gz OUSCUOFOCGFISA-HXUWFJFHSA-N 1 0 323.392 4.181 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC001308825875 1066301026 /nfs/dbraw/zinc/30/10/26/1066301026.db2.gz QGIGIAOQKUSFDC-DJABAAGCSA-N 1 0 300.490 4.160 20 10 DICDRO C[N@H+](Cc1ccc2c(c1)CCN2Cc1ccccc1)C(C)(C)C ZINC001308835210 1066311082 /nfs/dbraw/zinc/31/10/82/1066311082.db2.gz WMVTUWALSMROEZ-UHFFFAOYSA-N 1 0 308.469 4.480 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]C1(c2ccccc2Cl)CC1 ZINC001308835449 1066312509 /nfs/dbraw/zinc/31/25/09/1066312509.db2.gz XJLVNLAUNBPCPV-UHFFFAOYSA-N 1 0 308.208 4.478 20 10 DICDRO Cc1cc(CC[NH2+][C@@H](C)COC(C)C)c(C)n1-c1ccccc1 ZINC001308889594 1066371144 /nfs/dbraw/zinc/37/11/44/1066371144.db2.gz LDQOQLMSKXSCAC-INIZCTEOSA-N 1 0 314.473 4.040 20 10 DICDRO C[C@@H](O)CC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000090085978 185281265 /nfs/dbraw/zinc/28/12/65/185281265.db2.gz UQOJBBXKMITMFC-SJORKVTESA-N 1 0 318.505 4.125 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@H](C)c2sc(C)nc2C)c1 ZINC000093275644 193223676 /nfs/dbraw/zinc/22/36/76/193223676.db2.gz YLLDPUAFLSQRSX-GFCCVEGCSA-N 1 0 320.458 4.057 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)c1O ZINC000093275179 193224169 /nfs/dbraw/zinc/22/41/69/193224169.db2.gz XEAABJQDUTZALR-GFCCVEGCSA-N 1 0 320.458 4.057 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccccc2Cl)c1O ZINC000021014658 182260766 /nfs/dbraw/zinc/26/07/66/182260766.db2.gz QTWSPHCPRCVWSB-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(N(C)C)cc1 ZINC000297465762 533505270 /nfs/dbraw/zinc/50/52/70/533505270.db2.gz YEYLPKBFFNFMOG-KGLIPLIRSA-N 1 0 313.401 4.073 20 10 DICDRO COc1cccc(C2([NH2+][C@H](C)c3ccc(N(C)C)cc3)CC2)c1 ZINC000272311802 130019126 /nfs/dbraw/zinc/01/91/26/130019126.db2.gz TYCUTYYNCFCYGU-OAHLLOKOSA-N 1 0 310.441 4.101 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273426062 130120528 /nfs/dbraw/zinc/12/05/28/130120528.db2.gz UDSLMQTZPGEYJD-MRXNPFEDSA-N 1 0 313.441 4.396 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(O)c1C ZINC000273431219 130120748 /nfs/dbraw/zinc/12/07/48/130120748.db2.gz VTLQWTKMLFBGKH-KBPBESRZSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cnn(-c3ccccc3)c2)c(O)c1C ZINC000273438536 130121661 /nfs/dbraw/zinc/12/16/61/130121661.db2.gz XVHCYDIPHVQKNU-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccc(C)o1 ZINC000273442534 130122580 /nfs/dbraw/zinc/12/25/80/130122580.db2.gz NBSUJYWBZDEFOD-WFASDCNBSA-N 1 0 323.820 4.375 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2ccc(F)cc2O)c1 ZINC000273510240 130130123 /nfs/dbraw/zinc/13/01/23/130130123.db2.gz RNDJKZWSJFMETL-CYBMUJFWSA-N 1 0 302.393 4.074 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2nc3c(cccc3C)o2)c1 ZINC000273573523 130138208 /nfs/dbraw/zinc/13/82/08/130138208.db2.gz LEIXVQYHYJHFSB-AWEZNQCLSA-N 1 0 310.397 4.044 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](CCCO)c2ccccc2)c(O)c1C ZINC000273598157 130141549 /nfs/dbraw/zinc/14/15/49/130141549.db2.gz REMBIKQXNKTZEH-VQIMIIECSA-N 1 0 313.441 4.173 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1 ZINC000273590482 130141813 /nfs/dbraw/zinc/14/18/13/130141813.db2.gz PAGVHYANKQXSBR-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO COCc1cc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)ccc1F ZINC000273612550 130145556 /nfs/dbraw/zinc/14/55/56/130145556.db2.gz WOQFDCOEVFEKKG-AWEZNQCLSA-N 1 0 317.404 4.145 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cc(Cl)ccc1O ZINC000273621756 130147227 /nfs/dbraw/zinc/14/72/27/130147227.db2.gz ZGNLQHCSTOEAER-MEBBXXQBSA-N 1 0 303.789 4.089 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1cc(Cl)ccc1O ZINC000278450969 130692900 /nfs/dbraw/zinc/69/29/00/130692900.db2.gz LNPDCBBESYMPLF-LBPRGKRZSA-N 1 0 316.832 4.170 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2-n2cccn2)c(O)c1 ZINC000284856305 131116286 /nfs/dbraw/zinc/11/62/86/131116286.db2.gz AJUNNCOTDMQZHZ-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc3ncccc3c2)c(O)c1 ZINC000285396140 131164222 /nfs/dbraw/zinc/16/42/22/131164222.db2.gz WYDQGTVPXVSOAG-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)s1 ZINC000285402813 131165171 /nfs/dbraw/zinc/16/51/71/131165171.db2.gz XIAKWGSIGDYKAP-JSGCOSHPSA-N 1 0 304.459 4.228 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)c2c(C)noc2C)cc1 ZINC000285466194 131170999 /nfs/dbraw/zinc/17/09/99/131170999.db2.gz KFFGWEAJWXRBBV-UHFFFAOYSA-N 1 0 315.461 4.163 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cncc2F)c(O)c1C ZINC000285540122 131178388 /nfs/dbraw/zinc/17/83/88/131178388.db2.gz DEPGWXNBLHGGKU-VXGBXAGGSA-N 1 0 306.356 4.094 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(CSC)cc2)c1 ZINC000285856931 131206375 /nfs/dbraw/zinc/20/63/75/131206375.db2.gz ZJEIJZOZESYVHY-ZDUSSCGKSA-N 1 0 317.454 4.115 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)c1 ZINC000287197468 131268425 /nfs/dbraw/zinc/26/84/25/131268425.db2.gz WCYUZJJNPZURLV-CVEARBPZSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cc(C(F)(F)F)ccn2)c(O)c1 ZINC000293760445 131766907 /nfs/dbraw/zinc/76/69/07/131766907.db2.gz REFRKXKJHGBZDR-LBPRGKRZSA-N 1 0 324.346 4.008 20 10 DICDRO COC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccc(Cl)c1 ZINC000297472013 132017235 /nfs/dbraw/zinc/01/72/35/132017235.db2.gz YRBZUQHCIZTLAF-HOTGVXAUSA-N 1 0 317.816 4.010 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1OC(F)F)c1ccccc1O ZINC000120502793 132144449 /nfs/dbraw/zinc/14/44/49/132144449.db2.gz OWDOSZHWDVWXRS-AWEZNQCLSA-N 1 0 307.340 4.235 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1C ZINC000035257825 331491552 /nfs/dbraw/zinc/49/15/52/331491552.db2.gz UMXRQROOVHZURM-ZIAGYGMSSA-N 1 0 301.352 4.214 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)C[C@@H](O)c2cccs2)c(O)c1 ZINC000294821838 335127849 /nfs/dbraw/zinc/12/78/49/335127849.db2.gz QLWWJWZUUGRNIT-QLFBSQMISA-N 1 0 319.470 4.233 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccccc1 ZINC000186034276 333216548 /nfs/dbraw/zinc/21/65/48/333216548.db2.gz YWMRGMLRZIWBLY-WBMJQRKESA-N 1 0 305.805 4.084 20 10 DICDRO COCCC(C)(C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000183929876 333324867 /nfs/dbraw/zinc/32/48/67/333324867.db2.gz AMOMJBYYGQYTEZ-CQSZACIVSA-N 1 0 301.430 4.259 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(O)c1C ZINC000296633465 335145018 /nfs/dbraw/zinc/14/50/18/335145018.db2.gz BOAMBJKLIHTGMD-KBPBESRZSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)n1 ZINC000273409360 334046409 /nfs/dbraw/zinc/04/64/09/334046409.db2.gz HPYCXTKODXCNJS-FZMZJTMJSA-N 1 0 304.459 4.228 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c(O)c1 ZINC000285331967 334147164 /nfs/dbraw/zinc/14/71/64/334147164.db2.gz UHOWWBFCMCLGJW-HOTGVXAUSA-N 1 0 303.446 4.151 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCSc3ccccc32)c1 ZINC000192834888 336265175 /nfs/dbraw/zinc/26/51/75/336265175.db2.gz KGZOPCJDLYQYOR-BLLLJJGKSA-N 1 0 315.438 4.289 20 10 DICDRO FC(F)(F)c1ccnc(NCCCSc2nccs2)c1 ZINC000301752995 336327820 /nfs/dbraw/zinc/32/78/20/336327820.db2.gz BSUMWKFAPRKTNM-UHFFFAOYSA-N 1 0 319.377 4.151 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)CCC2 ZINC000371602814 336908807 /nfs/dbraw/zinc/90/88/07/336908807.db2.gz UFSIKZYGLIHNFS-MLGOLLRUSA-N 1 0 315.486 4.246 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)CCC2 ZINC000371602813 336908853 /nfs/dbraw/zinc/90/88/53/336908853.db2.gz UFSIKZYGLIHNFS-LRDDRELGSA-N 1 0 315.486 4.246 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCc2cnn(C(C)C)c21)c1ccccc1O ZINC000373456147 336961040 /nfs/dbraw/zinc/96/10/40/336961040.db2.gz YNLVAAKTKRBVTP-DLBZAZTESA-N 1 0 313.445 4.288 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(-c3cccnc3)c2)c1 ZINC000375135311 337004153 /nfs/dbraw/zinc/00/41/53/337004153.db2.gz JWUWWJCJBKIWQB-UHFFFAOYSA-N 1 0 304.393 4.052 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cccc(-c3cccnc3)c2)cc1C ZINC000375134806 337004190 /nfs/dbraw/zinc/00/41/90/337004190.db2.gz IEZXIMAOLQNTTK-UHFFFAOYSA-N 1 0 318.420 4.361 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)c(O)c1 ZINC000375243579 337006373 /nfs/dbraw/zinc/00/63/73/337006373.db2.gz ZEILGHORVLQRNX-RIFZZMRRSA-N 1 0 311.425 4.129 20 10 DICDRO Cc1cccc(C[NH2+]Cc2cccc(-c3cccnc3)c2)c1O ZINC000376365776 337032058 /nfs/dbraw/zinc/03/20/58/337032058.db2.gz GPRHMPOHAJWHBI-UHFFFAOYSA-N 1 0 304.393 4.052 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccccc1O ZINC000183450710 337191714 /nfs/dbraw/zinc/19/17/14/337191714.db2.gz NATYWRNDXBSRIU-MGPUTAFESA-N 1 0 304.393 4.227 20 10 DICDRO Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183549822 337192223 /nfs/dbraw/zinc/19/22/23/337192223.db2.gz NACDJHNZKFNHHG-HUUCEWRRSA-N 1 0 321.424 4.298 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1ccccc1O ZINC000183716673 337193183 /nfs/dbraw/zinc/19/31/83/337193183.db2.gz VERSURXQKHGBJM-LRDDRELGSA-N 1 0 301.361 4.096 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(-c2ccccn2)c1)c1cc(F)ccc1O ZINC000186150395 337253977 /nfs/dbraw/zinc/25/39/77/337253977.db2.gz UVMSDRDSSIBTLY-CQSZACIVSA-N 1 0 322.383 4.444 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCOc3cc(F)ccc32)c(O)c1 ZINC000186374472 337256837 /nfs/dbraw/zinc/25/68/37/337256837.db2.gz AGXGASAAVBYJKV-DYVFJYSZSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1cc(F)ccc1O ZINC000189370617 337278939 /nfs/dbraw/zinc/27/89/39/337278939.db2.gz SHKJADVEYCHCHF-MLGOLLRUSA-N 1 0 301.361 4.014 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1cc(F)ccc1O ZINC000527966818 337780982 /nfs/dbraw/zinc/78/09/82/337780982.db2.gz OVKCJQSKMCQJRO-KPZWWZAWSA-N 1 0 300.377 4.118 20 10 DICDRO CC[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccc(F)cn1 ZINC000479443626 339535241 /nfs/dbraw/zinc/53/52/41/339535241.db2.gz ZCSSBDAMIRRRCI-INIZCTEOSA-N 1 0 311.404 4.262 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1OC(F)F ZINC000296024405 341715804 /nfs/dbraw/zinc/71/58/04/341715804.db2.gz PRQJCYJBGHOIDV-BXUZGUMPSA-N 1 0 319.351 4.332 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)c1O ZINC000130331494 521371303 /nfs/dbraw/zinc/37/13/03/521371303.db2.gz YXYQXEKJVFAOKR-NSHDSACASA-N 1 0 323.795 4.434 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccc(F)cc1F ZINC000182391897 522696297 /nfs/dbraw/zinc/69/62/97/522696297.db2.gz UWLGWTBHLDSWIT-GTNSWQLSSA-N 1 0 321.367 4.481 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1O ZINC000156697103 522738347 /nfs/dbraw/zinc/73/83/47/522738347.db2.gz SVEXUPZZNGJBIW-CJNGLKHVSA-N 1 0 314.385 4.411 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccccc1O ZINC000156768546 522756796 /nfs/dbraw/zinc/75/67/96/522756796.db2.gz IYUQCBFBCXYOTR-RDJZCZTQSA-N 1 0 303.446 4.315 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)c1ccccc1O ZINC000157901495 522877465 /nfs/dbraw/zinc/87/74/65/522877465.db2.gz JIBJBWVSGLCZSJ-MRXNPFEDSA-N 1 0 314.429 4.205 20 10 DICDRO CC[C@@H]([NH2+][C@H](COC)c1ccc(F)c(F)c1)c1ccccc1O ZINC000157028422 522945019 /nfs/dbraw/zinc/94/50/19/522945019.db2.gz YHINSEFUNHQRTA-IAGOWNOFSA-N 1 0 321.367 4.099 20 10 DICDRO C[C@@H]([NH2+]C1CCSCC1)c1ccc(N2CCCCC2)cc1 ZINC000180509859 525405066 /nfs/dbraw/zinc/40/50/66/525405066.db2.gz RYIGCUUUUCZXGS-OAHLLOKOSA-N 1 0 304.503 4.223 20 10 DICDRO C[C@@H]([NH2+]CCCCOCCc1ccccc1)c1ccccc1O ZINC000183430874 525434633 /nfs/dbraw/zinc/43/46/33/525434633.db2.gz ZQIZZLUNZXDTRT-QGZVFWFLSA-N 1 0 313.441 4.082 20 10 DICDRO C[C@@H]([NH2+]CCc1nccs1)c1ccc(N2CCCCC2)cc1 ZINC000127825883 525467572 /nfs/dbraw/zinc/46/75/72/525467572.db2.gz CJRSMNMMFBUXGB-OAHLLOKOSA-N 1 0 315.486 4.027 20 10 DICDRO C[C@@H]([NH2+]Cc1ccn(C)c1)c1ccc(N2CCCCCC2)cc1 ZINC000158526897 525543241 /nfs/dbraw/zinc/54/32/41/525543241.db2.gz HSTGKVCKHNSXGT-QGZVFWFLSA-N 1 0 311.473 4.256 20 10 DICDRO C[C@H]([NH2+][C@H](CCCO)c1ccccc1)c1cc(Cl)ccc1O ZINC000185532043 525593027 /nfs/dbraw/zinc/59/30/27/525593027.db2.gz ZGEHSNLZTAGABE-SUMWQHHRSA-N 1 0 319.832 4.210 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cncs1)C1CCCCC1 ZINC000156775442 526371655 /nfs/dbraw/zinc/37/16/55/526371655.db2.gz PRPGCQMANUUBBO-UHFFFAOYSA-N 1 0 302.443 4.184 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)CCC2 ZINC000364950818 527113504 /nfs/dbraw/zinc/11/35/04/527113504.db2.gz KAAVFIHVPCPQHU-SMDDNHRTSA-N 1 0 302.443 4.194 20 10 DICDRO CCSc1cc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)ccn1 ZINC000285120862 535732124 /nfs/dbraw/zinc/73/21/24/535732124.db2.gz LBNSFOCHBPAYRZ-AWEZNQCLSA-N 1 0 316.470 4.367 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273571644 536153969 /nfs/dbraw/zinc/15/39/69/536153969.db2.gz KURFXLBNLLALMD-STQMWFEESA-N 1 0 304.459 4.440 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]CCc2ccc3[nH]ccc3c2)c1O ZINC000799739865 1035963498 /nfs/dbraw/zinc/96/34/98/1035963498.db2.gz RJXBBZZVDVTCES-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO CN(C)c1ccc(C[N@H+](CCCc2ccccc2)C2CC2)cc1 ZINC001167108863 1036094156 /nfs/dbraw/zinc/09/41/56/1036094156.db2.gz VOQIBMSKAFHBSV-UHFFFAOYSA-N 1 0 308.469 4.350 20 10 DICDRO CC[C@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccccc1O ZINC000155265136 1036222100 /nfs/dbraw/zinc/22/21/00/1036222100.db2.gz HRKDXVGJDTXVQN-IBGZPJMESA-N 1 0 310.441 4.102 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(F)cc2C)cc1 ZINC001648832803 1036611791 /nfs/dbraw/zinc/61/17/91/1036611791.db2.gz MVAZWWJXFBVZNP-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2c(O)cccc2Cl)cc1F ZINC000083551564 1036895461 /nfs/dbraw/zinc/89/54/61/1036895461.db2.gz NZRTYNNSJXXSFD-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2c(O)cccc2Cl)cc1 ZINC001140341230 1037481089 /nfs/dbraw/zinc/48/10/89/1037481089.db2.gz FJVLXAWJBLCDBW-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1c(O)cccc1Cl ZINC001140342206 1037486766 /nfs/dbraw/zinc/48/67/66/1037486766.db2.gz XPCUXGOTSPOBAX-UHFFFAOYSA-N 1 0 318.848 4.134 20 10 DICDRO CCc1nc(CC[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)cs1 ZINC000157062943 1037524179 /nfs/dbraw/zinc/52/41/79/1037524179.db2.gz ZNDLHRGHUWNNLN-AWEZNQCLSA-N 1 0 317.502 4.055 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cc(F)cc(F)c1 ZINC000177974789 1037547021 /nfs/dbraw/zinc/54/70/21/1037547021.db2.gz NGUOGSYBAFSPCX-CQSZACIVSA-N 1 0 316.395 4.416 20 10 DICDRO CC[C@H]([NH2+]CCc1scnc1C)c1cc(Cl)ccc1O ZINC000834881576 1037695890 /nfs/dbraw/zinc/69/58/90/1037695890.db2.gz UNTIWIMEUKTLDX-ZDUSSCGKSA-N 1 0 310.850 4.094 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cn1 ZINC000834902077 1037743169 /nfs/dbraw/zinc/74/31/69/1037743169.db2.gz DHPOAHPPNLQTFU-ZDUSSCGKSA-N 1 0 304.821 4.217 20 10 DICDRO Oc1cccc(Br)c1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000707165588 1037873555 /nfs/dbraw/zinc/87/35/55/1037873555.db2.gz IUAVZCMWJMYBEV-CHWSQXEVSA-N 1 0 324.262 4.167 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001140467247 1038167105 /nfs/dbraw/zinc/16/71/05/1038167105.db2.gz RNCVEBLCVJMUNJ-MRXNPFEDSA-N 1 0 319.857 4.336 20 10 DICDRO FC1(F)CCC([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000761334848 1038266223 /nfs/dbraw/zinc/26/62/23/1038266223.db2.gz JOIHUCUCAMNFAG-UHFFFAOYSA-N 1 0 308.416 4.344 20 10 DICDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)CC)cc2)C1 ZINC001167496038 1038299861 /nfs/dbraw/zinc/29/98/61/1038299861.db2.gz IZEKVXDDYJYEBU-ROUUACIJSA-N 1 0 306.519 4.249 20 10 DICDRO CCCCC1([NH2+]Cc2ccc(N3CCC(OC)CC3)cc2)CC1 ZINC000934202004 1038515191 /nfs/dbraw/zinc/51/51/91/1038515191.db2.gz FGWZBLWHTRFOQT-UHFFFAOYSA-N 1 0 316.489 4.114 20 10 DICDRO Cc1csc(C2([NH2+]Cc3cc(C)ccc3O)CCCC2)n1 ZINC000172120952 1038548152 /nfs/dbraw/zinc/54/81/52/1038548152.db2.gz DPKWHSOMOJPRJD-UHFFFAOYSA-N 1 0 302.443 4.025 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2Br)c1 ZINC000048819904 1038670107 /nfs/dbraw/zinc/67/01/07/1038670107.db2.gz CYDDARHHYBOSCT-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO Oc1ccc2oc3c(c2c1C[N@@H+]1CCC[C@@H]1C1CC1)CCCC3 ZINC000728562420 1039278854 /nfs/dbraw/zinc/27/88/54/1039278854.db2.gz OENMNERNBOINAN-MRXNPFEDSA-N 1 0 311.425 4.392 20 10 DICDRO C[C@H]1CCCCC[C@H]1[NH2+]Cc1cccc(Br)c1[O-] ZINC000088506850 1039387163 /nfs/dbraw/zinc/38/71/63/1039387163.db2.gz DACAGTLFKZPENB-SMDDNHRTSA-N 1 0 312.251 4.213 20 10 DICDRO Cc1cccc(CC[NH2+][C@@H](C)c2ccc3ccccc3c2O)n1 ZINC000280062084 1040129586 /nfs/dbraw/zinc/12/95/86/1040129586.db2.gz KJVFKOHROLKCEL-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO CCOC[C@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000318308342 1040503355 /nfs/dbraw/zinc/50/33/55/1040503355.db2.gz QBLASHXLGJTRLN-KDOFPFPSSA-N 1 0 301.430 4.257 20 10 DICDRO CCOC[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000318308344 1040504157 /nfs/dbraw/zinc/50/41/57/1040504157.db2.gz QBLASHXLGJTRLN-KSSFIOAISA-N 1 0 301.430 4.257 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000179553394 1040506088 /nfs/dbraw/zinc/50/60/88/1040506088.db2.gz QEXLZAAQRLWSBM-UHFFFAOYSA-N 1 0 324.449 4.382 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000166966102 1040513553 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Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808697022 1041008704 /nfs/dbraw/zinc/00/87/04/1041008704.db2.gz TZMDYEUPPWQSQP-ZJUUUORDSA-N 1 0 308.809 4.371 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)c1ccc(C)o1 ZINC000808699919 1041009300 /nfs/dbraw/zinc/00/93/00/1041009300.db2.gz DTBRZXFYURXZQF-SWLSCSKDSA-N 1 0 323.820 4.294 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)Cc2ccncc2)c1O ZINC000808701478 1041010668 /nfs/dbraw/zinc/01/06/68/1041010668.db2.gz ZBKPFFONPKJZPY-OLZOCXBDSA-N 1 0 304.821 4.031 20 10 DICDRO CSc1cc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)ccn1 ZINC000808703641 1041010744 /nfs/dbraw/zinc/01/07/44/1041010744.db2.gz QMLPDINJDUBSHP-LLVKDONJSA-N 1 0 322.861 4.322 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](C)c2ccncc2)c1O ZINC000808701515 1041011207 /nfs/dbraw/zinc/01/12/07/1041011207.db2.gz ZOIZIPSLXCKDEW-STQMWFEESA-N 1 0 304.821 4.203 20 10 DICDRO Cc1noc(C)c1CCC[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808701985 1041012289 /nfs/dbraw/zinc/01/22/89/1041012289.db2.gz OTCIJNTWOOKSIG-LLVKDONJSA-N 1 0 322.836 4.242 20 10 DICDRO Cc1[nH]c2ccccc2c1C1=CCN(c2cc[nH+]c(C)c2)CC1 ZINC000685911945 1041134155 /nfs/dbraw/zinc/13/41/55/1041134155.db2.gz CXWLYVGFXHHIGV-UHFFFAOYSA-N 1 0 303.409 4.473 20 10 DICDRO CCCCCC[C@@H](CC)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001170580764 1041170738 /nfs/dbraw/zinc/17/07/38/1041170738.db2.gz GJCCILAUKXRJBV-LJQANCHMSA-N 1 0 318.505 4.362 20 10 DICDRO Cc1ccncc1CCC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000809545505 1041189370 /nfs/dbraw/zinc/18/93/70/1041189370.db2.gz DUAJWSXPCGVZCJ-UHFFFAOYSA-N 1 0 323.484 4.053 20 10 DICDRO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(C)c1O ZINC000809768145 1041235866 /nfs/dbraw/zinc/23/58/66/1041235866.db2.gz DAPVXYHQQRBLKA-HNNXBMFYSA-N 1 0 319.836 4.031 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)c1O ZINC000809739711 1041240179 /nfs/dbraw/zinc/24/01/79/1041240179.db2.gz BWGLWGUCMVMCLC-QZTJIDSGSA-N 1 0 311.425 4.217 20 10 DICDRO COc1cccc(C[NH2+]Cc2c(Cl)oc3ccccc32)c1O ZINC000809740323 1041241222 /nfs/dbraw/zinc/24/12/22/1041241222.db2.gz UHTRBJAKHWVUMI-UHFFFAOYSA-N 1 0 317.772 4.090 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)c1 ZINC000103855271 1041242276 /nfs/dbraw/zinc/24/22/76/1041242276.db2.gz SFDIRVSYNRHJGK-LBPRGKRZSA-N 1 0 307.340 4.153 20 10 DICDRO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@@H+]1Cc1cc(C)ccc1O ZINC000809757319 1041246924 /nfs/dbraw/zinc/24/69/24/1041246924.db2.gz MGDZLCMDQLJGMQ-QGZVFWFLSA-N 1 0 313.445 4.158 20 10 DICDRO CC[C@@H]([NH2+]CCCc1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000166171073 1041316567 /nfs/dbraw/zinc/31/65/67/1041316567.db2.gz KRQCGPDDKWFZGI-LJQANCHMSA-N 1 0 315.461 4.031 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCCCO1)c1ccc(C(F)(F)F)cc1O ZINC000810212222 1041337805 /nfs/dbraw/zinc/33/78/05/1041337805.db2.gz OGINIIXMSPRVER-GXTWGEPZSA-N 1 0 317.351 4.021 20 10 DICDRO CCC[C@@](C)(O)C[NH2+][C@@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000810218008 1041338403 /nfs/dbraw/zinc/33/84/03/1041338403.db2.gz NQHKSPZNROBECN-DZGCQCFKSA-N 1 0 319.367 4.003 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nccc2ccccc21 ZINC000810215129 1041338616 /nfs/dbraw/zinc/33/86/16/1041338616.db2.gz RKUGBGHQIMQWEI-AWEZNQCLSA-N 1 0 304.393 4.021 20 10 DICDRO CC[C@@H]([NH2+][C@@H](COC)C(C)C)c1ccc(C(F)(F)F)cc1O ZINC000810218518 1041339274 /nfs/dbraw/zinc/33/92/74/1041339274.db2.gz AQZRAHATQTVZCL-KGLIPLIRSA-N 1 0 319.367 4.123 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1nccc2ccccc21 ZINC000810219053 1041340096 /nfs/dbraw/zinc/34/00/96/1041340096.db2.gz NONDMVAQINNMEY-INIZCTEOSA-N 1 0 319.452 4.460 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCSC1)c1ccc(C(F)(F)F)cc1O ZINC000810221148 1041340188 /nfs/dbraw/zinc/34/01/88/1041340188.db2.gz LQSHGXXNCPBAND-DGCLKSJQSA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@H]([NH2+][C@H](COC)C(C)C)c1ccc(C(F)(F)F)cc1O ZINC000810218519 1041340375 /nfs/dbraw/zinc/34/03/75/1041340375.db2.gz AQZRAHATQTVZCL-UONOGXRCSA-N 1 0 319.367 4.123 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCOCC1)c1ccc(C(F)(F)F)cc1O ZINC000810229992 1041343148 /nfs/dbraw/zinc/34/31/48/1041343148.db2.gz PVZDPYQEOPLYHF-GXTWGEPZSA-N 1 0 317.351 4.021 20 10 DICDRO CC[C@@H]([NH2+]CCOC1CCC1)c1ccc(C(F)(F)F)cc1O ZINC000810233076 1041345475 /nfs/dbraw/zinc/34/54/75/1041345475.db2.gz QDXMIHJDDVHFQB-CQSZACIVSA-N 1 0 317.351 4.021 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2c(C)noc2C)cc1 ZINC000168178822 1041347642 /nfs/dbraw/zinc/34/76/42/1041347642.db2.gz ARFVXRCBXHHLPS-STQMWFEESA-N 1 0 301.434 4.159 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCSC1)c1ccc(C(F)(F)F)cc1O ZINC000810236886 1041352611 /nfs/dbraw/zinc/35/26/11/1041352611.db2.gz BFVKLCHDXVJCGO-GXFFZTMASA-N 1 0 319.392 4.205 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCSC1)c1ccc(C(F)(F)F)cc1O ZINC000810236887 1041353209 /nfs/dbraw/zinc/35/32/09/1041353209.db2.gz BFVKLCHDXVJCGO-MFKMUULPSA-N 1 0 319.392 4.205 20 10 DICDRO COc1cccc(C2(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)CC2)c1 ZINC000810242794 1041356264 /nfs/dbraw/zinc/35/62/64/1041356264.db2.gz UFCUNUVYLOVFNJ-MRXNPFEDSA-N 1 0 324.468 4.144 20 10 DICDRO CC[C@@H]([NH2+]CC1(c2cccc(OC)c2)CC1)c1ccccc1O ZINC000810241797 1041356316 /nfs/dbraw/zinc/35/63/16/1041356316.db2.gz DYMBUQWGNUFAQK-GOSISDBHSA-N 1 0 311.425 4.173 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C(C)C)no1)c1ccc(N(C)C)cc1 ZINC000169246931 1041360587 /nfs/dbraw/zinc/36/05/87/1041360587.db2.gz JFFLVWDUEUXRSW-QGZVFWFLSA-N 1 0 301.434 4.105 20 10 DICDRO C[C@@H]([NH2+][C@H]1COc2ccccc2C1)c1ccc2ccccc2c1O ZINC000328422615 1041434914 /nfs/dbraw/zinc/43/49/14/1041434914.db2.gz ZKAIIRYHJPTGCL-RHSMWYFYSA-N 1 0 319.404 4.200 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccnc(Cl)c1Cl ZINC000811480557 1041528887 /nfs/dbraw/zinc/52/88/87/1041528887.db2.gz YDGKEOKIKQJVOE-UHFFFAOYSA-N 1 0 324.255 4.053 20 10 DICDRO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1cc(C)cc(C)c1O)C2 ZINC000811793891 1041572169 /nfs/dbraw/zinc/57/21/69/1041572169.db2.gz HDVNRQLSQCVUKU-UHFFFAOYSA-N 1 0 323.436 4.065 20 10 DICDRO C[C@H]([NH2+]CCc1csc(-c2ccccc2)n1)c1ccccc1O ZINC000183388676 1041582586 /nfs/dbraw/zinc/58/25/86/1041582586.db2.gz RTYTUJIUNZCMJD-AWEZNQCLSA-N 1 0 324.449 4.409 20 10 DICDRO Cc1nc(CC[NH2+][C@@H](C)c2ccc3ccccc3c2O)cs1 ZINC000318640999 1041593639 /nfs/dbraw/zinc/59/36/39/1041593639.db2.gz AGSYUTUJMDCHCN-LBPRGKRZSA-N 1 0 312.438 4.204 20 10 DICDRO CCN(CC)[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccco1 ZINC000185227848 1041609351 /nfs/dbraw/zinc/60/93/51/1041609351.db2.gz UNJBHHKFIQPOIQ-WBVHZDCISA-N 1 0 316.445 4.027 20 10 DICDRO CC(C)c1nc(CC[NH2+][C@@H](C)c2cc(F)ccc2O)cs1 ZINC000185310355 1041610272 /nfs/dbraw/zinc/61/02/72/1041610272.db2.gz QIJQOBARVBIDCE-NSHDSACASA-N 1 0 308.422 4.005 20 10 DICDRO C[C@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1ccc2ccccc2c1O ZINC000185454138 1041614293 /nfs/dbraw/zinc/61/42/93/1041614293.db2.gz OFVWZVBMHARBBF-YCRPNKLZSA-N 1 0 321.420 4.104 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCO[C@@H]2C(C)(C)C)c(O)c1 ZINC000185488994 1041615570 /nfs/dbraw/zinc/61/55/70/1041615570.db2.gz JPSSCTQDXFNDEF-DAYGRLMNSA-N 1 0 305.462 4.193 20 10 DICDRO COCC[N@H+](Cc1cc(C(C)C)c(C)cc1O)C1CCCC1 ZINC000747791499 1041625575 /nfs/dbraw/zinc/62/55/75/1041625575.db2.gz OBQIYFIZOBYYBJ-UHFFFAOYSA-N 1 0 305.462 4.215 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2c3ccccc3CC[C@@H]2C)c1 ZINC000186196814 1041626528 /nfs/dbraw/zinc/62/65/28/1041626528.db2.gz WWCOYMBTXBVPQA-PJSUUKDQSA-N 1 0 311.425 4.375 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)cc1 ZINC000812841628 1041655654 /nfs/dbraw/zinc/65/56/54/1041655654.db2.gz GBKBKHLOAISYQW-JFIYKMOQSA-N 1 0 316.489 4.078 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccccc1O ZINC000310071370 1041702471 /nfs/dbraw/zinc/70/24/71/1041702471.db2.gz AGYVAHYUGCREDX-VDGAXYAQSA-N 1 0 324.468 4.096 20 10 DICDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2ccccc2F)cc1F ZINC000813791479 1041732496 /nfs/dbraw/zinc/73/24/96/1041732496.db2.gz BSBNGUZKWTVOHY-UHFFFAOYSA-N 1 0 304.384 4.056 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)c1cc(F)ccc1O ZINC000813872996 1041739860 /nfs/dbraw/zinc/73/98/60/1041739860.db2.gz MVGUDXAXTXLQGO-NEPJUHHUSA-N 1 0 301.352 4.398 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCCC(F)(F)C2)c1 ZINC000813872487 1041740205 /nfs/dbraw/zinc/74/02/05/1041740205.db2.gz HCEABOOPYZKIGM-STQMWFEESA-N 1 0 313.388 4.267 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)o1 ZINC000813885656 1041742702 /nfs/dbraw/zinc/74/27/02/1041742702.db2.gz PWTFIBOXCSRJRV-MFKMUULPSA-N 1 0 318.392 4.118 20 10 DICDRO CCc1nc(C)c(C[NH2+][C@H](CC)c2cc(Cl)ccc2O)o1 ZINC000813886899 1041743653 /nfs/dbraw/zinc/74/36/53/1041743653.db2.gz PQMBICQWKWNYJB-CYBMUJFWSA-N 1 0 308.809 4.145 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1OC(F)F ZINC000120565422 1041749219 /nfs/dbraw/zinc/74/92/19/1041749219.db2.gz XCBFYXGMTIBWJE-ZDUSSCGKSA-N 1 0 320.383 4.205 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1c[nH]c3ccc(Cl)cc13)CC2 ZINC001137714161 1041753478 /nfs/dbraw/zinc/75/34/78/1041753478.db2.gz IPJHAYFMPDMKCG-UHFFFAOYSA-N 1 0 312.800 4.085 20 10 DICDRO CC1(C)CN(Cc2cc(Cl)ccc2O)[C@H]1c1cccnc1 ZINC000814171678 1041777819 /nfs/dbraw/zinc/77/78/19/1041777819.db2.gz UHZJZZLEOOPRDN-INIZCTEOSA-N 1 0 302.805 4.024 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(Cl)cc1 ZINC000194254978 1041785634 /nfs/dbraw/zinc/78/56/34/1041785634.db2.gz LEMWHOMLVIHOTD-SUMWQHHRSA-N 1 0 319.832 4.392 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(Cl)cc1 ZINC000194257488 1041786089 /nfs/dbraw/zinc/78/60/89/1041786089.db2.gz POACJERWKACJGF-SUMWQHHRSA-N 1 0 319.832 4.392 20 10 DICDRO COCc1ccccc1/C=C(/C)C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000814289095 1041804018 /nfs/dbraw/zinc/80/40/18/1041804018.db2.gz ITMOUAZTGYTYCJ-LGMDPLHJSA-N 1 0 324.468 4.092 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)cc1F ZINC000814300125 1041807498 /nfs/dbraw/zinc/80/74/98/1041807498.db2.gz HFTHLZUNWRZIJO-JCNLHEQBSA-N 1 0 316.395 4.067 20 10 DICDRO CCO[C@H](CC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)C(C)C ZINC000756628363 1041810481 /nfs/dbraw/zinc/81/04/81/1041810481.db2.gz LSNYPQANMMDIPV-IVMMDQJWSA-N 1 0 309.425 4.120 20 10 DICDRO CSCCCCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000775582446 1041830436 /nfs/dbraw/zinc/83/04/36/1041830436.db2.gz TVGFKVXHAKLCTH-AWEZNQCLSA-N 1 0 307.503 4.455 20 10 DICDRO Cc1noc(C)c1C[N@@H+](C)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000124601458 1041842526 /nfs/dbraw/zinc/84/25/26/1041842526.db2.gz YKYCAOJGINRBOG-UHFFFAOYSA-N 1 0 316.445 4.235 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)c1ccc(C)cc1 ZINC000181709737 1041850789 /nfs/dbraw/zinc/85/07/89/1041850789.db2.gz DUKFNLMHGBRSKC-GOSISDBHSA-N 1 0 315.388 4.283 20 10 DICDRO COC1(CC[N@H+](Cc2ccccc2O)C2CCCC2)CCC1 ZINC000815048565 1041906066 /nfs/dbraw/zinc/90/60/66/1041906066.db2.gz OMYPYKKHUVJKEC-UHFFFAOYSA-N 1 0 303.446 4.096 20 10 DICDRO COc1ccccc1C(C)(C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000815068852 1041910317 /nfs/dbraw/zinc/91/03/17/1041910317.db2.gz GEFLMDWDNNICLU-UHFFFAOYSA-N 1 0 312.457 4.095 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(C)C)nc2C)c1 ZINC000815083385 1041912793 /nfs/dbraw/zinc/91/27/93/1041912793.db2.gz VQFIVCKRJGXTCW-CQSZACIVSA-N 1 0 314.429 4.078 20 10 DICDRO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000815093151 1041918202 /nfs/dbraw/zinc/91/82/02/1041918202.db2.gz CJZGIKZTERIQJS-HNNXBMFYSA-N 1 0 311.473 4.430 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cc1 ZINC000815092157 1041918286 /nfs/dbraw/zinc/91/82/86/1041918286.db2.gz AYNOEBDHPJSYOM-OXQOHEQNSA-N 1 0 309.457 4.121 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)cc1 ZINC000815141591 1041925591 /nfs/dbraw/zinc/92/55/91/1041925591.db2.gz CJZWBBXFORVJKI-UHFFFAOYSA-N 1 0 304.384 4.154 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]Cc1ccco1 ZINC000815553207 1041961747 /nfs/dbraw/zinc/96/17/47/1041961747.db2.gz ULNMOHFCZFMCMC-LJQANCHMSA-N 1 0 307.393 4.449 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccnc2OC(C)C)c(O)c1 ZINC000815561136 1041962520 /nfs/dbraw/zinc/96/25/20/1041962520.db2.gz ZKBVNVLXBWBCKU-HNNXBMFYSA-N 1 0 314.429 4.042 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cccc3cccnc32)c(O)c1 ZINC000815557052 1041963198 /nfs/dbraw/zinc/96/31/98/1041963198.db2.gz LGZXUJCEUMHVLB-INIZCTEOSA-N 1 0 320.436 4.451 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCOc3ccccc32)c(O)c1 ZINC000815578341 1041965988 /nfs/dbraw/zinc/96/59/88/1041965988.db2.gz MIUSZAQCYHLVEI-JKSUJKDBSA-N 1 0 311.425 4.226 20 10 DICDRO Cn1ccc(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)c1 ZINC000815586060 1041968355 /nfs/dbraw/zinc/96/83/55/1041968355.db2.gz YHQKFALEAXKROF-FQEVSTJZSA-N 1 0 320.436 4.194 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ccc3ccccc3n2)c(O)c1 ZINC000815570361 1041971580 /nfs/dbraw/zinc/97/15/80/1041971580.db2.gz AJIOFBFLIHNWRA-MRXNPFEDSA-N 1 0 320.436 4.451 20 10 DICDRO CCCCn1cc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c(C)n1 ZINC000815600317 1041971677 /nfs/dbraw/zinc/97/16/77/1041971677.db2.gz QLHYRLIMEIJXOH-INIZCTEOSA-N 1 0 315.461 4.165 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCCC(=O)OC(C)(C)C)c(O)c1 ZINC000815599809 1041972117 /nfs/dbraw/zinc/97/21/17/1041972117.db2.gz BOQRJCBFQQMWIY-OAHLLOKOSA-N 1 0 321.461 4.172 20 10 DICDRO COCC1(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)CCC1 ZINC000815641993 1041982691 /nfs/dbraw/zinc/98/26/91/1041982691.db2.gz OENCCVRXCQLASV-OAHLLOKOSA-N 1 0 313.441 4.403 20 10 DICDRO CC[C@H]([NH2+]CCC1(COC)CCC1)c1cc(Cl)ccc1O ZINC000815643277 1041982842 /nfs/dbraw/zinc/98/28/42/1041982842.db2.gz YHPSIJGMWGSOCZ-HNNXBMFYSA-N 1 0 311.853 4.293 20 10 DICDRO CC[C@H]([NH2+]CCC1(COC)CCC1)c1ccc(N(C)C)cc1 ZINC000815642638 1041983379 /nfs/dbraw/zinc/98/33/79/1041983379.db2.gz IJRXSQDRSAZAAH-SFHVURJKSA-N 1 0 304.478 4.000 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)(C)O ZINC000815652062 1041985416 /nfs/dbraw/zinc/98/54/16/1041985416.db2.gz NRIYKZVPECUXIS-KSSFIOAISA-N 1 0 322.468 4.016 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)C1CC1 ZINC000815651001 1041985548 /nfs/dbraw/zinc/98/55/48/1041985548.db2.gz HGPSOZMTKGOSOY-JXFKEZNVSA-N 1 0 316.489 4.143 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)C1CC1 ZINC000815651002 1041985940 /nfs/dbraw/zinc/98/59/40/1041985940.db2.gz HGPSOZMTKGOSOY-OXJNMPFZSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@@H]([NH2+][C@H](CC)C(C)(C)O)c1ccc(C(F)(F)F)cc1O ZINC000815651954 1041986982 /nfs/dbraw/zinc/98/69/82/1041986982.db2.gz JWRGPRXMCFMIJF-TZMCWYRMSA-N 1 0 319.367 4.001 20 10 DICDRO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1c(O)cccc1Cl)CCC2 ZINC000125583669 1042014953 /nfs/dbraw/zinc/01/49/53/1042014953.db2.gz VPKBKVPEHNRXEL-CQSZACIVSA-N 1 0 322.861 4.320 20 10 DICDRO COCc1ccccc1/C=C(/C)C[N@H+](C)Cc1ccccc1O ZINC000816493384 1042057814 /nfs/dbraw/zinc/05/78/14/1042057814.db2.gz ZBXBWDNYWFWPOI-VBKFSLOCSA-N 1 0 311.425 4.074 20 10 DICDRO CN(C)c1cccc(C[N@H+](C)Cc2ccc3ccccc3c2O)c1 ZINC000816519760 1042059918 /nfs/dbraw/zinc/05/99/18/1042059918.db2.gz UPENVSANJSCPKY-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cccc(O)c1Cl ZINC000816499651 1042060193 /nfs/dbraw/zinc/06/01/93/1042060193.db2.gz WKNSSPYPHTWRQU-UHFFFAOYSA-N 1 0 305.805 4.163 20 10 DICDRO Cn1cc(Cl)cc1C[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816520362 1042060466 /nfs/dbraw/zinc/06/04/66/1042060466.db2.gz MXPPCWLWLUJGFI-UHFFFAOYSA-N 1 0 314.816 4.169 20 10 DICDRO COc1ccc(C)cc1CC[NH2+]Cc1ccc2ccccc2c1O ZINC000816530855 1042061749 /nfs/dbraw/zinc/06/17/49/1042061749.db2.gz XVVFJUXPGRMLMT-UHFFFAOYSA-N 1 0 321.420 4.195 20 10 DICDRO C[C@H](Cc1ccc(O)cc1)[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816508306 1042062191 /nfs/dbraw/zinc/06/21/91/1042062191.db2.gz IPYGCKNLKBONPX-OAHLLOKOSA-N 1 0 321.420 4.314 20 10 DICDRO Oc1c(C[N@@H+]2CCOC[C@@H]2c2ccccc2)ccc2ccccc21 ZINC000816516079 1042062464 /nfs/dbraw/zinc/06/24/64/1042062464.db2.gz ULKDTKVPIWIJRL-HXUWFJFHSA-N 1 0 319.404 4.119 20 10 DICDRO Oc1c(C[NH2+]CCc2c(F)cccc2F)ccc2ccccc21 ZINC000816536489 1042063118 /nfs/dbraw/zinc/06/31/18/1042063118.db2.gz ZHAVDOHFICYYLD-UHFFFAOYSA-N 1 0 313.347 4.156 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc2ccccc2c1O)Oc1ccccc1 ZINC000816551396 1042064372 /nfs/dbraw/zinc/06/43/72/1042064372.db2.gz ABTDRKHZDUPOGT-OAHLLOKOSA-N 1 0 307.393 4.103 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1NCc1cc(Cl)c(F)cc1O ZINC000816527258 1042065761 /nfs/dbraw/zinc/06/57/61/1042065761.db2.gz CFHIBFJWMLTDNR-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO Oc1c(C[NH2+][C@H]2CCOc3ccc(F)cc32)ccc2ccccc21 ZINC000816584292 1042065905 /nfs/dbraw/zinc/06/59/05/1042065905.db2.gz HBXJPSYSUZWIKE-SFHVURJKSA-N 1 0 323.367 4.298 20 10 DICDRO COc1cc(CC[NH2+]Cc2ccc3ccccc3c2O)ccc1C ZINC000816553359 1042067869 /nfs/dbraw/zinc/06/78/69/1042067869.db2.gz RTWAPEDOMOBFFI-UHFFFAOYSA-N 1 0 321.420 4.195 20 10 DICDRO Cc1[nH+]c2cc(NCc3ccc4ccccc4c3O)ccc2n1C ZINC000816563861 1042068536 /nfs/dbraw/zinc/06/85/36/1042068536.db2.gz LWTRLBZPLMAJIR-UHFFFAOYSA-N 1 0 317.392 4.353 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+]Cc2ccc3ccccc3c2O)s1 ZINC000816569266 1042069286 /nfs/dbraw/zinc/06/92/86/1042069286.db2.gz FGESJKWSSIVLSG-GFCCVEGCSA-N 1 0 312.438 4.204 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC000816630852 1042070133 /nfs/dbraw/zinc/07/01/33/1042070133.db2.gz UWHHIHLGEKRCGW-LJQANCHMSA-N 1 0 309.409 4.128 20 10 DICDRO Oc1c(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)ccc2ccccc21 ZINC000816616164 1042073296 /nfs/dbraw/zinc/07/32/96/1042073296.db2.gz PPXSSQPJLSBYPT-UYAOXDASSA-N 1 0 323.436 4.079 20 10 DICDRO CSC[C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816616994 1042073910 /nfs/dbraw/zinc/07/39/10/1042073910.db2.gz LNDIQBLCPMPRTR-CQSZACIVSA-N 1 0 301.455 4.120 20 10 DICDRO Cc1cncc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000181836261 1042079665 /nfs/dbraw/zinc/07/96/65/1042079665.db2.gz ZMFQGTBBOYVBHE-QGZVFWFLSA-N 1 0 309.457 4.231 20 10 DICDRO Cc1cncc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000181836241 1042080256 /nfs/dbraw/zinc/08/02/56/1042080256.db2.gz ZMFQGTBBOYVBHE-KRWDZBQOSA-N 1 0 309.457 4.231 20 10 DICDRO Oc1c(C[NH2+]C[C@H]2CC23CCSCC3)ccc2ccccc21 ZINC000817411734 1042108198 /nfs/dbraw/zinc/10/81/98/1042108198.db2.gz UVWHQMMSUUIGFK-MRXNPFEDSA-N 1 0 313.466 4.168 20 10 DICDRO CC(C)[N@H+](Cc1cc2c(cc1O)OCO2)[C@H](C)c1ccsc1 ZINC000817416202 1042108255 /nfs/dbraw/zinc/10/82/55/1042108255.db2.gz QMXSMIWQILYTHR-GFCCVEGCSA-N 1 0 319.426 4.154 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccncc1Cl ZINC000817578790 1042115791 /nfs/dbraw/zinc/11/57/91/1042115791.db2.gz YHJRTVZZQIZEFA-SNVBAGLBSA-N 1 0 313.879 4.025 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccncc1Cl ZINC000817578789 1042116275 /nfs/dbraw/zinc/11/62/75/1042116275.db2.gz YHJRTVZZQIZEFA-JTQLQIEISA-N 1 0 313.879 4.025 20 10 DICDRO COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000817576256 1042116363 /nfs/dbraw/zinc/11/63/63/1042116363.db2.gz OXXWLLIPHMAYQK-CYBMUJFWSA-N 1 0 318.848 4.265 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](N)c2ccc(C(C)C)cc2)c1 ZINC000817952214 1042131068 /nfs/dbraw/zinc/13/10/68/1042131068.db2.gz CUCBOXZABXQAIA-KXBFYZLASA-N 1 0 312.457 4.175 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(C(F)(F)F)cc1 ZINC000817956018 1042131682 /nfs/dbraw/zinc/13/16/82/1042131682.db2.gz NTKQVXAIZLWVLL-GFCCVEGCSA-N 1 0 308.347 4.181 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cccc(C(F)(F)F)c1 ZINC000817956252 1042132301 /nfs/dbraw/zinc/13/23/01/1042132301.db2.gz UUHTVYNEUCTXTO-LBPRGKRZSA-N 1 0 308.347 4.181 20 10 DICDRO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817957839 1042132364 /nfs/dbraw/zinc/13/23/64/1042132364.db2.gz PUGUNLIQCYUYDD-KBPBESRZSA-N 1 0 302.849 4.247 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(Cl)c1 ZINC000818327850 1042147270 /nfs/dbraw/zinc/14/72/70/1042147270.db2.gz JMEWWBSEIVBAMI-CYBMUJFWSA-N 1 0 318.848 4.265 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(Cl)c1 ZINC000818327852 1042147800 /nfs/dbraw/zinc/14/78/00/1042147800.db2.gz JMEWWBSEIVBAMI-ZDUSSCGKSA-N 1 0 318.848 4.265 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccc(C)cc2C)cc1 ZINC001648946582 1042378729 /nfs/dbraw/zinc/37/87/29/1042378729.db2.gz ROXOPMQLJNKYSZ-UHFFFAOYSA-N 1 0 310.485 4.482 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1-n1cccn1)c1ccc(C)cc1O ZINC000279935268 1042386295 /nfs/dbraw/zinc/38/62/95/1042386295.db2.gz AXMXCILRZXITPP-SFHVURJKSA-N 1 0 321.424 4.127 20 10 DICDRO Cc1ncoc1C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC000893872392 1042394428 /nfs/dbraw/zinc/39/44/28/1042394428.db2.gz SITKGAYTTXYGJV-UHFFFAOYSA-N 1 0 300.402 4.024 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCc3occc32)cc1F ZINC000236973782 1042440125 /nfs/dbraw/zinc/44/01/25/1042440125.db2.gz VQRDPLDCGYGIHC-QGZVFWFLSA-N 1 0 316.420 4.432 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccc(C)cc1O ZINC000279961630 1042465868 /nfs/dbraw/zinc/46/58/68/1042465868.db2.gz CHKGTUMFEYRJKL-MOPGFXCFSA-N 1 0 313.441 4.255 20 10 DICDRO CC[C@H]1CCC[C@H]([NH2+]C2CCN(c3ccc(OC)cc3)CC2)C1 ZINC000237075297 1042491552 /nfs/dbraw/zinc/49/15/52/1042491552.db2.gz GULRZCPFEFDLEP-WMZOPIPTSA-N 1 0 316.489 4.222 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2CCc3c2cccc3Cl)c1O ZINC000894205470 1042502857 /nfs/dbraw/zinc/50/28/57/1042502857.db2.gz ZGPZPYSCFQQUNU-MRXNPFEDSA-N 1 0 317.816 4.140 20 10 DICDRO CC[C@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1ccc(C)cc1O ZINC000280036722 1042562173 /nfs/dbraw/zinc/56/21/73/1042562173.db2.gz IMYJIWDEJJAPND-HOTGVXAUSA-N 1 0 303.402 4.030 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(-n2cccn2)cc1)c1ccc(C)cc1O ZINC000280245567 1042568027 /nfs/dbraw/zinc/56/80/27/1042568027.db2.gz WGVJYOVPIOLJPU-LJQANCHMSA-N 1 0 321.424 4.127 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCOC)c1ccc(C)o1)c1ccc(C)cc1O ZINC000280272580 1042568942 /nfs/dbraw/zinc/56/89/42/1042568942.db2.gz YACQZRAZGCDAQV-IAGOWNOFSA-N 1 0 317.429 4.421 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccncc1Cl ZINC000421863914 1042658226 /nfs/dbraw/zinc/65/82/26/1042658226.db2.gz ZCJSVRIXLZSXEJ-CYBMUJFWSA-N 1 0 313.832 4.386 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccccc1OC ZINC000319682372 1042678443 /nfs/dbraw/zinc/67/84/43/1042678443.db2.gz VQMXEXDEBJEEEN-CXAGYDPISA-N 1 0 315.413 4.211 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)c1O ZINC000894855862 1042989489 /nfs/dbraw/zinc/98/94/89/1042989489.db2.gz UTOZYOIUBISUPW-UHFFFAOYSA-N 1 0 321.367 4.111 20 10 DICDRO CCc1nc(CC[NH2+][C@@H](CC)c2ccc(C)cc2O)cs1 ZINC000794804975 1043048925 /nfs/dbraw/zinc/04/89/25/1043048925.db2.gz ONLSAPUMPBFRAF-HNNXBMFYSA-N 1 0 304.459 4.003 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1N(C)CC)c1ccc(C)cc1O ZINC000794803623 1043051936 /nfs/dbraw/zinc/05/19/36/1043051936.db2.gz BRUFVFRGDIZLSZ-GOSISDBHSA-N 1 0 312.457 4.398 20 10 DICDRO CC[C@H]([NH2+]CC1(CCOC)CCCC1)c1ccc(C)cc1O ZINC000794809718 1043055372 /nfs/dbraw/zinc/05/53/72/1043055372.db2.gz ITXWPYNCDFMUSD-KRWDZBQOSA-N 1 0 305.462 4.338 20 10 DICDRO CC[C@@H]([NH2+]CC1(CCO)CCCCC1)c1ccc(C)cc1O ZINC000794811402 1043056152 /nfs/dbraw/zinc/05/61/52/1043056152.db2.gz QPRCVXIXORESLP-QGZVFWFLSA-N 1 0 305.462 4.074 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](CC(C)C)C1)c1ccc(C)cc1O ZINC000794813896 1043058721 /nfs/dbraw/zinc/05/87/21/1043058721.db2.gz QLLCUAOLIMBBBW-RYRKJORJSA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@H]([NH2+]CCC[C@H]1CCCC[C@H]1O)c1ccc(C)cc1O ZINC000794815343 1043059020 /nfs/dbraw/zinc/05/90/20/1043059020.db2.gz KCJJRHCCCOQTEZ-BPQIPLTHSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@H]([NH2+]C1(c2ccc(OC)cc2)CC1)c1ccc(C)cc1O ZINC000794812530 1043060970 /nfs/dbraw/zinc/06/09/70/1043060970.db2.gz MBCYBZJFIIEJMA-SFHVURJKSA-N 1 0 311.425 4.439 20 10 DICDRO CC[C@@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1ccc(C)cc1O ZINC000794818453 1043062336 /nfs/dbraw/zinc/06/23/36/1043062336.db2.gz XDHNJWFWHRRRQE-IEBWSBKVSA-N 1 0 305.462 4.073 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(c3nccs3)CCCC2)cc1C ZINC000174402904 1043065910 /nfs/dbraw/zinc/06/59/10/1043065910.db2.gz RVCBSVGLMRSMPX-UHFFFAOYSA-N 1 0 302.443 4.025 20 10 DICDRO CCC[C@H]([NH2+][C@H](CC)c1ccccc1O)[C@@H](O)c1ccccc1 ZINC000794828540 1043066177 /nfs/dbraw/zinc/06/61/77/1043066177.db2.gz BVUKKCALJLIPTR-HBFSDRIKSA-N 1 0 313.441 4.335 20 10 DICDRO CCC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)[C@@H](O)c1ccccc1 ZINC000794830520 1043068285 /nfs/dbraw/zinc/06/82/85/1043068285.db2.gz JSPYLSYDOYSFAY-BPAFIMBUSA-N 1 0 313.441 4.254 20 10 DICDRO CCOc1cccc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)c1O ZINC000175989500 1043092365 /nfs/dbraw/zinc/09/23/65/1043092365.db2.gz VEIHXNGWJOHCAE-UHFFFAOYSA-N 1 0 321.367 4.094 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@H](CC(C)C)C1)c1ccc(N(C)C)cc1 ZINC000777311021 1043096700 /nfs/dbraw/zinc/09/67/00/1043096700.db2.gz ZEAWMHMNGPOQQT-SXLOBPIMSA-N 1 0 318.505 4.387 20 10 DICDRO CCOc1cccc(C[NH2+]C2CCC(OC(C)(C)C)CC2)c1O ZINC000865697874 1043124894 /nfs/dbraw/zinc/12/48/94/1043124894.db2.gz GMBAIGNCZUKQOT-UHFFFAOYSA-N 1 0 321.461 4.007 20 10 DICDRO CCSc1cc(C[NH2+]Cc2cc(Cl)c(C)cc2O)ccn1 ZINC000825568148 1043134935 /nfs/dbraw/zinc/13/49/35/1043134935.db2.gz SOQONXFIGLLZFP-UHFFFAOYSA-N 1 0 322.861 4.151 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000183344486 1043161049 /nfs/dbraw/zinc/16/10/49/1043161049.db2.gz DLROPBSSJAFUDY-RDJZCZTQSA-N 1 0 320.452 4.036 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000183344470 1043161464 /nfs/dbraw/zinc/16/14/64/1043161464.db2.gz DLROPBSSJAFUDY-NVXWUHKLSA-N 1 0 320.452 4.036 20 10 DICDRO COc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000866228836 1043162473 /nfs/dbraw/zinc/16/24/73/1043162473.db2.gz LEDORAWRTCRBDR-NRFANRHFSA-N 1 0 322.452 4.073 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCc3ncccc32)cc1 ZINC000866237596 1043163752 /nfs/dbraw/zinc/16/37/52/1043163752.db2.gz IEAUBHNQIVIVBM-FQEVSTJZSA-N 1 0 309.457 4.095 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1O ZINC000183446655 1043164617 /nfs/dbraw/zinc/16/46/17/1043164617.db2.gz YOSLVCMMLXRJLR-XAUMDUMWSA-N 1 0 311.425 4.211 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccccc1O ZINC000183644853 1043168754 /nfs/dbraw/zinc/16/87/54/1043168754.db2.gz WTVSTJUTSZMUPB-BJOOFOGMSA-N 1 0 317.816 4.226 20 10 DICDRO COc1ccc([C@H]([NH2+][C@H](C)c2cc(F)ccc2O)C2CC2)cc1 ZINC000184910993 1043190631 /nfs/dbraw/zinc/19/06/31/1043190631.db2.gz WBVDAUVOJHJZSG-CWTRNNRKSA-N 1 0 315.388 4.342 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c(O)c1 ZINC000185006117 1043192754 /nfs/dbraw/zinc/19/27/54/1043192754.db2.gz LMQLAOIEBCASKY-MRXNPFEDSA-N 1 0 310.441 4.152 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccsc1C(F)(F)F)CC2 ZINC000866405919 1043198389 /nfs/dbraw/zinc/19/83/89/1043198389.db2.gz MZPVVCVQBPXOKM-LLVKDONJSA-N 1 0 313.344 4.250 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOc2ccccc21)c1cc(F)ccc1O ZINC000185271306 1043199289 /nfs/dbraw/zinc/19/92/89/1043199289.db2.gz HESHTFKMZYGRFN-BLLLJJGKSA-N 1 0 301.361 4.096 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000185374158 1043201102 /nfs/dbraw/zinc/20/11/02/1043201102.db2.gz GQZIDBQDTCRBOM-GFCCVEGCSA-N 1 0 304.459 4.305 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CCC(OC(C)(C)C)CC2)c(O)c1 ZINC000866449936 1043203752 /nfs/dbraw/zinc/20/37/52/1043203752.db2.gz AKEWSLFRZKIKIU-FHERZECASA-N 1 0 305.462 4.478 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C2CCC(OC(C)(C)C)CC2)c(O)c1 ZINC000866449937 1043203796 /nfs/dbraw/zinc/20/37/96/1043203796.db2.gz AKEWSLFRZKIKIU-QQFBHYJXSA-N 1 0 305.462 4.478 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2cnc(C)s2)cc1 ZINC000866454569 1043205014 /nfs/dbraw/zinc/20/50/14/1043205014.db2.gz CWQYIUVPQXONQU-STQMWFEESA-N 1 0 303.475 4.319 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2CCC(OC(C)(C)C)CC2)c1O ZINC000866451787 1043205233 /nfs/dbraw/zinc/20/52/33/1043205233.db2.gz YNSFRVSKIJTEBC-WLYUNCDWSA-N 1 0 321.461 4.178 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc3c2CCOC3)cc1 ZINC000866477724 1043206126 /nfs/dbraw/zinc/20/61/26/1043206126.db2.gz BEWHEMQVFJZITI-INIZCTEOSA-N 1 0 324.468 4.066 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)C[C@H](O)c2ccc(F)cc2)c1 ZINC000185838261 1043208538 /nfs/dbraw/zinc/20/85/38/1043208538.db2.gz AKKQPWOUIQOALT-LPMFXHHGSA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc2[nH]c(=O)oc2c1)c1ccccc1O ZINC000866486003 1043209151 /nfs/dbraw/zinc/20/91/51/1043209151.db2.gz VKMBKJCAQIDBPX-RISCZKNCSA-N 1 0 312.369 4.041 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1cc(F)ccc1F ZINC000186071096 1043212128 /nfs/dbraw/zinc/21/21/28/1043212128.db2.gz CXNFUOFTDHQJSX-DIFFPNOSSA-N 1 0 321.367 4.481 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c(O)c1 ZINC000186010100 1043213535 /nfs/dbraw/zinc/21/35/35/1043213535.db2.gz PIFMLGSSTXIVLK-BLLLJJGKSA-N 1 0 301.361 4.014 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(OC)c1OC ZINC000866509024 1043213596 /nfs/dbraw/zinc/21/35/96/1043213596.db2.gz UJURQXQNYRDRKS-BBRMVZONSA-N 1 0 315.413 4.211 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1cc(Cl)ccc1O ZINC000186129021 1043214583 /nfs/dbraw/zinc/21/45/83/1043214583.db2.gz PWICMWLACAJEQN-OCCSQVGLSA-N 1 0 309.837 4.188 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2noc3ccc(F)cc32)c(O)c1C ZINC000866511561 1043214599 /nfs/dbraw/zinc/21/45/99/1043214599.db2.gz QWWYYAVZXGTACQ-LBPRGKRZSA-N 1 0 314.360 4.140 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1Cl ZINC000186120802 1043214928 /nfs/dbraw/zinc/21/49/28/1043214928.db2.gz CUCLVCZKZCWWFK-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(O)c1 ZINC000186093036 1043214983 /nfs/dbraw/zinc/21/49/83/1043214983.db2.gz ZWGFKQZPMGSUHB-ZIAGYGMSSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(O)c1C ZINC000866540513 1043220612 /nfs/dbraw/zinc/22/06/12/1043220612.db2.gz POSWQPOOIXYFTF-AWEZNQCLSA-N 1 0 314.385 4.076 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCSCCC(F)(F)F)c(O)c1 ZINC000866543868 1043221651 /nfs/dbraw/zinc/22/16/51/1043221651.db2.gz ZEEKCDVORZKHHR-NSHDSACASA-N 1 0 307.381 4.037 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOc2cc(F)ccc21)c1cc(F)ccc1O ZINC000186374616 1043222968 /nfs/dbraw/zinc/22/29/68/1043222968.db2.gz BJYBKBWDHXSQHU-ZBEGNZNMSA-N 1 0 319.351 4.235 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCOc3c(F)cccc32)c(O)c1 ZINC000186506831 1043226258 /nfs/dbraw/zinc/22/62/58/1043226258.db2.gz FNFFTRLAMYKDMX-GUYCJALGSA-N 1 0 315.388 4.404 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC12CCCC2)c1cc(Br)ccc1O ZINC000760040486 1043227870 /nfs/dbraw/zinc/22/78/70/1043227870.db2.gz KSYKILUBPXXCIL-IINYFYTJSA-N 1 0 310.235 4.138 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1cc(Cl)ccc1O ZINC000186615465 1043230899 /nfs/dbraw/zinc/23/08/99/1043230899.db2.gz FHCDOQVUVGRGEJ-GFCCVEGCSA-N 1 0 319.832 4.124 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)c1cc(F)ccc1O ZINC000866608078 1043232981 /nfs/dbraw/zinc/23/29/81/1043232981.db2.gz DXGQWCYEQDEUJJ-OASPWFOLSA-N 1 0 303.299 4.079 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)c1nccs1)c1ccc(N(C)C)cc1 ZINC000186736688 1043233435 /nfs/dbraw/zinc/23/34/35/1043233435.db2.gz VVPHAMWQPRPGRR-CZUORRHYSA-N 1 0 303.475 4.054 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2noc3cc(F)ccc32)c(O)c1C ZINC000866612786 1043235948 /nfs/dbraw/zinc/23/59/48/1043235948.db2.gz OBFFOJLNVPGENB-LBPRGKRZSA-N 1 0 314.360 4.140 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2noc3cc(F)ccc32)c(O)c1 ZINC000866612461 1043236301 /nfs/dbraw/zinc/23/63/01/1043236301.db2.gz JFZAGEQZYCYOPW-GFCCVEGCSA-N 1 0 314.360 4.140 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2cccc3[nH]ccc32)c2c1c(F)ccc2O ZINC000866632252 1043239411 /nfs/dbraw/zinc/23/94/11/1043239411.db2.gz WDFIDOPZOIGGER-ZBEGNZNMSA-N 1 0 310.372 4.351 20 10 DICDRO Cc1cc(F)cc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001143586977 1043239526 /nfs/dbraw/zinc/23/95/26/1043239526.db2.gz YGEOLVKIQXCRII-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO CCSc1cc(C[NH2+][C@@H](C)c2cc(C)ccc2O)ccn1 ZINC000187793935 1043250706 /nfs/dbraw/zinc/25/07/06/1043250706.db2.gz RKVOLVPJJCJJAE-ZDUSSCGKSA-N 1 0 302.443 4.058 20 10 DICDRO CCSc1cc(C[NH2+][C@@H](C)c2ccc(C)cc2O)ccn1 ZINC000187799488 1043250837 /nfs/dbraw/zinc/25/08/37/1043250837.db2.gz QOBKJNRVYUYXAN-ZDUSSCGKSA-N 1 0 302.443 4.058 20 10 DICDRO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000121877684 1043264347 /nfs/dbraw/zinc/26/43/47/1043264347.db2.gz LJQRPKYTTCFWIX-INIZCTEOSA-N 1 0 312.457 4.391 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccc(Cl)nc2)cc1 ZINC000122713072 1043324082 /nfs/dbraw/zinc/32/40/82/1043324082.db2.gz ASEHQRUBIFSTHF-CQSZACIVSA-N 1 0 317.864 4.084 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1cc(F)cc(F)c1 ZINC000122740539 1043326155 /nfs/dbraw/zinc/32/61/55/1043326155.db2.gz CRKRCMKTDWQIRJ-ZDUSSCGKSA-N 1 0 304.384 4.190 20 10 DICDRO CC[C@H]([NH2+]CC1(CCOC)CCC1)c1ccc(N(C)C)cc1 ZINC000123053428 1043343709 /nfs/dbraw/zinc/34/37/09/1043343709.db2.gz UGVXMVHUFZBKIN-SFHVURJKSA-N 1 0 304.478 4.000 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)[C@H]1CCOC1 ZINC000268939438 1043345409 /nfs/dbraw/zinc/34/54/09/1043345409.db2.gz ZRCUCOBPIYVFGK-SCTDSRPQSA-N 1 0 316.489 4.143 20 10 DICDRO Clc1ncc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)s1 ZINC000895155765 1043373259 /nfs/dbraw/zinc/37/32/59/1043373259.db2.gz NTCOXTWLQVLUGA-UHFFFAOYSA-N 1 0 321.877 4.077 20 10 DICDRO COCC(C)(C)CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000872104826 1043461279 /nfs/dbraw/zinc/46/12/79/1043461279.db2.gz QVLKBYCEXRGJHN-CQSZACIVSA-N 1 0 301.430 4.259 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(C(F)(F)F)nc1 ZINC000872129953 1043471562 /nfs/dbraw/zinc/47/15/62/1043471562.db2.gz HTIRKNRFIXTSRT-GHMZBOCLSA-N 1 0 310.319 4.218 20 10 DICDRO Cc1csc([C@@H]2CC[N@H+](Cc3c(O)ccc4ccccc43)C2)n1 ZINC000872807627 1043509068 /nfs/dbraw/zinc/50/90/68/1043509068.db2.gz XCNDMPDJGRRTCL-OAHLLOKOSA-N 1 0 324.449 4.300 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)cc1C ZINC000873052541 1043512940 /nfs/dbraw/zinc/51/29/40/1043512940.db2.gz YTAOEFXXUXTAFU-MRXNPFEDSA-N 1 0 315.461 4.412 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2cncc(F)c2)cc1C ZINC000873101394 1043516385 /nfs/dbraw/zinc/51/63/85/1043516385.db2.gz DWJCJWVXIQZWGD-AWEZNQCLSA-N 1 0 302.393 4.169 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](c2cccnc2)C2CC2)cc1C ZINC000873099101 1043516716 /nfs/dbraw/zinc/51/67/16/1043516716.db2.gz YCXJFXHEUWDFIV-HXUWFJFHSA-N 1 0 310.441 4.420 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccc(N(C)C)cc1 ZINC000124408330 1043519303 /nfs/dbraw/zinc/51/93/03/1043519303.db2.gz RDJVBSXIWNCJKI-STQMWFEESA-N 1 0 304.384 4.443 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)c1O ZINC000124935352 1043577525 /nfs/dbraw/zinc/57/75/25/1043577525.db2.gz ZANBEHHQOPAVQU-LBPRGKRZSA-N 1 0 321.367 4.262 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2[C@@H](c3ccccc3)C2(F)F)c1 ZINC000926971937 1043664940 /nfs/dbraw/zinc/66/49/40/1043664940.db2.gz AHMIRJFCZXFPSB-MZMPZRCHSA-N 1 0 317.379 4.400 20 10 DICDRO Cc1nc2c(cccc2CC[NH2+][C@@H](C)c2cc(C)ccc2O)o1 ZINC000926974493 1043665006 /nfs/dbraw/zinc/66/50/06/1043665006.db2.gz LWTLYJGKBUIOJE-ZDUSSCGKSA-N 1 0 310.397 4.044 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCCc3cccnc32)cc1 ZINC000927059547 1043675755 /nfs/dbraw/zinc/67/57/55/1043675755.db2.gz IGEBPKAUJSZFEK-HNAYVOBHSA-N 1 0 309.457 4.266 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](c2cnn(C)c2)C(C)C)c1O ZINC000927070553 1043683168 /nfs/dbraw/zinc/68/31/68/1043683168.db2.gz OZOMEAYDAPIYCH-WBMJQRKESA-N 1 0 321.852 4.135 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3ccncc3)CC2)cc1Cl ZINC000825903886 1043712090 /nfs/dbraw/zinc/71/20/90/1043712090.db2.gz VMDVFQUGDBZHGF-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO Cc1cccnc1[C@H]1CCC[C@H]([NH2+][C@@H](C)c2ccccc2O)C1 ZINC000877757996 1043792510 /nfs/dbraw/zinc/79/25/10/1043792510.db2.gz CEJKFMLRQJVIGA-ULQDDVLXSA-N 1 0 310.441 4.473 20 10 DICDRO Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccccc2O)C1 ZINC000877757995 1043793376 /nfs/dbraw/zinc/79/33/76/1043793376.db2.gz CEJKFMLRQJVIGA-GVDBMIGSSA-N 1 0 310.441 4.473 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(C(F)(F)F)s2)c(O)c1 ZINC000877805248 1043801491 /nfs/dbraw/zinc/80/14/91/1043801491.db2.gz JKUMSLWHQRZSJG-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO Cc1csc([C@H]2CC[N@H+](Cc3ccc4ccccc4c3O)C2)n1 ZINC000877813689 1043804649 /nfs/dbraw/zinc/80/46/49/1043804649.db2.gz JKEBWVBJOROPPI-INIZCTEOSA-N 1 0 324.449 4.300 20 10 DICDRO C[C@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1ccc(N(C)C)cc1 ZINC000878454768 1043896500 /nfs/dbraw/zinc/89/65/00/1043896500.db2.gz HXLWFDHVJAKKER-NSHDSACASA-N 1 0 312.335 4.215 20 10 DICDRO C[C@H]([NH2+]Cc1sccc1Br)c1ccccc1O ZINC000147921102 1043903706 /nfs/dbraw/zinc/90/37/06/1043903706.db2.gz RYVJGBQAFCWGAB-VIFPVBQESA-N 1 0 312.232 4.067 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(N(C)C)cc1 ZINC000127264516 1043911004 /nfs/dbraw/zinc/91/10/04/1043911004.db2.gz RBYRKNBIPMYOBO-MJGOQNOKSA-N 1 0 316.489 4.285 20 10 DICDRO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)c1 ZINC000127374276 1043924360 /nfs/dbraw/zinc/92/43/60/1043924360.db2.gz NNNMTFKZCQBWGN-FQEVSTJZSA-N 1 0 309.457 4.342 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2nccn2-c2ccccc2)cc1C ZINC000290179751 1043926959 /nfs/dbraw/zinc/92/69/59/1043926959.db2.gz RSIRMCKFYKHCGN-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(Cl)c1 ZINC000290209561 1043929818 /nfs/dbraw/zinc/92/98/18/1043929818.db2.gz HGCHSVPTDVAKCQ-BLLLJJGKSA-N 1 0 305.805 4.084 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000290351993 1043943409 /nfs/dbraw/zinc/94/34/09/1043943409.db2.gz GCUSPKRAPVKGNZ-HNNXBMFYSA-N 1 0 320.820 4.032 20 10 DICDRO Cc1cc(C)n(-c2ccc(C[NH2+][C@H](C)c3ccccc3O)cc2)n1 ZINC000879648664 1043978520 /nfs/dbraw/zinc/97/85/20/1043978520.db2.gz YJGZYFWMPZJPRK-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1nc(C(F)(F)F)c(C[NH2+][C@H](C)c2ccccc2O)s1 ZINC000879649510 1043979298 /nfs/dbraw/zinc/97/92/98/1043979298.db2.gz VLRSRYPSXKZESQ-MRVPVSSYSA-N 1 0 316.348 4.027 20 10 DICDRO CC(C)CCc1nc(C[NH2+][C@H](C)c2ccccc2O)cs1 ZINC000879648864 1043979723 /nfs/dbraw/zinc/97/97/23/1043979723.db2.gz FJPRWCHJKLQFRQ-CYBMUJFWSA-N 1 0 304.459 4.288 20 10 DICDRO Cc1nc(C(F)(F)F)c(C[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000879650881 1043979947 /nfs/dbraw/zinc/97/99/47/1043979947.db2.gz VLRSRYPSXKZESQ-QMMMGPOBSA-N 1 0 316.348 4.027 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H]1OCCc2sccc21)c1ccccc1O ZINC000291974894 1044121881 /nfs/dbraw/zinc/12/18/81/1044121881.db2.gz UMQAPURIGBHPCK-MRAWALMUSA-N 1 0 317.454 4.197 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000036387989 1044145171 /nfs/dbraw/zinc/14/51/71/1044145171.db2.gz URQGKUOOGOCPFA-UHFFFAOYSA-N 1 0 315.722 4.354 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1cc(Cl)ccc1O ZINC000883258989 1044249637 /nfs/dbraw/zinc/24/96/37/1044249637.db2.gz XNOVQVGPNSTNSY-UHFFFAOYSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(-n3cccn3)cc2)c(O)c1 ZINC000293252226 1044264867 /nfs/dbraw/zinc/26/48/67/1044264867.db2.gz BQHRJLLQMKHFFW-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H](C)c2ccc(N(C)CC)cc2)o1 ZINC000293380550 1044278515 /nfs/dbraw/zinc/27/85/15/1044278515.db2.gz IGURUWPGCJGDQB-CQSZACIVSA-N 1 0 315.461 4.242 20 10 DICDRO CC[C@@H]([NH2+]C1CCC2(COC2)CC1)c1cc(Cl)ccc1O ZINC000883381846 1044294890 /nfs/dbraw/zinc/29/48/90/1044294890.db2.gz UMBYRBYZXOSCBE-OAHLLOKOSA-N 1 0 309.837 4.046 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)c1 ZINC000192724509 1044306369 /nfs/dbraw/zinc/30/63/69/1044306369.db2.gz RTBXUXPUDDZATP-MNOVXSKESA-N 1 0 307.340 4.091 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2OC(F)F)c1 ZINC000192744429 1044306601 /nfs/dbraw/zinc/30/66/01/1044306601.db2.gz ODXDMNJKZUMMSV-LBPRGKRZSA-N 1 0 307.340 4.153 20 10 DICDRO COc1ccc(C)cc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC000475192424 1044310794 /nfs/dbraw/zinc/31/07/94/1044310794.db2.gz GPRDWFOMPANSLA-UHFFFAOYSA-N 1 0 308.425 4.094 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000192809878 1044314835 /nfs/dbraw/zinc/31/48/35/1044314835.db2.gz XSVDBJHGFSFOFA-STQMWFEESA-N 1 0 303.377 4.260 20 10 DICDRO Cc1cc(C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)on1 ZINC000293882877 1044347003 /nfs/dbraw/zinc/34/70/03/1044347003.db2.gz VMOANZVQJKCAKV-LJQANCHMSA-N 1 0 322.408 4.152 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)CCOC)c1ccc(C(F)(F)F)cc1O ZINC000840836498 1044356578 /nfs/dbraw/zinc/35/65/78/1044356578.db2.gz ZEXRLHCGMNMQLQ-RISCZKNCSA-N 1 0 319.367 4.124 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1)C1CC1 ZINC001202603512 1044366471 /nfs/dbraw/zinc/36/64/71/1044366471.db2.gz SFHRPKALDVDUNV-INIZCTEOSA-N 1 0 306.453 4.137 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2OC(F)F)c(O)c1 ZINC000192931944 1044404948 /nfs/dbraw/zinc/40/49/48/1044404948.db2.gz ZUXZMOSGUDLHTH-LBPRGKRZSA-N 1 0 307.340 4.153 20 10 DICDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000192948125 1044407246 /nfs/dbraw/zinc/40/72/46/1044407246.db2.gz KBLBDGYHHUSZTA-UONOGXRCSA-N 1 0 312.413 4.071 20 10 DICDRO C[C@H](c1ccccn1)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000133613558 1044428223 /nfs/dbraw/zinc/42/82/23/1044428223.db2.gz COKGMTHUWHLXSW-QGZVFWFLSA-N 1 0 309.457 4.265 20 10 DICDRO Cc1nocc1C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC000294914037 1044472153 /nfs/dbraw/zinc/47/21/53/1044472153.db2.gz NNVYRVJCVTWHRM-UHFFFAOYSA-N 1 0 300.402 4.024 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(N2CCCCC2)cc1 ZINC000119301582 1044494436 /nfs/dbraw/zinc/49/44/36/1044494436.db2.gz YTPPUMKSVKZXIU-WMZOPIPTSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)c1cnccn1 ZINC000119348096 1044494596 /nfs/dbraw/zinc/49/45/96/1044494596.db2.gz GOTSDGXXJPIYLU-MRXNPFEDSA-N 1 0 324.472 4.096 20 10 DICDRO CC(C)OCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000216484277 1044557305 /nfs/dbraw/zinc/55/73/05/1044557305.db2.gz UQTGCWLEBTYUOF-KRWDZBQOSA-N 1 0 313.441 4.380 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccnc(C(F)(F)F)c2)c(O)c1C ZINC000295855867 1044569551 /nfs/dbraw/zinc/56/95/51/1044569551.db2.gz BFXMWLCOGCQJNH-GFCCVEGCSA-N 1 0 324.346 4.274 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ncc(Cl)s1 ZINC000719442295 1044610081 /nfs/dbraw/zinc/61/00/81/1044610081.db2.gz SHECLDQYSDRBBR-UWVGGRQHSA-N 1 0 308.834 4.149 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000886272537 1044628725 /nfs/dbraw/zinc/62/87/25/1044628725.db2.gz SFKXVRISMYOMCE-UHFFFAOYSA-N 1 0 320.392 4.214 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1cc(Cl)ccc1O ZINC000363885535 1044652411 /nfs/dbraw/zinc/65/24/11/1044652411.db2.gz IJVMATBBFZJJPF-ZUZCIYMTSA-N 1 0 321.779 4.359 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)CCC2 ZINC000363868993 1044653220 /nfs/dbraw/zinc/65/32/20/1044653220.db2.gz PPYBZEJSDGMHTB-SMDDNHRTSA-N 1 0 302.443 4.194 20 10 DICDRO CC(C)C[N@H+](Cc1ccccc1O)[C@H]1CCCc2cccnc21 ZINC000155218742 1044685598 /nfs/dbraw/zinc/68/55/98/1044685598.db2.gz ZFFOWDCOTMMVTO-SFHVURJKSA-N 1 0 310.441 4.323 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c(O)c1 ZINC000886774473 1044696639 /nfs/dbraw/zinc/69/66/39/1044696639.db2.gz ODHYYYQKMQEGKO-MAUKXSAKSA-N 1 0 303.446 4.091 20 10 DICDRO CCOCc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000151621189 1045028767 /nfs/dbraw/zinc/02/87/67/1045028767.db2.gz GNYUOHDEJRBZRE-INIZCTEOSA-N 1 0 312.457 4.140 20 10 DICDRO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000153166078 1045053094 /nfs/dbraw/zinc/05/30/94/1045053094.db2.gz KCUYSCAJOGVVGZ-ROUUACIJSA-N 1 0 324.468 4.243 20 10 DICDRO Oc1ccccc1C[NH+](Cc1ccccc1O)C1CCCCC1 ZINC000778988953 1045107797 /nfs/dbraw/zinc/10/77/97/1045107797.db2.gz OLMXHARMHSFQMU-UHFFFAOYSA-N 1 0 311.425 4.433 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(F)cn1 ZINC000779010033 1045125202 /nfs/dbraw/zinc/12/52/02/1045125202.db2.gz JYRSRADHWRCGEO-GOSISDBHSA-N 1 0 313.420 4.062 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(F)cn1 ZINC000779010039 1045125729 /nfs/dbraw/zinc/12/57/29/1045125729.db2.gz JYRSRADHWRCGEO-SFHVURJKSA-N 1 0 313.420 4.062 20 10 DICDRO C[C@H](CCCCO)[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000779039763 1045188642 /nfs/dbraw/zinc/18/86/42/1045188642.db2.gz SVZDKZRKZVEQOU-QGZVFWFLSA-N 1 0 318.505 4.096 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCSC1)c1ccc(N2CCCCC2)cc1 ZINC000159516909 1045200768 /nfs/dbraw/zinc/20/07/68/1045200768.db2.gz VUAFQJQHXXFFGJ-NVXWUHKLSA-N 1 0 304.503 4.223 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000779054026 1045218110 /nfs/dbraw/zinc/21/81/10/1045218110.db2.gz OTZNUQORVUITSW-HZMBPMFUSA-N 1 0 319.351 4.017 20 10 DICDRO Fc1cc2c(cc1Cl)[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC000527858377 1045269481 /nfs/dbraw/zinc/26/94/81/1045269481.db2.gz QUECRZBPROZWJH-KRWDZBQOSA-N 1 0 317.791 4.191 20 10 DICDRO CSCc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000188725705 1045339383 /nfs/dbraw/zinc/33/93/83/1045339383.db2.gz NUEPEPZLHYZYLH-AWEZNQCLSA-N 1 0 301.455 4.414 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC([C@@H]3CCCO3)CC2)cc1C(C)C ZINC000190186581 1045386950 /nfs/dbraw/zinc/38/69/50/1045386950.db2.gz YOTRFSBUOVASKL-FQEVSTJZSA-N 1 0 317.473 4.215 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H](c1ccncc1)C1CC1 ZINC001120257844 1045534956 /nfs/dbraw/zinc/53/49/56/1045534956.db2.gz ANDVHKLDTCKOTA-AUJRIZCKSA-N 1 0 308.425 4.385 20 10 DICDRO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1cccc(Cl)c1[O-] ZINC000380879316 1045555851 /nfs/dbraw/zinc/55/58/51/1045555851.db2.gz UFXMTPBEGKRNSC-LLVKDONJSA-N 1 0 307.743 4.208 20 10 DICDRO CCC[N@H+](Cc1nc2ccccc2s1)Cc1ccccc1O ZINC000750875209 1045565380 /nfs/dbraw/zinc/56/53/80/1045565380.db2.gz PYJWCVMDVRLZNG-UHFFFAOYSA-N 1 0 312.438 4.414 20 10 DICDRO CCSCCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000800283583 1045604173 /nfs/dbraw/zinc/60/41/73/1045604173.db2.gz ZKVFOJNHKSYSGE-UHFFFAOYSA-N 1 0 301.455 4.292 20 10 DICDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000751600135 1045620025 /nfs/dbraw/zinc/62/00/25/1045620025.db2.gz GXKABYRFLJOWRQ-YJBOKZPZSA-N 1 0 318.420 4.318 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000800493340 1045632362 /nfs/dbraw/zinc/63/23/62/1045632362.db2.gz WUVRKYIMXQMIKB-ZWNOBZJWSA-N 1 0 320.795 4.226 20 10 DICDRO C[C@@H]1CCCN(c2ccc(C[NH2+][C@@H]3CCSC3)cc2Cl)C1 ZINC000800494650 1045633158 /nfs/dbraw/zinc/63/31/58/1045633158.db2.gz YEIKKPJPCFJFAW-UKRRQHHQSA-N 1 0 324.921 4.171 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c1 ZINC000800494866 1045633921 /nfs/dbraw/zinc/63/39/21/1045633921.db2.gz GIPXEPWTIXHBBP-WBMJQRKESA-N 1 0 301.817 4.172 20 10 DICDRO CC[C@@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccc(C)cc1O ZINC000800500008 1045635832 /nfs/dbraw/zinc/63/58/32/1045635832.db2.gz MKFGSKHTSJDTRZ-GOSISDBHSA-N 1 0 308.425 4.465 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000800525311 1045639535 /nfs/dbraw/zinc/63/95/35/1045639535.db2.gz SOPPDMIVAMYTMM-WIYYLYMNSA-N 1 0 323.484 4.483 20 10 DICDRO CN(C)c1ccc(C[N@H+](CCCCC(F)(F)F)C2CC2)cc1 ZINC000751963603 1045646240 /nfs/dbraw/zinc/64/62/40/1045646240.db2.gz KTGSZSGDDDYBQF-UHFFFAOYSA-N 1 0 314.395 4.450 20 10 DICDRO FCCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000800966874 1045671696 /nfs/dbraw/zinc/67/16/96/1045671696.db2.gz DYSYPZLJJDUNDA-MJGOQNOKSA-N 1 0 304.453 4.295 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2ccccc2OC1)c1ccc(C)cc1O ZINC000800986612 1045677648 /nfs/dbraw/zinc/67/76/48/1045677648.db2.gz JRXIYTLFWVHQDB-AEFFLSMTSA-N 1 0 311.425 4.135 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2ccccc2OC1)c1cc(Cl)ccc1O ZINC000800987426 1045678253 /nfs/dbraw/zinc/67/82/53/1045678253.db2.gz XSRVYGACWORHHP-SWLSCSKDSA-N 1 0 317.816 4.090 20 10 DICDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)c1ccc(C)cc1O ZINC000800994769 1045679268 /nfs/dbraw/zinc/67/92/68/1045679268.db2.gz XHLHLCQQMDMOHC-PXAZEXFGSA-N 1 0 315.388 4.186 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccc(C)cc1 ZINC000078372128 1045690984 /nfs/dbraw/zinc/69/09/84/1045690984.db2.gz IXOCGLXDDNGTAK-OAQYLSRUSA-N 1 0 324.468 4.073 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000078378997 1045694937 /nfs/dbraw/zinc/69/49/37/1045694937.db2.gz UQLVHFBOQIMLIK-NRFANRHFSA-N 1 0 324.468 4.154 20 10 DICDRO c1cc(N2CCSCC2)ccc1C[NH2+]C1CCC2(CC2)CC1 ZINC000752890939 1045712747 /nfs/dbraw/zinc/71/27/47/1045712747.db2.gz PMMWKNUYVXOUKB-UHFFFAOYSA-N 1 0 316.514 4.052 20 10 DICDRO CCCC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1O ZINC000801595790 1045747813 /nfs/dbraw/zinc/74/78/13/1045747813.db2.gz UEBYHPZJGSKYDK-UHFFFAOYSA-N 1 0 320.414 4.164 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1ccccc1[N+](=O)[O-] ZINC000801597563 1045749968 /nfs/dbraw/zinc/74/99/68/1045749968.db2.gz JIJRMVFBHCZKRF-UHFFFAOYSA-N 1 0 314.385 4.103 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]C1(C2CC2)CC1 ZINC000753570402 1045762939 /nfs/dbraw/zinc/76/29/39/1045762939.db2.gz KPQVNVSMZZSPLC-UHFFFAOYSA-N 1 0 309.409 4.003 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@H](c3cc(C)cc(C)c3)C2)c1O ZINC000753587951 1045770812 /nfs/dbraw/zinc/77/08/12/1045770812.db2.gz FLCBUOVFVPUYOL-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]CC2CC(c3ccccc3)C2)c1 ZINC000801730129 1045783006 /nfs/dbraw/zinc/78/30/06/1045783006.db2.gz GBYSUBCDCPMYQS-UHFFFAOYSA-N 1 0 311.425 4.074 20 10 DICDRO COc1cc(C)c([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1C ZINC000753660202 1045783982 /nfs/dbraw/zinc/78/39/82/1045783982.db2.gz YZRLFYHCKWMELA-OAHLLOKOSA-N 1 0 311.425 4.098 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)c1 ZINC000754099847 1045844638 /nfs/dbraw/zinc/84/46/38/1045844638.db2.gz HDKQCDGVWPRBKV-FUHWJXTLSA-N 1 0 311.425 4.217 20 10 DICDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]CCCSc2nccs2)CS1 ZINC000754145027 1045855520 /nfs/dbraw/zinc/85/55/20/1045855520.db2.gz SOIVFVYGJQVCIB-NEPJUHHUSA-N 1 0 316.561 4.135 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2cccnc2)ccc1N1CCCCC1 ZINC000828485969 1045909812 /nfs/dbraw/zinc/90/98/12/1045909812.db2.gz BHQAJMIYWSFTDT-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO C[C@@H](O)CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000828564690 1045916563 /nfs/dbraw/zinc/91/65/63/1045916563.db2.gz VESXRMAORBUTAX-SJORKVTESA-N 1 0 313.441 4.116 20 10 DICDRO COc1cc(C)cc(C[N@H+](Cc2cccs2)C(C)C)c1O ZINC000754722089 1045919077 /nfs/dbraw/zinc/91/90/77/1045919077.db2.gz BUNTVZABSQJKAR-UHFFFAOYSA-N 1 0 305.443 4.181 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)c1O ZINC000754725842 1045921025 /nfs/dbraw/zinc/92/10/25/1045921025.db2.gz BSVLHKVYDNUTCE-RDJZCZTQSA-N 1 0 311.425 4.087 20 10 DICDRO CCC[N@H+](Cc1cc(C)cc(C)c1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000754742654 1045923322 /nfs/dbraw/zinc/92/33/22/1045923322.db2.gz VXAIAAMSAXITAY-UHOSZYNNSA-N 1 0 317.473 4.035 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2F)c1 ZINC000192707327 1045925901 /nfs/dbraw/zinc/92/59/01/1045925901.db2.gz BSJDKHWXRJJSML-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)cc1C(C)C ZINC000754782654 1045926229 /nfs/dbraw/zinc/92/62/29/1045926229.db2.gz KESBGGPBKSHTBF-QGZVFWFLSA-N 1 0 317.473 4.073 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(OC(F)F)c1 ZINC000192720839 1045926314 /nfs/dbraw/zinc/92/63/14/1045926314.db2.gz KCWHINAKCDVXMI-NEPJUHHUSA-N 1 0 307.340 4.405 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCC2C[C@@H](C)O[C@H](C)C2)c2c1c(F)ccc2O ZINC000802309693 1045952365 /nfs/dbraw/zinc/95/23/65/1045952365.db2.gz UDUAQDGRYVZGNP-BRXULGCHSA-N 1 0 321.436 4.263 20 10 DICDRO Cc1cc(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c(C)n1-c1ccccc1 ZINC001137855518 1045987140 /nfs/dbraw/zinc/98/71/40/1045987140.db2.gz ABVZKPPIZNMAOT-AEFFLSMTSA-N 1 0 316.395 4.181 20 10 DICDRO CO[C@@H]1CCC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001137858107 1045987393 /nfs/dbraw/zinc/98/73/93/1045987393.db2.gz WZTGEJCCEKBBKD-HXUWFJFHSA-N 1 0 312.457 4.095 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c(C)n1-c1ccccc1 ZINC001137855883 1045987655 /nfs/dbraw/zinc/98/76/55/1045987655.db2.gz IUOFXANEJCGBDA-OAQYLSRUSA-N 1 0 324.468 4.239 20 10 DICDRO COc1cccc(O)c1C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000802658406 1046026129 /nfs/dbraw/zinc/02/61/29/1046026129.db2.gz ZATVOGDRMYNLQQ-BCDXTJNWSA-N 1 0 323.436 4.311 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1 ZINC000802657977 1046029993 /nfs/dbraw/zinc/02/99/93/1046029993.db2.gz XYDGHFBWKVLAPB-HNNXBMFYSA-N 1 0 313.363 4.255 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CCCO1 ZINC000756047769 1046044387 /nfs/dbraw/zinc/04/43/87/1046044387.db2.gz VJCMUQKZUUURPZ-ICSRJNTNSA-N 1 0 311.425 4.106 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@H]1CCCO1 ZINC000756047776 1046044713 /nfs/dbraw/zinc/04/47/13/1046044713.db2.gz VJCMUQKZUUURPZ-UYAOXDASSA-N 1 0 311.425 4.106 20 10 DICDRO Cc1nc(C[N@H+](Cc2ccccc2O)C2CCCC2)sc1C ZINC000756047936 1046044744 /nfs/dbraw/zinc/04/47/44/1046044744.db2.gz LNBTXZMIHBBCRA-UHFFFAOYSA-N 1 0 316.470 4.410 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCCC(F)(F)F)c1 ZINC000756079541 1046049566 /nfs/dbraw/zinc/04/95/66/1046049566.db2.gz QJZMKDXYZJEQQI-QWRGUYRKSA-N 1 0 305.340 4.173 20 10 DICDRO C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000756117246 1046053942 /nfs/dbraw/zinc/05/39/42/1046053942.db2.gz BCEMFISKKPHZAG-KEYYUXOJSA-N 1 0 324.415 4.035 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cccc(N3CCCC3)c2)cc1C ZINC000756144786 1046055486 /nfs/dbraw/zinc/05/54/86/1046055486.db2.gz BCRLWNFMDPIPOO-QGZVFWFLSA-N 1 0 324.468 4.455 20 10 DICDRO Cc1cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)ccc1F ZINC000756367226 1046071220 /nfs/dbraw/zinc/07/12/20/1046071220.db2.gz YHGLWQQXSDWCLC-ABAIWWIYSA-N 1 0 303.352 4.317 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1cc(Cl)ccc1O ZINC000756369199 1046072095 /nfs/dbraw/zinc/07/20/95/1046072095.db2.gz BBZRPBURJPVIBV-ABAIWWIYSA-N 1 0 324.877 4.061 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2ccsc2)N(C)C)c(O)c1C ZINC000756371871 1046072158 /nfs/dbraw/zinc/07/21/58/1046072158.db2.gz OUJDFDOARQHXTR-RHSMWYFYSA-N 1 0 318.486 4.024 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)ccc1F ZINC000756367227 1046072575 /nfs/dbraw/zinc/07/25/75/1046072575.db2.gz YHGLWQQXSDWCLC-IAQYHMDHSA-N 1 0 303.352 4.317 20 10 DICDRO CC(C)Oc1ccc(CC[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756383965 1046074145 /nfs/dbraw/zinc/07/41/45/1046074145.db2.gz MBQZJFPVONQWGA-AWEZNQCLSA-N 1 0 317.404 4.212 20 10 DICDRO C[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000756379307 1046074647 /nfs/dbraw/zinc/07/46/47/1046074647.db2.gz NCHKTSQWDAOSPM-QWRGUYRKSA-N 1 0 324.218 4.030 20 10 DICDRO CC(C)Oc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000756428131 1046079073 /nfs/dbraw/zinc/07/90/73/1046079073.db2.gz CESWJLJUXBXLPH-CYBMUJFWSA-N 1 0 303.377 4.169 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193902901 1046080125 /nfs/dbraw/zinc/08/01/25/1046080125.db2.gz HAWIMXKNKSLFSH-QWHCGFSZSA-N 1 0 300.358 4.021 20 10 DICDRO CCOc1ccccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756442663 1046083255 /nfs/dbraw/zinc/08/32/55/1046083255.db2.gz FRWQHMMNCDCSMV-WFASDCNBSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccsc1C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756465046 1046085063 /nfs/dbraw/zinc/08/50/63/1046085063.db2.gz IXGFXWTYGQDBDP-CYBMUJFWSA-N 1 0 301.455 4.492 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)CCC3)c1 ZINC000756454976 1046085438 /nfs/dbraw/zinc/08/54/38/1046085438.db2.gz GWPPAKYGXNKHOD-ZIAGYGMSSA-N 1 0 311.425 4.301 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCOc2cccc(Cl)c2)c(O)c1 ZINC000756476980 1046086455 /nfs/dbraw/zinc/08/64/55/1046086455.db2.gz ULZTUVRQADREFK-ZDUSSCGKSA-N 1 0 305.805 4.084 20 10 DICDRO COc1cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)ccc1C ZINC000756480707 1046087028 /nfs/dbraw/zinc/08/70/28/1046087028.db2.gz UEMFQWHHDLPUEG-DOMZBBRYSA-N 1 0 315.388 4.186 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc3c(s2)CCCC3)c1 ZINC000756483341 1046088401 /nfs/dbraw/zinc/08/84/01/1046088401.db2.gz MOLABLRQVPWJSD-LBPRGKRZSA-N 1 0 317.454 4.192 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCCOC2CCCC2)c2c1c(F)ccc2O ZINC000756501131 1046090499 /nfs/dbraw/zinc/09/04/99/1046090499.db2.gz BEHIIPRTZQBEDJ-IUODEOHRSA-N 1 0 307.409 4.019 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccc3ccccc3n2)c1 ZINC000756493873 1046090624 /nfs/dbraw/zinc/09/06/24/1046090624.db2.gz ARBZETLYNPKUNV-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO COc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000756502425 1046091567 /nfs/dbraw/zinc/09/15/67/1046091567.db2.gz HVIBDCKGMLPFAB-CVEARBPZSA-N 1 0 313.441 4.381 20 10 DICDRO C[C@H](COc1ccccc1)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756493432 1046091854 /nfs/dbraw/zinc/09/18/54/1046091854.db2.gz DPHUSKUTVJXTIY-WOSRLPQWSA-N 1 0 315.388 4.137 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1 ZINC000756498705 1046092235 /nfs/dbraw/zinc/09/22/35/1046092235.db2.gz YREJAOMMPVFTTB-WQGACYEGSA-N 1 0 315.388 4.439 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3c(C)cccc32)c(O)c1C ZINC000756518421 1046093577 /nfs/dbraw/zinc/09/35/77/1046093577.db2.gz WATBXVMIHHBJED-CRAIPNDOSA-N 1 0 311.425 4.492 20 10 DICDRO CCn1nc(C)c(C[NH2+][C@H](C)c2ccc3ccccc3c2O)c1C ZINC000756534887 1046096843 /nfs/dbraw/zinc/09/68/43/1046096843.db2.gz LKJWNZDORICGMD-CYBMUJFWSA-N 1 0 323.440 4.229 20 10 DICDRO COc1ccc(CC[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1F ZINC000756539359 1046097312 /nfs/dbraw/zinc/09/73/12/1046097312.db2.gz MLQVHRVUGZCARO-NSHDSACASA-N 1 0 323.795 4.087 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](Nc2ccccc2)C(C)C)c(O)c1 ZINC000756554960 1046097841 /nfs/dbraw/zinc/09/78/41/1046097841.db2.gz KZCMMWGOHMIOFF-LPHOPBHVSA-N 1 0 312.457 4.488 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1cc2c(cc1O)CCCC2 ZINC000756547869 1046098149 /nfs/dbraw/zinc/09/81/49/1046098149.db2.gz IBYOKCCERVFZCH-LBPRGKRZSA-N 1 0 317.379 4.400 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCOc3ccccc32)c(O)c1C ZINC000756548758 1046098793 /nfs/dbraw/zinc/09/87/93/1046098793.db2.gz DRMZHRBPVIRFMT-CVEARBPZSA-N 1 0 311.425 4.226 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCOc2ccccc21)c1cc(Cl)ccc1O ZINC000756554279 1046099079 /nfs/dbraw/zinc/09/90/79/1046099079.db2.gz ORIJQTBEPUZFBH-QWHCGFSZSA-N 1 0 317.816 4.263 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](Nc2ccccc2)C(C)C)c1 ZINC000756555616 1046100866 /nfs/dbraw/zinc/10/08/66/1046100866.db2.gz LHEJLROITGLYNT-QFBILLFUSA-N 1 0 312.457 4.488 20 10 DICDRO CC(C)[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)Nc1ccccc1 ZINC000756555972 1046101114 /nfs/dbraw/zinc/10/11/14/1046101114.db2.gz NNKGFZSCQDHUNV-KDOFPFPSSA-N 1 0 316.420 4.319 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(F)cc1F)c1cc(Cl)ccc1O ZINC000756576150 1046103219 /nfs/dbraw/zinc/10/32/19/1046103219.db2.gz KQXPXROBQCNCAX-SNVBAGLBSA-N 1 0 311.759 4.217 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCN(c3ccccc3)C2)c(O)c1C ZINC000756582378 1046103878 /nfs/dbraw/zinc/10/38/78/1046103878.db2.gz HYMJWGBKEHZDKW-ZWKOTPCHSA-N 1 0 324.468 4.329 20 10 DICDRO CCCC[C@@H](COC)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756584984 1046104395 /nfs/dbraw/zinc/10/43/95/1046104395.db2.gz IAKPTPFBOOYCFH-HOCLYGCPSA-N 1 0 301.430 4.401 20 10 DICDRO CCCC(O)(CCC)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756594924 1046105802 /nfs/dbraw/zinc/10/58/02/1046105802.db2.gz QLZIXMQFHBPBBQ-JSGCOSHPSA-N 1 0 309.425 4.001 20 10 DICDRO C[C@H]([NH2+][C@H](CCO)c1ccccc1)c1ccc2ccccc2c1O ZINC000756603771 1046108604 /nfs/dbraw/zinc/10/86/04/1046108604.db2.gz KTNYEGSPPOUFFL-MGPUTAFESA-N 1 0 321.420 4.320 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(C)cc2O)C12CCCC2 ZINC000756618119 1046109612 /nfs/dbraw/zinc/10/96/12/1046109612.db2.gz MXGYLKHLIYKCBU-ZTFGCOKTSA-N 1 0 303.446 4.089 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1c(C)nn(C)c1C ZINC000756615693 1046109661 /nfs/dbraw/zinc/10/96/61/1046109661.db2.gz FUJQULOSFWLQDZ-BMIGLBTASA-N 1 0 321.852 4.198 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)C1CCN(c2ccccc2)CC1 ZINC000194981479 1046110202 /nfs/dbraw/zinc/11/02/02/1046110202.db2.gz MOCIFEBKTCTXAS-UHFFFAOYSA-N 1 0 323.484 4.031 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1c(C)nn(C)c1C ZINC000756617926 1046109989 /nfs/dbraw/zinc/10/99/89/1046109989.db2.gz QRJHNCLRNTVTCQ-SUMWQHHRSA-N 1 0 315.461 4.161 20 10 DICDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000756611597 1046110481 /nfs/dbraw/zinc/11/04/81/1046110481.db2.gz UAKTVIUQBSBWFQ-VBNZEHGJSA-N 1 0 305.487 4.206 20 10 DICDRO COc1ccc([C@H](C)CC[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756613063 1046110776 /nfs/dbraw/zinc/11/07/76/1046110776.db2.gz NMKAWLNKXQINPE-ZIAGYGMSSA-N 1 0 317.404 4.384 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)C1CCOCC1 ZINC000756628500 1046111755 /nfs/dbraw/zinc/11/17/55/1046111755.db2.gz MRVJCHLUDVKMDY-LIRRHRJNSA-N 1 0 313.441 4.401 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(C)ccc2O)C12CCCC2 ZINC000756619940 1046112132 /nfs/dbraw/zinc/11/21/32/1046112132.db2.gz ZBZJZQJFVPAOAD-JCGIZDLHSA-N 1 0 303.446 4.089 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc2c(cc1O)CCCC2)C1CCOCC1 ZINC000756627312 1046112642 /nfs/dbraw/zinc/11/26/42/1046112642.db2.gz HEOLJYPHSLZNIN-KUHUBIRLSA-N 1 0 317.473 4.127 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCOc2ccc(F)cc2F)c(O)c1C ZINC000756636701 1046113541 /nfs/dbraw/zinc/11/35/41/1046113541.db2.gz GFHQOBAPZUDDTK-ZDUSSCGKSA-N 1 0 321.367 4.017 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2SCCc3ccccc32)c(O)c1 ZINC000756634068 1046113584 /nfs/dbraw/zinc/11/35/84/1046113584.db2.gz LULWGJMOKXBCRW-IFXJQAMLSA-N 1 0 313.466 4.382 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CCCC[C@H]1O)c1ccc2ccccc2c1O ZINC000756639033 1046113795 /nfs/dbraw/zinc/11/37/95/1046113795.db2.gz VQJRQYMZGRTSCN-BOUXLOLZSA-N 1 0 313.441 4.137 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2SCCc3ccccc32)c1 ZINC000756634601 1046113947 /nfs/dbraw/zinc/11/39/47/1046113947.db2.gz MGAVVZJVUBCZKD-LIRRHRJNSA-N 1 0 313.466 4.382 20 10 DICDRO CC[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Oc1ccccc1F ZINC000756638208 1046113961 /nfs/dbraw/zinc/11/39/61/1046113961.db2.gz NPUSCXQLKTUCAA-GXTWGEPZSA-N 1 0 321.367 4.179 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2SCCc3ccccc32)c1 ZINC000756634243 1046114012 /nfs/dbraw/zinc/11/40/12/1046114012.db2.gz MGAVVZJVUBCZKD-KUHUBIRLSA-N 1 0 313.466 4.382 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cc(F)ccc2F)c(O)c1C ZINC000756638544 1046114542 /nfs/dbraw/zinc/11/45/42/1046114542.db2.gz SQIWYRZSIVMCOI-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO CCO[C@@H](CC[NH2+][C@H](C)c1ccc(C)cc1O)C1CCCC1 ZINC000756635695 1046114714 /nfs/dbraw/zinc/11/47/14/1046114714.db2.gz HDMULXJSKDDBEX-BEFAXECRSA-N 1 0 305.462 4.337 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2SCCc3ccccc32)c(O)c1 ZINC000756634060 1046114764 /nfs/dbraw/zinc/11/47/64/1046114764.db2.gz LULWGJMOKXBCRW-AUUYWEPGSA-N 1 0 313.466 4.382 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CCCS1)c1cc2c(cc1O)CCCC2 ZINC000756646352 1046115701 /nfs/dbraw/zinc/11/57/01/1046115701.db2.gz LTJNTKYJOMNDKF-SCLBCKFNSA-N 1 0 305.487 4.207 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CCCS1)c1cc2c(cc1O)CCCC2 ZINC000756646354 1046115792 /nfs/dbraw/zinc/11/57/92/1046115792.db2.gz LTJNTKYJOMNDKF-UGSOOPFHSA-N 1 0 305.487 4.207 20 10 DICDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc(C)cc2O)c(Cl)c1 ZINC000756645884 1046115988 /nfs/dbraw/zinc/11/59/88/1046115988.db2.gz KJCSGTOCQHEDHS-ZDUSSCGKSA-N 1 0 319.832 4.256 20 10 DICDRO Cc1noc(C)c1CCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756640464 1046116014 /nfs/dbraw/zinc/11/60/14/1046116014.db2.gz MPGNDKMSZQORMJ-CYBMUJFWSA-N 1 0 324.424 4.434 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC2(CCO)CCCCC2)c2c1c(F)ccc2O ZINC000756647489 1046116081 /nfs/dbraw/zinc/11/60/81/1046116081.db2.gz GZMVNTHQSXPRBM-UKRRQHHQSA-N 1 0 321.436 4.002 20 10 DICDRO Cc1noc(C)c1CCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756640470 1046116321 /nfs/dbraw/zinc/11/63/21/1046116321.db2.gz MPGNDKMSZQORMJ-ZDUSSCGKSA-N 1 0 324.424 4.434 20 10 DICDRO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CCO1 ZINC000756665985 1046117600 /nfs/dbraw/zinc/11/76/00/1046117600.db2.gz XYLHPJLFZOQLNC-GZRFBZBPSA-N 1 0 317.473 4.125 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2cccnc2)C(C)C)c(O)c1C ZINC000756649224 1046117649 /nfs/dbraw/zinc/11/76/49/1046117649.db2.gz MQPBGYPFXDLADZ-VQIMIIECSA-N 1 0 312.457 4.494 20 10 DICDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756684676 1046119603 /nfs/dbraw/zinc/11/96/03/1046119603.db2.gz PESBLSZQVLZACI-MLGOLLRUSA-N 1 0 317.816 4.447 20 10 DICDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756684679 1046119864 /nfs/dbraw/zinc/11/98/64/1046119864.db2.gz PESBLSZQVLZACI-WBMJQRKESA-N 1 0 317.816 4.447 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756683104 1046120053 /nfs/dbraw/zinc/12/00/53/1046120053.db2.gz FQDHUFRVARNVMP-PXAZEXFGSA-N 1 0 315.388 4.268 20 10 DICDRO COCC[C@H]1CCCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001138219640 1046120262 /nfs/dbraw/zinc/12/02/62/1046120262.db2.gz KRYIHNOUICDXDU-LJQANCHMSA-N 1 0 316.489 4.068 20 10 DICDRO c1cc2c(s1)C[N@H+](Cc1ccc(N3CCCCC3)cc1)CC2 ZINC001138219972 1046120902 /nfs/dbraw/zinc/12/09/02/1046120902.db2.gz VXNJJJOHGZGPOH-UHFFFAOYSA-N 1 0 312.482 4.297 20 10 DICDRO FC(F)(F)[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138219501 1046121209 /nfs/dbraw/zinc/12/12/09/1046121209.db2.gz DQXKSQSTQGDHEY-HNNXBMFYSA-N 1 0 312.379 4.061 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCOc2ccc(F)c(F)c2)c(O)c1C ZINC000756706344 1046121821 /nfs/dbraw/zinc/12/18/21/1046121821.db2.gz MISNICYKBZQEDN-ZDUSSCGKSA-N 1 0 321.367 4.017 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccc(F)cc32)c2c1c(F)ccc2O ZINC000756709061 1046122071 /nfs/dbraw/zinc/12/20/71/1046122071.db2.gz VXMWATHXSKVUCP-VFVAKGGASA-N 1 0 315.363 4.496 20 10 DICDRO CC1(C)C[NH+](Cc2ccc(N3CCCCC3)cc2)CC(C)(C)O1 ZINC001138220844 1046122471 /nfs/dbraw/zinc/12/24/71/1046122471.db2.gz PMVJYBJBXAJUSJ-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(F)cc1Cl)c1cc(F)ccc1O ZINC000756706154 1046122776 /nfs/dbraw/zinc/12/27/76/1046122776.db2.gz PABHCMYRXHZADY-SNVBAGLBSA-N 1 0 311.759 4.217 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCNc2ccc3ccccc3n2)c(O)c1 ZINC000756744777 1046125369 /nfs/dbraw/zinc/12/53/69/1046125369.db2.gz CAPRIUZOJUQDGA-OAHLLOKOSA-N 1 0 321.424 4.012 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)c1 ZINC000756744689 1046125688 /nfs/dbraw/zinc/12/56/88/1046125688.db2.gz BMUSGZOWCIRPEY-UJKGCTCZSA-N 1 0 311.425 4.304 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)c(O)c1C ZINC000756757803 1046127268 /nfs/dbraw/zinc/12/72/68/1046127268.db2.gz CDCWDGCVDVNKGH-WBMJQRKESA-N 1 0 317.816 4.447 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cc3c(cc1O)CCCC3)CO2 ZINC000756757789 1046127373 /nfs/dbraw/zinc/12/73/73/1046127373.db2.gz BWVCWNCZUULNLT-IFXJQAMLSA-N 1 0 323.436 4.364 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)CO2 ZINC000756758462 1046127657 /nfs/dbraw/zinc/12/76/57/1046127657.db2.gz FSYKVWXUGYHKGR-IAQYHMDHSA-N 1 0 303.789 4.138 20 10 DICDRO CCOCCC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CCC1 ZINC000756762028 1046127867 /nfs/dbraw/zinc/12/78/67/1046127867.db2.gz VZYBMMZPPZLQAK-DZGCQCFKSA-N 1 0 321.436 4.266 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c(F)c1 ZINC000756759745 1046128061 /nfs/dbraw/zinc/12/80/61/1046128061.db2.gz XXEWNPGFHNTOBI-ZUZCIYMTSA-N 1 0 319.351 4.017 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CCC(OC(C)C)CC2)c(O)c1C ZINC000756766629 1046129708 /nfs/dbraw/zinc/12/97/08/1046129708.db2.gz AQXDHRCWERZOFR-GTPINHCMSA-N 1 0 305.462 4.396 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)c(O)c1C ZINC000756763595 1046130001 /nfs/dbraw/zinc/13/00/01/1046130001.db2.gz XIWSKIMVKUUBCQ-NDSDBLNTSA-N 1 0 307.437 4.246 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756767974 1046130249 /nfs/dbraw/zinc/13/02/49/1046130249.db2.gz HLJDBMIMBMCKMO-MLGOLLRUSA-N 1 0 315.388 4.186 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CCOC3(CCCC3)C2)c2c1c(F)ccc2O ZINC000756764396 1046130286 /nfs/dbraw/zinc/13/02/86/1046130286.db2.gz IJOUSZHYCPRPRL-VNHYZAJKSA-N 1 0 319.420 4.161 20 10 DICDRO C[C@H]([NH2+]CCOCc1ccc(Cl)cc1)c1cc(F)ccc1O ZINC000756770874 1046130555 /nfs/dbraw/zinc/13/05/55/1046130555.db2.gz PBNHJJNAPTXEPF-LBPRGKRZSA-N 1 0 323.795 4.052 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCOC3(CCCC3)C2)c2c1c(F)ccc2O ZINC000756764393 1046130713 /nfs/dbraw/zinc/13/07/13/1046130713.db2.gz IJOUSZHYCPRPRL-IPYPFGDCSA-N 1 0 319.420 4.161 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@H]2c2nccs2)c2ccccc2n1C ZINC001138258343 1046132082 /nfs/dbraw/zinc/13/20/82/1046132082.db2.gz QTDGKUGSIZXAJP-KRWDZBQOSA-N 1 0 311.454 4.280 20 10 DICDRO Cc1c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c2ccccc2n1C ZINC001138259966 1046132161 /nfs/dbraw/zinc/13/21/61/1046132161.db2.gz SYVQPHUVUGKJAJ-UHFFFAOYSA-N 1 0 321.468 4.185 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1c(C)noc1C ZINC000756774296 1046132158 /nfs/dbraw/zinc/13/21/58/1046132158.db2.gz BPKLDAQZCXPUBQ-BIGNPOOSSA-N 1 0 318.392 4.425 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756786131 1046133194 /nfs/dbraw/zinc/13/31/94/1046133194.db2.gz JPPBUZRHKOVJIG-NWDGAFQWSA-N 1 0 304.821 4.415 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H](c2cccnc2)C2CC2)c2c1c(F)ccc2O ZINC000756784008 1046133736 /nfs/dbraw/zinc/13/37/36/1046133736.db2.gz JUHTVLQEZBWLIC-VZMUKZCBSA-N 1 0 312.388 4.216 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000756786116 1046134207 /nfs/dbraw/zinc/13/42/07/1046134207.db2.gz XNFCYOZZQBFCBM-SPLOXXLWSA-N 1 0 322.452 4.468 20 10 DICDRO CCCCn1cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c(C)n1 ZINC000756788467 1046135108 /nfs/dbraw/zinc/13/51/08/1046135108.db2.gz VESKWBAGDSLNPW-ZDUSSCGKSA-N 1 0 321.852 4.201 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCCC(=O)OC(C)(C)C)c(O)c1C ZINC000756787766 1046135301 /nfs/dbraw/zinc/13/53/01/1046135301.db2.gz RRKDGAKGSAUILS-HNNXBMFYSA-N 1 0 321.461 4.172 20 10 DICDRO CCCCn1cc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c(C)n1 ZINC000756787080 1046135378 /nfs/dbraw/zinc/13/53/78/1046135378.db2.gz OCHSXQDCDHZOAI-INIZCTEOSA-N 1 0 315.461 4.165 20 10 DICDRO Cc1cc(NCc2ccc(N(C)C)c(F)c2)c2ccccc2[nH+]1 ZINC000195737336 1046135718 /nfs/dbraw/zinc/13/57/18/1046135718.db2.gz ZPUWUVLNZSQXFY-UHFFFAOYSA-N 1 0 309.388 4.360 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C2(c3cccc(F)c3)CC2)c2c1c(F)ccc2O ZINC000756831983 1046140018 /nfs/dbraw/zinc/14/00/18/1046140018.db2.gz CPOIJBBASBOIJJ-ABAIWWIYSA-N 1 0 315.363 4.498 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CC(c3ccc(F)cc3)C2)c1 ZINC000756834989 1046142124 /nfs/dbraw/zinc/14/21/24/1046142124.db2.gz JVBPVNIQOFTEQK-XEBKBJJBSA-N 1 0 315.388 4.137 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](CC(C)C)C2)c(O)c1C ZINC000756864424 1046145759 /nfs/dbraw/zinc/14/57/59/1046145759.db2.gz MIVMSGVZYJVOFJ-YESZJQIVSA-N 1 0 305.462 4.253 20 10 DICDRO CCC[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@@H](C)CC ZINC001138338343 1046153715 /nfs/dbraw/zinc/15/37/15/1046153715.db2.gz OURMICGDJHXBFW-HNNXBMFYSA-N 1 0 316.489 4.102 20 10 DICDRO CN1CCCc2cc(C[N@@H+]3CC[C@H](c4ccccc4)C3)ccc21 ZINC001138354200 1046154801 /nfs/dbraw/zinc/15/48/01/1046154801.db2.gz ANINQYUEMHJMBW-FQEVSTJZSA-N 1 0 306.453 4.059 20 10 DICDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccc2c(c1)CCCN2C ZINC001138355850 1046155259 /nfs/dbraw/zinc/15/52/59/1046155259.db2.gz FEZAVDJCRMAMNQ-INIZCTEOSA-N 1 0 324.468 4.271 20 10 DICDRO CCc1cccc2c(C[N@@H+](CC)Cc3ccccc3O)c[nH]c21 ZINC001138365182 1046157816 /nfs/dbraw/zinc/15/78/16/1046157816.db2.gz GYEWKTOCEOCOEU-UHFFFAOYSA-N 1 0 308.425 4.458 20 10 DICDRO Cc1c2ccccc2[nH]c1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001138399450 1046164824 /nfs/dbraw/zinc/16/48/24/1046164824.db2.gz DQJUBJFFWZXBIS-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO C[C@H](c1ccccc1)[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000757277513 1046172195 /nfs/dbraw/zinc/17/21/95/1046172195.db2.gz QGVOFBWPYMPOBR-VQIMIIECSA-N 1 0 311.425 4.134 20 10 DICDRO C[C@@H]([NH2+]Cc1nccc2c1CCCC2)c1ccc(Cl)cc1O ZINC000903183064 1046185558 /nfs/dbraw/zinc/18/55/58/1046185558.db2.gz ZMYPOJFAQHEJAC-GFCCVEGCSA-N 1 0 316.832 4.170 20 10 DICDRO CC[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1cc(Cl)ccc1O ZINC000903191244 1046189147 /nfs/dbraw/zinc/18/91/47/1046189147.db2.gz QXVZBDGJJWARIA-GFCCVEGCSA-N 1 0 322.861 4.232 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2(COC)CCCC2)cc1C ZINC001202832856 1046190005 /nfs/dbraw/zinc/19/00/05/1046190005.db2.gz MOHZFTMRCFFDDP-UHFFFAOYSA-N 1 0 305.462 4.080 20 10 DICDRO CC[C@H]([NH2+]Cc1nc2c(s1)CCC2)c1cc(Cl)ccc1O ZINC000903191245 1046189962 /nfs/dbraw/zinc/18/99/62/1046189962.db2.gz QXVZBDGJJWARIA-LBPRGKRZSA-N 1 0 322.861 4.232 20 10 DICDRO CCCOc1ccc(C[NH2+]CC(C)(C)C2(O)CCCC2)cc1C ZINC001202832308 1046191785 /nfs/dbraw/zinc/19/17/85/1046191785.db2.gz KKDQHNOKMCOWSV-UHFFFAOYSA-N 1 0 319.489 4.205 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccco1 ZINC000757640278 1046195895 /nfs/dbraw/zinc/19/58/95/1046195895.db2.gz XEOSNPDDMKSZOM-RISCZKNCSA-N 1 0 309.793 4.067 20 10 DICDRO C[C@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1cc2c(cc1O)CCCC2 ZINC000757655814 1046197812 /nfs/dbraw/zinc/19/78/12/1046197812.db2.gz HBJDLSKKPDNHFM-OWCLPIDISA-N 1 0 317.473 4.127 20 10 DICDRO C[C@@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1cc2c(cc1O)CCCC2 ZINC000757655807 1046198003 /nfs/dbraw/zinc/19/80/03/1046198003.db2.gz HBJDLSKKPDNHFM-OAGGEKHMSA-N 1 0 317.473 4.127 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cc(F)c(F)c(F)c2)c(O)c1C ZINC000757639717 1046198174 /nfs/dbraw/zinc/19/81/74/1046198174.db2.gz SGEKQDAYKZMFGI-GFCCVEGCSA-N 1 0 323.358 4.320 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2COc3cc(F)cc(F)c32)c(O)c1C ZINC000757663096 1046199925 /nfs/dbraw/zinc/19/99/25/1046199925.db2.gz HTBFDRFMYWMKTH-NHYWBVRUSA-N 1 0 319.351 4.072 20 10 DICDRO CC[C@H]([NH2+]C1CC2(C1)CO[C@H](C)C2)c1cc(Cl)ccc1O ZINC000903283635 1046222438 /nfs/dbraw/zinc/22/24/38/1046222438.db2.gz RZTOSNRYBZKWOA-GDDYJNFWSA-N 1 0 309.837 4.044 20 10 DICDRO Cc1cc(CO)cc(C)c1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000903303815 1046230391 /nfs/dbraw/zinc/23/03/91/1046230391.db2.gz WEWFGJMVPGILTG-ZDUSSCGKSA-N 1 0 319.832 4.006 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1ccc2ccccc2c1O ZINC000903324253 1046238354 /nfs/dbraw/zinc/23/83/54/1046238354.db2.gz CXPHWCBHNFCEKD-FZKQIMNGSA-N 1 0 319.408 4.137 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1cc(Cl)ccc1O ZINC000903325508 1046238813 /nfs/dbraw/zinc/23/88/13/1046238813.db2.gz IECOXSZCNZXUGR-GOEBONIOSA-N 1 0 317.820 4.028 20 10 DICDRO C[C@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1cc(Cl)ccc1O ZINC000903325599 1046239322 /nfs/dbraw/zinc/23/93/22/1046239322.db2.gz VCXRSTSOLAQYHO-BLQFLSLASA-N 1 0 309.837 4.044 20 10 DICDRO Cc1cccnc1[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)C(C)(C)C ZINC000903327922 1046240718 /nfs/dbraw/zinc/24/07/18/1046240718.db2.gz BJJQNZMEUCRBSC-BEFAXECRSA-N 1 0 310.441 4.460 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc(Cl)cc1O ZINC000903336088 1046248355 /nfs/dbraw/zinc/24/83/55/1046248355.db2.gz VWIIFCCVLQBSIG-APPDUMDISA-N 1 0 302.805 4.243 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)cc1 ZINC000903338204 1046250463 /nfs/dbraw/zinc/25/04/63/1046250463.db2.gz GXIDBYVPFLPGOI-MGPUTAFESA-N 1 0 309.457 4.340 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cc(F)ccc1OC ZINC000903371259 1046258942 /nfs/dbraw/zinc/25/89/42/1046258942.db2.gz QTWAGEKBIOEVJL-LRDDRELGSA-N 1 0 303.377 4.342 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cc(F)ccc1OC ZINC000903371169 1046259978 /nfs/dbraw/zinc/25/99/78/1046259978.db2.gz PPUJYFICRYXBIJ-HZPDHXFCSA-N 1 0 315.388 4.268 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccncc2)C2CC2)c2c1c(F)ccc2O ZINC000903429226 1046279585 /nfs/dbraw/zinc/27/95/85/1046279585.db2.gz TYRBTWOQOXGPPI-VWCVUJCZSA-N 1 0 312.388 4.216 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H](c2ccncc2)C2CC2)c2c1c(F)ccc2O ZINC000903429224 1046279902 /nfs/dbraw/zinc/27/99/02/1046279902.db2.gz TYRBTWOQOXGPPI-KOXAJKMWSA-N 1 0 312.388 4.216 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1c(C)cc(OC)c(C)c1C ZINC001138725435 1046280144 /nfs/dbraw/zinc/28/01/44/1046280144.db2.gz ZYFRCHRPKQGJTK-UHFFFAOYSA-N 1 0 313.441 4.348 20 10 DICDRO CC[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903430336 1046280449 /nfs/dbraw/zinc/28/04/49/1046280449.db2.gz YUOAISLYCDPCBX-UXHICEINSA-N 1 0 309.457 4.340 20 10 DICDRO COc1cccc(C[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)c1O ZINC000758645185 1046283178 /nfs/dbraw/zinc/28/31/78/1046283178.db2.gz XXQREWRUJJLYCJ-GOSISDBHSA-N 1 0 315.388 4.089 20 10 DICDRO Cc1cc([C@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CC2)ccc1F ZINC000758644677 1046283308 /nfs/dbraw/zinc/28/33/08/1046283308.db2.gz SHOZAMPRSLZTMB-HXUWFJFHSA-N 1 0 311.400 4.310 20 10 DICDRO CC[C@@H]([NH2+]CCc1cccc2cccnc21)c1ccccc1O ZINC000321610666 1046337001 /nfs/dbraw/zinc/33/70/01/1046337001.db2.gz VGWLJINXBDZNAP-GOSISDBHSA-N 1 0 306.409 4.224 20 10 DICDRO CCCCOc1cccc(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001138956199 1046337401 /nfs/dbraw/zinc/33/74/01/1046337401.db2.gz JCQHZZKQACWALT-UHFFFAOYSA-N 1 0 311.425 4.129 20 10 DICDRO Cc1cc(O)c(C[N@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)cc1C ZINC000246470185 1046358824 /nfs/dbraw/zinc/35/88/24/1046358824.db2.gz MOAWCKLDTOYNJN-RDTXWAMCSA-N 1 0 317.454 4.033 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1Cl ZINC000090468927 1046374843 /nfs/dbraw/zinc/37/48/43/1046374843.db2.gz KRSBDHYXLPIDDM-CYBMUJFWSA-N 1 0 318.848 4.265 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)cc1 ZINC000246567008 1046377218 /nfs/dbraw/zinc/37/72/18/1046377218.db2.gz BOXCUWBNNRNSOW-AEFFLSMTSA-N 1 0 316.489 4.285 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000090536193 1046382101 /nfs/dbraw/zinc/38/21/01/1046382101.db2.gz ANFXSVLZWGHZJM-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO CC[C@@H]1C[C@@H](C[N@H+](Cc2ccccc2O)C2CCCC2)CCO1 ZINC000780758444 1046403579 /nfs/dbraw/zinc/40/35/79/1046403579.db2.gz RVVVWIPNLPGNQJ-QFBILLFUSA-N 1 0 317.473 4.342 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)c1 ZINC000780791740 1046406429 /nfs/dbraw/zinc/40/64/29/1046406429.db2.gz PFBXQRIMTAGRHB-HJCTWCACSA-N 1 0 309.409 4.079 20 10 DICDRO CC[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCN(c3ccc(OC)cc3)C2)C1 ZINC001202913400 1046418679 /nfs/dbraw/zinc/41/86/79/1046418679.db2.gz KDRRUSRONVYBCS-KURKYZTESA-N 1 0 316.489 4.080 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)c1O ZINC000827962523 1046476139 /nfs/dbraw/zinc/47/61/39/1046476139.db2.gz NNHDVRNSJQDNTD-CQSZACIVSA-N 1 0 311.425 4.130 20 10 DICDRO CCOc1ccc(C[N@H+](CC)Cc2ccccc2O)cc1Cl ZINC001139597285 1046482518 /nfs/dbraw/zinc/48/25/18/1046482518.db2.gz TVNKVKFUCWASPS-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc(-c3cccnc3)cc1)CC2 ZINC001139644639 1046493489 /nfs/dbraw/zinc/49/34/89/1046493489.db2.gz MTOIPOCPKXLGTN-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc(N(C)C)c(C)c3)C2)cc1 ZINC001139674172 1046497423 /nfs/dbraw/zinc/49/74/23/1046497423.db2.gz SSQNOQPBJOSDKQ-IBGZPJMESA-N 1 0 324.468 4.059 20 10 DICDRO Cc1cc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)ccc1N(C)C ZINC001139673777 1046497594 /nfs/dbraw/zinc/49/75/94/1046497594.db2.gz ZQVZVAGVYAQIGW-QGZVFWFLSA-N 1 0 304.453 4.165 20 10 DICDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)c(C)c2)c1 ZINC001139672975 1046497602 /nfs/dbraw/zinc/49/76/02/1046497602.db2.gz MFEOQRDCRCCYMM-NRFANRHFSA-N 1 0 324.468 4.407 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cc(F)ccc1O ZINC000359974140 1046529863 /nfs/dbraw/zinc/52/98/63/1046529863.db2.gz NFAZUCYTXCJCGK-VBKZILBWSA-N 1 0 322.383 4.367 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](c2ccccc2F)C(C)C)c1 ZINC000827017967 1046540205 /nfs/dbraw/zinc/54/02/05/1046540205.db2.gz PRWHWUDTJJUJHS-GOSISDBHSA-N 1 0 303.377 4.027 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCC=CO1)c1ccc(N2CCCCCC2)cc1 ZINC000783307898 1046576650 /nfs/dbraw/zinc/57/66/50/1046576650.db2.gz BGSICQBLQGDGJN-XLIONFOSSA-N 1 0 314.473 4.410 20 10 DICDRO CCOC(C)(C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000783312045 1046579065 /nfs/dbraw/zinc/57/90/65/1046579065.db2.gz BJVVVADHBCZLBN-OAHLLOKOSA-N 1 0 322.468 4.282 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC2(CCc3ccccc32)CC1 ZINC001140063760 1046582400 /nfs/dbraw/zinc/58/24/00/1046582400.db2.gz YWYARBLDHHSJFS-UHFFFAOYSA-N 1 0 311.400 4.011 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N2CCCCC2)cc1)c1ccccc1O ZINC000783505854 1046602427 /nfs/dbraw/zinc/60/24/27/1046602427.db2.gz XTRFJBFXCFDPOF-KRWDZBQOSA-N 1 0 324.468 4.276 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2O)C12CCCCC2 ZINC000783519109 1046603555 /nfs/dbraw/zinc/60/35/55/1046603555.db2.gz VVRZIUPZCUEEHI-JCGIZDLHSA-N 1 0 303.446 4.171 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000783520099 1046603638 /nfs/dbraw/zinc/60/36/38/1046603638.db2.gz ZRWNDIANMNEWMV-SJKOYZFVSA-N 1 0 305.805 4.084 20 10 DICDRO CC[N@H+](Cc1cccc(F)c1F)Cc1c(C)ccc(C)c1O ZINC001140185373 1046609709 /nfs/dbraw/zinc/60/97/09/1046609709.db2.gz UHEFOZGKNUGDAC-UHFFFAOYSA-N 1 0 305.368 4.309 20 10 DICDRO Cc1ccc(C)c(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1O ZINC001140182232 1046610379 /nfs/dbraw/zinc/61/03/79/1046610379.db2.gz LLXHMUMLVQJGCZ-SFHVURJKSA-N 1 0 313.466 4.299 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000841747977 1046615062 /nfs/dbraw/zinc/61/50/62/1046615062.db2.gz GCKWMZRZRSUUBR-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)CC2 ZINC000834487797 1046623440 /nfs/dbraw/zinc/62/34/40/1046623440.db2.gz MRYOVWILVOWHSC-CQSZACIVSA-N 1 0 308.208 4.476 20 10 DICDRO CCCCOc1cccc(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000834513642 1046625615 /nfs/dbraw/zinc/62/56/15/1046625615.db2.gz NSLXIJDBYQWFJC-SFHVURJKSA-N 1 0 311.425 4.348 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000248624759 1046629518 /nfs/dbraw/zinc/62/95/18/1046629518.db2.gz CRGHQOCEIWJYIY-TWOQFEAHSA-N 1 0 312.457 4.043 20 10 DICDRO COc1cccc(C[N@@H+]2CCCCC[C@H]2c2ccco2)c1O ZINC000093441709 1046629582 /nfs/dbraw/zinc/62/95/82/1046629582.db2.gz JVUJUKWXXQOZKK-HNNXBMFYSA-N 1 0 301.386 4.111 20 10 DICDRO Cc1cc(Cl)cc(CNc2ccccc2CC[NH+](C)C)c1O ZINC000783743946 1046630020 /nfs/dbraw/zinc/63/00/20/1046630020.db2.gz MUOSYYRBOYFIST-UHFFFAOYSA-N 1 0 318.848 4.070 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)cc1C(C)C ZINC000795671477 1046631054 /nfs/dbraw/zinc/63/10/54/1046631054.db2.gz VSINBSDNWRVXOE-GOSISDBHSA-N 1 0 313.445 4.274 20 10 DICDRO Cc1cccc2[nH]cc(CC[NH2+][C@H]3CCc4cccc(O)c43)c21 ZINC000834562532 1046631938 /nfs/dbraw/zinc/63/19/38/1046631938.db2.gz QCNWPALAKIKMIX-KRWDZBQOSA-N 1 0 306.409 4.002 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(F)cc1F ZINC000834594140 1046636425 /nfs/dbraw/zinc/63/64/25/1046636425.db2.gz PXADERPNAFUSNF-HZPDHXFCSA-N 1 0 303.352 4.399 20 10 DICDRO C[C@H](CCCc1cccnc1)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000834769726 1046667946 /nfs/dbraw/zinc/66/79/46/1046667946.db2.gz QRUINDHMEHJTBQ-IAGOWNOFSA-N 1 0 311.473 4.210 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)cc1 ZINC001140344740 1046668838 /nfs/dbraw/zinc/66/88/38/1046668838.db2.gz LIRCHCFXRJASQI-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2c(F)cc(F)cc21)c1ccccc1O ZINC000834814100 1046674505 /nfs/dbraw/zinc/67/45/05/1046674505.db2.gz FCASJHXRIGMDGZ-PIGZYNQJSA-N 1 0 303.352 4.399 20 10 DICDRO CC[C@@H]([NH2+]CCCC1CCOCC1)c1ccc(N(C)C)cc1 ZINC000834818064 1046676005 /nfs/dbraw/zinc/67/60/05/1046676005.db2.gz HEDPMLZXHGYHOT-LJQANCHMSA-N 1 0 304.478 4.000 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CSc2ccccc21)c1cc(F)ccc1O ZINC000834819081 1046676302 /nfs/dbraw/zinc/67/63/02/1046676302.db2.gz SEEAQBVWUDTWGX-VXGBXAGGSA-N 1 0 303.402 4.071 20 10 DICDRO c1csc(SCCC[NH2+][C@H](c2cccnc2)C2CCC2)n1 ZINC000795798649 1046680282 /nfs/dbraw/zinc/68/02/82/1046680282.db2.gz WQYLCQMWUGHAOG-HNNXBMFYSA-N 1 0 319.499 4.151 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2cc(F)cnc2Cl)c2c1c(F)ccc2O ZINC000834836275 1046680878 /nfs/dbraw/zinc/68/08/78/1046680878.db2.gz LWIOJPWAZOIYSM-PELKAZGASA-N 1 0 324.758 4.057 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCn2ccnc21)c1ccc(N2CCCCCC2)cc1 ZINC000834834669 1046681034 /nfs/dbraw/zinc/68/10/34/1046681034.db2.gz DWVJRXWMDGQWID-QFBILLFUSA-N 1 0 324.472 4.059 20 10 DICDRO CC[C@H](COCC(F)(F)F)[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000834843803 1046683993 /nfs/dbraw/zinc/68/39/93/1046683993.db2.gz MCVKLMJTUPTRMH-CHWSQXEVSA-N 1 0 319.367 4.017 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2ccccn2)c2c1c(F)ccc2O ZINC000834849294 1046686081 /nfs/dbraw/zinc/68/60/81/1046686081.db2.gz ACORYTQCGSNTPE-GXTWGEPZSA-N 1 0 314.404 4.042 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC(C)(C)c2ccccn2)c1O ZINC000834851200 1046686536 /nfs/dbraw/zinc/68/65/36/1046686536.db2.gz VQNNEAPORJXGNM-ZDUSSCGKSA-N 1 0 318.848 4.377 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc(C(F)(F)F)n2)c(O)c1 ZINC000834855933 1046689015 /nfs/dbraw/zinc/68/90/15/1046689015.db2.gz IHNKHTNMJWNZOV-LBPRGKRZSA-N 1 0 324.346 4.274 20 10 DICDRO C[C@@H]([NH2+]CCC(C)(C)CO)c1ccc(N2CCCCCC2)cc1 ZINC000834872226 1046691354 /nfs/dbraw/zinc/69/13/54/1046691354.db2.gz XSJUBPLOOKUIDJ-QGZVFWFLSA-N 1 0 318.505 4.126 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)Oc2ccccc21)c1ccc(N(C)C)cc1 ZINC000834876425 1046693545 /nfs/dbraw/zinc/69/35/45/1046693545.db2.gz CBWGRVGZZIWCPL-ZRGWGRIASA-N 1 0 310.441 4.316 20 10 DICDRO C[C@@H](CC(C)(C)O)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834880216 1046695199 /nfs/dbraw/zinc/69/51/99/1046695199.db2.gz OFCMHPVYBCTVML-IRXDYDNUSA-N 1 0 318.505 4.267 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c(O)c1C ZINC000834883348 1046696683 /nfs/dbraw/zinc/69/66/83/1046696683.db2.gz QAEJAXKRZCUOES-HOTGVXAUSA-N 1 0 303.446 4.009 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1ccc(C)cc1O ZINC000834883591 1046696692 /nfs/dbraw/zinc/69/66/92/1046696692.db2.gz RKEMLTPOCCNJSY-NVXWUHKLSA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1ccc(C)cc1O ZINC000834883590 1046697170 /nfs/dbraw/zinc/69/71/70/1046697170.db2.gz RKEMLTPOCCNJSY-DOTOQJQBSA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000834883916 1046698183 /nfs/dbraw/zinc/69/81/83/1046698183.db2.gz UYZVOYXBHGMEOR-VQIMIIECSA-N 1 0 316.489 4.143 20 10 DICDRO COC[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000834885779 1046698387 /nfs/dbraw/zinc/69/83/87/1046698387.db2.gz YAWVBWMXBHKYQC-DZGCQCFKSA-N 1 0 319.832 4.126 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@]2(C)CC2(Cl)Cl)c2c1c(F)ccc2O ZINC000834885753 1046698665 /nfs/dbraw/zinc/69/86/65/1046698665.db2.gz XSTADHQXNVPXOW-YACGNSKGSA-N 1 0 318.219 4.253 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCO[C@@H](C(C)C)C2)c(O)c1C ZINC000834887114 1046700002 /nfs/dbraw/zinc/70/00/02/1046700002.db2.gz YHGSJLOVRBBNDK-LZLYRXPVSA-N 1 0 305.462 4.111 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC[C@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834889552 1046702587 /nfs/dbraw/zinc/70/25/87/1046702587.db2.gz AYRBBDMXSWOBRY-BXUZGUMPSA-N 1 0 302.245 4.325 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCc3cc(F)c(F)c(F)c31)CC2 ZINC000834897198 1046707803 /nfs/dbraw/zinc/70/78/03/1046707803.db2.gz RHWQASFKBLWFAO-STQMWFEESA-N 1 0 319.326 4.074 20 10 DICDRO CCCc1ncc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)o1 ZINC000834898838 1046709316 /nfs/dbraw/zinc/70/93/16/1046709316.db2.gz HBVVOXBRWGFNIL-ZDUSSCGKSA-N 1 0 314.429 4.062 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)c(O)c1 ZINC000834898478 1046709992 /nfs/dbraw/zinc/70/99/92/1046709992.db2.gz DQXWRNASFLVQLC-JJRVBVJISA-N 1 0 317.454 4.333 20 10 DICDRO C[C@H]([NH2+]C1CCC(OC(F)F)CC1)c1cc(Cl)ccc1O ZINC000834901829 1046711895 /nfs/dbraw/zinc/71/18/95/1046711895.db2.gz DCNXEFYNGPPIQY-GCVQQVDUSA-N 1 0 319.779 4.247 20 10 DICDRO CCC1(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)COC1 ZINC000834900897 1046712909 /nfs/dbraw/zinc/71/29/09/1046712909.db2.gz SXBYRMZZTVRYPW-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO CO[C@@H]([C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C1CC1 ZINC000834903408 1046714580 /nfs/dbraw/zinc/71/45/80/1046714580.db2.gz JEUILRHUBGVZDO-YRNRMSPPSA-N 1 0 316.489 4.141 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CCC(OC(F)F)CC2)c(O)c1C ZINC000834903191 1046715016 /nfs/dbraw/zinc/71/50/16/1046715016.db2.gz JUKMXDLDCOXZBT-HSBZDZAISA-N 1 0 313.388 4.210 20 10 DICDRO CC[C@H]([NH2+]C1CCC(OC(F)F)CC1)c1ccc(C)cc1O ZINC000834904040 1046715577 /nfs/dbraw/zinc/71/55/77/1046715577.db2.gz MJLASWIABDRIKL-PIMMBPRGSA-N 1 0 313.388 4.292 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccc2ccccc2c1O ZINC000834911111 1046718262 /nfs/dbraw/zinc/71/82/62/1046718262.db2.gz RSOHKPVWDJOOED-CABCVRRESA-N 1 0 313.441 4.401 20 10 DICDRO CC[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(F)cc1[O-] ZINC000796759262 1046728126 /nfs/dbraw/zinc/72/81/26/1046728126.db2.gz GPNPQGBVSJAGNI-SFHVURJKSA-N 1 0 322.468 4.228 20 10 DICDRO Cc1ccccc1O[C@H]1CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140464882 1046738967 /nfs/dbraw/zinc/73/89/67/1046738967.db2.gz DUTWYRZKFYNNBR-INIZCTEOSA-N 1 0 317.816 4.007 20 10 DICDRO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1ccc(Cl)cc1O ZINC001140465691 1046739566 /nfs/dbraw/zinc/73/95/66/1046739566.db2.gz RIXCEAYLFGBBJS-UHFFFAOYSA-N 1 0 317.816 4.139 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH+]2CCC(OC(C)(C)C)CC2)cc1 ZINC000835026798 1046743296 /nfs/dbraw/zinc/74/32/96/1046743296.db2.gz HZLAXQKIDUYNPK-VOTSOKGWSA-N 1 0 316.489 4.045 20 10 DICDRO CC(C)c1csc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)n1 ZINC000835042493 1046746425 /nfs/dbraw/zinc/74/64/25/1046746425.db2.gz IXJFUUBEGCIAHI-WAYWQWQTSA-N 1 0 315.486 4.136 20 10 DICDRO C[C@@H]1C[C@H](c2cccnc2)[N@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835048152 1046748189 /nfs/dbraw/zinc/74/81/89/1046748189.db2.gz MJVQUZSGYFMBMF-LRJKKDHCSA-N 1 0 321.468 4.244 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C2(C)CCC(F)(F)CC2)cc1 ZINC000835047873 1046748990 /nfs/dbraw/zinc/74/89/90/1046748990.db2.gz LXDGZVBXZBQWKN-SNAWJCMRSA-N 1 0 308.416 4.323 20 10 DICDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)[C@H](C)c1cccnc1 ZINC000835053891 1046751567 /nfs/dbraw/zinc/75/15/67/1046751567.db2.gz PZRCVHVVFDVSAQ-IWAYRVGRSA-N 1 0 309.457 4.244 20 10 DICDRO Oc1ccc2ccncc2c1C[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC000835071494 1046754628 /nfs/dbraw/zinc/75/46/28/1046754628.db2.gz YUPOHNWWPJDOGM-UHFFFAOYSA-N 1 0 322.383 4.244 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCCC[C@H]2OC)cc1 ZINC001203043107 1046755052 /nfs/dbraw/zinc/75/50/52/1046755052.db2.gz LCLKNAHSBWFCRL-WOJBJXKFSA-N 1 0 318.505 4.360 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000797010650 1046770283 /nfs/dbraw/zinc/77/02/83/1046770283.db2.gz SZHRVKTXOLSNMD-GFCCVEGCSA-N 1 0 305.418 4.412 20 10 DICDRO C[N@H+](Cc1ccc2ccccc2c1)Cc1c([O-])cc(F)cc1F ZINC001140584428 1046795616 /nfs/dbraw/zinc/79/56/16/1046795616.db2.gz QVDHFYJNLNLRGR-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001140620880 1046815051 /nfs/dbraw/zinc/81/50/51/1046815051.db2.gz DPGLMEFNVLEYDN-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC3(CC2)O[C@@H](C)c2ccccc23)c1 ZINC001140624504 1046816888 /nfs/dbraw/zinc/81/68/88/1046816888.db2.gz YTGSPETWXULMAN-INIZCTEOSA-N 1 0 323.436 4.283 20 10 DICDRO Oc1ccccc1C[NH2+]Cc1cc(Cl)ccc1OCC1CC1 ZINC000797465791 1046839651 /nfs/dbraw/zinc/83/96/51/1046839651.db2.gz HUUQRAIBPFUXFA-UHFFFAOYSA-N 1 0 317.816 4.124 20 10 DICDRO COc1ccc(O)c(C[NH2+]C2CCC(c3ccccc3)CC2)c1 ZINC000237360356 1046870541 /nfs/dbraw/zinc/87/05/41/1046870541.db2.gz WWFDXDOQVJFVSK-UHFFFAOYSA-N 1 0 311.425 4.217 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CC(C)(C)Cc3oc(C)cc32)c1 ZINC000237362845 1046872381 /nfs/dbraw/zinc/87/23/81/1046872381.db2.gz UJVBOMHQUVIHJL-INIZCTEOSA-N 1 0 315.413 4.106 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1O ZINC001140750118 1046884429 /nfs/dbraw/zinc/88/44/29/1046884429.db2.gz VTRVYBPGIDZFDC-MRXNPFEDSA-N 1 0 319.351 4.022 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)c1O ZINC001140748848 1046885217 /nfs/dbraw/zinc/88/52/17/1046885217.db2.gz MERCJHVWVWINIM-KRWDZBQOSA-N 1 0 311.425 4.176 20 10 DICDRO Oc1ccccc1C[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000797880487 1046899491 /nfs/dbraw/zinc/89/94/91/1046899491.db2.gz RINZPQZFWDYVKU-KOMQPUFPSA-N 1 0 321.342 4.447 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000797877584 1046900036 /nfs/dbraw/zinc/90/00/36/1046900036.db2.gz XLOVHYHTOHENDP-CTYIDZIISA-N 1 0 317.816 4.090 20 10 DICDRO Oc1ccccc1C[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000797876469 1046900562 /nfs/dbraw/zinc/90/05/62/1046900562.db2.gz KFNXJTFCAVFDIK-KOMQPUFPSA-N 1 0 321.342 4.447 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCc2ccc(C)c(C)c2)c(Cl)c1 ZINC001203068365 1046909947 /nfs/dbraw/zinc/90/99/47/1046909947.db2.gz RWUYMMQDPNTQCY-UHFFFAOYSA-N 1 0 303.833 4.303 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1ccc(N(C)C)cc1 ZINC000797998675 1046917765 /nfs/dbraw/zinc/91/77/65/1046917765.db2.gz JSPCQTWSJRWCGA-FNHZYXHNSA-N 1 0 312.432 4.489 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCN2C2CCCCC2)c1 ZINC000798002901 1046919605 /nfs/dbraw/zinc/91/96/05/1046919605.db2.gz WBKJCFBILYQMGY-FUHWJXTLSA-N 1 0 316.489 4.148 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CCC3(CCC3)CC2)c(O)c1 ZINC001140850713 1046928539 /nfs/dbraw/zinc/92/85/39/1046928539.db2.gz ROZFPOKDKXUXCV-UHFFFAOYSA-N 1 0 302.462 4.005 20 10 DICDRO Oc1ccccc1C[N@H+](C/C=C/c1ccccc1)C[C@@H]1CCCO1 ZINC000303639457 1046938732 /nfs/dbraw/zinc/93/87/32/1046938732.db2.gz QOVYRKIDVADSCU-FXVWLTTGSA-N 1 0 323.436 4.087 20 10 DICDRO Oc1ccccc1C[N@H+](C/C=C/c1ccccc1)C[C@H]1CCCO1 ZINC000303639455 1046938875 /nfs/dbraw/zinc/93/88/75/1046938875.db2.gz QOVYRKIDVADSCU-CLOLKSBNSA-N 1 0 323.436 4.087 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2ccc(F)cc2)c(Cl)c1 ZINC001140921597 1046950806 /nfs/dbraw/zinc/95/08/06/1046950806.db2.gz JNOMEKFRBSPRJL-UHFFFAOYSA-N 1 0 306.812 4.177 20 10 DICDRO CN(C)c1ccc(CN2CCC[C@@H]2c2nccs2)c(Cl)c1 ZINC001140926013 1046951977 /nfs/dbraw/zinc/95/19/77/1046951977.db2.gz XKWVOPPXNNGWOC-OAHLLOKOSA-N 1 0 321.877 4.200 20 10 DICDRO CN(C)c1ccc(CN2CC[C@H]2c2ccccc2)c(Cl)c1 ZINC001140924118 1046952227 /nfs/dbraw/zinc/95/22/27/1046952227.db2.gz DTZMCQARFQIPKH-SFHVURJKSA-N 1 0 300.833 4.353 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(N(C)C)cc1Cl ZINC001140926078 1046954068 /nfs/dbraw/zinc/95/40/68/1046954068.db2.gz YSYMKNUHCPZSME-UHFFFAOYSA-N 1 0 318.848 4.134 20 10 DICDRO Cc1ccc(C[NH+]2CCC3(CC2)O[C@@H](C)c2ccccc23)c(O)c1 ZINC001140954284 1046959384 /nfs/dbraw/zinc/95/93/84/1046959384.db2.gz OQPVSVYTAJQDEX-INIZCTEOSA-N 1 0 323.436 4.283 20 10 DICDRO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccc(F)cc2)c(O)c1 ZINC001140950956 1046961101 /nfs/dbraw/zinc/96/11/01/1046961101.db2.gz QMNRBZOWKQQDDO-QGZVFWFLSA-N 1 0 317.429 4.130 20 10 DICDRO CC[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)CCCO1 ZINC000798964781 1046994796 /nfs/dbraw/zinc/99/47/96/1046994796.db2.gz PSYWMJXYJUPFRD-LJQANCHMSA-N 1 0 311.425 4.060 20 10 DICDRO CC[C@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)CCCO1 ZINC000798964778 1046995523 /nfs/dbraw/zinc/99/55/23/1046995523.db2.gz PSYWMJXYJUPFRD-IBGZPJMESA-N 1 0 311.425 4.060 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H](c3ccccn3)C2)c(O)c(C(C)(C)C)c1 ZINC000799160163 1047006253 /nfs/dbraw/zinc/00/62/53/1047006253.db2.gz PHMWYWMLGLROCQ-INIZCTEOSA-N 1 0 324.468 4.383 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC=C(Br)C1 ZINC000799573830 1047044331 /nfs/dbraw/zinc/04/43/31/1047044331.db2.gz FKLXGGPPZPZAKO-UHFFFAOYSA-N 1 0 318.214 4.030 20 10 DICDRO COc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc(N(C)C)cc1C ZINC000799719157 1047055796 /nfs/dbraw/zinc/05/57/96/1047055796.db2.gz UJYHHQHDOQATFT-FQEVSTJZSA-N 1 0 324.468 4.237 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000799715516 1047056132 /nfs/dbraw/zinc/05/61/32/1047056132.db2.gz RKSQWZUBOHGNCG-UHFFFAOYSA-N 1 0 310.432 4.446 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1Cc2[nH]c3ccccc3c2C1 ZINC000799735291 1047059021 /nfs/dbraw/zinc/05/90/21/1047059021.db2.gz NUMWOHIWGIKSGQ-KRWDZBQOSA-N 1 0 319.452 4.010 20 10 DICDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000799728858 1047059053 /nfs/dbraw/zinc/05/90/53/1047059053.db2.gz FOODPVYKNWXYCK-VDGAXYAQSA-N 1 0 316.489 4.285 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CCC2CCOCC2)cc1 ZINC001116071255 1047105255 /nfs/dbraw/zinc/10/52/55/1047105255.db2.gz WBAQSPVHJDTRMD-UHFFFAOYSA-N 1 0 318.505 4.219 20 10 DICDRO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116444163 1047141469 /nfs/dbraw/zinc/14/14/69/1047141469.db2.gz TUSGBXJQIGQUIR-MRXNPFEDSA-N 1 0 310.441 4.185 20 10 DICDRO CS[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC001116444889 1047142722 /nfs/dbraw/zinc/14/27/22/1047142722.db2.gz CXOQJOKUHJLMIS-OALUTQOASA-N 1 0 318.530 4.393 20 10 DICDRO CN(C)[C@H]1CCCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC001116489383 1047147978 /nfs/dbraw/zinc/14/79/78/1047147978.db2.gz YHTLFPAMJNQKFG-UXHICEINSA-N 1 0 324.468 4.022 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c(C)c1 ZINC001116589119 1047160024 /nfs/dbraw/zinc/16/00/24/1047160024.db2.gz QCMIIZFRGPAAJS-YOEHRIQHSA-N 1 0 311.425 4.356 20 10 DICDRO COC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CCCCC1 ZINC001116651091 1047164940 /nfs/dbraw/zinc/16/49/40/1047164940.db2.gz MBNJKIHKHYIBJS-LSDHHAIUSA-N 1 0 303.446 4.188 20 10 DICDRO Cc1cc(NCc2c(O)ccc(Cl)c2F)ccc1C[NH+](C)C ZINC000839188828 1047202689 /nfs/dbraw/zinc/20/26/89/1047202689.db2.gz MMLRRWDYRHUVIG-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+][C@@H](C)c1cncc(F)c1 ZINC001117944988 1047249619 /nfs/dbraw/zinc/24/96/19/1047249619.db2.gz OUNFYJDSVKCDPH-HUBLWGQQSA-N 1 0 300.377 4.134 20 10 DICDRO C[C@@H](CCOCc1ccccc1)[NH2+]Cc1cc(Cl)ccc1O ZINC000389905845 1047292479 /nfs/dbraw/zinc/29/24/79/1047292479.db2.gz GPIAOQFLCBFWBK-AWEZNQCLSA-N 1 0 319.832 4.131 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCOCc2ccccc2)c1 ZINC000389930232 1047292846 /nfs/dbraw/zinc/29/28/46/1047292846.db2.gz HXSHIRJPMQEZBB-IRXDYDNUSA-N 1 0 313.441 4.347 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCOCc2ccccc2)c(O)c1 ZINC000389935971 1047293446 /nfs/dbraw/zinc/29/34/46/1047293446.db2.gz MNSONIBVABEXAF-DLBZAZTESA-N 1 0 313.441 4.347 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CCOCc1ccccc1)c1ccccc1O ZINC000389952062 1047293512 /nfs/dbraw/zinc/29/35/12/1047293512.db2.gz XJGKZDWVCJWALP-APWZRJJASA-N 1 0 313.441 4.428 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCN2Cc2ccccc2)c1 ZINC000390557197 1047297412 /nfs/dbraw/zinc/29/74/12/1047297412.db2.gz IIYROFJUNANWAX-IEBWSBKVSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)c2ncccc2F)c1O ZINC000528038030 1047300933 /nfs/dbraw/zinc/30/09/33/1047300933.db2.gz OLFOBDXQWWFZAQ-QWRGUYRKSA-N 1 0 308.784 4.300 20 10 DICDRO COc1cccc(C[NH2+]C2CCC(c3ccccc3)CC2)c1O ZINC000393410103 1047310928 /nfs/dbraw/zinc/31/09/28/1047310928.db2.gz OZCWHDXWTJJMLV-UHFFFAOYSA-N 1 0 311.425 4.217 20 10 DICDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000725781087 1047313321 /nfs/dbraw/zinc/31/33/21/1047313321.db2.gz XRQTYDUSSIYWCU-SFHVURJKSA-N 1 0 307.437 4.179 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3cc(Br)ccc32)C1 ZINC000725778965 1047314136 /nfs/dbraw/zinc/31/41/36/1047314136.db2.gz JVTTYDZYBBYNMH-LLVKDONJSA-N 1 0 320.230 4.150 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]C[C@@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000725841434 1047318476 /nfs/dbraw/zinc/31/84/76/1047318476.db2.gz IHRUMOIHDQGHIV-INIZCTEOSA-N 1 0 319.489 4.256 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2csc3ccccc23)c(O)c1 ZINC000725846688 1047318827 /nfs/dbraw/zinc/31/88/27/1047318827.db2.gz PRSKBDSOFXXGGK-UHFFFAOYSA-N 1 0 313.422 4.295 20 10 DICDRO Cc1cccc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)n1 ZINC000725847641 1047319903 /nfs/dbraw/zinc/31/99/03/1047319903.db2.gz OASXGFBGPZCWLZ-UHFFFAOYSA-N 1 0 304.393 4.052 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc(-c3ccccc3)o2)c1 ZINC000725847134 1047321795 /nfs/dbraw/zinc/32/17/95/1047321795.db2.gz TXJPFOQHTKTSII-UHFFFAOYSA-N 1 0 323.392 4.341 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccccc1O ZINC000398163646 1047326401 /nfs/dbraw/zinc/32/64/01/1047326401.db2.gz CTIAPOBFSIIPNE-HQRMLTQVSA-N 1 0 324.468 4.096 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)CCCc2cccnc2)c(O)c1C ZINC000840771117 1047331737 /nfs/dbraw/zinc/33/17/37/1047331737.db2.gz ARYRLTOAUWEYJU-WBVHZDCISA-N 1 0 312.457 4.466 20 10 DICDRO Cc1ncc(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)o1 ZINC000840795483 1047333940 /nfs/dbraw/zinc/33/39/40/1047333940.db2.gz HCMJOXLEZTWMSP-HNNXBMFYSA-N 1 0 313.445 4.214 20 10 DICDRO Cc1cc(O)c(CNc2cccc(C[NH+](C)C)c2)c(Cl)c1 ZINC000840878270 1047350724 /nfs/dbraw/zinc/35/07/24/1047350724.db2.gz CPDYBHCSYAIMGJ-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000840892622 1047356161 /nfs/dbraw/zinc/35/61/61/1047356161.db2.gz WCJWNYAFXMLGKX-IBGZPJMESA-N 1 0 311.473 4.166 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc(N(C)C)cc1C)c1ccncc1 ZINC000840895472 1047356175 /nfs/dbraw/zinc/35/61/75/1047356175.db2.gz YLPLOPFVGGOGIG-OXQOHEQNSA-N 1 0 311.473 4.128 20 10 DICDRO Cc1cncc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)c1 ZINC000840892712 1047356867 /nfs/dbraw/zinc/35/68/67/1047356867.db2.gz CBHAOPCGBAACOG-DLBZAZTESA-N 1 0 311.473 4.046 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC(C)(C)c2cccnc2)c1O ZINC000840892446 1047357548 /nfs/dbraw/zinc/35/75/48/1047357548.db2.gz SKYUBVGVKSYZBZ-ZDUSSCGKSA-N 1 0 318.848 4.377 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCO[C@H](c2ccccc2)C1 ZINC000840938400 1047361558 /nfs/dbraw/zinc/36/15/58/1047361558.db2.gz DIALKCPEFNMPIA-FPOVZHCZSA-N 1 0 324.468 4.071 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C1(c2nccs2)CCCC1 ZINC000840933337 1047361641 /nfs/dbraw/zinc/36/16/41/1047361641.db2.gz CFZILNSWQUBTQY-UHFFFAOYSA-N 1 0 315.486 4.077 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(Cl)c1 ZINC000840946086 1047363036 /nfs/dbraw/zinc/36/30/36/1047363036.db2.gz HUBRWHIFJDWBMX-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cnccc2C(C)(C)C)c(Cl)c1 ZINC000840959283 1047363485 /nfs/dbraw/zinc/36/34/85/1047363485.db2.gz QKGBDMVTBAHCSL-UHFFFAOYSA-N 1 0 318.848 4.336 20 10 DICDRO CC(C)(C)c1ccncc1C[NH2+]Cc1c(O)cccc1Cl ZINC000840958994 1047366085 /nfs/dbraw/zinc/36/60/85/1047366085.db2.gz ODTYJFGXSNJGHJ-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCc1ccc(N)cc1 ZINC000841036464 1047372950 /nfs/dbraw/zinc/37/29/50/1047372950.db2.gz SITGWFVEMHRABL-CYBMUJFWSA-N 1 0 322.374 4.051 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000841034645 1047373988 /nfs/dbraw/zinc/37/39/88/1047373988.db2.gz JBEIQJQUAOUHLW-MOPGFXCFSA-N 1 0 314.860 4.391 20 10 DICDRO CC[NH2+]Cc1cccc(NCc2cc(Cl)cc(C)c2O)c1 ZINC000841042865 1047375003 /nfs/dbraw/zinc/37/50/03/1047375003.db2.gz JSZOYLORVOBWTH-UHFFFAOYSA-N 1 0 304.821 4.076 20 10 DICDRO Cc1cc(C(=O)Cn2cnc(C)c2C)c(C)n1-c1cccc(C)c1 ZINC000749333073 1047410513 /nfs/dbraw/zinc/41/05/13/1047410513.db2.gz CGCYZKZGNBMEFE-UHFFFAOYSA-N 1 0 321.424 4.099 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OC3CCC3)CC2)cc1C(C)C ZINC000841687568 1047442343 /nfs/dbraw/zinc/44/23/43/1047442343.db2.gz NNIXOVILJWFZCN-UHFFFAOYSA-N 1 0 317.473 4.358 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1ccc(Cl)cc1O ZINC000841744465 1047447005 /nfs/dbraw/zinc/44/70/05/1047447005.db2.gz OJKWJNHBNYGLOH-ABAIWWIYSA-N 1 0 324.877 4.061 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1ccc(Cl)cc1O ZINC000841745493 1047449031 /nfs/dbraw/zinc/44/90/31/1047449031.db2.gz YYPKYHQUYSYTJI-WDEREUQCSA-N 1 0 319.788 4.186 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccc(Cl)cc1O ZINC000841751523 1047450253 /nfs/dbraw/zinc/45/02/53/1047450253.db2.gz HQNBXLZQXIWDIO-LBPRGKRZSA-N 1 0 316.832 4.170 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccco1 ZINC000841753147 1047452013 /nfs/dbraw/zinc/45/20/13/1047452013.db2.gz JTCRCCMVRRFZBN-BXUZGUMPSA-N 1 0 309.793 4.067 20 10 DICDRO C[C@H]([NH2+][C@H]1COCc2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000841760381 1047453269 /nfs/dbraw/zinc/45/32/69/1047453269.db2.gz KDJXSRRWSYLPDX-XOBRGWDASA-N 1 0 323.436 4.193 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(Cl)cc1O ZINC000841757794 1047453595 /nfs/dbraw/zinc/45/35/95/1047453595.db2.gz QEIFDUIUHRVSOK-IUCAKERBSA-N 1 0 312.747 4.131 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841761262 1047455746 /nfs/dbraw/zinc/45/57/46/1047455746.db2.gz XSVANTXREVREIM-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO CCOc1ccc(N2CC[NH+](CCC(C)(C)C3CC3)CC2)cc1 ZINC001168331824 1047471550 /nfs/dbraw/zinc/47/15/50/1047471550.db2.gz SIQWERMDARMUNJ-UHFFFAOYSA-N 1 0 316.489 4.034 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2(c3ccc(C)cc3)CCC2)c1 ZINC000842773306 1047503205 /nfs/dbraw/zinc/50/32/05/1047503205.db2.gz DIQWBXVOVONHPF-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H]2c2cccnc2)c1O ZINC001143104048 1047530907 /nfs/dbraw/zinc/53/09/07/1047530907.db2.gz OOBBGAHOLQOWDF-SFHVURJKSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1cccc(C[N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c1O ZINC001143103632 1047531000 /nfs/dbraw/zinc/53/10/00/1047531000.db2.gz IAESZMJSGGIBPE-OKILXGFUSA-N 1 0 309.400 4.167 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@H]32)c1O ZINC001143104565 1047531913 /nfs/dbraw/zinc/53/19/13/1047531913.db2.gz VITIUMWNHVSIGI-DOTOQJQBSA-N 1 0 315.457 4.023 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CCC3(CC(F)C3)CC2)c1O ZINC001143104498 1047531935 /nfs/dbraw/zinc/53/19/35/1047531935.db2.gz UESHRTIGHIBZFT-UHFFFAOYSA-N 1 0 305.437 4.404 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H](c3ccncc3)C2)c1O ZINC001143110967 1047532202 /nfs/dbraw/zinc/53/22/02/1047532202.db2.gz UEJXMUGQNQHXOZ-MRXNPFEDSA-N 1 0 310.441 4.074 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCOc3ccccc3C2)c1O ZINC001143110874 1047532272 /nfs/dbraw/zinc/53/22/72/1047532272.db2.gz SDNVPVIGCFEKBS-UHFFFAOYSA-N 1 0 311.425 4.084 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cccc(C(C)(C)C)c1O ZINC001143112347 1047532696 /nfs/dbraw/zinc/53/26/96/1047532696.db2.gz RBAFUKQCTWMFSD-UHFFFAOYSA-N 1 0 313.441 4.417 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001143157968 1047535752 /nfs/dbraw/zinc/53/57/52/1047535752.db2.gz SAADKVGMZRTRBE-UHFFFAOYSA-N 1 0 324.468 4.236 20 10 DICDRO CC1(CC(F)F)C[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843424557 1047550278 /nfs/dbraw/zinc/55/02/78/1047550278.db2.gz CMHGRBRXUFIOOY-UHFFFAOYSA-N 1 0 308.416 4.154 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(O)c1 ZINC001204375366 1047569664 /nfs/dbraw/zinc/56/96/64/1047569664.db2.gz RCVZSIFTSCVNGI-SFHVURJKSA-N 1 0 315.388 4.185 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2nc3c(s2)CCCC3)c(O)c1C ZINC000926918948 1047602664 /nfs/dbraw/zinc/60/26/64/1047602664.db2.gz KIXUWGILTYSMMJ-CYBMUJFWSA-N 1 0 316.470 4.195 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2nc3c(s2)CCCC3)c(O)c1C ZINC000926918949 1047603949 /nfs/dbraw/zinc/60/39/49/1047603949.db2.gz KIXUWGILTYSMMJ-ZDUSSCGKSA-N 1 0 316.470 4.195 20 10 DICDRO CC[C@H]([NH2+]Cc1ncc(C)cc1C)c1cc(Cl)ccc1O ZINC000926960529 1047642227 /nfs/dbraw/zinc/64/22/27/1047642227.db2.gz OXZXVGXJJRVECK-HNNXBMFYSA-N 1 0 304.821 4.298 20 10 DICDRO Cc1cc(O)c(C[NH+]2CC(Cc3ccccc3C)C2)c(Cl)c1 ZINC001182989855 1047873386 /nfs/dbraw/zinc/87/33/86/1047873386.db2.gz LYDZTIDSIBJTAL-UHFFFAOYSA-N 1 0 315.844 4.337 20 10 DICDRO Cc1cc(CC[NH2+][C@H]2CC[C@H]2C2CC2)c(C)n1-c1ccccc1 ZINC001183180586 1047901345 /nfs/dbraw/zinc/90/13/45/1047901345.db2.gz PFPLKCVLNJSMJS-SFTDATJTSA-N 1 0 308.469 4.415 20 10 DICDRO Nc1ccc(Nc2ccc3cc4ccc(N)cc4[nH+]c3c2)cc1 ZINC001159700807 1047902930 /nfs/dbraw/zinc/90/29/30/1047902930.db2.gz TUABICXUQXSOBP-UHFFFAOYSA-N 1 0 300.365 4.296 20 10 DICDRO CC[C@](C)([NH2+]Cc1cc(C)cc(OC)c1O)c1ccc(F)cc1 ZINC001183267974 1047913008 /nfs/dbraw/zinc/91/30/08/1047913008.db2.gz CWSLSPUWXCNNAE-IBGZPJMESA-N 1 0 317.404 4.263 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2CCO[C@H]2c2ccccc2)c1 ZINC001183313041 1047917846 /nfs/dbraw/zinc/91/78/46/1047917846.db2.gz OHCLYAXAGOXAON-QUCCMNQESA-N 1 0 311.425 4.135 20 10 DICDRO COCC1=CC[N@H+](Cc2cc3oc4ccccc4c3cc2O)CC1 ZINC000774647668 1047943031 /nfs/dbraw/zinc/94/30/31/1047943031.db2.gz USCRLSSXLVGGHT-UHFFFAOYSA-N 1 0 323.392 4.070 20 10 DICDRO Cc1ccc(NC2=C[C@H]3CC[C@@H](C2)[NH2+]3)c(C(=O)c2ccccc2)c1 ZINC001159899113 1047943990 /nfs/dbraw/zinc/94/39/90/1047943990.db2.gz AHWCPNLOFFUXPL-SJORKVTESA-N 1 0 318.420 4.046 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000775834565 1047944443 /nfs/dbraw/zinc/94/44/43/1047944443.db2.gz VAGQPZDIHRYCKA-JXFKEZNVSA-N 1 0 312.457 4.181 20 10 DICDRO Oc1c(C[NH2+]Cc2cccc3ncccc23)ccc2ccccc21 ZINC001183697197 1047957285 /nfs/dbraw/zinc/95/72/85/1047957285.db2.gz QHULWSBMFNXYIL-UHFFFAOYSA-N 1 0 314.388 4.383 20 10 DICDRO CCSc1ccccc1CC[NH2+]Cc1ccc(C)cc1O ZINC001183728009 1047961257 /nfs/dbraw/zinc/96/12/57/1047961257.db2.gz OWOOLUXPNBJXBD-UHFFFAOYSA-N 1 0 301.455 4.145 20 10 DICDRO CCc1cccc(C[N@@H+]2Cc3ccccc3OC3(CCC3)C2)c1O ZINC001183788242 1047967320 /nfs/dbraw/zinc/96/73/20/1047967320.db2.gz JQKVQZKEUZYVAB-UHFFFAOYSA-N 1 0 323.436 4.272 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)cc1 ZINC001174749301 1047977295 /nfs/dbraw/zinc/97/72/95/1047977295.db2.gz JCDCPWVNHUDGNA-INIZCTEOSA-N 1 0 324.468 4.319 20 10 DICDRO CC1(C)C[NH2+]Cc2cc(Nc3ccc4c(c3)CCCN4)ccc21 ZINC001160286341 1048024595 /nfs/dbraw/zinc/02/45/95/1048024595.db2.gz IBJCWAHHUBDWHR-UHFFFAOYSA-N 1 0 307.441 4.169 20 10 DICDRO COc1cc(O)c(C[NH2+]CC(C)(C)C2=CCCCC2)cc1OC ZINC000775983945 1048074815 /nfs/dbraw/zinc/07/48/15/1048074815.db2.gz QLDKHZQRTXIYFM-UHFFFAOYSA-N 1 0 319.445 4.026 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c1O ZINC000776023920 1048101453 /nfs/dbraw/zinc/10/14/53/1048101453.db2.gz LQIYZYORVIKRTM-ZUZCIYMTSA-N 1 0 305.805 4.360 20 10 DICDRO CC[C@H](CSC)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000774831135 1048136940 /nfs/dbraw/zinc/13/69/40/1048136940.db2.gz VBCLZRACIPNCHE-QGZVFWFLSA-N 1 0 301.455 4.290 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)c1O ZINC001203613899 1048160534 /nfs/dbraw/zinc/16/05/34/1048160534.db2.gz IXDVLSFEZHHTQW-INIZCTEOSA-N 1 0 303.446 4.193 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C2(c3ccc(F)cc3)CC2)cc1 ZINC001200952548 1048168955 /nfs/dbraw/zinc/16/89/55/1048168955.db2.gz RXRBVLKHUAFLBL-ARJAWSKDSA-N 1 0 310.416 4.184 20 10 DICDRO CC[C@@H](O)CC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001201017252 1048171958 /nfs/dbraw/zinc/17/19/58/1048171958.db2.gz AEGTUMBXJSDTNM-MRXNPFEDSA-N 1 0 321.505 4.238 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H](OC)c2ccccc2Cl)cc1C ZINC001201017512 1048172216 /nfs/dbraw/zinc/17/22/16/1048172216.db2.gz IEVGRSHOEVKXLB-GOSISDBHSA-N 1 0 319.832 4.134 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2COc3ccc(C)cc32)cc1C ZINC001201035825 1048183418 /nfs/dbraw/zinc/18/34/18/1048183418.db2.gz KQQQEYFQFGCZGJ-GOSISDBHSA-N 1 0 311.425 4.316 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cc(Cl)cc(C)c1O)CC2 ZINC000776175419 1048269290 /nfs/dbraw/zinc/26/92/90/1048269290.db2.gz ZGKSFFDILMACIE-QGZVFWFLSA-N 1 0 301.817 4.440 20 10 DICDRO CCc1cccc2c(CC[NH2+]Cc3cccc(C)c3O)c[nH]c21 ZINC000776175688 1048269365 /nfs/dbraw/zinc/26/93/65/1048269365.db2.gz WKEOYMIEORAMQE-UHFFFAOYSA-N 1 0 308.425 4.077 20 10 DICDRO CC(C)=CCC[C@@H](C)C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001201495748 1048285543 /nfs/dbraw/zinc/28/55/43/1048285543.db2.gz FUHYHCZQGFNPMK-OAHLLOKOSA-N 1 0 303.446 4.229 20 10 DICDRO CN(c1ccc(N)cc1)C1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001201478043 1048295843 /nfs/dbraw/zinc/29/58/43/1048295843.db2.gz SEYLCRBEWFTGFS-UXHICEINSA-N 1 0 319.452 4.026 20 10 DICDRO C[C@@H]([NH2+]Cc1cscc1Br)c1ccccc1O ZINC001175418779 1048299031 /nfs/dbraw/zinc/29/90/31/1048299031.db2.gz OEOJBELSXGKOOB-SECBINFHSA-N 1 0 312.232 4.067 20 10 DICDRO C(=C/c1ccccc1)\C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001201692746 1048360730 /nfs/dbraw/zinc/36/07/30/1048360730.db2.gz FVAWFYKVRYDXDK-JXMROGBWSA-N 1 0 306.453 4.480 20 10 DICDRO Cc1cccc(C[NH2+]CCc2c[nH]c3ccc(Cl)cc23)c1O ZINC000776220901 1048392630 /nfs/dbraw/zinc/39/26/30/1048392630.db2.gz PRZXENJCMAUFQR-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCC[C@@H]2CCCCO2)cc1F ZINC001201911534 1048399319 /nfs/dbraw/zinc/39/93/19/1048399319.db2.gz NSVIEHQMXRDZHV-KRWDZBQOSA-N 1 0 322.468 4.111 20 10 DICDRO Cc1cccc(C[NH2+]C[C@H]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000776230786 1048412871 /nfs/dbraw/zinc/41/28/71/1048412871.db2.gz MHTTZOJVOVTULY-GXTWGEPZSA-N 1 0 301.352 4.159 20 10 DICDRO CCCN(Cc1cnc(CC(C)C)s1)c1ccc(C[NH3+])cc1 ZINC000775139579 1048429541 /nfs/dbraw/zinc/42/95/41/1048429541.db2.gz CZECFRNWFOCTPA-UHFFFAOYSA-N 1 0 317.502 4.217 20 10 DICDRO CCCN(Cc1nccc2ccccc21)c1ccc(C[NH3+])cc1 ZINC000775140356 1048430640 /nfs/dbraw/zinc/43/06/40/1048430640.db2.gz MFHGTJUGOSLMNF-UHFFFAOYSA-N 1 0 305.425 4.110 20 10 DICDRO COc1ccc(C[NH2+]CCc2c[nH]c3cc(C)ccc23)cc1C ZINC001202057525 1048432492 /nfs/dbraw/zinc/43/24/92/1048432492.db2.gz HWZQIQITZLNONH-UHFFFAOYSA-N 1 0 308.425 4.126 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000775139952 1048432885 /nfs/dbraw/zinc/43/28/85/1048432885.db2.gz GVNSWCHIMSPLLB-GOEBONIOSA-N 1 0 314.395 4.483 20 10 DICDRO c1ccc(C[C@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001202058938 1048433654 /nfs/dbraw/zinc/43/36/54/1048433654.db2.gz SMJIORWNAUCVMC-YLJYHZDGSA-N 1 0 307.437 4.123 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC001202066165 1048436997 /nfs/dbraw/zinc/43/69/97/1048436997.db2.gz NSCHVKWDAJLRAO-UZLBHIALSA-N 1 0 308.469 4.351 20 10 DICDRO Cc1c[nH+]c(N[C@H]2c3c(c(C)cc(C)c3O)CC2(C)C)c(N)c1 ZINC001163487574 1048477437 /nfs/dbraw/zinc/47/74/37/1048477437.db2.gz POIMETSUHGKTFO-KRWDZBQOSA-N 1 0 311.429 4.030 20 10 DICDRO COc1cc(C[NH2+]Cc2ccc(Cl)o2)c(O)c(C(C)(C)C)c1 ZINC000850009022 1048610930 /nfs/dbraw/zinc/61/09/30/1048610930.db2.gz BAHNGAKYDVBPAL-UHFFFAOYSA-N 1 0 323.820 4.235 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1F)c1ccc(N(C)C)cc1 ZINC000850252362 1048628628 /nfs/dbraw/zinc/62/86/28/1048628628.db2.gz QSZAGYNVAVWPKH-LLVKDONJSA-N 1 0 308.347 4.021 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](c2ccccc2F)C(C)C)c1 ZINC000850362929 1048640057 /nfs/dbraw/zinc/64/00/57/1048640057.db2.gz VRGFDEKHWOEUEL-IBGZPJMESA-N 1 0 317.404 4.417 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1cc2cnccc2o1 ZINC000850435161 1048656247 /nfs/dbraw/zinc/65/62/47/1048656247.db2.gz IZYWYWFOAHPTHX-CQSZACIVSA-N 1 0 309.413 4.053 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1ccc2ccccc2c1O ZINC000850481330 1048668955 /nfs/dbraw/zinc/66/89/55/1048668955.db2.gz GKIGGLZMKUENJM-LSDHHAIUSA-N 1 0 306.409 4.395 20 10 DICDRO CC[C@H]([NH2+]CCc1noc2ccccc12)c1ccc(N(C)C)cc1 ZINC000850483005 1048671580 /nfs/dbraw/zinc/67/15/80/1048671580.db2.gz MXVMOQYWDSYWOT-SFHVURJKSA-N 1 0 323.440 4.177 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)COc1c(F)cccc1F)c1ccccc1O ZINC000850522876 1048677120 /nfs/dbraw/zinc/67/71/20/1048677120.db2.gz QFBVEIVAQGUCDX-BLLLJJGKSA-N 1 0 321.367 4.179 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c1O ZINC000850527756 1048681562 /nfs/dbraw/zinc/68/15/62/1048681562.db2.gz YNJUPIWHUKTCHS-YMRXKLBXSA-N 1 0 317.816 4.183 20 10 DICDRO CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc(Cl)cc1[O-] ZINC001205471603 1048682274 /nfs/dbraw/zinc/68/22/74/1048682274.db2.gz ONJLUQQTXPAMOD-UHFFFAOYSA-N 1 0 324.896 4.180 20 10 DICDRO CC[C@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(C(F)(F)F)cc1O ZINC000850536620 1048685455 /nfs/dbraw/zinc/68/54/55/1048685455.db2.gz MBIROYQUQDXMNC-AAEUAGOBSA-N 1 0 323.305 4.497 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(COC)cs2)cc1 ZINC000850533155 1048685561 /nfs/dbraw/zinc/68/55/61/1048685561.db2.gz RIPKEQYJEZADCT-AWEZNQCLSA-N 1 0 318.486 4.201 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cc(Cl)ccc1O ZINC000850543541 1048686464 /nfs/dbraw/zinc/68/64/64/1048686464.db2.gz LTNLZIWUMVUJAZ-QFYYESIMSA-N 1 0 303.789 4.089 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cc(Cl)ccc1O ZINC000850543080 1048686764 /nfs/dbraw/zinc/68/67/64/1048686764.db2.gz XZPJESPLFRHQTD-IRXDYDNUSA-N 1 0 317.816 4.479 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc(N(C)C)cc1 ZINC000850544444 1048687183 /nfs/dbraw/zinc/68/71/83/1048687183.db2.gz XDPGEQAPIALTAB-PMACEKPBSA-N 1 0 310.441 4.186 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc(Cl)cc1O ZINC000850542173 1048687275 /nfs/dbraw/zinc/68/72/75/1048687275.db2.gz ISULCAOYSQJKBY-QFYYESIMSA-N 1 0 303.789 4.089 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl)C1CC1 ZINC000850540417 1048687387 /nfs/dbraw/zinc/68/73/87/1048687387.db2.gz MNYLMZIKCUXTBA-FZKQIMNGSA-N 1 0 322.880 4.016 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)c1O ZINC000850542105 1048687429 /nfs/dbraw/zinc/68/74/29/1048687429.db2.gz HTTHMIMWCXXDEL-APPDUMDISA-N 1 0 317.816 4.398 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl)C1CC1 ZINC000850540416 1048687600 /nfs/dbraw/zinc/68/76/00/1048687600.db2.gz MNYLMZIKCUXTBA-ACJLOTCBSA-N 1 0 322.880 4.016 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccc(O)cc32)c2c1c(F)ccc2O ZINC000850543484 1048687623 /nfs/dbraw/zinc/68/76/23/1048687623.db2.gz KJTWDOICMNULJS-VFVAKGGASA-N 1 0 313.372 4.062 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCC3(CC3(F)F)CC2)c1 ZINC000850551837 1048688427 /nfs/dbraw/zinc/68/84/27/1048688427.db2.gz VVDVGYVLJNROGF-FZWSLVFFSA-N 1 0 311.372 4.019 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@H](O)C(C)C)c1ccccc1O ZINC000850555201 1048689709 /nfs/dbraw/zinc/68/97/09/1048689709.db2.gz NGLADUQUIFZQJG-YSIASYRMSA-N 1 0 313.441 4.191 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@H](O)C(C)C)c(O)c1 ZINC000850557171 1048690426 /nfs/dbraw/zinc/69/04/26/1048690426.db2.gz UUVWAOSYFPVAAI-CWFSZBLJSA-N 1 0 313.441 4.109 20 10 DICDRO C[C@H]([NH2+]CC1SCCS1)c1ccc(N2CCCCC2)cc1 ZINC000850559818 1048691179 /nfs/dbraw/zinc/69/11/79/1048691179.db2.gz AAFOUENCPYXEMN-AWEZNQCLSA-N 1 0 322.543 4.134 20 10 DICDRO C[C@H]([NH2+]CCCc1ccco1)c1ccc(Br)cc1O ZINC000850569316 1048695747 /nfs/dbraw/zinc/69/57/47/1048695747.db2.gz ADIOOFOUUDDKKG-NSHDSACASA-N 1 0 324.218 4.031 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCc3c(C)cccc32)c1O ZINC000850573781 1048700056 /nfs/dbraw/zinc/70/00/56/1048700056.db2.gz RATZUYIIMXFNBX-KBXCAEBGSA-N 1 0 311.425 4.437 20 10 DICDRO C[C@H]([NH2+]Cc1cc2cc(F)ccc2o1)c1ccc(N(C)C)cc1 ZINC000775363895 1048704046 /nfs/dbraw/zinc/70/40/46/1048704046.db2.gz NGMNPWYPYPJWIQ-ZDUSSCGKSA-N 1 0 312.388 4.489 20 10 DICDRO COc1ccccc1/C=C\C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000775364574 1048706737 /nfs/dbraw/zinc/70/67/37/1048706737.db2.gz RWVLCOFVZZPONF-DZFYGRHCSA-N 1 0 310.441 4.125 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(F)c2Cl)c1 ZINC000775368574 1048706789 /nfs/dbraw/zinc/70/67/89/1048706789.db2.gz BGVKZIVCZRJKNB-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO C[C@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)c1ccc(N(C)C)cc1 ZINC000775366076 1048708695 /nfs/dbraw/zinc/70/86/95/1048708695.db2.gz ZQVKPXZFSURGOQ-HNNXBMFYSA-N 1 0 324.468 4.317 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCCc2ccc(Cl)cc2)c1 ZINC000775373743 1048717135 /nfs/dbraw/zinc/71/71/35/1048717135.db2.gz VSODKBAFXYJRNV-ZDUSSCGKSA-N 1 0 319.832 4.338 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(CC(C)C)cc2)c1 ZINC000775372729 1048719629 /nfs/dbraw/zinc/71/96/29/1048719629.db2.gz HHNMFIIBIUHJKT-OAHLLOKOSA-N 1 0 313.441 4.450 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccsc2)ccc1N(C)C ZINC001190348635 1048722331 /nfs/dbraw/zinc/72/23/31/1048722331.db2.gz MSDBYPXLFZHSNT-GOSISDBHSA-N 1 0 300.471 4.460 20 10 DICDRO CN(Cc1csc(-c2cccs2)n1)Cc1ccccc1O ZINC000109773279 1048741985 /nfs/dbraw/zinc/74/19/85/1048741985.db2.gz MFMWZUNACDRCLM-UHFFFAOYSA-N 1 0 316.451 4.209 20 10 DICDRO CC(C)=CCC[C@@H](C)[NH2+]Cc1c(O)cccc1Br ZINC001202483831 1048798282 /nfs/dbraw/zinc/79/82/82/1048798282.db2.gz TZGNJCROAFKMPF-GFCCVEGCSA-N 1 0 312.251 4.379 20 10 DICDRO C[C@H](C[NH2+]Cc1cc(Br)ccc1O)c1ccccc1 ZINC000110246775 1048807674 /nfs/dbraw/zinc/80/76/74/1048807674.db2.gz IRBSGMNCJCLANY-GFCCVEGCSA-N 1 0 320.230 4.048 20 10 DICDRO CCCC[C@@H](CC)C[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC001177082057 1048820507 /nfs/dbraw/zinc/82/05/07/1048820507.db2.gz TVOMINGJYITKOB-QGZVFWFLSA-N 1 0 318.505 4.470 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCOCc2ccccc2)c(Cl)c1 ZINC001177143431 1048838814 /nfs/dbraw/zinc/83/88/14/1048838814.db2.gz UTAXTKFBLFABKC-UHFFFAOYSA-N 1 0 319.832 4.051 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC2(c3ccccc3)CCC2)cc1F ZINC001177203486 1048844592 /nfs/dbraw/zinc/84/45/92/1048844592.db2.gz DMPRODBYGVNVSD-UHFFFAOYSA-N 1 0 312.432 4.103 20 10 DICDRO CO[C@@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)C1CCCCC1 ZINC001203254605 1048853031 /nfs/dbraw/zinc/85/30/31/1048853031.db2.gz HXJGOXDAVKLRFH-KRWDZBQOSA-N 1 0 311.853 4.039 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc2c(c1)CCCO2 ZINC000853239728 1048889028 /nfs/dbraw/zinc/88/90/28/1048889028.db2.gz CTFQSXUVSYKIII-GUYCJALGSA-N 1 0 309.409 4.055 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cnccc2C(F)(F)F)c(O)c1 ZINC000853240880 1048891001 /nfs/dbraw/zinc/89/10/01/1048891001.db2.gz NGQFVTJVJHLFFE-GFCCVEGCSA-N 1 0 324.346 4.274 20 10 DICDRO C[C@@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000853242350 1048892176 /nfs/dbraw/zinc/89/21/76/1048892176.db2.gz PLKLBXLKORHQQJ-GFCCVEGCSA-N 1 0 323.362 4.017 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC(C)(C)CC(F)(F)F)c1O ZINC000853240576 1048892238 /nfs/dbraw/zinc/89/22/38/1048892238.db2.gz KSNHJAFQACIVOV-SNVBAGLBSA-N 1 0 305.340 4.030 20 10 DICDRO C[C@H](c1ccc(OC(F)F)cc1)[N@H+](C)Cc1ccccc1O ZINC000111235781 1048899026 /nfs/dbraw/zinc/89/90/26/1048899026.db2.gz RHEMCNXJKYGUOR-GFCCVEGCSA-N 1 0 307.340 4.187 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2CCC3(CCCC3)CC2)cc1F ZINC001177554437 1048906406 /nfs/dbraw/zinc/90/64/06/1048906406.db2.gz YEZGHHZTOQQHTR-UHFFFAOYSA-N 1 0 304.453 4.484 20 10 DICDRO Cc1cc(C)c(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)c(C)c1 ZINC001177528786 1048909810 /nfs/dbraw/zinc/90/98/10/1048909810.db2.gz HMOGBWKAUKTLCJ-UHFFFAOYSA-N 1 0 318.411 4.246 20 10 DICDRO C[C@@H](CCc1ccccc1)C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001177548237 1048914216 /nfs/dbraw/zinc/91/42/16/1048914216.db2.gz CNEKUECUBSAYLF-INIZCTEOSA-N 1 0 314.448 4.250 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2O)cc(C)c1OC(F)F ZINC001203536172 1048924271 /nfs/dbraw/zinc/92/42/71/1048924271.db2.gz HJPGVICLELJDRH-CYBMUJFWSA-N 1 0 321.367 4.461 20 10 DICDRO COc1ccccc1C(C)(C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177673892 1048928373 /nfs/dbraw/zinc/92/83/73/1048928373.db2.gz BIGCZVGPKHWQTQ-UHFFFAOYSA-N 1 0 311.425 4.045 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(Cc2ccc(F)cc2F)CC1 ZINC001203558669 1048929166 /nfs/dbraw/zinc/92/91/66/1048929166.db2.gz UHJNAEFUWWYDOI-UHFFFAOYSA-N 1 0 317.379 4.125 20 10 DICDRO CC[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1ccccc1O ZINC001203560858 1048930419 /nfs/dbraw/zinc/93/04/19/1048930419.db2.gz IEWNMALGIHYJGY-UHFFFAOYSA-N 1 0 309.331 4.433 20 10 DICDRO CCCCN1CCCC[C@@H]1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001177741704 1048938444 /nfs/dbraw/zinc/93/84/44/1048938444.db2.gz BXISXIRJHZYZCY-OAHLLOKOSA-N 1 0 324.896 4.098 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(C)cc2)c1O ZINC001203609257 1048939157 /nfs/dbraw/zinc/93/91/57/1048939157.db2.gz NURWLOJEUYDULN-SFHVURJKSA-N 1 0 311.425 4.436 20 10 DICDRO CCOc1cccc(C[N@H+]2CC=C(c3ccccc3)CC2)c1O ZINC001203614082 1048939443 /nfs/dbraw/zinc/93/94/43/1048939443.db2.gz NSQKIAZGHVBXKG-UHFFFAOYSA-N 1 0 309.409 4.080 20 10 DICDRO COc1cc(C[NH2+]CC2(C)CCCC2)c(O)c(C(C)(C)C)c1 ZINC001177791036 1048945274 /nfs/dbraw/zinc/94/52/74/1048945274.db2.gz PLLLMHFWLBQERB-UHFFFAOYSA-N 1 0 305.462 4.368 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001203657814 1048952108 /nfs/dbraw/zinc/95/21/08/1048952108.db2.gz NSKVYMRLMDFDCF-HNNXBMFYSA-N 1 0 301.817 4.110 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001203664218 1048953438 /nfs/dbraw/zinc/95/34/38/1048953438.db2.gz RFQGFAFUMNIISM-CYBMUJFWSA-N 1 0 305.780 4.174 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)cc1 ZINC000854226119 1048954651 /nfs/dbraw/zinc/95/46/51/1048954651.db2.gz NZROFLNHVKGOSA-XOBRGWDASA-N 1 0 309.457 4.063 20 10 DICDRO COc1cccc(CCC[N@H+](C)Cc2cc(Cl)ccc2O)c1 ZINC001203663707 1048954925 /nfs/dbraw/zinc/95/49/25/1048954925.db2.gz DUDRWOALMLSSKM-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001203678248 1048959252 /nfs/dbraw/zinc/95/92/52/1048959252.db2.gz IIKASPMGDNXSPW-QGZVFWFLSA-N 1 0 319.351 4.016 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H](c1cccnc1)C(C)C ZINC001177943429 1048966595 /nfs/dbraw/zinc/96/65/95/1048966595.db2.gz QXZDERAIIOVKLE-LJQANCHMSA-N 1 0 321.468 4.411 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)cc1)c1cc(Cl)ccc1O ZINC000775482795 1049002183 /nfs/dbraw/zinc/00/21/83/1049002183.db2.gz BFGDLCXUDWIDQC-INIZCTEOSA-N 1 0 305.805 4.295 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(OC(C)C)cc1)c1ccccc1O ZINC000775486215 1049003977 /nfs/dbraw/zinc/00/39/77/1049003977.db2.gz CLFFGMDCOUQRBM-LJQANCHMSA-N 1 0 313.441 4.463 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H]2CC(C)(C)OC2(C)C)cc1C ZINC001203819546 1049010217 /nfs/dbraw/zinc/01/02/17/1049010217.db2.gz GPSIDRVRLAODFZ-KRWDZBQOSA-N 1 0 319.489 4.467 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)c(F)c1)c1cc(Cl)ccc1O ZINC000775488925 1049010987 /nfs/dbraw/zinc/01/09/87/1049010987.db2.gz XHCGTUAFDYMNCX-HNNXBMFYSA-N 1 0 323.795 4.434 20 10 DICDRO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2ccc(O)c(O)c2)cc1C ZINC001203879982 1049021303 /nfs/dbraw/zinc/02/13/03/1049021303.db2.gz HUWNETMFXUGDJW-SFHVURJKSA-N 1 0 311.425 4.442 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CCc1ccc(OC)cc1)c1ccccc1O ZINC000775497068 1049029714 /nfs/dbraw/zinc/02/97/14/1049029714.db2.gz MEFRCBBQAKUXLW-DNVCBOLYSA-N 1 0 313.441 4.463 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@@H](OC(C)C)C1(C)C ZINC001178430139 1049029814 /nfs/dbraw/zinc/02/98/14/1049029814.db2.gz AAMGDNSRIFNXFY-RTBURBONSA-N 1 0 314.473 4.168 20 10 DICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001192005859 1049030014 /nfs/dbraw/zinc/03/00/14/1049030014.db2.gz NBGPZUYQERTBII-SOLBZPMBSA-N 1 0 311.425 4.424 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H](c2cccs2)C2CC2)cc1F ZINC000113316739 1049032255 /nfs/dbraw/zinc/03/22/55/1049032255.db2.gz KOIJUAPQNKHBPC-KRWDZBQOSA-N 1 0 304.434 4.194 20 10 DICDRO CC[C@H]([NH2+]Cc1ccoc1C)c1cc(Br)ccc1O ZINC000775496729 1049032356 /nfs/dbraw/zinc/03/23/56/1049032356.db2.gz JWNBYQDUACOSON-AWEZNQCLSA-N 1 0 324.218 4.297 20 10 DICDRO CCc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OC)c(C)c1)CCO2 ZINC001178445419 1049032949 /nfs/dbraw/zinc/03/29/49/1049032949.db2.gz YQHILIKVCPINRQ-GOSISDBHSA-N 1 0 311.425 4.179 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cc1 ZINC001203937341 1049034773 /nfs/dbraw/zinc/03/47/73/1049034773.db2.gz VQZDZHGIWAXSOG-LJQANCHMSA-N 1 0 316.395 4.368 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2ccccn2)C2CCCCC2)cc1 ZINC001203936395 1049035362 /nfs/dbraw/zinc/03/53/62/1049035362.db2.gz DWQWMQAXMRZZLE-UHFFFAOYSA-N 1 0 323.484 4.483 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(C)nn(CC)c1C)c1cc(Cl)ccc1O ZINC000775498846 1049037287 /nfs/dbraw/zinc/03/72/87/1049037287.db2.gz OKCZNXUTDAOYJL-MRXNPFEDSA-N 1 0 321.852 4.120 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)c(O)c1)c1cc(Cl)ccc1O ZINC000775500869 1049040936 /nfs/dbraw/zinc/04/09/36/1049040936.db2.gz MBXQUOZPUWYVFX-AWEZNQCLSA-N 1 0 321.804 4.001 20 10 DICDRO CC[C@@H]([NH2+]CC1(c2ccccc2OC)CC1)c1ccccc1O ZINC000775500548 1049042104 /nfs/dbraw/zinc/04/21/04/1049042104.db2.gz RCJXIWOPRFFNKZ-QGZVFWFLSA-N 1 0 311.425 4.173 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccccc1O)c1cc(Cl)ccc1O ZINC000775500507 1049042856 /nfs/dbraw/zinc/04/28/56/1049042856.db2.gz KSFOGPYRWSVVNK-OAHLLOKOSA-N 1 0 305.805 4.035 20 10 DICDRO CC[C@H]([NH2+]Cc1nccn1CC(C)C)c1cc(Cl)ccc1O ZINC000775510138 1049044056 /nfs/dbraw/zinc/04/40/56/1049044056.db2.gz VOUMNDPKMYLOAN-HNNXBMFYSA-N 1 0 321.852 4.139 20 10 DICDRO CC[C@H]([NH2+]CC1(CC)CCOCC1)c1cc(Cl)ccc1O ZINC000775513609 1049048980 /nfs/dbraw/zinc/04/89/80/1049048980.db2.gz QLMVCXUEPSAYDX-HNNXBMFYSA-N 1 0 311.853 4.293 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](CCO)CC(C)C)c1cc(Cl)ccc1O ZINC000775513593 1049049212 /nfs/dbraw/zinc/04/92/12/1049049212.db2.gz PZHLESWVJKRWQF-CZUORRHYSA-N 1 0 313.869 4.131 20 10 DICDRO CC[C@H]([NH2+][C@H](C)C[C@H](O)c1ccco1)c1cc(Cl)ccc1O ZINC000775513449 1049050095 /nfs/dbraw/zinc/05/00/95/1049050095.db2.gz JKVCRTCNOGJLII-WPGHFRTFSA-N 1 0 323.820 4.192 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](CCO)CC(C)C)c1cc(Cl)ccc1O ZINC000775513591 1049050322 /nfs/dbraw/zinc/05/03/22/1049050322.db2.gz PZHLESWVJKRWQF-BBRMVZONSA-N 1 0 313.869 4.131 20 10 DICDRO CC[C@H]([NH2+][C@H](C)Cc1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775509401 1049052308 /nfs/dbraw/zinc/05/23/08/1049052308.db2.gz LREXEUVQOQVAPX-HWPZZCPQSA-N 1 0 322.836 4.322 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCO[C@H]2CC(C)C)cc1 ZINC001178542840 1049055572 /nfs/dbraw/zinc/05/55/72/1049055572.db2.gz STRJLHOLTITCEQ-UXHICEINSA-N 1 0 318.505 4.216 20 10 DICDRO Oc1cc2c(cc1O)C[N@H+](Cc1ccc3ccccc3c1)CCC2 ZINC001204000114 1049058469 /nfs/dbraw/zinc/05/84/69/1049058469.db2.gz VBLLPPBUDCMQED-UHFFFAOYSA-N 1 0 319.404 4.199 20 10 DICDRO CCOC[C@@H]1CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000113923657 1049077169 /nfs/dbraw/zinc/07/71/69/1049077169.db2.gz BQYLTPFPNMCISV-MRXNPFEDSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccccc1O ZINC000775522159 1049078537 /nfs/dbraw/zinc/07/85/37/1049078537.db2.gz KQYDYOORMNAQJS-LSDHHAIUSA-N 1 0 303.789 4.220 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000775521804 1049080254 /nfs/dbraw/zinc/08/02/54/1049080254.db2.gz BCGNBGSHQCYHNW-HIFRSBDPSA-N 1 0 309.837 4.188 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCO[C@H](C(C)C)C1 ZINC001178758879 1049082273 /nfs/dbraw/zinc/08/22/73/1049082273.db2.gz LZLZECLRAWEGRI-JXFKEZNVSA-N 1 0 314.473 4.028 20 10 DICDRO CCCCCn1cc(C[NH2+][C@@H](CC)c2ccccc2O)c(C)n1 ZINC000775523936 1049085837 /nfs/dbraw/zinc/08/58/37/1049085837.db2.gz BJAYFERFSQQBAN-SFHVURJKSA-N 1 0 315.461 4.328 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H]1Oc2ccccc2[C@H]1C)c1ccccc1O ZINC000775526068 1049092484 /nfs/dbraw/zinc/09/24/84/1049092484.db2.gz IQADRQMSXCXNEN-ILHOTROSSA-N 1 0 311.425 4.386 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1cc(Cl)ccc1O ZINC000775527037 1049092875 /nfs/dbraw/zinc/09/28/75/1049092875.db2.gz VTLHXHMYZWVUQS-UOJCXKCYSA-N 1 0 321.848 4.044 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C2(c3ccc(F)cc3)CCC2)cc1 ZINC000773771871 1049094057 /nfs/dbraw/zinc/09/40/57/1049094057.db2.gz JBXBBHBYHBOYKD-UHFFFAOYSA-N 1 0 312.432 4.451 20 10 DICDRO C[C@@H]([NH2+]CCOC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000776888989 1049094720 /nfs/dbraw/zinc/09/47/20/1049094720.db2.gz CXVMCKYUJQZSGF-MRXNPFEDSA-N 1 0 304.478 4.143 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C/C=C\c2ccc(F)cc2F)cc1 ZINC001204145950 1049095945 /nfs/dbraw/zinc/09/59/45/1049095945.db2.gz PRFMDISBDXAPED-PLNGDYQASA-N 1 0 316.395 4.176 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1cc(Cl)ccc1O ZINC000775525703 1049101062 /nfs/dbraw/zinc/10/10/62/1049101062.db2.gz MJKCQMCYXOJGHV-GWCFXTLKSA-N 1 0 322.840 4.089 20 10 DICDRO Fc1cc(C2CC2)ccc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001178851111 1049101107 /nfs/dbraw/zinc/10/11/07/1049101107.db2.gz GLYNBUVKJCJFGL-UHFFFAOYSA-N 1 0 311.400 4.318 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(CF)CC2)c2ccccc21 ZINC001204241360 1049117827 /nfs/dbraw/zinc/11/78/27/1049117827.db2.gz FWDUDZWERKGXSB-UHFFFAOYSA-N 1 0 300.421 4.087 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1C[C@]1(F)c1ccccc1 ZINC001178998379 1049120517 /nfs/dbraw/zinc/12/05/17/1049120517.db2.gz LPXCBEJDFKLPJR-PMACEKPBSA-N 1 0 308.400 4.214 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000857080060 1049125667 /nfs/dbraw/zinc/12/56/67/1049125667.db2.gz CKXXGFDIPPFSOS-MEBBXXQBSA-N 1 0 319.351 4.017 20 10 DICDRO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)c(O)c1 ZINC001204279238 1049125914 /nfs/dbraw/zinc/12/59/14/1049125914.db2.gz TVHYJNMEOUONHI-LBPRGKRZSA-N 1 0 309.818 4.150 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CC2(Cl)Cl)c2c1c(F)ccc2O ZINC000857082347 1049127237 /nfs/dbraw/zinc/12/72/37/1049127237.db2.gz MUFDWPFUIYNKLZ-WCABBAIRSA-N 1 0 318.219 4.253 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(OC)ccc1F)c1ccc(C)cc1O ZINC000857082752 1049127718 /nfs/dbraw/zinc/12/77/18/1049127718.db2.gz XJHBMZUANFYQOO-KRWDZBQOSA-N 1 0 303.377 4.089 20 10 DICDRO CCCOc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC001204310522 1049138033 /nfs/dbraw/zinc/13/80/33/1049138033.db2.gz UUWRVJKHSZZJAR-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)Cc2ccccc21 ZINC001204326285 1049142441 /nfs/dbraw/zinc/14/24/41/1049142441.db2.gz WSZZZDHQEOABGR-KRWDZBQOSA-N 1 0 306.453 4.406 20 10 DICDRO Cc1ccc2c(c1)C[N@@H+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001204325781 1049142658 /nfs/dbraw/zinc/14/26/58/1049142658.db2.gz VIKBXUDNEUGLIF-UHFFFAOYSA-N 1 0 306.453 4.154 20 10 DICDRO C[C@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)CCC1(F)F ZINC001204323117 1049143118 /nfs/dbraw/zinc/14/31/18/1049143118.db2.gz DRFVFPZNNKUBHO-HNNXBMFYSA-N 1 0 308.416 4.154 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CC[C@@H]2CCCOC2)cc1 ZINC001179232485 1049145397 /nfs/dbraw/zinc/14/53/97/1049145397.db2.gz BGHUMIKPTCWAMI-IBGZPJMESA-N 1 0 318.505 4.219 20 10 DICDRO Cc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001179238526 1049145511 /nfs/dbraw/zinc/14/55/11/1049145511.db2.gz QHNKVNKNHVXVSP-IBGZPJMESA-N 1 0 312.432 4.367 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)C1CCC(F)CC1 ZINC001179259642 1049149202 /nfs/dbraw/zinc/14/92/02/1049149202.db2.gz WOITUMLCGIJPGN-FHERZECASA-N 1 0 302.437 4.493 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)CC)cc1)c1ccccc1OC ZINC000773812497 1049150568 /nfs/dbraw/zinc/15/05/68/1049150568.db2.gz QZEUXWHVCRIYEH-LJQANCHMSA-N 1 0 312.457 4.392 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2cccc(F)c2F)cc1 ZINC000773809952 1049151252 /nfs/dbraw/zinc/15/12/52/1049151252.db2.gz FGVBUMGKIIQMBS-ZDUSSCGKSA-N 1 0 304.384 4.272 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000775555944 1049153812 /nfs/dbraw/zinc/15/38/12/1049153812.db2.gz SZENBVMYAZYDOH-QRTARXTBSA-N 1 0 309.837 4.044 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)s1)Cc1ccc(N(C)C)cc1 ZINC001204444731 1049164589 /nfs/dbraw/zinc/16/45/89/1049164589.db2.gz PPQALVPIBWMDKQ-UHFFFAOYSA-N 1 0 308.878 4.490 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC[C@@H]2CCCC2(F)F)cc1 ZINC001179443909 1049165379 /nfs/dbraw/zinc/16/53/79/1049165379.db2.gz WRGVUTCUOMNKKK-AWFCHZOYSA-N 1 0 308.416 4.181 20 10 DICDRO C[C@@H]([NH2+]Cc1cc2cc(Cl)cnc2o1)c1ccccc1O ZINC001179489056 1049170698 /nfs/dbraw/zinc/17/06/98/1049170698.db2.gz FEVVWORWGZMJSN-SNVBAGLBSA-N 1 0 302.761 4.038 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@H]2CCC3(CCC3)O2)cc1 ZINC001179654768 1049187183 /nfs/dbraw/zinc/18/71/83/1049187183.db2.gz OOKYFGNBYBKZBF-LJQANCHMSA-N 1 0 316.489 4.114 20 10 DICDRO CC(C)c1ccc(O)c(CN2CCOC[C@H]2c2ccccc2)c1 ZINC001204549963 1049187283 /nfs/dbraw/zinc/18/72/83/1049187283.db2.gz DIGDXKMGODFHPZ-IBGZPJMESA-N 1 0 311.425 4.089 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCCCC1 ZINC000775589045 1049193706 /nfs/dbraw/zinc/19/37/06/1049193706.db2.gz MGNGUUBMXGTHJS-KRWDZBQOSA-N 1 0 318.505 4.390 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCCCC1 ZINC000775589455 1049201694 /nfs/dbraw/zinc/20/16/94/1049201694.db2.gz QRUAHGMEYZYPLY-INIZCTEOSA-N 1 0 305.462 4.338 20 10 DICDRO CN(C)c1cc(F)c(C[NH+]2CCC(C3CCCC3)CC2)cc1F ZINC001179849280 1049216234 /nfs/dbraw/zinc/21/62/34/1049216234.db2.gz BNMNOTYUYITSHQ-UHFFFAOYSA-N 1 0 322.443 4.433 20 10 DICDRO CC[C@@H](Cc1ccc(C)cc1)[N@H+](C)Cc1cc(OC)ccc1O ZINC001179881347 1049228153 /nfs/dbraw/zinc/22/81/53/1049228153.db2.gz BMBUCMMATKJPPH-SFHVURJKSA-N 1 0 313.441 4.162 20 10 DICDRO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ccc2O)C1 ZINC001179936380 1049229686 /nfs/dbraw/zinc/22/96/86/1049229686.db2.gz GMTMWZHULQLNCP-SJCJKPOMSA-N 1 0 303.352 4.254 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2CC[C@H](OCCC(C)C)CC2)c1 ZINC000858258402 1049232897 /nfs/dbraw/zinc/23/28/97/1049232897.db2.gz HXYSNCPIAWLJJI-IYARVYRRSA-N 1 0 305.462 4.164 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2csc(C(F)(F)F)c2)cc1C ZINC000858305315 1049237800 /nfs/dbraw/zinc/23/78/00/1049237800.db2.gz WCSYNBRQFVWAGY-UHFFFAOYSA-N 1 0 315.360 4.379 20 10 DICDRO COc1cc(C)cc(C[N@H+](CC2CCCCC2)C2CC2)c1O ZINC001204713360 1049237987 /nfs/dbraw/zinc/23/79/87/1049237987.db2.gz CMFFWVZXEKJDLD-UHFFFAOYSA-N 1 0 303.446 4.254 20 10 DICDRO C[C@@H]([NH2+]CCCOC1CCCCC1)c1ccc(N(C)C)cc1 ZINC000195616016 1049241333 /nfs/dbraw/zinc/24/13/33/1049241333.db2.gz KYCNHGCRHWIQGZ-MRXNPFEDSA-N 1 0 304.478 4.143 20 10 DICDRO Cc1ccc(C[N@H+]2CCN(c3ccc(C)c(C)c3)C[C@H]2C)c(O)c1 ZINC001204731003 1049244906 /nfs/dbraw/zinc/24/49/06/1049244906.db2.gz ZVQVYZJZQYOOIF-GOSISDBHSA-N 1 0 324.468 4.028 20 10 DICDRO Cc1cc(Br)c([O-])c(C[N@@H+]([C@H](C)C2CC2)C2CC2)c1 ZINC001204744755 1049248551 /nfs/dbraw/zinc/24/85/51/1049248551.db2.gz XJSMKSMZDSUDPH-LLVKDONJSA-N 1 0 324.262 4.226 20 10 DICDRO CN(C)c1cc(F)c(C[N@H+](C)C2CCC(C)(C)CC2)cc1F ZINC001204776816 1049260729 /nfs/dbraw/zinc/26/07/29/1049260729.db2.gz REKTTWNBKAMIAB-UHFFFAOYSA-N 1 0 310.432 4.431 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2Cc3ccccc3C[C@H]2C)c1O ZINC001180094192 1049265926 /nfs/dbraw/zinc/26/59/26/1049265926.db2.gz ZONBZTRAMAJODR-GFCCVEGCSA-N 1 0 317.816 4.001 20 10 DICDRO CC(C)[N@H+](CCc1ccc(F)cc1)Cc1ccc(N(C)C)cc1 ZINC001180071577 1049271652 /nfs/dbraw/zinc/27/16/52/1049271652.db2.gz CBFWQUGBEHHIQY-UHFFFAOYSA-N 1 0 314.448 4.345 20 10 DICDRO CCn1ccnc1[C@H](C)NCc1cc(C)n(-c2ccccc2)c1C ZINC000858543069 1049273112 /nfs/dbraw/zinc/27/31/12/1049273112.db2.gz PTLXRGBARVZHGX-INIZCTEOSA-N 1 0 322.456 4.161 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccccc2O)cc1C(C)(C)C ZINC001204826925 1049277803 /nfs/dbraw/zinc/27/78/03/1049277803.db2.gz OEHVHKFAIZOADX-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001180141753 1049282323 /nfs/dbraw/zinc/28/23/23/1049282323.db2.gz ILBFVSRSHRAQBQ-QZTJIDSGSA-N 1 0 306.519 4.167 20 10 DICDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cccc(F)c2[O-])C12CCCCC2 ZINC001180098284 1049286896 /nfs/dbraw/zinc/28/68/96/1049286896.db2.gz KTSOAAWYYLPWDU-IAGOWNOFSA-N 1 0 321.436 4.091 20 10 DICDRO COc1ccccc1CC[N@H+](C)Cc1cc(C(C)C)ccc1O ZINC001180189429 1049304928 /nfs/dbraw/zinc/30/49/28/1049304928.db2.gz PSOPCXREFLYCBK-UHFFFAOYSA-N 1 0 313.441 4.199 20 10 DICDRO Cc1ccc(C[N@@H+](C)C/C=C\c2ccc(N(C)C)cc2)s1 ZINC001180212681 1049310252 /nfs/dbraw/zinc/31/02/52/1049310252.db2.gz FNTZCXOPICJYPP-WAYWQWQTSA-N 1 0 300.471 4.268 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(O)cc2)c(O)c1 ZINC001180209293 1049310565 /nfs/dbraw/zinc/31/05/65/1049310565.db2.gz ZWDKKJNCDFEPHL-UHFFFAOYSA-N 1 0 323.392 4.202 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC001180208853 1049311047 /nfs/dbraw/zinc/31/10/47/1049311047.db2.gz RICCGIQNQNGCPA-OAQYLSRUSA-N 1 0 324.468 4.025 20 10 DICDRO CCCO[C@@H]1CCC[N@H+](Cc2cc(C(C)C)ccc2O)CC1 ZINC001180288135 1049335646 /nfs/dbraw/zinc/33/56/46/1049335646.db2.gz BXQLAFNRBYJVBJ-GOSISDBHSA-N 1 0 305.462 4.297 20 10 DICDRO CCc1cccc(C[N@H+](C)CCc2ccc(Cl)cc2)c1O ZINC001205008091 1049338903 /nfs/dbraw/zinc/33/89/03/1049338903.db2.gz RNSYMDSANJRAIK-UHFFFAOYSA-N 1 0 303.833 4.283 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H](CC(C)C)OC)cc1 ZINC001180359381 1049342273 /nfs/dbraw/zinc/34/22/73/1049342273.db2.gz KAHUBWSZDLLQAB-LJQANCHMSA-N 1 0 306.494 4.026 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@H+](C)Cc2ccc(F)c(F)c2)cc1 ZINC001180394073 1049352762 /nfs/dbraw/zinc/35/27/62/1049352762.db2.gz RQGYSUDSMLIRMC-SNAWJCMRSA-N 1 0 316.395 4.176 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001180531369 1049373741 /nfs/dbraw/zinc/37/37/41/1049373741.db2.gz HQVQHEQCQFBHJL-UHFFFAOYSA-N 1 0 302.849 4.346 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2c2cccn2C)cc1Cl ZINC001180505258 1049376948 /nfs/dbraw/zinc/37/69/48/1049376948.db2.gz LVHZLOMBQMFRJJ-MRXNPFEDSA-N 1 0 304.821 4.030 20 10 DICDRO CCc1cccc(C[N@H+](C)CCOc2cccc(Cl)c2)c1O ZINC001205107931 1049380671 /nfs/dbraw/zinc/38/06/71/1049380671.db2.gz LZRMTDCEWCXQBC-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2cccn2C2CC2)C2CC2)cc1 ZINC001180558106 1049380659 /nfs/dbraw/zinc/38/06/59/1049380659.db2.gz JRTNQQDPAUBJHC-UHFFFAOYSA-N 1 0 309.457 4.054 20 10 DICDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2cc(C(C)C)ccc2O)C1(C)C ZINC001205268915 1049421488 /nfs/dbraw/zinc/42/14/88/1049421488.db2.gz BUOALRQAPZUKLR-MSOLQXFVSA-N 1 0 305.462 4.197 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@H]2CCOc3ccc(F)cc32)c1 ZINC001180896637 1049421668 /nfs/dbraw/zinc/42/16/68/1049421668.db2.gz IXKXJDQNIXUXGH-KRWDZBQOSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCc2cccc3[nH]ccc32)cc1Cl ZINC001181196555 1049452298 /nfs/dbraw/zinc/45/22/98/1049452298.db2.gz QZSUXXNGNAZCCX-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c(Cl)c1 ZINC001181350519 1049465836 /nfs/dbraw/zinc/46/58/36/1049465836.db2.gz SKXQOQGVZNWPSZ-GXSJLCMTSA-N 1 0 307.743 4.127 20 10 DICDRO CCCN(Cc1ccc2scnc2c1)c1ccc(C[NH3+])cc1 ZINC001181456226 1049479471 /nfs/dbraw/zinc/47/94/71/1049479471.db2.gz LJNQUJCZHHCCHL-UHFFFAOYSA-N 1 0 311.454 4.172 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)CC1(OC)CCCCC1 ZINC001205513038 1049489253 /nfs/dbraw/zinc/48/92/53/1049489253.db2.gz AXXURKLKAMMLLT-UHFFFAOYSA-N 1 0 305.462 4.344 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)C1CC(F)(F)C1 ZINC000862394185 1049492981 /nfs/dbraw/zinc/49/29/81/1049492981.db2.gz DBXOQKROCLZODJ-ZIAGYGMSSA-N 1 0 310.432 4.015 20 10 DICDRO Cc1ccc(F)c(C[N@H+](C)Cc2cc(Cl)c(C)cc2O)c1 ZINC001205554730 1049496479 /nfs/dbraw/zinc/49/64/79/1049496479.db2.gz KLQKCVQAGKFEAP-UHFFFAOYSA-N 1 0 307.796 4.434 20 10 DICDRO CCc1cccc(C[NH2+]Cc2csc(C(F)(F)F)c2)c1O ZINC000862536282 1049499906 /nfs/dbraw/zinc/49/99/06/1049499906.db2.gz 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315.413 4.329 20 10 DICDRO COc1ccc(N2CCC([NH2+]CC(C(C)C)C(C)C)CC2)cc1 ZINC000774374236 1049654156 /nfs/dbraw/zinc/65/41/56/1049654156.db2.gz KVHFOFSGDCYHPW-UHFFFAOYSA-N 1 0 318.505 4.182 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@@H](c3ccc(F)cc3)C3CC3)ccc21 ZINC000774407601 1049660147 /nfs/dbraw/zinc/66/01/47/1049660147.db2.gz XFERIRPECJNPMJ-OAQYLSRUSA-N 1 0 324.443 4.449 20 10 DICDRO c1csc(SCCC[NH2+][C@@H](c2ccccc2)C2CC2)n1 ZINC000774420036 1049660518 /nfs/dbraw/zinc/66/05/18/1049660518.db2.gz AYOMKLBTYMFNNV-HNNXBMFYSA-N 1 0 304.484 4.366 20 10 DICDRO CCO[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccccc1 ZINC000774494896 1049677344 /nfs/dbraw/zinc/67/73/44/1049677344.db2.gz GSBJWOALCUHOJF-FZKQIMNGSA-N 1 0 319.832 4.474 20 10 DICDRO CCO[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccccc1 ZINC000774494898 1049677777 /nfs/dbraw/zinc/67/77/77/1049677777.db2.gz GSBJWOALCUHOJF-SCLBCKFNSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1ccc(C)cc1O ZINC000794789943 1049694019 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CC(C)c1ccc(O)c(C[NH+]2CCC([C@@H]3CCCCO3)CC2)c1 ZINC001206691545 1049779971 /nfs/dbraw/zinc/77/99/71/1049779971.db2.gz JPUZEWJJYHBDTK-FQEVSTJZSA-N 1 0 317.473 4.297 20 10 DICDRO CC(C)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)C1CC1 ZINC001206728568 1049784545 /nfs/dbraw/zinc/78/45/45/1049784545.db2.gz QOPPWLMNBLCARZ-MRXNPFEDSA-N 1 0 314.395 4.296 20 10 DICDRO CC[N@H+](Cc1c(O)ccc2cc(Br)ccc21)C1CC1 ZINC000912854199 1049811999 /nfs/dbraw/zinc/81/19/99/1049811999.db2.gz KNKYYDVHLRBXTA-UHFFFAOYSA-N 1 0 320.230 4.292 20 10 DICDRO Oc1cccc2c1C[N@H+](C[C@H]1C[C@@H]1c1ccc(Cl)cc1)CC2 ZINC001207189305 1049857891 /nfs/dbraw/zinc/85/78/91/1049857891.db2.gz AIKMZMWNIIOXCD-NVXWUHKLSA-N 1 0 313.828 4.207 20 10 DICDRO Cc1ccc(C[N@H+](C)CCCOc2ccc(Cl)cc2)c(O)c1 ZINC001204720735 1049926473 /nfs/dbraw/zinc/92/64/73/1049926473.db2.gz ANZOTAJVUIMVQL-UHFFFAOYSA-N 1 0 319.832 4.255 20 10 DICDRO Oc1c(C[NH2+]C[C@@H]2CCCC3(CCC3)O2)ccc2ccccc21 ZINC001207699953 1049928402 /nfs/dbraw/zinc/92/84/02/1049928402.db2.gz 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C[C@@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000716170883 1050170641 /nfs/dbraw/zinc/17/06/41/1050170641.db2.gz NXVHWXPPCNAXLE-YLZJTPGZSA-N 1 0 324.468 4.151 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCC12CCOCC2)c1cc(Cl)ccc1O ZINC000282652425 1050172816 /nfs/dbraw/zinc/17/28/16/1050172816.db2.gz ICQLYUUNTWNFCB-LRDDRELGSA-N 1 0 309.837 4.046 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)[C@@H](OC)c2ccc(F)cc2)cc1C ZINC000770749682 1050192183 /nfs/dbraw/zinc/19/21/83/1050192183.db2.gz XGNPKNOPWOOKLG-IFXJQAMLSA-N 1 0 317.404 4.009 20 10 DICDRO CC(C)c1cc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)on1 ZINC000734005948 1050212226 /nfs/dbraw/zinc/21/22/26/1050212226.db2.gz DWGDQKJMIQKLOR-UHFFFAOYSA-N 1 0 322.408 4.460 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3c(F)cccc32)c1 ZINC000824468184 1050214715 /nfs/dbraw/zinc/21/47/15/1050214715.db2.gz FKMDWHSKLNUAIM-KZULUSFZSA-N 1 0 315.388 4.268 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H]2CCCc3c(F)cccc32)c(O)c1 ZINC000824468177 1050214955 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Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1 ZINC000825087196 1050276981 /nfs/dbraw/zinc/27/69/81/1050276981.db2.gz YDCAWJJMQLUJNM-UKRRQHHQSA-N 1 0 323.845 4.117 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)c1 ZINC000825127507 1050280017 /nfs/dbraw/zinc/28/00/17/1050280017.db2.gz XYNNTBFRXNACFP-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)cc1 ZINC000825168466 1050281241 /nfs/dbraw/zinc/28/12/41/1050281241.db2.gz YGWWSUIHRCOJCQ-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CSCc3ccccc32)cc1Cl ZINC000825151411 1050281310 /nfs/dbraw/zinc/28/13/10/1050281310.db2.gz XQOHTKXANDIAAQ-INIZCTEOSA-N 1 0 319.857 4.432 20 10 DICDRO FC(F)(F)SCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000225637060 1050282803 /nfs/dbraw/zinc/28/28/03/1050282803.db2.gz CAAJHGMSMIFDOD-UHFFFAOYSA-N 1 0 318.408 4.020 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000825214913 1050286427 /nfs/dbraw/zinc/28/64/27/1050286427.db2.gz ASHUHUQMCRWZKF-IBGZPJMESA-N 1 0 313.466 4.265 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(c3ccc(F)cc3)CC2)cc1Cl ZINC000825247816 1050287558 /nfs/dbraw/zinc/28/75/58/1050287558.db2.gz XMGFPCDDGGDXAP-UHFFFAOYSA-N 1 0 305.780 4.272 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825282947 1050289712 /nfs/dbraw/zinc/28/97/12/1050289712.db2.gz CDRLOZAYQFVHBR-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO Cc1cnc(C(C)(C)[NH2+]Cc2cc(Cl)c(C)cc2O)s1 ZINC000825330801 1050296881 /nfs/dbraw/zinc/29/68/81/1050296881.db2.gz DANDPJIYRAAKGN-UHFFFAOYSA-N 1 0 310.850 4.144 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](Cc2ccc(F)cc2)C2CC2)c1 ZINC000771935187 1050300699 /nfs/dbraw/zinc/30/06/99/1050300699.db2.gz NMBWMLIHFHIINH-UHFFFAOYSA-N 1 0 315.388 4.095 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)ccc2F)cc1F ZINC000735084064 1050343926 /nfs/dbraw/zinc/34/39/26/1050343926.db2.gz CINYEQFZGXRCNK-UHFFFAOYSA-N 1 0 318.411 4.409 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(C)ccc1OC ZINC000772448517 1050360351 /nfs/dbraw/zinc/36/03/51/1050360351.db2.gz PFBUIQCMUXABBH-GOSISDBHSA-N 1 0 311.425 4.179 20 10 DICDRO CCC(CC)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000157749413 1050371024 /nfs/dbraw/zinc/37/10/24/1050371024.db2.gz VAZSFQTXTKJQIF-UHFFFAOYSA-N 1 0 312.404 4.035 20 10 DICDRO Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000785538249 1050387122 /nfs/dbraw/zinc/38/71/22/1050387122.db2.gz UXTKBYJMYRFLOD-UHFFFAOYSA-N 1 0 321.342 4.239 20 10 DICDRO Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000785535476 1050387358 /nfs/dbraw/zinc/38/73/58/1050387358.db2.gz QGBRYYYCJKSLRC-UHFFFAOYSA-N 1 0 322.374 4.370 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@@H](C)CC1)c1ccc(N2CCOCC2)cc1 ZINC000785571339 1050395526 /nfs/dbraw/zinc/39/55/26/1050395526.db2.gz YFHYGNUMJRMDMF-AOIWGVFYSA-N 1 0 316.489 4.143 20 10 DICDRO C[N@H+](Cc1ccc(O)cc1)Cc1ccc(N2CCCCC2)cc1 ZINC000785969941 1050438222 /nfs/dbraw/zinc/43/82/22/1050438222.db2.gz FGARONMNDTUQIN-UHFFFAOYSA-N 1 0 310.441 4.015 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccncc1OC)c1cc(Cl)ccc1O ZINC000783328388 1050484850 /nfs/dbraw/zinc/48/48/50/1050484850.db2.gz AHWTWXBYEXWXDC-ABAIWWIYSA-N 1 0 320.820 4.251 20 10 DICDRO CC(C)[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccn1 ZINC000736648372 1050485016 /nfs/dbraw/zinc/48/50/16/1050485016.db2.gz XCXHEEWGCKXNIO-HXUWFJFHSA-N 1 0 309.457 4.169 20 10 DICDRO CO[C@@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000786576463 1050498434 /nfs/dbraw/zinc/49/84/34/1050498434.db2.gz UVNVINYQIHGRHP-BBWFWOEESA-N 1 0 304.478 4.141 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1nccs1)C1CCCCC1 ZINC000749513230 1050510202 /nfs/dbraw/zinc/51/02/02/1050510202.db2.gz AMIVAUYVQXOATD-UHFFFAOYSA-N 1 0 302.443 4.184 20 10 DICDRO CC[NH+](CC)Cc1ccc(NCc2ccc(N(C)C)cc2)cc1 ZINC000786829911 1050519306 /nfs/dbraw/zinc/51/93/06/1050519306.db2.gz FSNYUTXEOOPWHZ-UHFFFAOYSA-N 1 0 311.473 4.207 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1C[NH2+]C)c1cccc(Cl)c1[O-] ZINC000844926393 1050522162 /nfs/dbraw/zinc/52/21/62/1050522162.db2.gz ZFWVYFZRFUYRPU-QGZVFWFLSA-N 1 0 318.848 4.006 20 10 DICDRO CCS[C@@H]1CCCC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000738217893 1050525264 /nfs/dbraw/zinc/52/52/64/1050525264.db2.gz CHNGFTSGJJAFGU-OAHLLOKOSA-N 1 0 316.470 4.048 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCSC[C@H]2c2ccccc2)cc1C ZINC000738064411 1050525564 /nfs/dbraw/zinc/52/55/64/1050525564.db2.gz BTNKXXWTIBQSLZ-SFHVURJKSA-N 1 0 313.466 4.299 20 10 DICDRO CCC[N@H+](Cc1scnc1C1CC1)Cc1ccccc1O ZINC000787136982 1050554886 /nfs/dbraw/zinc/55/48/86/1050554886.db2.gz IMQXEIOETAUDNU-UHFFFAOYSA-N 1 0 302.443 4.138 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C23CCC(C(F)(F)F)(CC2)CC3)c1 ZINC000787298608 1050584627 /nfs/dbraw/zinc/58/46/27/1050584627.db2.gz LVXWXTOFBLAJBO-UHFFFAOYSA-N 1 0 313.363 4.446 20 10 DICDRO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cccc(C)c1O ZINC000787330043 1050587095 /nfs/dbraw/zinc/58/70/95/1050587095.db2.gz CBGNYAUSTFQRCF-QGZVFWFLSA-N 1 0 319.832 4.174 20 10 DICDRO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cc(F)ccc1O ZINC000787330235 1050587569 /nfs/dbraw/zinc/58/75/69/1050587569.db2.gz DGTLKOUWLNQNBX-MRXNPFEDSA-N 1 0 323.795 4.004 20 10 DICDRO CC[C@H](c1ccncc1)[N@H+](CC)Cc1c(O)ccc2ccncc21 ZINC000739888395 1050589901 /nfs/dbraw/zinc/58/99/01/1050589901.db2.gz TXWRLYDAEBNKHM-LJQANCHMSA-N 1 0 321.424 4.309 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)[C@H]2CCC[C@H](C)C2)c1O ZINC001171190441 1050595992 /nfs/dbraw/zinc/59/59/92/1050595992.db2.gz SICVIBUEAIVRLC-OBJOEFQTSA-N 1 0 307.409 4.038 20 10 DICDRO COc1ccccc1[C@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000129849123 1050618617 /nfs/dbraw/zinc/61/86/17/1050618617.db2.gz VNHRKBOVVYNUIM-ZDUSSCGKSA-N 1 0 317.816 4.044 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCS1)c1ccc(N2CCCCC2)cc1 ZINC000168653608 1050618743 /nfs/dbraw/zinc/61/87/43/1050618743.db2.gz QNZCWFDGUHISCU-YJBOKZPZSA-N 1 0 304.503 4.223 20 10 DICDRO CC(C)[N@H+](Cc1cc2cnccc2o1)Cc1ccc(N(C)C)cc1 ZINC000845903084 1050633033 /nfs/dbraw/zinc/63/30/33/1050633033.db2.gz BUYGTYKIYBQODM-UHFFFAOYSA-N 1 0 323.440 4.304 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCc2ccsc2)c1 ZINC000845970846 1050638380 /nfs/dbraw/zinc/63/83/80/1050638380.db2.gz DEUVRGQFCIMRJZ-CHWSQXEVSA-N 1 0 305.443 4.134 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)c(Cl)c2)c1 ZINC000845971384 1050638746 /nfs/dbraw/zinc/63/87/46/1050638746.db2.gz JISUQXYNFGTMMB-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)c2cc(F)cc(F)c2)c1 ZINC000845971116 1050640018 /nfs/dbraw/zinc/64/00/18/1050640018.db2.gz HEFCWQJQXHBFCT-RYUDHWBXSA-N 1 0 321.367 4.133 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1 ZINC000845972170 1050640205 /nfs/dbraw/zinc/64/02/05/1050640205.db2.gz PGUQMCRZNNFBNF-RYUDHWBXSA-N 1 0 313.388 4.265 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC[C@]2(C)C[C@@]2(F)Cl)cc1 ZINC000846028590 1050651479 /nfs/dbraw/zinc/65/14/79/1050651479.db2.gz CHDXQYDDPDLGKF-UIZHIOIMSA-N 1 0 310.844 4.060 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@@H](SC)C2)cc1 ZINC000227378478 1050665092 /nfs/dbraw/zinc/66/50/92/1050665092.db2.gz USCVCQVTWDQJEU-FUHWJXTLSA-N 1 0 306.519 4.297 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C)cc2SC)c1O ZINC000846148498 1050672754 /nfs/dbraw/zinc/67/27/54/1050672754.db2.gz FJEQEONIUIAJLJ-CYBMUJFWSA-N 1 0 317.454 4.282 20 10 DICDRO CCc1ccc(C[NH2+]Cc2cc(Br)ccc2O)cc1 ZINC000227442115 1050673274 /nfs/dbraw/zinc/67/32/74/1050673274.db2.gz UDNWAVDCGGSSMZ-UHFFFAOYSA-N 1 0 320.230 4.007 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(Br)ccc2O)cc1 ZINC000227438355 1050674086 /nfs/dbraw/zinc/67/40/86/1050674086.db2.gz XOXKAOPBDKLUDS-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](Cc2ccccc2)C2CC2)c1O ZINC000846156940 1050674421 /nfs/dbraw/zinc/67/44/21/1050674421.db2.gz ZQJWRUQUFVTGGK-KBXCAEBGSA-N 1 0 311.425 4.073 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](c3ccccc3F)C2)c1O ZINC000846167866 1050678089 /nfs/dbraw/zinc/67/80/89/1050678089.db2.gz NCCWKDPWPQVXGY-MGPQQGTHSA-N 1 0 315.388 4.137 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCc2ccc(SC)cc2)c1O ZINC000846167913 1050678232 /nfs/dbraw/zinc/67/82/32/1050678232.db2.gz NZTTYECOMFIEHP-ZDUSSCGKSA-N 1 0 317.454 4.016 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)CCCC(F)(F)F)c1O ZINC000846165381 1050678243 /nfs/dbraw/zinc/67/82/43/1050678243.db2.gz KYGMQGNGYSWICP-GHMZBOCLSA-N 1 0 305.340 4.173 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2CC(C)(c3ccccc3)C2)c1O ZINC000846165356 1050678286 /nfs/dbraw/zinc/67/82/86/1050678286.db2.gz ZCMXNXFRGUMEPP-GPWPYBQESA-N 1 0 311.425 4.172 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C(F)F)cc2)c1O ZINC000846165796 1050678598 /nfs/dbraw/zinc/67/85/98/1050678598.db2.gz YLSKNZKNBWDXQM-LLVKDONJSA-N 1 0 307.340 4.189 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC2CC(c3ccccc3)C2)c1O ZINC000846168968 1050679922 /nfs/dbraw/zinc/67/99/22/1050679922.db2.gz WOWYOIAJOMSOLI-HPUBIQBYSA-N 1 0 311.425 4.245 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c1O ZINC000846169717 1050680246 /nfs/dbraw/zinc/68/02/46/1050680246.db2.gz SENLMBPLIDRAMI-HZMBPMFUSA-N 1 0 318.244 4.025 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCc3c(F)cccc32)c1O ZINC000846171781 1050680527 /nfs/dbraw/zinc/68/05/27/1050680527.db2.gz WDCRJWBHIIPAEN-YVEFUNNKSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(c3ccccc3F)CCC2)c1O ZINC000846171407 1050680654 /nfs/dbraw/zinc/68/06/54/1050680654.db2.gz GKZUYUQBEZZQRR-ZDUSSCGKSA-N 1 0 315.388 4.270 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(c3ccc(C)cc3)CCC2)c1O ZINC000846170637 1050680773 /nfs/dbraw/zinc/68/07/73/1050680773.db2.gz BJCKYWRBFWSZHE-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO CCSc1cccc(C[NH2+][C@H](C)c2cccc(OC)c2O)c1 ZINC000846171071 1050681056 /nfs/dbraw/zinc/68/10/56/1050681056.db2.gz QYLRCRFYKYTGEU-CYBMUJFWSA-N 1 0 317.454 4.364 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c1O ZINC000846135705 1050681773 /nfs/dbraw/zinc/68/17/73/1050681773.db2.gz FTDJIPHJPMXKEY-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C[C@@H](c2ccccc2)C2CC2)c1O ZINC000846172583 1050682158 /nfs/dbraw/zinc/68/21/58/1050682158.db2.gz ZIKCHBFVLZHBRS-KSSFIOAISA-N 1 0 311.425 4.245 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccccc1OC ZINC000846138762 1050682599 /nfs/dbraw/zinc/68/25/99/1050682599.db2.gz GPVQAZZIBHRUTH-CJNGLKHVSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2OC)c1O ZINC000846138129 1050682606 /nfs/dbraw/zinc/68/26/06/1050682606.db2.gz SWOWVRGBUJVDDI-KGLIPLIRSA-N 1 0 315.413 4.130 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](c2cccs2)C2CC2)c1O ZINC000846136975 1050682683 /nfs/dbraw/zinc/68/26/83/1050682683.db2.gz PBSCHSLQFXMDOQ-ZBEGNZNMSA-N 1 0 303.427 4.264 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCc2c[nH]c3c2cccc3C)c1O ZINC000846145517 1050683890 /nfs/dbraw/zinc/68/38/90/1050683890.db2.gz LCKQJKXBLUAISV-CQSZACIVSA-N 1 0 324.424 4.084 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCc2c[nH]c3c2cccc3C)c1O ZINC000846145514 1050683901 /nfs/dbraw/zinc/68/39/01/1050683901.db2.gz LCKQJKXBLUAISV-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C[C@@H](C)c2ccc(F)cc2F)c1O ZINC000846145506 1050683990 /nfs/dbraw/zinc/68/39/90/1050683990.db2.gz LBADKYPHDZZWJE-NEPJUHHUSA-N 1 0 321.367 4.133 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC(C)(C)c2ccccc2F)c1O ZINC000846141959 1050684288 /nfs/dbraw/zinc/68/42/88/1050684288.db2.gz OSAMFQMNKVSAKK-ZDUSSCGKSA-N 1 0 317.404 4.168 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1O ZINC000846141261 1050684400 /nfs/dbraw/zinc/68/44/00/1050684400.db2.gz HBRGEQICBLQMMC-MEDUHNTESA-N 1 0 317.816 4.392 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c1 ZINC000846214655 1050693951 /nfs/dbraw/zinc/69/39/51/1050693951.db2.gz LCAQDYOTYJYNKA-RYUDHWBXSA-N 1 0 302.245 4.325 20 10 DICDRO C[C@H]([NH2+]CC[C@@]1(C)C[C@]1(F)Cl)c1cc(Cl)ccc1O ZINC000846185838 1050689264 /nfs/dbraw/zinc/68/92/64/1050689264.db2.gz SWQQVHGCORVARR-QCZZGDTMSA-N 1 0 306.208 4.401 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000846189742 1050690949 /nfs/dbraw/zinc/69/09/49/1050690949.db2.gz RYZOKGLNFNHNNK-QSFXBCCZSA-N 1 0 313.441 4.038 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2OC(F)F)c(O)c1 ZINC000788504368 1050694599 /nfs/dbraw/zinc/69/45/99/1050694599.db2.gz HQOVQLFZJUFANC-CYBMUJFWSA-N 1 0 321.367 4.461 20 10 DICDRO C[C@@H]([NH2+]CCC[C@@H]1CC1(Cl)Cl)c1cc(F)ccc1O ZINC000846215726 1050696077 /nfs/dbraw/zinc/69/60/77/1050696077.db2.gz OLPAUNPHYBRQLO-NXEZZACHSA-N 1 0 306.208 4.156 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c(O)c1 ZINC000846216542 1050696132 /nfs/dbraw/zinc/69/61/32/1050696132.db2.gz SQJBBNLZGCZNAY-RYUDHWBXSA-N 1 0 302.245 4.325 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1O ZINC000846211922 1050705298 /nfs/dbraw/zinc/70/52/98/1050705298.db2.gz DCVBHUGGJVIWRO-WDEREUQCSA-N 1 0 318.244 4.025 20 10 DICDRO CC[C@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000788608833 1050706061 /nfs/dbraw/zinc/70/60/61/1050706061.db2.gz CVXOEMNTTMYDME-HNNXBMFYSA-N 1 0 323.864 4.029 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1O)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000788576367 1050707687 /nfs/dbraw/zinc/70/76/87/1050707687.db2.gz HRGPVZPFBFRSAL-WCFLWFBJSA-N 1 0 307.846 4.389 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)Oc2ccccc2F)c(O)c1 ZINC000788616136 1050715264 /nfs/dbraw/zinc/71/52/64/1050715264.db2.gz XJBYWOMKANTMID-HUUCEWRRSA-N 1 0 317.404 4.266 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000788618746 1050717674 /nfs/dbraw/zinc/71/76/74/1050717674.db2.gz AVVHKCQCDVIHHW-QZTJIDSGSA-N 1 0 324.468 4.268 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCOc2ccc(F)c(F)c2)c(O)c1 ZINC000788638439 1050722534 /nfs/dbraw/zinc/72/25/34/1050722534.db2.gz GTUDHQIXNZZKLA-CYBMUJFWSA-N 1 0 321.367 4.017 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)c(O)c1 ZINC000788708978 1050730942 /nfs/dbraw/zinc/73/09/42/1050730942.db2.gz CATFWQGICZTGAJ-GVDBMIGSSA-N 1 0 305.462 4.253 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2sc(C)nc2C)cc1 ZINC000741775380 1050738485 /nfs/dbraw/zinc/73/84/85/1050738485.db2.gz RDCCCFOIEULIDU-UHFFFAOYSA-N 1 0 317.502 4.238 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)c1O ZINC000761184138 1050744973 /nfs/dbraw/zinc/74/49/73/1050744973.db2.gz RHGAIKDYESHMNL-NSHDSACASA-N 1 0 323.795 4.386 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ccc3[nH]ccc3c2)c(O)c1 ZINC000788816187 1050754949 /nfs/dbraw/zinc/75/49/49/1050754949.db2.gz QQDKPRNTVMJWMQ-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO Cc1cc(C)cc([C@H](O)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788820335 1050757591 /nfs/dbraw/zinc/75/75/91/1050757591.db2.gz UQHAKZBBWNSPFW-VQIMIIECSA-N 1 0 313.441 4.010 20 10 DICDRO COc1c2ccccc2oc1C[NH2+]Cc1cc(C)c(C)cc1O ZINC000788969093 1050767895 /nfs/dbraw/zinc/76/78/95/1050767895.db2.gz GOYHKAQMYVFEPU-UHFFFAOYSA-N 1 0 311.381 4.054 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c1O ZINC000761195229 1050775120 /nfs/dbraw/zinc/77/51/20/1050775120.db2.gz KNWXDDIDTZJAFK-ZAQWFSBCSA-N 1 0 321.848 4.065 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)CCc2ccc(C)o2)c1O ZINC000761207839 1050780123 /nfs/dbraw/zinc/78/01/23/1050780123.db2.gz TYYWLGCUGOLYMX-LLVKDONJSA-N 1 0 323.820 4.067 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)c1ccccc1F ZINC000847023969 1050798908 /nfs/dbraw/zinc/79/89/08/1050798908.db2.gz GRUNVMPIDGQICJ-QGZVFWFLSA-N 1 0 319.351 4.114 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC000742165659 1050805274 /nfs/dbraw/zinc/80/52/74/1050805274.db2.gz KQISMZMUCUZDMH-UHFFFAOYSA-N 1 0 311.425 4.081 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C2(C)CCC(F)(F)CC2)c1O ZINC000761214036 1050815325 /nfs/dbraw/zinc/81/53/25/1050815325.db2.gz BYUYXEMXUSVOLH-UHFFFAOYSA-N 1 0 319.779 4.112 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCCOc3ccc(F)cc32)cc1C ZINC000742367849 1050821535 /nfs/dbraw/zinc/82/15/35/1050821535.db2.gz LWLNJZIFEVDHKE-KRWDZBQOSA-N 1 0 315.388 4.152 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CCC(F)(F)F)cc1 ZINC000742390078 1050826713 /nfs/dbraw/zinc/82/67/13/1050826713.db2.gz AXNPINUWFJCZDR-UHFFFAOYSA-N 1 0 302.384 4.355 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H](C)c2ccc(F)cc2F)cc1C ZINC000742391000 1050829630 /nfs/dbraw/zinc/82/96/30/1050829630.db2.gz YSTAKBCDRZHEOJ-CYBMUJFWSA-N 1 0 305.368 4.175 20 10 DICDRO COc1ccc(C[NH2+]C[C@H](OC)c2ccc(Cl)cc2)cc1C ZINC000742376900 1050837418 /nfs/dbraw/zinc/83/74/18/1050837418.db2.gz DAXRKGDZLZPNDE-SFHVURJKSA-N 1 0 319.832 4.134 20 10 DICDRO Cc1nc(C)c(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)s1 ZINC000742377356 1050837472 /nfs/dbraw/zinc/83/74/72/1050837472.db2.gz SSBSBRHINAWFGE-UHFFFAOYSA-N 1 0 324.449 4.422 20 10 DICDRO CC[N@H+](Cc1cccc(Cl)c1[O-])Cc1cccc(F)c1F ZINC001231914173 1050869522 /nfs/dbraw/zinc/86/95/22/1050869522.db2.gz GPVAGDZSXLZBAQ-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO CCCCO[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)CC)cc2)C1(C)C ZINC001170118107 1050883865 /nfs/dbraw/zinc/88/38/65/1050883865.db2.gz PBXWUQCNTXIEAQ-RBUKOAKNSA-N 1 0 318.505 4.216 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000772981325 1050887270 /nfs/dbraw/zinc/88/72/70/1050887270.db2.gz ZRFBGEKEMQZNGD-LEWJYISDSA-N 1 0 324.468 4.107 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccc(Br)cc1F ZINC000228407576 1050889770 /nfs/dbraw/zinc/88/97/70/1050889770.db2.gz XCPAJHFXOROWHG-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO COc1ccc(CC[C@H](C)[NH2+]Cc2ccc(OC)c(C)c2)cc1 ZINC000742731419 1050929225 /nfs/dbraw/zinc/92/92/25/1050929225.db2.gz QAAJQYMHAMPVEB-INIZCTEOSA-N 1 0 313.441 4.123 20 10 DICDRO CCn1ccc(C[N@H+](C)Cc2c(O)ccc3ccc(OC)cc32)c1 ZINC000790446651 1050960834 /nfs/dbraw/zinc/96/08/34/1050960834.db2.gz KTHOMZNEXAZXKJ-UHFFFAOYSA-N 1 0 324.424 4.007 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)cc(Cl)n1)c1ccc(N(C)C)cc1 ZINC000282712870 1050985577 /nfs/dbraw/zinc/98/55/77/1050985577.db2.gz LNRIAPVFDHYHQR-KRWDZBQOSA-N 1 0 317.864 4.350 20 10 DICDRO C[C@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1cc(Cl)ccc1O ZINC000790703702 1050987245 /nfs/dbraw/zinc/98/72/45/1050987245.db2.gz UEXDOVUORNEBAB-YVEFUNNKSA-N 1 0 311.853 4.028 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1cc(F)ccc1O ZINC000790714661 1050989373 /nfs/dbraw/zinc/98/93/73/1050989373.db2.gz GZVHMINCKKDQCX-HIFRSBDPSA-N 1 0 307.409 4.064 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cc1 ZINC000772999525 1051014949 /nfs/dbraw/zinc/01/49/49/1051014949.db2.gz LTZZHGIQLJJFQR-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2c(O)ccc3ccncc32)C1 ZINC000743398717 1051022771 /nfs/dbraw/zinc/02/27/71/1051022771.db2.gz JZVBZYPGPFZUIJ-CABCVRRESA-N 1 0 316.470 4.046 20 10 DICDRO CC[C@H](O)CCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000773014695 1051023492 /nfs/dbraw/zinc/02/34/92/1051023492.db2.gz KAZKTJHQWKWOEH-RDJZCZTQSA-N 1 0 322.468 4.018 20 10 DICDRO C[C@H]1C[N@H+](Cc2c(O)ccc3ccncc32)[C@H]1c1ccccc1 ZINC000743392845 1051024045 /nfs/dbraw/zinc/02/40/45/1051024045.db2.gz VLVYFOLLRAILCH-VBKZILBWSA-N 1 0 304.393 4.133 20 10 DICDRO CC[C@H](C)C[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000773022845 1051026331 /nfs/dbraw/zinc/02/63/31/1051026331.db2.gz FFAGLOOZLSHWSZ-ARFHVFGLSA-N 1 0 322.468 4.138 20 10 DICDRO Cc1nc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)sc1C ZINC000743495500 1051038425 /nfs/dbraw/zinc/03/84/25/1051038425.db2.gz GQSCBKNFJTZDKR-UHFFFAOYSA-N 1 0 324.449 4.422 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(OC)cc2C)cc1 ZINC000773050401 1051039391 /nfs/dbraw/zinc/03/93/91/1051039391.db2.gz HSIBKDFWCANYBR-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCCC(F)(F)F)cc1F ZINC000743495175 1051039575 /nfs/dbraw/zinc/03/95/75/1051039575.db2.gz BLHRIDWDDXPCRE-UHFFFAOYSA-N 1 0 306.347 4.104 20 10 DICDRO CCC1(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2Cl)CC1 ZINC000773050799 1051041566 /nfs/dbraw/zinc/04/15/66/1051041566.db2.gz UTHXDGBHBYKKQJ-AWEZNQCLSA-N 1 0 322.880 4.017 20 10 DICDRO CS[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773095304 1051060051 /nfs/dbraw/zinc/06/00/51/1051060051.db2.gz RGZPHNZIKMGHFM-JKSUJKDBSA-N 1 0 306.519 4.469 20 10 DICDRO CS[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000773090882 1051061221 /nfs/dbraw/zinc/06/12/21/1051061221.db2.gz HBXAKIKEZGBMCC-KGLIPLIRSA-N 1 0 310.482 4.218 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](c2cccnc2)C2CC2)cc1 ZINC000773117565 1051066813 /nfs/dbraw/zinc/06/68/13/1051066813.db2.gz IZUNCFCTEPTLRS-MGPUTAFESA-N 1 0 309.457 4.340 20 10 DICDRO CC[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000773119376 1051069872 /nfs/dbraw/zinc/06/98/72/1051069872.db2.gz OUGAOEBXKNSIDO-PMACEKPBSA-N 1 0 309.457 4.340 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCSCC(F)(F)F)cc1 ZINC000773145062 1051079476 /nfs/dbraw/zinc/07/94/76/1051079476.db2.gz IFPFWWALHXGSKI-LBPRGKRZSA-N 1 0 320.424 4.089 20 10 DICDRO CC[N@H+](CCC(C)C)Cc1cc(Br)ccc1O ZINC000743874559 1051086500 /nfs/dbraw/zinc/08/65/00/1051086500.db2.gz WYUPUWOYYPHEKK-UHFFFAOYSA-N 1 0 300.240 4.023 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2c(F)cccc2C1)c1ccc(N(C)C)cc1 ZINC001171406863 1051094158 /nfs/dbraw/zinc/09/41/58/1051094158.db2.gz GUJRAHBLCRFZAO-YOEHRIQHSA-N 1 0 312.432 4.100 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000036961230 1051104121 /nfs/dbraw/zinc/10/41/21/1051104121.db2.gz KRAIKGONHVGVDJ-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccc(OC)cc1 ZINC000037067426 1051109256 /nfs/dbraw/zinc/10/92/56/1051109256.db2.gz QWKFKKRJYHIBCX-MRXNPFEDSA-N 1 0 305.805 4.295 20 10 DICDRO C[C@@H]1CCSCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000792194970 1051125943 /nfs/dbraw/zinc/12/59/43/1051125943.db2.gz AZJXXYXCRDWHLD-MRXNPFEDSA-N 1 0 304.503 4.004 20 10 DICDRO C[C@@H]1CCSCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000792194806 1051126880 /nfs/dbraw/zinc/12/68/80/1051126880.db2.gz AGFBQFDTMUKDRT-OAHLLOKOSA-N 1 0 313.466 4.387 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)cc1F ZINC001203250006 1051199632 /nfs/dbraw/zinc/19/96/32/1051199632.db2.gz YXWAHHNFYANMNH-FQEVSTJZSA-N 1 0 312.432 4.307 20 10 DICDRO Fc1cccc2c1C[C@@H]([NH2+]Cc1ccc(N3CCCCC3)cc1)C2 ZINC001171772904 1051211817 /nfs/dbraw/zinc/21/18/17/1051211817.db2.gz GCECTJGXJKFZFM-SFHVURJKSA-N 1 0 324.443 4.073 20 10 DICDRO C[C@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@@H](C2CC2)O1 ZINC000793214797 1051259220 /nfs/dbraw/zinc/25/92/20/1051259220.db2.gz RHKXYUZWZXHZCG-BTYIYWSLSA-N 1 0 323.436 4.059 20 10 DICDRO COCCCC[C@@H]([NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC000793232438 1051266871 /nfs/dbraw/zinc/26/68/71/1051266871.db2.gz LKHCASIKWXDZSN-GOSISDBHSA-N 1 0 317.404 4.179 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@](C)(OC)CC2)cc1F ZINC000793339818 1051279854 /nfs/dbraw/zinc/27/98/54/1051279854.db2.gz NBXKTCVAUQAGOF-IBGZPJMESA-N 1 0 322.468 4.063 20 10 DICDRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000793521912 1051308230 /nfs/dbraw/zinc/30/82/30/1051308230.db2.gz YUEREGVXZYSVDB-IPHXSNPTSA-N 1 0 324.468 4.043 20 10 DICDRO Oc1cc2c(cc1C[N@H+](CCc1ccccc1)C1CC1)CCC2 ZINC000746022866 1051309099 /nfs/dbraw/zinc/30/90/99/1051309099.db2.gz JUSXYYVPHYNOEY-UHFFFAOYSA-N 1 0 307.437 4.088 20 10 DICDRO C[N@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1c(O)ccc2ccccc21 ZINC000773343894 1051319467 /nfs/dbraw/zinc/31/94/67/1051319467.db2.gz YAYVPWUYGIPMIJ-UHFFFAOYSA-N 1 0 323.440 4.198 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000793620103 1051328637 /nfs/dbraw/zinc/32/86/37/1051328637.db2.gz LDSWDUOGKJRIFS-NRFANRHFSA-N 1 0 323.436 4.062 20 10 DICDRO CC[C@@H](C)OCC[C@@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001172345335 1051364525 /nfs/dbraw/zinc/36/45/25/1051364525.db2.gz WOPMNRIPTJPSGN-HUUCEWRRSA-N 1 0 301.430 4.229 20 10 DICDRO COc1ccc(C[NH2+]CCSCc2ccccc2F)cc1C ZINC000806682538 1051408997 /nfs/dbraw/zinc/40/89/97/1051408997.db2.gz ZZTLHVJFESXTMO-UHFFFAOYSA-N 1 0 319.445 4.166 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2nc3cc(C)ccc3[nH]2)cc1 ZINC000766378011 1051411626 /nfs/dbraw/zinc/41/16/26/1051411626.db2.gz NZWLMJCKTWDYRA-OAHLLOKOSA-N 1 0 322.456 4.178 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCSC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766447718 1051421694 /nfs/dbraw/zinc/42/16/94/1051421694.db2.gz ZZELDBVNYDULDJ-HOCLYGCPSA-N 1 0 322.493 4.362 20 10 DICDRO CCCCCC[C@H](CCCC)[NH2+]CCc1cc(O)c(O)cc1O ZINC001172516025 1051430873 /nfs/dbraw/zinc/43/08/73/1051430873.db2.gz FIOBBEPFVOLPPR-INIZCTEOSA-N 1 0 323.477 4.465 20 10 DICDRO CC[C@H]([NH2+]CC1(CCO)CCCCC1)c1ccc(N(C)C)cc1 ZINC000766537292 1051464765 /nfs/dbraw/zinc/46/47/65/1051464765.db2.gz TXYRAEPIKKPJLN-IBGZPJMESA-N 1 0 318.505 4.126 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2cc(C)ccc2C)c1O ZINC001168924556 1051468120 /nfs/dbraw/zinc/46/81/20/1051468120.db2.gz DWUXZQIMKYVYCG-ZDUSSCGKSA-N 1 0 315.388 4.202 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@@H]2Cc3ccc(Cl)cc3C2)cc1 ZINC001172724661 1051483595 /nfs/dbraw/zinc/48/35/95/1051483595.db2.gz PHGWTDHHHGVESO-LJQANCHMSA-N 1 0 314.860 4.005 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCS1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766566815 1051495053 /nfs/dbraw/zinc/49/50/53/1051495053.db2.gz GUCOOQRZMPCDFG-HOCLYGCPSA-N 1 0 322.493 4.362 20 10 DICDRO C[C@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1ccc(N(C)C)cc1 ZINC001172711551 1051495844 /nfs/dbraw/zinc/49/58/44/1051495844.db2.gz GPKKKRWCASXTAK-SCLBCKFNSA-N 1 0 314.860 4.224 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(C)cc1OC)c1ccc(N(C)C)cc1 ZINC000766575287 1051506581 /nfs/dbraw/zinc/50/65/81/1051506581.db2.gz INMVOFXVQJFWNG-IBGZPJMESA-N 1 0 312.457 4.311 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H]3CCCCC3(C)C)CC2)cc1 ZINC000766576347 1051508714 /nfs/dbraw/zinc/50/87/14/1051508714.db2.gz MPZHQUWJGJCRGI-IBGZPJMESA-N 1 0 316.489 4.222 20 10 DICDRO C[C@H](C[C@H]1CCOC1)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766581518 1051514127 /nfs/dbraw/zinc/51/41/27/1051514127.db2.gz LYHBLKRDGWGHEW-KZNAEPCWSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc(F)cc1Cl)c1ccccc1O ZINC001172855798 1051541252 /nfs/dbraw/zinc/54/12/52/1051541252.db2.gz HHSIOLDVUBFURO-NWDGAFQWSA-N 1 0 307.796 4.467 20 10 DICDRO C[C@@H](CSc1ccc(Cl)cc1)[NH2+]Cc1ccc(O)cc1O ZINC001172883852 1051565883 /nfs/dbraw/zinc/56/58/83/1051565883.db2.gz UXDURVRQRBOMGT-NSHDSACASA-N 1 0 323.845 4.022 20 10 DICDRO CC[C@H]1CC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000806137866 1051738413 /nfs/dbraw/zinc/73/84/13/1051738413.db2.gz SYYGUKPGJHFMDC-GUYCJALGSA-N 1 0 324.415 4.035 20 10 DICDRO C[C@@H]([NH2+]CCC1(F)CCC1)c1cc(Br)ccc1O ZINC000806173955 1051746675 /nfs/dbraw/zinc/74/66/75/1051746675.db2.gz PMTZDNLEVVKURV-SNVBAGLBSA-N 1 0 316.214 4.088 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2CCC[C@H](CC)C2)ccc1OC ZINC000740899073 1051745695 /nfs/dbraw/zinc/74/56/95/1051745695.db2.gz PFUMLJVSLDIALR-YJBOKZPZSA-N 1 0 305.462 4.290 20 10 DICDRO CC(C)SCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000806167997 1051766295 /nfs/dbraw/zinc/76/62/95/1051766295.db2.gz QYANMDOBSYYNRZ-INIZCTEOSA-N 1 0 306.519 4.469 20 10 DICDRO CC[C@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1cccc(Cl)c1[O-] ZINC000806163673 1051767040 /nfs/dbraw/zinc/76/70/40/1051767040.db2.gz USFCOYVCYWQQDP-HNNXBMFYSA-N 1 0 323.864 4.029 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2c(C)oc3ccccc32)c(O)c1 ZINC000767193649 1051771823 /nfs/dbraw/zinc/77/18/23/1051771823.db2.gz AQHUZYFHMLRXQL-UHFFFAOYSA-N 1 0 311.381 4.135 20 10 DICDRO COc1ccc(C[NH2+]CCCSc2ccc(F)cc2)cc1C ZINC000806674443 1051840632 /nfs/dbraw/zinc/84/06/32/1051840632.db2.gz APUCRKAQLUQDCW-UHFFFAOYSA-N 1 0 319.445 4.415 20 10 DICDRO COc1ccc(C[NH2+]CCSc2ccc(C)cc2)cc1C ZINC000806681931 1051841679 /nfs/dbraw/zinc/84/16/79/1051841679.db2.gz QWEYPTQCIDMKHT-UHFFFAOYSA-N 1 0 301.455 4.194 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3c(n2)CCCC3)cc1 ZINC000767727568 1051842365 /nfs/dbraw/zinc/84/23/65/1051842365.db2.gz LFXXUEYWDLSIHB-UHFFFAOYSA-N 1 0 323.484 4.096 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCC(F)(F)C2)cc1F ZINC000767930882 1051866562 /nfs/dbraw/zinc/86/65/62/1051866562.db2.gz ZLLGYWQZOZCXJL-AWEZNQCLSA-N 1 0 314.395 4.339 20 10 DICDRO CC[C@@H]([NH2+]CCCc1c(C)noc1C)c1cccc(Cl)c1[O-] ZINC000806143516 1051879831 /nfs/dbraw/zinc/87/98/31/1051879831.db2.gz JYSNJERBYLXQNQ-MRXNPFEDSA-N 1 0 322.836 4.324 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2cccc(Cl)c2)c(O)c1 ZINC000768175754 1051893712 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COc1cccc(O)c1C[N@H+](C)Cc1csc2ccccc12 ZINC000768246891 1051914997 /nfs/dbraw/zinc/91/49/97/1051914997.db2.gz PCTFMXJPILMHKA-UHFFFAOYSA-N 1 0 313.422 4.248 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000768330409 1051918845 /nfs/dbraw/zinc/91/88/45/1051918845.db2.gz RDYHLJSKPHQAGF-GOSISDBHSA-N 1 0 315.388 4.267 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(O)c1 ZINC000768329461 1051919091 /nfs/dbraw/zinc/91/90/91/1051919091.db2.gz FIXGOGBNGDQACT-SFHVURJKSA-N 1 0 315.388 4.267 20 10 DICDRO COc1ccsc1C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000768350392 1051921276 /nfs/dbraw/zinc/92/12/76/1051921276.db2.gz FHSAHHYNOQDBFQ-UHFFFAOYSA-N 1 0 318.486 4.233 20 10 DICDRO CCc1ncc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)s1 ZINC000768354374 1051921335 /nfs/dbraw/zinc/92/13/35/1051921335.db2.gz ZBIJNMNAHUZMGP-UHFFFAOYSA-N 1 0 317.502 4.182 20 10 DICDRO COc1cc(C[N@@H+]2CC[C@H](c3ccccc3C)C2)c(O)cc1C ZINC000768446423 1051930943 /nfs/dbraw/zinc/93/09/43/1051930943.db2.gz XENNHRZIIVLNBJ-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO Oc1ccc(Cl)cc1C[NH+]1CCC(Oc2ccccc2)CC1 ZINC000768528263 1051939035 /nfs/dbraw/zinc/93/90/35/1051939035.db2.gz NQXJVFGEGODFRZ-UHFFFAOYSA-N 1 0 317.816 4.089 20 10 DICDRO Oc1ccccc1C[N@@H+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000768531507 1051939939 /nfs/dbraw/zinc/93/99/39/1051939939.db2.gz YCPQIQYXSBDOIX-AWEZNQCLSA-N 1 0 321.342 4.401 20 10 DICDRO C[N@H+](Cc1ccc(-c2ccccc2F)o1)Cc1ccccc1O ZINC000768872929 1051974788 /nfs/dbraw/zinc/97/47/88/1051974788.db2.gz LUOSJHKFHZQHRR-UHFFFAOYSA-N 1 0 311.356 4.423 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1cc(C(F)(F)F)ccc1F ZINC000768872228 1051975637 /nfs/dbraw/zinc/97/56/37/1051975637.db2.gz FVXFFUMNXZRQDB-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO C[N@H+](Cc1ccc(F)c(C(F)(F)F)c1)Cc1ccccc1O ZINC000768872753 1051975826 /nfs/dbraw/zinc/97/58/26/1051975826.db2.gz ICLYZPMVUHUDHD-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO C[N@H+](Cc1cc2ccccc2o1)Cc1c(O)ccc2ccncc21 ZINC000747468025 1051986907 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CCOc1cccc(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)c1O ZINC000769425538 1052044109 /nfs/dbraw/zinc/04/41/09/1052044109.db2.gz QMVXGTVRHGBNSN-ZDUSSCGKSA-N 1 0 315.388 4.049 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)cc1 ZINC000769427348 1052046494 /nfs/dbraw/zinc/04/64/94/1052046494.db2.gz KVXJYDJBMWLTDZ-LJQANCHMSA-N 1 0 312.482 4.043 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000769428247 1052048711 /nfs/dbraw/zinc/04/87/11/1052048711.db2.gz OERZMHBVOMQNGK-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO C[C@H]1SCC[N@H+](Cc2ccc(N3CCCCC3)cc2)[C@@H]1C ZINC000769446325 1052055536 /nfs/dbraw/zinc/05/55/36/1052055536.db2.gz NFOGIQMGJNUOMU-HZPDHXFCSA-N 1 0 304.503 4.003 20 10 DICDRO COc1cccc(C[N@H+](C)[C@H](C)Cc2ccc(Cl)cc2)c1O ZINC000769457073 1052057320 /nfs/dbraw/zinc/05/73/20/1052057320.db2.gz QLUGPJQYIGGIKI-CYBMUJFWSA-N 1 0 319.832 4.117 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000769457216 1052058147 /nfs/dbraw/zinc/05/81/47/1052058147.db2.gz OFNKLZWZXBSLBY-GUYCJALGSA-N 1 0 315.388 4.123 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)c2ccccc21 ZINC000808687380 1052061084 /nfs/dbraw/zinc/06/10/84/1052061084.db2.gz QKYCEMIQLIIIPV-YWZLYKJASA-N 1 0 306.453 4.407 20 10 DICDRO CCC[N@H+](Cc1c(O)cccc1Cl)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000769469718 1052064332 /nfs/dbraw/zinc/06/43/32/1052064332.db2.gz DDBJILIKSXJJPM-CSMYWGQOSA-N 1 0 323.864 4.071 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1O ZINC000808672226 1052064880 /nfs/dbraw/zinc/06/48/80/1052064880.db2.gz GWTKHLAMNNXCCG-CYBMUJFWSA-N 1 0 318.848 4.271 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)c1O ZINC000769492983 1052065249 /nfs/dbraw/zinc/06/52/49/1052065249.db2.gz PPABMLDNFXRVKN-CRAIPNDOSA-N 1 0 311.425 4.026 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000769492450 1052065516 /nfs/dbraw/zinc/06/55/16/1052065516.db2.gz KARNTHWXYRPMKF-RDJZCZTQSA-N 1 0 311.425 4.026 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c1O ZINC000808702804 1052066847 /nfs/dbraw/zinc/06/68/47/1052066847.db2.gz BLCRPSFBFJDSNQ-DUVNUKRYSA-N 1 0 311.853 4.208 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H]2C)c1O ZINC000769498004 1052067587 /nfs/dbraw/zinc/06/75/87/1052067587.db2.gz JDKSNKBXEKJCHJ-CRAIPNDOSA-N 1 0 311.425 4.169 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1C ZINC000769503842 1052068590 /nfs/dbraw/zinc/06/85/90/1052068590.db2.gz OPYBNIXTNNWUFP-LJQANCHMSA-N 1 0 310.441 4.086 20 10 DICDRO CCC1(O)CCC([NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000808703869 1052069012 /nfs/dbraw/zinc/06/90/12/1052069012.db2.gz YRIWMICYZVSGFA-RFSCMCKOSA-N 1 0 311.853 4.088 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c1O ZINC000808706329 1052069146 /nfs/dbraw/zinc/06/91/46/1052069146.db2.gz HDILQTDRKRCGSG-HIFRSBDPSA-N 1 0 323.864 4.496 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](CC)CCc2nccs2)cc1 ZINC000769518209 1052071727 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Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c1O ZINC000808715963 1052076719 /nfs/dbraw/zinc/07/67/19/1052076719.db2.gz ZNBBQIUWAMTFQA-UYHISHBKSA-N 1 0 323.864 4.210 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)c1O ZINC000769548938 1052080192 /nfs/dbraw/zinc/08/01/92/1052080192.db2.gz IWXRBDZRFKUPLW-CZUORRHYSA-N 1 0 315.413 4.275 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)c1O ZINC000769548939 1052080462 /nfs/dbraw/zinc/08/04/62/1052080462.db2.gz IWXRBDZRFKUPLW-XJKSGUPXSA-N 1 0 315.413 4.275 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1COc2ccccc21)c1ccc2ccccc2c1O ZINC000808727593 1052083854 /nfs/dbraw/zinc/08/38/54/1052083854.db2.gz JNMPTMSESXJKHF-ZBFHGGJFSA-N 1 0 319.404 4.372 20 10 DICDRO Cc1nc(C)c(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808694062 1052084710 /nfs/dbraw/zinc/08/47/10/1052084710.db2.gz ZTLAGYOLYLGABH-SNVBAGLBSA-N 1 0 324.877 4.321 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CCO[C@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000769711613 1052096892 /nfs/dbraw/zinc/09/68/92/1052096892.db2.gz REUCPTVOBLEYSW-VQIMIIECSA-N 1 0 312.457 4.060 20 10 DICDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1OCc1ccc(N)cc1 ZINC001217851018 1052156804 /nfs/dbraw/zinc/15/68/04/1052156804.db2.gz WKDBPONRZYOEIN-HXUWFJFHSA-N 1 0 324.468 4.086 20 10 DICDRO C[NH2+][C@H]1C[C@@H](Oc2ccc(/N=N/c3ccc(N(C)C)cc3)cc2)C1 ZINC001217957072 1052178207 /nfs/dbraw/zinc/17/82/07/1052178207.db2.gz QOXJWTNTALRJIJ-KHYWOLFFSA-N 1 0 324.428 4.297 20 10 DICDRO C[C@@H]1CC[NH2+]C[C@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218044120 1052188048 /nfs/dbraw/zinc/18/80/48/1052188048.db2.gz SASCNZLHKRDQRI-QCRUOMNUSA-N 1 0 311.385 4.184 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@@H]1CC[NH2+]C1 ZINC001218035261 1052188587 /nfs/dbraw/zinc/18/85/87/1052188587.db2.gz BAPLDKCQJGKAPV-QGZVFWFLSA-N 1 0 310.401 4.190 20 10 DICDRO c1csc(/N=N/c2c(OC3C[NH2+]C3)ccc3ccccc32)n1 ZINC001218053344 1052189461 /nfs/dbraw/zinc/18/94/61/1052189461.db2.gz YPAGIZJRGADZBZ-FMQUCBEESA-N 1 0 310.382 4.062 20 10 DICDRO C[C@H]1C[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)CC[NH2+]1 ZINC001218052623 1052190203 /nfs/dbraw/zinc/19/02/03/1052190203.db2.gz LROWHENNWWXHFL-SCLBCKFNSA-N 1 0 311.385 4.327 20 10 DICDRO C[C@H](Oc1ccc(/N=N/c2ccc(N(C)C)cc2)cc1)C1C[NH2+]C1 ZINC001218198201 1052206594 /nfs/dbraw/zinc/20/65/94/1052206594.db2.gz DUXRPTQPHMCRMT-OXBTWTFQSA-N 1 0 324.428 4.155 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2C[C@@H]3CC[NH2+][C@H]3C2)=C1 ZINC001218249609 1052212620 /nfs/dbraw/zinc/21/26/20/1052212620.db2.gz KACSUIWQQPLIHV-UXOCRGHBSA-N 1 0 323.396 4.327 20 10 DICDRO C[C@H]1[NH2+]C[C@H]1Oc1ccc2ccccc2c1/N=N/c1nccs1 ZINC001218387528 1052233029 /nfs/dbraw/zinc/23/30/29/1052233029.db2.gz QCSFKGVOPHTZFE-ZNMBODMASA-N 1 0 324.409 4.451 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3C[NH2+]CCC34CC4)cc2)C=C1 ZINC001218401168 1052234091 /nfs/dbraw/zinc/23/40/91/1052234091.db2.gz AHIMATJWLPFIGI-GOSISDBHSA-N 1 0 323.396 4.329 20 10 DICDRO C[C@@H]1CC[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C[NH2+]1 ZINC001218404256 1052234717 /nfs/dbraw/zinc/23/47/17/1052234717.db2.gz ZRXRZOYYAKQPIL-ACJLOTCBSA-N 1 0 311.385 4.327 20 10 DICDRO C[C@H]1C[NH2+]CC[C@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218417336 1052237295 /nfs/dbraw/zinc/23/72/95/1052237295.db2.gz VROMSNQEMRXWGD-LUWDRPHRSA-N 1 0 311.385 4.184 20 10 DICDRO FC1(F)CC[NH2+]C[C@H]1Oc1ccc(/N=N/c2ccccc2)cc1 ZINC001218446774 1052240468 /nfs/dbraw/zinc/24/04/68/1052240468.db2.gz GFMIZDRJFKEVSN-VNRULFPQSA-N 1 0 317.339 4.478 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@@H]3CC[C@H]4C[NH2+]C[C@@H]43)cc2)cc1 ZINC001218459931 1052241011 /nfs/dbraw/zinc/24/10/11/1052241011.db2.gz IXZMRLQVUXCXSA-PJAOBQMKSA-N 1 0 307.397 4.479 20 10 DICDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000317676672 1052393628 /nfs/dbraw/zinc/39/36/28/1052393628.db2.gz PDHVYZXMDQRDDJ-GYSYKLTISA-N 1 0 300.402 4.205 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000153559255 1052394229 /nfs/dbraw/zinc/39/42/29/1052394229.db2.gz FROMENSHSQNRSQ-INIZCTEOSA-N 1 0 303.427 4.190 20 10 DICDRO C[C@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1cc(F)ccc1O ZINC000762626800 1052408755 /nfs/dbraw/zinc/40/87/55/1052408755.db2.gz YMKLJSHIEZUMSM-OPFPJEHXSA-N 1 0 309.425 4.166 20 10 DICDRO CC[N@H+](Cc1ccccc1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000915794108 1052478705 /nfs/dbraw/zinc/47/87/05/1052478705.db2.gz FPYDHNLNCLKNKC-UHFFFAOYSA-N 1 0 313.441 4.417 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2ccc(Cl)cc2)c1 ZINC000915876448 1052525488 /nfs/dbraw/zinc/52/54/88/1052525488.db2.gz WEPWOHPLUSCZDJ-CHWSQXEVSA-N 1 0 319.832 4.336 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000763388935 1052622332 /nfs/dbraw/zinc/62/23/32/1052622332.db2.gz CLTOQIWOBGJFBF-GOSISDBHSA-N 1 0 300.833 4.183 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2ccc(F)c(F)c2)C2CC2)cc1 ZINC000917074324 1052690925 /nfs/dbraw/zinc/69/09/25/1052690925.db2.gz XRMGGDNAHPEKQW-UHFFFAOYSA-N 1 0 316.395 4.195 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000917075066 1052691233 /nfs/dbraw/zinc/69/12/33/1052691233.db2.gz PBLBUERCFOOHQT-UHFFFAOYSA-N 1 0 312.457 4.172 20 10 DICDRO CC(C)[N@H+](Cc1cccc(F)c1)Cc1c(O)ccc2ccncc21 ZINC000919952961 1052906575 /nfs/dbraw/zinc/90/65/75/1052906575.db2.gz ADKRUGPSKMTTPB-UHFFFAOYSA-N 1 0 324.399 4.490 20 10 DICDRO CC(C)n1cc(C[N@H+](Cc2ccccc2O)C2CCCC2)cn1 ZINC000179589098 1053017542 /nfs/dbraw/zinc/01/75/42/1053017542.db2.gz AZAPDVGNZNKFBO-UHFFFAOYSA-N 1 0 313.445 4.114 20 10 DICDRO Nc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000849352900 1053089244 /nfs/dbraw/zinc/08/92/44/1053089244.db2.gz RXZWCNCDCMTYBQ-OAQYLSRUSA-N 1 0 321.468 4.036 20 10 DICDRO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(N3CCCC3)cc2)o1 ZINC001318339322 1053162203 /nfs/dbraw/zinc/16/22/03/1053162203.db2.gz NNHKMVSUZCNZAJ-BEFAXECRSA-N 1 0 310.441 4.293 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@]3(C=Cc4ccccc4O3)C2)c(O)c1 ZINC001474728744 1053194455 /nfs/dbraw/zinc/19/44/55/1053194455.db2.gz PNNYAOWKVFOUNY-NRFANRHFSA-N 1 0 321.420 4.141 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)COc1ccccc1F)c1ccc(N(C)C)cc1 ZINC001319751821 1053269577 /nfs/dbraw/zinc/26/95/77/1053269577.db2.gz XVGPQFKYNYKUPT-LSDHHAIUSA-N 1 0 316.420 4.010 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(Nc2ccccc2Cl)CC1 ZINC001319842387 1053280225 /nfs/dbraw/zinc/28/02/25/1053280225.db2.gz LBBKYYDIRCBJOE-UHFFFAOYSA-N 1 0 316.832 4.122 20 10 DICDRO COc1ccccc1C1([NH2+]Cc2cc(Cl)ccc2O)CCC1 ZINC001319951739 1053287891 /nfs/dbraw/zinc/28/78/91/1053287891.db2.gz PUGRGJPIXOADAZ-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@H](C)c3c1c(O)ccc3C)CO2 ZINC001320134701 1053309957 /nfs/dbraw/zinc/30/99/57/1053309957.db2.gz ZMEWGUFRPVFHNT-NUEKZKHPSA-N 1 0 309.409 4.281 20 10 DICDRO Cc1nc(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)sc1C ZINC001320249349 1053317088 /nfs/dbraw/zinc/31/70/88/1053317088.db2.gz YENDCERPGMVGLD-FZMZJTMJSA-N 1 0 316.470 4.155 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc([C@H](C)O)cc1 ZINC001320249286 1053318019 /nfs/dbraw/zinc/31/80/19/1053318019.db2.gz XCAWUZCLHZGTPU-KEYYUXOJSA-N 1 0 311.425 4.092 20 10 DICDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001320667346 1053353920 /nfs/dbraw/zinc/35/39/20/1053353920.db2.gz OOBPNVWDBUAQAI-INIZCTEOSA-N 1 0 314.395 4.353 20 10 DICDRO CCOC1CC(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)C1 ZINC001320793843 1053361308 /nfs/dbraw/zinc/36/13/08/1053361308.db2.gz ZRIUVXZSQVOZOI-LMPOIIKSSA-N 1 0 303.446 4.044 20 10 DICDRO COc1ccc(Cl)cc1CC[NH2+][C@@H](C)c1ccc(C)cc1O ZINC001321028257 1053384269 /nfs/dbraw/zinc/38/42/69/1053384269.db2.gz RDYURYYMGUMPKL-ZDUSSCGKSA-N 1 0 319.832 4.256 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001321037585 1053385432 /nfs/dbraw/zinc/38/54/32/1053385432.db2.gz OQZXJKFLFWTVFO-LRDDRELGSA-N 1 0 315.388 4.186 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(OC(C)C)c2)c1 ZINC000182433202 1053433303 /nfs/dbraw/zinc/43/33/03/1053433303.db2.gz KXKHVKXSAWNFAR-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO CC[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccccc1O ZINC000183347418 1053640426 /nfs/dbraw/zinc/64/04/26/1053640426.db2.gz DBIZIGCNMJPJHX-CQSZACIVSA-N 1 0 314.410 4.350 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)o1 ZINC001324348104 1053646926 /nfs/dbraw/zinc/64/69/26/1053646926.db2.gz FWCLWHBVBWJZJS-OCCSQVGLSA-N 1 0 314.429 4.288 20 10 DICDRO CCN(CC)[C@H](C[NH2+][C@H](C)c1ccccc1O)c1ccsc1 ZINC000183415647 1053653865 /nfs/dbraw/zinc/65/38/65/1053653865.db2.gz HZYSFSIMANRCNJ-RHSMWYFYSA-N 1 0 318.486 4.187 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]C/C=C\C1CC1 ZINC001324554378 1053661380 /nfs/dbraw/zinc/66/13/80/1053661380.db2.gz LDJREIKIVQQGSN-DAXSKMNVSA-N 1 0 309.409 4.027 20 10 DICDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2F)CC1)c1ccccc1O ZINC000183632205 1053694211 /nfs/dbraw/zinc/69/42/11/1053694211.db2.gz VPLJXMGQYLSQMK-LBPRGKRZSA-N 1 0 303.352 4.053 20 10 DICDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2F)CC1)c1ccccc1O ZINC000183632224 1053695024 /nfs/dbraw/zinc/69/50/24/1053695024.db2.gz VPLJXMGQYLSQMK-GFCCVEGCSA-N 1 0 303.352 4.053 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CCCO[C@@H]1C(C)C ZINC001325357590 1053716014 /nfs/dbraw/zinc/71/60/14/1053716014.db2.gz VHOPUGVLZPFXPX-IHSNIMORSA-N 1 0 317.473 4.290 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccccc1N(C)C ZINC001325356778 1053716223 /nfs/dbraw/zinc/71/62/23/1053716223.db2.gz MJLKXOCHMOJFSM-GOEBONIOSA-N 1 0 310.441 4.105 20 10 DICDRO C[C@H]([NH2+]C1(c2ccc(F)cc2F)CCC1)c1ccccc1O ZINC000183669248 1053717408 /nfs/dbraw/zinc/71/74/08/1053717408.db2.gz RGEUIOVXQDFVIZ-LBPRGKRZSA-N 1 0 303.352 4.400 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001231465930 1053757784 /nfs/dbraw/zinc/75/77/84/1053757784.db2.gz IAYPNTQSKGQTEO-ROUUACIJSA-N 1 0 323.436 4.203 20 10 DICDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001231469186 1053758527 /nfs/dbraw/zinc/75/85/27/1053758527.db2.gz SBVZZOKAEIEJEB-GOSISDBHSA-N 1 0 311.425 4.346 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C2(CC2)C1 ZINC001231470138 1053758702 /nfs/dbraw/zinc/75/87/02/1053758702.db2.gz PCXWFGDWIVVPFX-INIZCTEOSA-N 1 0 323.436 4.346 20 10 DICDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001231466759 1053758907 /nfs/dbraw/zinc/75/89/07/1053758907.db2.gz VFVOGEQAFISFSA-INIZCTEOSA-N 1 0 311.425 4.346 20 10 DICDRO C[N@H+](Cc1ccc(OCc2ccccc2)cc1O)C1CCCC1 ZINC001231469293 1053759624 /nfs/dbraw/zinc/75/96/24/1053759624.db2.gz YNQKDCZMVAQKDE-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO COc1cccc2c1C[N@H+](Cc1c(O)ccc3ccccc31)C2 ZINC001231591128 1053790927 /nfs/dbraw/zinc/79/09/27/1053790927.db2.gz VEROAUKUJDEGFS-UHFFFAOYSA-N 1 0 305.377 4.070 20 10 DICDRO Cc1ccc(O[C@@H]2CCC[N@H+](Cc3cccc(C)c3O)C2)cc1 ZINC001231593173 1053791953 /nfs/dbraw/zinc/79/19/53/1053791953.db2.gz QDJYQADGYWEKDF-LJQANCHMSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cccc(C[NH+]2CCC(c3ccc(F)cc3F)CC2)c1O ZINC001231594296 1053792135 /nfs/dbraw/zinc/79/21/35/1053792135.db2.gz AVKYNOPQYHORMT-UHFFFAOYSA-N 1 0 317.379 4.358 20 10 DICDRO Cc1cccc(C[NH+]2CCC(Cc3ccc(F)cc3)CC2)c1O ZINC001231591928 1053792163 /nfs/dbraw/zinc/79/21/63/1053792163.db2.gz CPFHPQMBVLLUHZ-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO Cc1cccc(C[NH+]2CCC(n3ccc4ccccc43)CC2)c1O ZINC001231593920 1053792216 /nfs/dbraw/zinc/79/22/16/1053792216.db2.gz OMPPHQWUJDRYAE-UHFFFAOYSA-N 1 0 320.436 4.492 20 10 DICDRO Cc1cccc(C[N@H+]2CCC[C@H](Oc3ccccc3C)C2)c1O ZINC001231592384 1053793282 /nfs/dbraw/zinc/79/32/82/1053793282.db2.gz KVFURBFAMHCTSQ-SFHVURJKSA-N 1 0 311.425 4.052 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCc2ncc(Cl)cc2C1 ZINC001231590524 1053793530 /nfs/dbraw/zinc/79/35/30/1053793530.db2.gz GGNCYJKRIOCNFW-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO COc1ccccc1C1CC[NH+](Cc2cccc(C)c2O)CC1 ZINC001231592130 1053793956 /nfs/dbraw/zinc/79/39/56/1053793956.db2.gz CSDRAKBGYSPRAN-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1cccc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c1O ZINC001231591817 1053794044 /nfs/dbraw/zinc/79/40/44/1053794044.db2.gz APAWUEYUJZQSPM-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Cc1cccc(C[NH+]2CCC(Cc3ccccc3F)CC2)c1O ZINC001231593273 1053794190 /nfs/dbraw/zinc/79/41/90/1053794190.db2.gz SOBWNNFIIRCINV-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@H](Sc3ccc(F)cc3)C2)c1O ZINC001231594839 1053796902 /nfs/dbraw/zinc/79/69/02/1053796902.db2.gz PWNRQIDAHRNUTL-KRWDZBQOSA-N 1 0 317.429 4.206 20 10 DICDRO Cc1ccccc1OCCC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001327213761 1053840876 /nfs/dbraw/zinc/84/08/76/1053840876.db2.gz YTPWFFMPKMYYBV-UHFFFAOYSA-N 1 0 324.468 4.154 20 10 DICDRO CSCC1(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001327269682 1053846220 /nfs/dbraw/zinc/84/62/20/1053846220.db2.gz ZTUAHHBPJQUHHI-KGLIPLIRSA-N 1 0 305.487 4.372 20 10 DICDRO C[C@@H]([NH2+]CCCc1nccs1)c1ccc2ccccc2c1O ZINC000273539467 1053850465 /nfs/dbraw/zinc/85/04/65/1053850465.db2.gz XXOXRIRIRVOBPT-CYBMUJFWSA-N 1 0 312.438 4.285 20 10 DICDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)s1 ZINC000273579521 1053850757 /nfs/dbraw/zinc/85/07/57/1053850757.db2.gz MHNVGJFMVNDNSN-NSHDSACASA-N 1 0 312.438 4.470 20 10 DICDRO Nc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001327416140 1053859179 /nfs/dbraw/zinc/85/91/79/1053859179.db2.gz OSJNCXPJNABBGZ-NRFANRHFSA-N 1 0 321.468 4.036 20 10 DICDRO CC[C@H]([NH2+][C@H]1CC[C@@H](OC)C1)c1ccc(C(F)(F)F)cc1O ZINC001327534005 1053861963 /nfs/dbraw/zinc/86/19/63/1053861963.db2.gz VHDXCCMCJNPPIM-SCRDCRAPSA-N 1 0 317.351 4.019 20 10 DICDRO COc1cccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c1C ZINC001327614500 1053868768 /nfs/dbraw/zinc/86/87/68/1053868768.db2.gz UWUIDBYIQUSGFF-CJNGLKHVSA-N 1 0 311.425 4.356 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(C)cc(C)cc2O)cc1 ZINC001231844049 1053886654 /nfs/dbraw/zinc/88/66/54/1053886654.db2.gz FYWWQRGGBGXRPU-LJQANCHMSA-N 1 0 311.425 4.355 20 10 DICDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2c(C)cc(C)cc2O)C1 ZINC001231843325 1053888440 /nfs/dbraw/zinc/88/84/40/1053888440.db2.gz VWRSDXBBPGYZRU-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001231851852 1053890091 /nfs/dbraw/zinc/89/00/91/1053890091.db2.gz IVZVNSZULSIILV-GOSISDBHSA-N 1 0 324.468 4.141 20 10 DICDRO COc1cc(N(C)C)ccc1C[NH+]1CCC(c2ccccc2)CC1 ZINC001231852436 1053891618 /nfs/dbraw/zinc/89/16/18/1053891618.db2.gz VDCWVKNJZXWTBR-UHFFFAOYSA-N 1 0 324.468 4.141 20 10 DICDRO CC[N@H+](CCc1ccc(OC)cc1)Cc1c(C)cc(C)cc1O ZINC001231848832 1053891751 /nfs/dbraw/zinc/89/17/51/1053891751.db2.gz JNLLXDYWSGOLDG-UHFFFAOYSA-N 1 0 313.441 4.082 20 10 DICDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)c(C)cc2O)cn1 ZINC001231870053 1053899676 /nfs/dbraw/zinc/89/96/76/1053899676.db2.gz HLQYQBBIZDFIAM-QGZVFWFLSA-N 1 0 316.832 4.395 20 10 DICDRO C[N@H+](Cc1ccc2ccnc(Cl)c2c1)Cc1ccccc1O ZINC001231979756 1053930605 /nfs/dbraw/zinc/93/06/05/1053930605.db2.gz VBBGIKRPKZRUDL-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccnc2c(F)cccc12 ZINC001232212496 1053989036 /nfs/dbraw/zinc/98/90/36/1053989036.db2.gz STTWLRLKFFJWHF-UHFFFAOYSA-N 1 0 310.372 4.102 20 10 DICDRO CC[C@@H](C[NH2+]Cc1ccc(OC)c(C)c1)Oc1ccccc1C ZINC001200813844 1053999591 /nfs/dbraw/zinc/99/95/91/1053999591.db2.gz ZLJUIMRYIXTADW-SFHVURJKSA-N 1 0 313.441 4.259 20 10 DICDRO C[N@H+](Cc1cc(Cl)c(O)cc1O)Cc1ccccc1Cl ZINC001232261085 1054005324 /nfs/dbraw/zinc/00/53/24/1054005324.db2.gz BULRECCECQENAU-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232257389 1054007317 /nfs/dbraw/zinc/00/73/17/1054007317.db2.gz DTFYATPVFGXKNQ-INIZCTEOSA-N 1 0 317.816 4.397 20 10 DICDRO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232257390 1054007968 /nfs/dbraw/zinc/00/79/68/1054007968.db2.gz DTFYATPVFGXKNQ-MRXNPFEDSA-N 1 0 317.816 4.397 20 10 DICDRO CC[N@H+](Cc1ccccc1F)Cc1cc(Cl)c(OC)cc1O ZINC001232269468 1054010802 /nfs/dbraw/zinc/01/08/02/1054010802.db2.gz BKYSEYCSTVXMGW-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO CC(C)[N@H+](Cc1nc2ccccc2[nH]1)Cc1ccc(N(C)C)cc1 ZINC001330857558 1054055149 /nfs/dbraw/zinc/05/51/49/1054055149.db2.gz XVDKSNCKFKZIHD-UHFFFAOYSA-N 1 0 322.456 4.040 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCSc3ccc(F)cc31)CC2 ZINC000295816688 1054083624 /nfs/dbraw/zinc/08/36/24/1054083624.db2.gz DANGQBFQZCVEHO-LSDHHAIUSA-N 1 0 315.413 4.345 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cc1)CC2 ZINC000296152496 1054084857 /nfs/dbraw/zinc/08/48/57/1054084857.db2.gz WUOZWCGTFCVFKZ-AWEZNQCLSA-N 1 0 307.315 4.188 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1cccc(C(F)(F)F)c1)CC2 ZINC000296104619 1054084981 /nfs/dbraw/zinc/08/49/81/1054084981.db2.gz UNWISLHUPVOBAF-AWEZNQCLSA-N 1 0 307.315 4.188 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1OC(F)F ZINC000296024410 1054085087 /nfs/dbraw/zinc/08/50/87/1054085087.db2.gz PRQJCYJBGHOIDV-SMDDNHRTSA-N 1 0 319.351 4.332 20 10 DICDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCSC2(CCC2)C1 ZINC001332328766 1054115320 /nfs/dbraw/zinc/11/53/20/1054115320.db2.gz CBBAOYQVHLRZRG-QGZVFWFLSA-N 1 0 316.514 4.195 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000848496407 1054116295 /nfs/dbraw/zinc/11/62/95/1054116295.db2.gz BAFQBWIBUTXEMO-KRWDZBQOSA-N 1 0 311.425 4.079 20 10 DICDRO Cc1cc(C)cc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2O)c1 ZINC001232841536 1054128341 /nfs/dbraw/zinc/12/83/41/1054128341.db2.gz IUQOAHOADCVKON-FQEVSTJZSA-N 1 0 324.468 4.412 20 10 DICDRO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(N(C)C)cc1O ZINC001232836371 1054128466 /nfs/dbraw/zinc/12/84/66/1054128466.db2.gz OQDNWGFKQNUPIA-LJQANCHMSA-N 1 0 310.441 4.104 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2ccc(F)c(F)c2Cl)cc1 ZINC001232879682 1054137875 /nfs/dbraw/zinc/13/78/75/1054137875.db2.gz SVXVZJSDKXEFFC-UHFFFAOYSA-N 1 0 324.802 4.316 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000848560083 1054149544 /nfs/dbraw/zinc/14/95/44/1054149544.db2.gz JTEUFQGXJHRWSF-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@H](Cc1ccccn1)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000848566056 1054153227 /nfs/dbraw/zinc/15/32/27/1054153227.db2.gz WLNAXEKRLQSHRJ-QZTJIDSGSA-N 1 0 323.484 4.354 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)Cc1ccccn1)c1ccc(N2CCCCC2)cc1 ZINC000848566060 1054153562 /nfs/dbraw/zinc/15/35/62/1054153562.db2.gz WLNAXEKRLQSHRJ-ZWKOTPCHSA-N 1 0 323.484 4.354 20 10 DICDRO C[C@@H]([NH2+][C@H](C)C1CCC(F)(F)CC1)c1cc(F)ccc1O ZINC000848567713 1054155233 /nfs/dbraw/zinc/15/52/33/1054155233.db2.gz LVJBROIMZAAOBN-GHMZBOCLSA-N 1 0 301.352 4.396 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2noc3ccccc32)c2c1c(F)ccc2O ZINC000848574209 1054156886 /nfs/dbraw/zinc/15/68/86/1054156886.db2.gz BYNHTOZWUOVBHZ-ZWNOBZJWSA-N 1 0 312.344 4.011 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)C2CCC(F)(F)CC2)c1O ZINC000848574800 1054158341 /nfs/dbraw/zinc/15/83/41/1054158341.db2.gz IPPBLVDSTLBUQF-GFCCVEGCSA-N 1 0 313.388 4.095 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c(Cl)n1 ZINC001333595600 1054162662 /nfs/dbraw/zinc/16/26/62/1054162662.db2.gz LSKXYAXCNBJMOJ-FZMZJTMJSA-N 1 0 316.832 4.396 20 10 DICDRO [O-]c1cc(Br)cc(F)c1C[NH+]1CCCCCCC1 ZINC001233031828 1054173660 /nfs/dbraw/zinc/17/36/60/1054173660.db2.gz NYICZOICVHPERP-UHFFFAOYSA-N 1 0 316.214 4.060 20 10 DICDRO Cc1cc(Br)cc(C[NH+]2CCC3(CCC3)CC2)c1O ZINC001233107307 1054185553 /nfs/dbraw/zinc/18/55/53/1054185553.db2.gz XISLDNBYTIMZOW-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c1O ZINC001233109395 1054185240 /nfs/dbraw/zinc/18/52/40/1054185240.db2.gz VEFLSHKEALUQTI-STQMWFEESA-N 1 0 324.262 4.085 20 10 DICDRO Nc1ccc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)cc1 ZINC001334753900 1054197277 /nfs/dbraw/zinc/19/72/77/1054197277.db2.gz HSIWNCQUFADECP-UHFFFAOYSA-N 1 0 306.331 4.067 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC3(CC(F)C3)CC2)c1 ZINC001233284054 1054221538 /nfs/dbraw/zinc/22/15/38/1054221538.db2.gz GLRIUJYCEBCKTG-UHFFFAOYSA-N 1 0 305.437 4.404 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c1 ZINC001233284407 1054222313 /nfs/dbraw/zinc/22/23/13/1054222313.db2.gz TVNYXNQCFSABAM-SFHVURJKSA-N 1 0 310.441 4.422 20 10 DICDRO CCCOC1CC[NH+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233286081 1054222976 /nfs/dbraw/zinc/22/29/76/1054222976.db2.gz DQJIBPBYANSPCN-UHFFFAOYSA-N 1 0 305.462 4.081 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(N)cc1Cl ZINC001233377143 1054252595 /nfs/dbraw/zinc/25/25/95/1054252595.db2.gz QBDCGQRKGCOYCO-UHFFFAOYSA-N 1 0 317.864 4.010 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc2c(cc1O)CCCC2 ZINC000184894778 1054253861 /nfs/dbraw/zinc/25/38/61/1054253861.db2.gz XTLPLVIWDFZIIT-HNNXBMFYSA-N 1 0 324.468 4.188 20 10 DICDRO C[N@H+](Cc1cccc(F)c1)Cc1ccc(C(F)(F)F)cc1O ZINC001233452493 1054276150 /nfs/dbraw/zinc/27/61/50/1054276150.db2.gz YMXJNIKXXJGNCE-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO Cc1cccc2c1C[N@H+](Cc1ccc(C(F)(F)F)cc1O)C2 ZINC001233451909 1054278362 /nfs/dbraw/zinc/27/83/62/1054278362.db2.gz DCHDVCYKGNHUKE-UHFFFAOYSA-N 1 0 307.315 4.235 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc(N(C)C)cc1C ZINC001337784542 1054286023 /nfs/dbraw/zinc/28/60/23/1054286023.db2.gz CAIBIPDGSOQBAL-CRAIPNDOSA-N 1 0 324.468 4.413 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1OCCc2ccccc21 ZINC001337797761 1054286083 /nfs/dbraw/zinc/28/60/83/1054286083.db2.gz CWINSXLSRRWXJG-LJHODMEESA-N 1 0 323.436 4.153 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2)c1O ZINC000848892617 1054286053 /nfs/dbraw/zinc/28/60/53/1054286053.db2.gz CDFPTRQWTQRDBV-UHFFFAOYSA-N 1 0 309.331 4.263 20 10 DICDRO COc1cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)ccc1C ZINC001337786058 1054286460 /nfs/dbraw/zinc/28/64/60/1054286460.db2.gz UVAAHAARNJYYBN-HOCLYGCPSA-N 1 0 311.425 4.356 20 10 DICDRO CCCOCc1ccccc1C[NH2+]Cc1cccc(CC)c1O ZINC000848893506 1054287567 /nfs/dbraw/zinc/28/75/67/1054287567.db2.gz FKGDKQZGIQRKEN-UHFFFAOYSA-N 1 0 313.441 4.171 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)c1O ZINC000848894889 1054287717 /nfs/dbraw/zinc/28/77/17/1054287717.db2.gz NGPPEKUPTWBPTO-GOSISDBHSA-N 1 0 323.440 4.318 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)c1O ZINC000848893790 1054287848 /nfs/dbraw/zinc/28/78/48/1054287848.db2.gz HFXIJZLYRWRIMY-KRWDZBQOSA-N 1 0 315.388 4.097 20 10 DICDRO CCc1cccc(C[NH2+]Cc2coc(-c3ccc(C)cc3)n2)c1O ZINC000848897803 1054288386 /nfs/dbraw/zinc/28/83/86/1054288386.db2.gz MALBGPSQOYMONG-UHFFFAOYSA-N 1 0 322.408 4.208 20 10 DICDRO CCc1cccc(C[NH2+]C2(c3nc(C)cs3)CCCC2)c1O ZINC000848897723 1054288477 /nfs/dbraw/zinc/28/84/77/1054288477.db2.gz UGFRSKINRDIGHP-UHFFFAOYSA-N 1 0 316.470 4.279 20 10 DICDRO CCc1cccc(C[NH2+]Cc2cc(F)ccc2SC)c1O ZINC000848898635 1054289646 /nfs/dbraw/zinc/28/96/46/1054289646.db2.gz WVYAKYKGRWYDOV-UHFFFAOYSA-N 1 0 305.418 4.105 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCO[C@H](C(CC)CC)C2)c1O ZINC000848901086 1054290839 /nfs/dbraw/zinc/29/08/39/1054290839.db2.gz OQRWDWZVCQUQHF-ROUUACIJSA-N 1 0 305.462 4.028 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(COC)o2)c1O ZINC000848902912 1054292927 /nfs/dbraw/zinc/29/29/27/1054292927.db2.gz JSQHKPJVISBVNN-QGZVFWFLSA-N 1 0 315.413 4.031 20 10 DICDRO CCc1cccc(C[NH2+][C@H](COC)c2cccc(Cl)c2)c1O ZINC000848912854 1054295408 /nfs/dbraw/zinc/29/54/08/1054295408.db2.gz KYTKASSEUBQGOJ-QGZVFWFLSA-N 1 0 319.832 4.085 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c1O ZINC000848915169 1054296049 /nfs/dbraw/zinc/29/60/49/1054296049.db2.gz SMTNJLVSAJRUDX-CQSZACIVSA-N 1 0 321.342 4.149 20 10 DICDRO Oc1c(C[NH2+]C[C@H]2CCC3(CCCC3)O2)ccc2ccccc21 ZINC000848928232 1054302767 /nfs/dbraw/zinc/30/27/67/1054302767.db2.gz BDELLJKZYSMGHX-QGZVFWFLSA-N 1 0 311.425 4.127 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2cccc(C(F)F)c2)c1O ZINC001338641573 1054311605 /nfs/dbraw/zinc/31/16/05/1054311605.db2.gz MHWYWLBJQLXZKF-UHFFFAOYSA-N 1 0 307.340 4.018 20 10 DICDRO Cc1cccc(O[C@@H](C)C[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001339510751 1054340769 /nfs/dbraw/zinc/34/07/69/1054340769.db2.gz VWQVMBBKDUAUGO-SFHVURJKSA-N 1 0 324.468 4.152 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CC1(c2ccccn2)CCC1 ZINC001340993261 1054373581 /nfs/dbraw/zinc/37/35/81/1054373581.db2.gz ZDQFNQAEPZDOAX-JKSUJKDBSA-N 1 0 322.452 4.355 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001342409741 1054421100 /nfs/dbraw/zinc/42/11/00/1054421100.db2.gz WVXDPPAGNSNDFT-TYNCELHUSA-N 1 0 314.429 4.247 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1[C@H]2CCCO[C@H]2C1(C)C ZINC001342406513 1054421208 /nfs/dbraw/zinc/42/12/08/1054421208.db2.gz LUMRZCBMYLFXOP-CGNAIUDPSA-N 1 0 315.457 4.042 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCCOCc2ccccc2)c1 ZINC000185246804 1054487566 /nfs/dbraw/zinc/48/75/66/1054487566.db2.gz JCEDVOYDOGHTLP-KRWDZBQOSA-N 1 0 313.441 4.348 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)S3)c2c1c(F)ccc2O ZINC001345123869 1054488243 /nfs/dbraw/zinc/48/82/43/1054488243.db2.gz RBYBOCFODFKVDP-WPSPGLCESA-N 1 0 307.434 4.096 20 10 DICDRO C[C@H]([NH2+]CCCCOCc1ccccc1)c1cc(F)ccc1O ZINC000185247204 1054488377 /nfs/dbraw/zinc/48/83/77/1054488377.db2.gz MESHKMOMROUCEG-HNNXBMFYSA-N 1 0 317.404 4.179 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCCC[C@](C)(F)C3)c2c1 ZINC001234526465 1054542972 /nfs/dbraw/zinc/54/29/72/1054542972.db2.gz WEIIIEWENZUFII-IBGZPJMESA-N 1 0 317.404 4.268 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC2CC2)c(O)c1 ZINC000185516657 1054560097 /nfs/dbraw/zinc/56/00/97/1054560097.db2.gz NBTCXTQHLZCKLM-HNNXBMFYSA-N 1 0 311.425 4.340 20 10 DICDRO Cc1cc[nH+]c(NCc2cc(Cl)c3cccnc3c2O)c1C ZINC001168528640 1054568886 /nfs/dbraw/zinc/56/88/86/1054568886.db2.gz XKBDEXHTRDTPJV-UHFFFAOYSA-N 1 0 313.788 4.218 20 10 DICDRO Oc1c(C[NH2+][C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)ccc2ccccc21 ZINC001347427029 1054569086 /nfs/dbraw/zinc/56/90/86/1054569086.db2.gz VTVBHBSHSOUUSS-BMFZPTHFSA-N 1 0 303.352 4.069 20 10 DICDRO Oc1c(C[NH2+][C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)ccc2ccccc21 ZINC001347427054 1054570556 /nfs/dbraw/zinc/57/05/56/1054570556.db2.gz VTVBHBSHSOUUSS-VNQPRFMTSA-N 1 0 303.352 4.069 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)c(O)c1 ZINC000185571507 1054583140 /nfs/dbraw/zinc/58/31/40/1054583140.db2.gz JDQPWVFPRCHVSF-CQSZACIVSA-N 1 0 308.381 4.206 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)Sc2ccccc2)c1 ZINC000185580585 1054586435 /nfs/dbraw/zinc/58/64/35/1054586435.db2.gz CTBPCYLYGXTKPW-UONOGXRCSA-N 1 0 317.454 4.232 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@H](C(F)(F)F)C2)cccc1-c1ccccc1 ZINC001234996846 1054636960 /nfs/dbraw/zinc/63/69/60/1054636960.db2.gz NJUNWOMYZYCQRX-HNNXBMFYSA-N 1 0 321.342 4.443 20 10 DICDRO CC[N@H+](Cc1cccc(-c2ccccc2)c1O)C1CCOCC1 ZINC001234993330 1054637505 /nfs/dbraw/zinc/63/75/05/1054637505.db2.gz BZFJOIXTHGJTFG-UHFFFAOYSA-N 1 0 311.425 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)cccc1-c1ccccc1 ZINC001234992675 1054637683 /nfs/dbraw/zinc/63/76/83/1054637683.db2.gz QGPVMRFLRPTRDI-XLIONFOSSA-N 1 0 323.436 4.060 20 10 DICDRO CCCCOC1C[NH+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234993211 1054637719 /nfs/dbraw/zinc/63/77/19/1054637719.db2.gz AETCEZTUMOXJDD-UHFFFAOYSA-N 1 0 311.425 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)cccc1-c1ccccc1 ZINC001234992663 1054638227 /nfs/dbraw/zinc/63/82/27/1054638227.db2.gz QGPVMRFLRPTRDI-FXAWDEMLSA-N 1 0 323.436 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@]3(C2)CCCCO3)cccc1-c1ccccc1 ZINC001235002317 1054640319 /nfs/dbraw/zinc/64/03/19/1054640319.db2.gz PAPNMNDWEFPKGO-NRFANRHFSA-N 1 0 323.436 4.204 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)c1cc(Br)ccc1O ZINC001349314795 1054736202 /nfs/dbraw/zinc/73/62/02/1054736202.db2.gz ZQRUDIDJSSPAAV-MVWJERBFSA-N 1 0 316.214 4.086 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1ccccc1-c1ccncc1 ZINC001235621826 1054756563 /nfs/dbraw/zinc/75/65/63/1054756563.db2.gz VDCAKYWCZRPKKZ-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2nccs2)c(O)c1 ZINC001235677450 1054769885 /nfs/dbraw/zinc/76/98/85/1054769885.db2.gz DWRNLJIYNINKQX-OAHLLOKOSA-N 1 0 316.470 4.483 20 10 DICDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(C(C)(C)C)cc2O)no1 ZINC001235674612 1054772300 /nfs/dbraw/zinc/77/23/00/1054772300.db2.gz HCCZOJMRKPSWKF-QGZVFWFLSA-N 1 0 314.429 4.323 20 10 DICDRO CN(CC(=O)c1ccccc1)Cc1ccc(C(C)(C)C)cc1O ZINC001235681080 1054774034 /nfs/dbraw/zinc/77/40/34/1054774034.db2.gz XPYZCGQZGMKLIH-UHFFFAOYSA-N 1 0 311.425 4.004 20 10 DICDRO Nc1ccc(C[NH+]2CCC(c3nc4ccccc4s3)CC2)cc1 ZINC001235690000 1054777758 /nfs/dbraw/zinc/77/77/58/1054777758.db2.gz DKFWAPPVIQNSLZ-UHFFFAOYSA-N 1 0 323.465 4.258 20 10 DICDRO CC(C)(C)c1ccc(C[NH+]2CCC(c3ccncc3)CC2)c(O)c1 ZINC001235685397 1054779373 /nfs/dbraw/zinc/77/93/73/1054779373.db2.gz POIBJCVZDRSFMS-UHFFFAOYSA-N 1 0 324.468 4.464 20 10 DICDRO Cc1cc(Br)cc(C[N@H+]2CC(C)(C)C[C@@H]2C)c1O ZINC001474582635 1054830237 /nfs/dbraw/zinc/83/02/37/1054830237.db2.gz LRCVKVNFNMOEFY-NSHDSACASA-N 1 0 312.251 4.084 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1OC1CCC1)c1cc(F)ccc1O ZINC000186055682 1054870809 /nfs/dbraw/zinc/87/08/09/1054870809.db2.gz UTEBZSPDJZGKHR-CYBMUJFWSA-N 1 0 315.388 4.313 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(N)cc2)CCc2ccc(Cl)cc21 ZINC001236084928 1054934028 /nfs/dbraw/zinc/93/40/28/1054934028.db2.gz GXDPVVNNPQKHGQ-ZDUSSCGKSA-N 1 0 300.833 4.084 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2c[nH]c3ccccc32)c1O ZINC001236190131 1054987198 /nfs/dbraw/zinc/98/71/98/1054987198.db2.gz FGYJRSFVSPGJMR-GOSISDBHSA-N 1 0 322.408 4.219 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2c[nH]c3ccccc32)c1 ZINC001236189684 1054988050 /nfs/dbraw/zinc/98/80/50/1054988050.db2.gz BZNBOJQBRKMGDH-IBGZPJMESA-N 1 0 322.408 4.219 20 10 DICDRO Cc1cccc([C@@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000764140872 1055115347 /nfs/dbraw/zinc/11/53/47/1055115347.db2.gz QGXJLVAAQIXHHX-GOSISDBHSA-N 1 0 324.468 4.025 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1Br ZINC000768874083 1055139276 /nfs/dbraw/zinc/13/92/76/1055139276.db2.gz ZWKJDUYVVUOHTJ-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)N(C)C)c1ccc(N2CCCCCC2)cc1 ZINC000764534227 1055205543 /nfs/dbraw/zinc/20/55/43/1055205543.db2.gz WVXCQVXFHGNRJH-KRWDZBQOSA-N 1 0 317.521 4.058 20 10 DICDRO CC1(C)CC[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001236784379 1055257727 /nfs/dbraw/zinc/25/77/27/1055257727.db2.gz CRYRPIKMVBFGKY-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[NH+]1C2CCC1CC2 ZINC001236782183 1055258635 /nfs/dbraw/zinc/25/86/35/1055258635.db2.gz JPNSZQSJYORUOO-UHFFFAOYSA-N 1 0 309.409 4.098 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[N@@H+]1CC2CCC1CC2 ZINC001236790094 1055260505 /nfs/dbraw/zinc/26/05/05/1055260505.db2.gz UTEYMCLKWKXGHK-UHFFFAOYSA-N 1 0 323.436 4.346 20 10 DICDRO Cc1ncccc1C[N@@H+](C)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236803772 1055265834 /nfs/dbraw/zinc/26/58/34/1055265834.db2.gz OXRGTBOPCIZJBI-UHFFFAOYSA-N 1 0 311.212 4.034 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c([O-])c1Cl ZINC001236804031 1055266451 /nfs/dbraw/zinc/26/64/51/1055266451.db2.gz WUVOIYRVMVSJIB-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO COc1cc(C)c(C[NH+]2CCC(c3ccccc3)CC2)c(O)c1 ZINC001236807976 1055266619 /nfs/dbraw/zinc/26/66/19/1055266619.db2.gz IWCVSYDNBAAPME-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c([O-])c1Cl ZINC001236811469 1055272852 /nfs/dbraw/zinc/27/28/52/1055272852.db2.gz KIVUVRWTOKTOBS-TZMCWYRMSA-N 1 0 309.837 4.209 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1cc3ccccc3cc1O)C2 ZINC001236831498 1055284726 /nfs/dbraw/zinc/28/47/26/1055284726.db2.gz HVJXHXFPNVTUFP-UHFFFAOYSA-N 1 0 305.377 4.070 20 10 DICDRO C[N@H+](CCOc1ccccc1)Cc1cc2ccccc2cc1O ZINC001236841425 1055287422 /nfs/dbraw/zinc/28/74/22/1055287422.db2.gz JWJZMOZFSKWADV-UHFFFAOYSA-N 1 0 307.393 4.056 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccnc(Cl)c1 ZINC000764904062 1055290699 /nfs/dbraw/zinc/29/06/99/1055290699.db2.gz XQSPDAWPQUHICT-AWEZNQCLSA-N 1 0 315.848 4.186 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccnc(Cl)c1 ZINC000764904065 1055290883 /nfs/dbraw/zinc/29/08/83/1055290883.db2.gz XQSPDAWPQUHICT-CQSZACIVSA-N 1 0 315.848 4.186 20 10 DICDRO C[C@H]([NH2+]CCCOc1ccccc1F)c1ccc(N(C)C)cc1 ZINC000764924529 1055297742 /nfs/dbraw/zinc/29/77/42/1055297742.db2.gz BJLMCJKWYQENMN-HNNXBMFYSA-N 1 0 316.420 4.011 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2ccc(C(F)F)cc2)c(O)c1 ZINC000764978999 1055304516 /nfs/dbraw/zinc/30/45/16/1055304516.db2.gz BOQVPYHKPHJCAZ-UHFFFAOYSA-N 1 0 307.340 4.018 20 10 DICDRO CC(C)Oc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000765095821 1055327344 /nfs/dbraw/zinc/32/73/44/1055327344.db2.gz PLTVXCYQXPCRFW-INIZCTEOSA-N 1 0 312.457 4.391 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c(O)c1 ZINC001237041026 1055347469 /nfs/dbraw/zinc/34/74/69/1055347469.db2.gz AONZNGWGZSAZQP-KRWDZBQOSA-N 1 0 311.425 4.171 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](OC)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000765261040 1055348135 /nfs/dbraw/zinc/34/81/35/1055348135.db2.gz LVAOJXWAWYWOJM-UXHICEINSA-N 1 0 312.457 4.181 20 10 DICDRO CCOc1ccc(C[N@H+](Cc2ccccc2)C2CCC2)c(O)c1 ZINC001237046779 1055348902 /nfs/dbraw/zinc/34/89/02/1055348902.db2.gz FUHOPOXSIOHMAS-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCN(C)C[C@H]2c2ccccc2)c(O)c1 ZINC001237045814 1055348967 /nfs/dbraw/zinc/34/89/67/1055348967.db2.gz LGPLXQCKXAVYEC-FQEVSTJZSA-N 1 0 324.468 4.004 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c(O)c1 ZINC001237045966 1055349916 /nfs/dbraw/zinc/34/99/16/1055349916.db2.gz NQXJMUZGNQZFHJ-HNNXBMFYSA-N 1 0 301.352 4.085 20 10 DICDRO CCC[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)[C@H](C)CC ZINC001237051359 1055350702 /nfs/dbraw/zinc/35/07/02/1055350702.db2.gz LBEYQGLWARZEMC-GFCCVEGCSA-N 1 0 319.367 4.344 20 10 DICDRO COc1cccc(CC[N@H+](C)Cc2ccc(C(C)C)cc2O)c1 ZINC001237050213 1055351227 /nfs/dbraw/zinc/35/12/27/1055351227.db2.gz ZCLADCURLGRGBU-UHFFFAOYSA-N 1 0 313.441 4.199 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)CC/C=C/c2cccnc2)c(O)c1 ZINC001237054964 1055353412 /nfs/dbraw/zinc/35/34/12/1055353412.db2.gz JUSTVGVUMKODJO-QPJJXVBHSA-N 1 0 310.441 4.446 20 10 DICDRO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc(C(C)C)cc1O)CC2 ZINC001237055842 1055356277 /nfs/dbraw/zinc/35/62/77/1055356277.db2.gz QXNGWVZKBREXJP-UHFFFAOYSA-N 1 0 323.436 4.277 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001237053601 1055356455 /nfs/dbraw/zinc/35/64/55/1055356455.db2.gz OLUDATZYNFQWNP-CQSZACIVSA-N 1 0 301.352 4.290 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c(O)c1 ZINC001237053544 1055356874 /nfs/dbraw/zinc/35/68/74/1055356874.db2.gz MMVQKRMZWXJNDS-KRWDZBQOSA-N 1 0 310.441 4.290 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)CCc2cccc(F)c2)c(O)c1 ZINC001237056685 1055356924 /nfs/dbraw/zinc/35/69/24/1055356924.db2.gz ZARPJLMZWQXEHB-UHFFFAOYSA-N 1 0 301.405 4.329 20 10 DICDRO CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000765312228 1055359994 /nfs/dbraw/zinc/35/99/94/1055359994.db2.gz ALVPSZYFBOFNQK-ZNMIVQPWSA-N 1 0 324.896 4.262 20 10 DICDRO CC(C)=CCC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000765329444 1055361757 /nfs/dbraw/zinc/36/17/57/1055361757.db2.gz JFCWFAMQCGDQKY-ZWKOTPCHSA-N 1 0 316.489 4.309 20 10 DICDRO CC(C)OC1CC[NH+](Cc2c([O-])ccc(Cl)c2Cl)CC1 ZINC001237083004 1055369265 /nfs/dbraw/zinc/36/92/65/1055369265.db2.gz VUSRSZZETOUQIM-UHFFFAOYSA-N 1 0 318.244 4.088 20 10 DICDRO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237118798 1055374544 /nfs/dbraw/zinc/37/45/44/1055374544.db2.gz BEDXLXUHISPPAV-GHMZBOCLSA-N 1 0 303.324 4.054 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[NH+]1CC(c2ccccc2)C1 ZINC001237139019 1055378704 /nfs/dbraw/zinc/37/87/04/1055378704.db2.gz BPRFRSQRZDLKER-UHFFFAOYSA-N 1 0 307.315 4.010 20 10 DICDRO C[N@H+](CCCc1ccccc1)Cc1c(O)ccc(F)c1Cl ZINC001237125761 1055379375 /nfs/dbraw/zinc/37/93/75/1055379375.db2.gz VNHKCOBEQSDUQR-UHFFFAOYSA-N 1 0 307.796 4.249 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[NH+]1CCCCCCC1 ZINC001237122269 1055379514 /nfs/dbraw/zinc/37/95/14/1055379514.db2.gz HFBJXZJCPFWXNC-UHFFFAOYSA-N 1 0 303.324 4.057 20 10 DICDRO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765482870 1055404019 /nfs/dbraw/zinc/40/40/19/1055404019.db2.gz WHKUNZSMDJJVBX-VFNWGFHPSA-N 1 0 306.453 4.092 20 10 DICDRO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765482866 1055404029 /nfs/dbraw/zinc/40/40/29/1055404029.db2.gz WHKUNZSMDJJVBX-QVKFZJNVSA-N 1 0 306.453 4.092 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001237487171 1055458922 /nfs/dbraw/zinc/45/89/22/1055458922.db2.gz GUVHNUORIHHBEQ-AWEZNQCLSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC2(CC1)O[C@H](C)c1ccccc12 ZINC001237495724 1055461700 /nfs/dbraw/zinc/46/17/00/1055461700.db2.gz UTKWOKNSJPUCMO-MRXNPFEDSA-N 1 0 323.436 4.283 20 10 DICDRO Cc1ccc(O[C@H]2CCC[N@H+](Cc3c(C)cccc3O)C2)cc1 ZINC001237490658 1055462136 /nfs/dbraw/zinc/46/21/36/1055462136.db2.gz ZFOUXJQWBBJGJZ-SFHVURJKSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC(Cc2cccc(F)c2)CC1 ZINC001237492448 1055462225 /nfs/dbraw/zinc/46/22/25/1055462225.db2.gz QDJLZTPRSFVKPF-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001237621619 1055485496 /nfs/dbraw/zinc/48/54/96/1055485496.db2.gz DEGZAJDDQNZQQW-UHFFFAOYSA-N 1 0 317.791 4.474 20 10 DICDRO C[C@]1(CF)CC[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001237640295 1055490961 /nfs/dbraw/zinc/49/09/61/1055490961.db2.gz AAPCRMYCGMLIAB-LJQANCHMSA-N 1 0 317.379 4.380 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(Cl)c(F)c1 ZINC001620863788 1055491576 /nfs/dbraw/zinc/49/15/76/1055491576.db2.gz CVVXPHPBJIIKHJ-NSHDSACASA-N 1 0 305.780 4.265 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCC[C@H](F)C1 ZINC001237642470 1055491743 /nfs/dbraw/zinc/49/17/43/1055491743.db2.gz CAEKFIVBJYBBHP-KRWDZBQOSA-N 1 0 303.352 4.132 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(Cl)c(F)c1 ZINC001620863787 1055492180 /nfs/dbraw/zinc/49/21/80/1055492180.db2.gz CVVXPHPBJIIKHJ-LLVKDONJSA-N 1 0 305.780 4.265 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2ccccc2)cc1Br ZINC001237676567 1055503170 /nfs/dbraw/zinc/50/31/70/1055503170.db2.gz KYKYXBHERMOGOZ-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(OC)cc1 ZINC000765607971 1055512080 /nfs/dbraw/zinc/51/20/80/1055512080.db2.gz GCGIDSJJDVVVHY-LJQANCHMSA-N 1 0 311.425 4.261 20 10 DICDRO COc1ccc(C[C@@H](C)C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC001620886466 1055512131 /nfs/dbraw/zinc/51/21/31/1055512131.db2.gz KNWZTTRJODAHRQ-CYBMUJFWSA-N 1 0 319.832 4.023 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@@H](OC(C)C)C2(C)C)c(Cl)c1 ZINC001620893087 1055518347 /nfs/dbraw/zinc/51/83/47/1055518347.db2.gz BKUDWVCAXDXUCC-JKSUJKDBSA-N 1 0 311.853 4.036 20 10 DICDRO CC(C)N(C)CC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765623474 1055523031 /nfs/dbraw/zinc/52/30/31/1055523031.db2.gz CBRVENHPPIVNTN-GOSISDBHSA-N 1 0 317.521 4.058 20 10 DICDRO CCN(CC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C(C)C ZINC000765629144 1055527193 /nfs/dbraw/zinc/52/71/93/1055527193.db2.gz VSGPCNYQPMLVLU-SFHVURJKSA-N 1 0 317.521 4.058 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)CCC=C(C)C)CC2)cc1 ZINC000765638330 1055530197 /nfs/dbraw/zinc/53/01/97/1055530197.db2.gz KMPLNWDYGHPEKY-QGZVFWFLSA-N 1 0 316.489 4.389 20 10 DICDRO COc1ccc(N2CCC([NH2+]C3[C@@H](C)CCC[C@@H]3C)CC2)cc1 ZINC000765638745 1055530245 /nfs/dbraw/zinc/53/02/45/1055530245.db2.gz PKLQICLWDYLSMI-HOTGVXAUSA-N 1 0 316.489 4.078 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC001620935364 1055549455 /nfs/dbraw/zinc/54/94/55/1055549455.db2.gz NBEXDJDZAYWKLH-UHFFFAOYSA-N 1 0 303.409 4.258 20 10 DICDRO CC[N@H+](Cc1cccc(OC)c1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237950680 1055564220 /nfs/dbraw/zinc/56/42/20/1055564220.db2.gz YTRCDDCYGJWCJF-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CCCC2(CC(F)C2)CC1 ZINC001237949983 1055564497 /nfs/dbraw/zinc/56/44/97/1055564497.db2.gz PZRMHLBWMHPKHB-UHFFFAOYSA-N 1 0 315.791 4.289 20 10 DICDRO Fc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001620954141 1055574466 /nfs/dbraw/zinc/57/44/66/1055574466.db2.gz JWHUBJOGYFBGIQ-IBGZPJMESA-N 1 0 311.400 4.318 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(F)cc(C)c1O ZINC001238060630 1055597339 /nfs/dbraw/zinc/59/73/39/1055597339.db2.gz CNBLVURRIQOFBW-QGZVFWFLSA-N 1 0 315.388 4.185 20 10 DICDRO CCOc1ccc(C[N@H+](CC)Cc2ccccc2O)c(Cl)c1 ZINC001238402705 1055653102 /nfs/dbraw/zinc/65/31/02/1055653102.db2.gz JPWZYPXHPNXEQO-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO CCC[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C1CCCC1 ZINC001620966845 1055701140 /nfs/dbraw/zinc/70/11/40/1055701140.db2.gz MISAUWSKTIILMG-KRWDZBQOSA-N 1 0 310.432 4.479 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](C)CC(F)(F)F)cc1F ZINC001620973892 1055805199 /nfs/dbraw/zinc/80/51/99/1055805199.db2.gz USFCHLSLAAWIDO-LBPRGKRZSA-N 1 0 320.374 4.350 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)c1ccc(N(C)C)cc1 ZINC000765770041 1055914533 /nfs/dbraw/zinc/91/45/33/1055914533.db2.gz VMMDBUJKNZTSTF-MGPUTAFESA-N 1 0 312.457 4.130 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CC=CCC2)c(C(F)(F)F)c1 ZINC001620753923 1055925403 /nfs/dbraw/zinc/92/54/03/1055925403.db2.gz UFSWYJQSVWAZHH-CYBMUJFWSA-N 1 0 312.379 4.217 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2ccc(F)c(Cl)c2)cc1 ZINC001620761259 1055931376 /nfs/dbraw/zinc/93/13/76/1055931376.db2.gz QQQIMZNHADDYDI-ARJAWSKDSA-N 1 0 318.823 4.348 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3ccc(C)cc32)c1 ZINC000186200067 1055933120 /nfs/dbraw/zinc/93/31/20/1055933120.db2.gz DBVKAYHCUUCSRX-AUUYWEPGSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2csc(C(C)(C)C)n2)c(O)c1 ZINC000186202134 1055935140 /nfs/dbraw/zinc/93/51/40/1055935140.db2.gz MCLWIVGNROGWGF-ZDUSSCGKSA-N 1 0 318.486 4.348 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)c(Cl)c1 ZINC001620787915 1055963316 /nfs/dbraw/zinc/96/33/16/1055963316.db2.gz ORRNADMWGVLABO-UHFFFAOYSA-N 1 0 302.849 4.313 20 10 DICDRO C[C@H]1CCCC[C@H]1CC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001620796532 1055975134 /nfs/dbraw/zinc/97/51/34/1055975134.db2.gz MZMWXNHXOJKJDX-KBPBESRZSA-N 1 0 310.432 4.337 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2CCC[C@@H](C)O2)cc1 ZINC001621008818 1055976543 /nfs/dbraw/zinc/97/65/43/1055976543.db2.gz IVVXRDKMWGLTBW-XLIONFOSSA-N 1 0 318.505 4.360 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCO[C@H]1CCCC[C@@H]1C ZINC001620721075 1055986652 /nfs/dbraw/zinc/98/66/52/1055986652.db2.gz FUWPNEGDCWXLKK-YWZLYKJASA-N 1 0 314.473 4.172 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)cc1F ZINC001621031378 1055994408 /nfs/dbraw/zinc/99/44/08/1055994408.db2.gz PHDNFRAHEQRFEW-IEBWSBKVSA-N 1 0 312.432 4.318 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)Oc2ccccc2F)c(Cl)c1 ZINC001620814732 1056009363 /nfs/dbraw/zinc/00/93/63/1056009363.db2.gz YIYFXIFKUWSVGM-GFCCVEGCSA-N 1 0 323.795 4.050 20 10 DICDRO C[C@H]([NH2+]Cc1cnc(-c2cccs2)s1)c1ccccc1O ZINC001621052579 1056010258 /nfs/dbraw/zinc/01/02/58/1056010258.db2.gz CFJGYQFMBJMKNJ-NSHDSACASA-N 1 0 316.451 4.428 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C(C)C)ccc2O)c1 ZINC001621316361 1056019324 /nfs/dbraw/zinc/01/93/24/1056019324.db2.gz FODDEIJRVGPJFZ-CYBMUJFWSA-N 1 0 315.413 4.081 20 10 DICDRO COc1cccc2c1C[N@H+](Cc1cc(C(C)C)ccc1O)CC2 ZINC001621340480 1056047539 /nfs/dbraw/zinc/04/75/39/1056047539.db2.gz NBQXUOAJBODWJH-UHFFFAOYSA-N 1 0 311.425 4.083 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ccc(N(C)C)cc1 ZINC000090963523 1056126097 /nfs/dbraw/zinc/12/60/97/1056126097.db2.gz ICRCKRBBYVNIGW-OLZOCXBDSA-N 1 0 304.384 4.443 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)C1(CC)CC ZINC001620819613 1056132975 /nfs/dbraw/zinc/13/29/75/1056132975.db2.gz XHGOIPRQVSPIDI-HZPDHXFCSA-N 1 0 311.853 4.119 20 10 DICDRO Fc1ccc([C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CC2)c(F)c1 ZINC001620820385 1056167916 /nfs/dbraw/zinc/16/79/16/1056167916.db2.gz RLWMCDXQLRMOOT-IBGZPJMESA-N 1 0 315.363 4.141 20 10 DICDRO Cc1ccc([C@@H](C)NCc2nc(C(C)(C)C)co2)c(O)c1C ZINC000903313715 1056205618 /nfs/dbraw/zinc/20/56/18/1056205618.db2.gz XLRRAUHOHHZMCA-CYBMUJFWSA-N 1 0 302.418 4.145 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000765851349 1056327465 /nfs/dbraw/zinc/32/74/65/1056327465.db2.gz ZORJQNLZCMTIFA-INIZCTEOSA-N 1 0 311.473 4.060 20 10 DICDRO c1csc(C2([NH2+]Cc3ccc4c(c3)CCCO4)CCCC2)n1 ZINC000921750379 1056458954 /nfs/dbraw/zinc/45/89/54/1056458954.db2.gz VKPDDXCBKOTAHH-UHFFFAOYSA-N 1 0 314.454 4.027 20 10 DICDRO CCN(C)c1ccc(C[NH+]2CCC(Oc3ccccc3)CC2)cc1 ZINC001615252172 1056484652 /nfs/dbraw/zinc/48/46/52/1056484652.db2.gz UNXQMJPGFGJKQQ-UHFFFAOYSA-N 1 0 324.468 4.186 20 10 DICDRO CCC(CC)c1cc(CNCc2ccc3c(c2)CCCO3)on1 ZINC000921784590 1056490068 /nfs/dbraw/zinc/49/00/68/1056490068.db2.gz FDCSMOOHKTZYQY-UHFFFAOYSA-N 1 0 314.429 4.193 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@H]1CC[C@H](C2CC2)O1)C1CCCC1 ZINC001615466350 1056514144 /nfs/dbraw/zinc/51/41/44/1056514144.db2.gz XNCGVSHEYWNKHV-UYAOXDASSA-N 1 0 315.457 4.094 20 10 DICDRO CC[C@H](C)[C@@](C)(O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765943218 1056537762 /nfs/dbraw/zinc/53/77/62/1056537762.db2.gz AEUNFCRJLMOSNL-QKLQHJQFSA-N 1 0 318.505 4.125 20 10 DICDRO Cc1ccccc1[C@H]1C[C@@H](C)[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001615622032 1056546155 /nfs/dbraw/zinc/54/61/55/1056546155.db2.gz OFEUFOKRHTZXIY-MJGOQNOKSA-N 1 0 308.469 4.439 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)cc2O)CCO1 ZINC000186503162 1056561878 /nfs/dbraw/zinc/56/18/78/1056561878.db2.gz MVZNZROZESCWKE-GMBSWORKSA-N 1 0 305.462 4.335 20 10 DICDRO CCC[N@H+](Cc1ccc(OC)c(Cl)c1)Cc1ccccc1O ZINC001615686303 1056564159 /nfs/dbraw/zinc/56/41/59/1056564159.db2.gz MKHFQNMKFRKARO-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO CC(C)[C@@](C)(O)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765955493 1056623277 /nfs/dbraw/zinc/62/32/77/1056623277.db2.gz WNHSKIYBZVYVML-XLIONFOSSA-N 1 0 318.505 4.125 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@H](C)C[C@H]3C)CC2)cc1 ZINC000765959843 1056650536 /nfs/dbraw/zinc/65/05/36/1056650536.db2.gz SIDVQZWANYQQOQ-RZQQEMMASA-N 1 0 316.489 4.078 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1 ZINC000922670531 1057047017 /nfs/dbraw/zinc/04/70/17/1057047017.db2.gz KABCBFLRGSXZEV-ZDUSSCGKSA-N 1 0 303.377 4.089 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1ccc2ccccc2c1O ZINC000282382711 1057064040 /nfs/dbraw/zinc/06/40/40/1057064040.db2.gz JEQCDLSKHDDQSN-SCLBCKFNSA-N 1 0 321.424 4.007 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000766005415 1057076796 /nfs/dbraw/zinc/07/67/96/1057076796.db2.gz ITXKVJHPWLXDLH-MJGOQNOKSA-N 1 0 323.484 4.072 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2cc(Cl)ccc21 ZINC000766027963 1057128992 /nfs/dbraw/zinc/12/89/92/1057128992.db2.gz BSMLYOPFSGYVTI-LJQANCHMSA-N 1 0 314.860 4.492 20 10 DICDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)ccc1F ZINC000766030931 1057132953 /nfs/dbraw/zinc/13/29/53/1057132953.db2.gz XYDYKKMEDHVUBX-OAHLLOKOSA-N 1 0 300.421 4.359 20 10 DICDRO Cc1cc(Br)cc([C@H](C)[NH2+]C/C=C/C2CC2)c1O ZINC001117749828 1057160798 /nfs/dbraw/zinc/16/07/98/1057160798.db2.gz CEGVITSKOSAOFU-UFFNRZRYSA-N 1 0 310.235 4.080 20 10 DICDRO CO[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@H](C)C1 ZINC000282522662 1057281893 /nfs/dbraw/zinc/28/18/93/1057281893.db2.gz ZTJLTPCGRLBZDQ-DNVCBOLYSA-N 1 0 311.425 4.059 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccc2c(c1)COC2 ZINC000766072721 1057285188 /nfs/dbraw/zinc/28/51/88/1057285188.db2.gz MHVWJCHQLSJTFW-GFCCVEGCSA-N 1 0 320.483 4.006 20 10 DICDRO Cc1cccc2c1CC[C@@H]2[NH2+]CCCSc1nccs1 ZINC000766071758 1057285416 /nfs/dbraw/zinc/28/54/16/1057285416.db2.gz APTLQIGWSMVCMK-HNNXBMFYSA-N 1 0 304.484 4.211 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCCSc1nccs1)CC2 ZINC000766072356 1057285698 /nfs/dbraw/zinc/28/56/98/1057285698.db2.gz HBNPTALHJBVLMU-HNNXBMFYSA-N 1 0 304.484 4.211 20 10 DICDRO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CCCSc1nccs1 ZINC000766072757 1057285916 /nfs/dbraw/zinc/28/59/16/1057285916.db2.gz MPISEVWQFJDBBV-IUODEOHRSA-N 1 0 304.484 4.148 20 10 DICDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]CCCSc1nccs1 ZINC000766074678 1057286875 /nfs/dbraw/zinc/28/68/75/1057286875.db2.gz ZDKJLNGEJMAVHT-OAHLLOKOSA-N 1 0 304.484 4.211 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CCC(C)(C)C)c1ccc(N2CCOCC2)cc1 ZINC000766075306 1057287692 /nfs/dbraw/zinc/28/76/92/1057287692.db2.gz LTLVVJYJJCKEPZ-DLBZAZTESA-N 1 0 318.505 4.389 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)Cc2cc(Cl)ccc2F)c1O ZINC000766090636 1057314627 /nfs/dbraw/zinc/31/46/27/1057314627.db2.gz WYTGWALUFBXGGE-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO CC[C@H](COC)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766093062 1057323066 /nfs/dbraw/zinc/32/30/66/1057323066.db2.gz GZRJJXFXPLSYJH-SJLPKXTDSA-N 1 0 304.478 4.143 20 10 DICDRO Clc1ccc(C2(C[NH2+]Cc3ccc4c(c3)CCO4)CC2)cc1 ZINC000727471465 1057653731 /nfs/dbraw/zinc/65/37/31/1057653731.db2.gz BDMIQYNUIBFRJG-UHFFFAOYSA-N 1 0 313.828 4.096 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCCC[C@@H]2C)ccc1OC ZINC000727468590 1057655581 /nfs/dbraw/zinc/65/55/81/1057655581.db2.gz TWEQFSQLKFOZSK-RDJZCZTQSA-N 1 0 305.462 4.148 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(F)cc1 ZINC000727643276 1057661302 /nfs/dbraw/zinc/66/13/02/1057661302.db2.gz FKCYFAQBUBYZKS-IBGZPJMESA-N 1 0 312.432 4.449 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(F)cc2C)cc1F ZINC000731360538 1057742560 /nfs/dbraw/zinc/74/25/60/1057742560.db2.gz IAWJRPHAOAPVPS-UHFFFAOYSA-N 1 0 318.411 4.409 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)cc1 ZINC000731675111 1057751282 /nfs/dbraw/zinc/75/12/82/1057751282.db2.gz ITPDKXSNVHJFBV-UHFFFAOYSA-N 1 0 324.468 4.146 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000732233194 1057771737 /nfs/dbraw/zinc/77/17/37/1057771737.db2.gz XLYMVTASYOGUPM-SJORKVTESA-N 1 0 301.817 4.472 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2ccccc2N2CCCC2)cc1C ZINC000732532027 1057778115 /nfs/dbraw/zinc/77/81/15/1057778115.db2.gz KPPWQRFKEWQECU-UHFFFAOYSA-N 1 0 324.468 4.241 20 10 DICDRO CCOc1ccc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)c(O)c1 ZINC000732672243 1057783068 /nfs/dbraw/zinc/78/30/68/1057783068.db2.gz CSFKSNKCLCIIJQ-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO CCc1cc(C[NH+]2CCC(COC)CC2)c(O)c(C(C)(C)C)c1 ZINC000732797617 1057787377 /nfs/dbraw/zinc/78/73/77/1057787377.db2.gz DCKAQMOAOVDUCY-UHFFFAOYSA-N 1 0 319.489 4.111 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(O)c(Cl)c2)cc1 ZINC000733325089 1057812907 /nfs/dbraw/zinc/81/29/07/1057812907.db2.gz WUMWNWHUZIGKCL-UHFFFAOYSA-N 1 0 318.848 4.182 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCCc1c[nH]c2ccccc12 ZINC000733328711 1057813732 /nfs/dbraw/zinc/81/37/32/1057813732.db2.gz ZFKBEETWNBSXOX-UHFFFAOYSA-N 1 0 314.816 4.249 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@@H](C)C[C@@H]2C)ccc1OC ZINC000733327970 1057813946 /nfs/dbraw/zinc/81/39/46/1057813946.db2.gz NSSPBKXGLSHGTJ-RVKKMQEKSA-N 1 0 305.462 4.146 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCc2ccc(F)cc2Cl)cc1F ZINC000733329752 1057814099 /nfs/dbraw/zinc/81/40/99/1057814099.db2.gz KUGZZGOYJFZIOB-UHFFFAOYSA-N 1 0 324.802 4.017 20 10 DICDRO C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]Cc1ccc(N)cc1 ZINC001246173650 1058716205 /nfs/dbraw/zinc/71/62/05/1058716205.db2.gz UWCAXYSQQJPCKN-LLVKDONJSA-N 1 0 309.240 4.296 20 10 DICDRO Cc1cccc(C2=CC[N@H+](Cc3ccc(N(C)C)cc3)CC2)c1 ZINC001559679275 1059507471 /nfs/dbraw/zinc/50/74/71/1059507471.db2.gz JRMIZRCRXOOXPB-UHFFFAOYSA-N 1 0 306.453 4.350 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](C)CC(C)(C)C)c1ccc(N2CCOCC2)cc1 ZINC001559709682 1059539558 /nfs/dbraw/zinc/53/95/58/1059539558.db2.gz NPQVMBHYIAUXKM-DLBZAZTESA-N 1 0 318.505 4.246 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)c(C)c1)[C@@H]1CCCO1 ZINC001559738033 1059571337 /nfs/dbraw/zinc/57/13/37/1059571337.db2.gz UHDOAVMJQSDPGY-QUCCMNQESA-N 1 0 316.489 4.033 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)cc1 ZINC001559741187 1059575222 /nfs/dbraw/zinc/57/52/22/1059575222.db2.gz JRGDKDMZFGKICK-UKRRQHHQSA-N 1 0 314.395 4.306 20 10 DICDRO C[C@@H]([NH2+]CCc1ccccc1Cl)c1ccc(N(C)C)cc1 ZINC001559767107 1059604879 /nfs/dbraw/zinc/60/48/79/1059604879.db2.gz SPXMNYIYAUENDM-CQSZACIVSA-N 1 0 302.849 4.299 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@H](C)OC3(CCCCC3)C2)cc1 ZINC001559953798 1059763263 /nfs/dbraw/zinc/76/32/63/1059763263.db2.gz DBFSWDJLKIXASG-KRWDZBQOSA-N 1 0 316.489 4.066 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(F)c3cc[nH]c32)cc1 ZINC001248818561 1059998903 /nfs/dbraw/zinc/99/89/03/1059998903.db2.gz QXKVCMGPFVGNQA-UHFFFAOYSA-N 1 0 311.404 4.005 20 10 DICDRO C[N@H+](Cc1ccncc1)Cc1cc(Cl)c(C(C)(C)C)cc1O ZINC001248881536 1060033822 /nfs/dbraw/zinc/03/38/22/1060033822.db2.gz ZCCMTPYHUSJVOE-UHFFFAOYSA-N 1 0 318.848 4.370 20 10 DICDRO C[N@H+](Cc1cccnc1)Cc1cc(Cl)c(C(C)(C)C)cc1O ZINC001248880468 1060034911 /nfs/dbraw/zinc/03/49/11/1060034911.db2.gz JWALCLYBQIULER-UHFFFAOYSA-N 1 0 318.848 4.370 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C/C=C\c2ccccc2OC)cc1 ZINC001560274864 1060049602 /nfs/dbraw/zinc/04/96/02/1060049602.db2.gz RSTMTMZNIWSEGQ-NTMALXAHSA-N 1 0 324.468 4.344 20 10 DICDRO c1ccc2cc(CC[NH2+]Cc3ccc4c(c3)CCCO4)ccc2c1 ZINC001560315871 1060101292 /nfs/dbraw/zinc/10/12/92/1060101292.db2.gz FUAXYNAZWFXFON-UHFFFAOYSA-N 1 0 317.432 4.497 20 10 DICDRO c1csc(SCCC[NH2+]Cc2ccc3scnc3c2)n1 ZINC001560348814 1060135130 /nfs/dbraw/zinc/13/51/30/1060135130.db2.gz NNOLGNGPSLSKAK-UHFFFAOYSA-N 1 0 321.496 4.025 20 10 DICDRO Oc1cccc(Br)c1C[NH2+][C@H]1C[C@@H]1C1CCCCC1 ZINC001560359349 1060145329 /nfs/dbraw/zinc/14/53/29/1060145329.db2.gz JDQLEFYLYGHFRG-DOMZBBRYSA-N 1 0 324.262 4.213 20 10 DICDRO CCS[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001560370130 1060157390 /nfs/dbraw/zinc/15/73/90/1060157390.db2.gz WZEFTZJAHTVDRN-OALUTQOASA-N 1 0 318.530 4.441 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(C)cc2OC(C)C)cc1C ZINC001560374050 1060159692 /nfs/dbraw/zinc/15/96/92/1060159692.db2.gz YDBLJLQCPPYTIZ-UHFFFAOYSA-N 1 0 313.441 4.389 20 10 DICDRO Cc1cccc2c1C[N@H+](Cc1ccc3c(c1O)C=CC(C)(C)O3)C2 ZINC001249223619 1060194378 /nfs/dbraw/zinc/19/43/78/1060194378.db2.gz JSQSTCAHMJOPPP-UHFFFAOYSA-N 1 0 321.420 4.401 20 10 DICDRO C[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001560415976 1060200312 /nfs/dbraw/zinc/20/03/12/1060200312.db2.gz HQYJHDNMKPYLPF-YCRPNKLZSA-N 1 0 307.437 4.425 20 10 DICDRO C[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001560416689 1060202027 /nfs/dbraw/zinc/20/20/27/1060202027.db2.gz VQEUGTDEDCDTCC-XOBRGWDASA-N 1 0 312.432 4.305 20 10 DICDRO COc1cc(C[NH2+]C23CCC(CC2)C3)c(O)c(C(C)(C)C)c1 ZINC001560438309 1060225221 /nfs/dbraw/zinc/22/52/21/1060225221.db2.gz RBTGTMQGGMEVOM-UHFFFAOYSA-N 1 0 303.446 4.121 20 10 DICDRO COc1c2ccccc2oc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001560445337 1060235872 /nfs/dbraw/zinc/23/58/72/1060235872.db2.gz SECZPTDNFBDUSV-UHFFFAOYSA-N 1 0 323.392 4.056 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCCC2(F)F)c(Cl)c1 ZINC001560483972 1060274449 /nfs/dbraw/zinc/27/44/49/1060274449.db2.gz RKGUENHKKJJRJB-LLVKDONJSA-N 1 0 303.780 4.269 20 10 DICDRO COc1cc(C[NH2+][C@@H]2CCC[C@H](F)C2)c(O)c(C(C)(C)C)c1 ZINC001560516051 1060314879 /nfs/dbraw/zinc/31/48/79/1060314879.db2.gz RILDIDHXUUJEHW-UONOGXRCSA-N 1 0 309.425 4.069 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC001560516201 1060315135 /nfs/dbraw/zinc/31/51/35/1060315135.db2.gz XKODPQCNFHXCPG-HKUYNNGSSA-N 1 0 304.437 4.380 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@]2(C)CC2(F)F)cc1 ZINC001560535778 1060340148 /nfs/dbraw/zinc/34/01/48/1060340148.db2.gz KBRIVTNSMPSGQD-KRWDZBQOSA-N 1 0 310.432 4.448 20 10 DICDRO COCC1([NH2+]Cc2ccc(N3CCCCC3)cc2)CCCCC1 ZINC001560544883 1060356212 /nfs/dbraw/zinc/35/62/12/1060356212.db2.gz MTALTRWHYIVQBV-UHFFFAOYSA-N 1 0 316.489 4.116 20 10 DICDRO CSC1CCC(C[NH2+]Cc2c(C)c3ccccc3n2C)CC1 ZINC001560589462 1060402844 /nfs/dbraw/zinc/40/28/44/1060402844.db2.gz QCMHGERAGDVEGT-UHFFFAOYSA-N 1 0 316.514 4.498 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CC(C)(C)OC2(C)C)c(Cl)c1 ZINC001560601189 1060414766 /nfs/dbraw/zinc/41/47/66/1060414766.db2.gz POFNIRCEVJEUMB-LBPRGKRZSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c(Cl)c1 ZINC001560614781 1060427239 /nfs/dbraw/zinc/42/72/39/1060427239.db2.gz WZVXWMOHULMCCG-AWEZNQCLSA-N 1 0 322.235 4.264 20 10 DICDRO CC(C)C[N@H+](Cc1ccccc1F)Cc1cc(F)ccc1O ZINC001560651863 1060473703 /nfs/dbraw/zinc/47/37/03/1060473703.db2.gz KAXUDLUPUJTJEV-UHFFFAOYSA-N 1 0 305.368 4.329 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1 ZINC001560662043 1060487670 /nfs/dbraw/zinc/48/76/70/1060487670.db2.gz OHOGHWMAFKIWPJ-OBNUAKFSSA-N 1 0 316.514 4.126 20 10 DICDRO CCC[N@@H+](Cc1cc(C)c(Br)cc1O)CC1CC1 ZINC001250116693 1060622982 /nfs/dbraw/zinc/62/29/82/1060622982.db2.gz HFKMSBKDSGFTOT-UHFFFAOYSA-N 1 0 312.251 4.085 20 10 DICDRO Cc1cc(C[NH+]2CCC3(CCC3)CC2)c(O)cc1Br ZINC001250120459 1060627211 /nfs/dbraw/zinc/62/72/11/1060627211.db2.gz FBBWXGSNOJPOHC-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO Cc1cc(C[N@H+]2CCC[C@@H]2C(C)C)c(O)cc1Br ZINC001250132624 1060634505 /nfs/dbraw/zinc/63/45/05/1060634505.db2.gz AXLUHIYGSWNTHQ-CQSZACIVSA-N 1 0 312.251 4.084 20 10 DICDRO COC1(C[NH2+]Cc2ccc3ccccc3c2O)CCC(C)CC1 ZINC001560802914 1060663831 /nfs/dbraw/zinc/66/38/31/1060663831.db2.gz HWMYLKVETBRMKH-UHFFFAOYSA-N 1 0 313.441 4.230 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCc2ccc(F)cc2)c1 ZINC001560814612 1060673771 /nfs/dbraw/zinc/67/37/71/1060673771.db2.gz COTMQODYJFTAAB-ZIAGYGMSSA-N 1 0 317.404 4.212 20 10 DICDRO COc1cc(C)cc(C[NH2+]CCc2ccc(Cl)c(C)c2)c1O ZINC001560857129 1060714908 /nfs/dbraw/zinc/71/49/08/1060714908.db2.gz WYXWLKJDJLYZLQ-UHFFFAOYSA-N 1 0 319.832 4.003 20 10 DICDRO C[C@H]1CC(C)(C)C[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001560888442 1060752341 /nfs/dbraw/zinc/75/23/41/1060752341.db2.gz DSUAWBNPJAIPHX-LBPRGKRZSA-N 1 0 314.395 4.392 20 10 DICDRO COc1ccc(C[N@H+](C)[C@H]2CCC[C@H]2C(C)(C)C)c(O)c1OC ZINC001560893122 1060755852 /nfs/dbraw/zinc/75/58/52/1060755852.db2.gz GZIBNMWBDVKNMS-CABCVRRESA-N 1 0 321.461 4.056 20 10 DICDRO COc1ccc(C[N@H+](C)[C@H]2CCC[C@@H]2C(C)(C)C)c(O)c1OC ZINC001560893123 1060757610 /nfs/dbraw/zinc/75/76/10/1060757610.db2.gz GZIBNMWBDVKNMS-GJZGRUSLSA-N 1 0 321.461 4.056 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@]2(F)c2ccccc2)cc1Cl ZINC001560897940 1060759639 /nfs/dbraw/zinc/75/96/39/1060759639.db2.gz RSLONDWBHLFPSA-IRXDYDNUSA-N 1 0 305.780 4.081 20 10 DICDRO CC[C@]1(C)CCC[C@H]1[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001560899126 1060763030 /nfs/dbraw/zinc/76/30/30/1060763030.db2.gz YIGBJBXXQWUFPO-NSISKUIASA-N 1 0 316.489 4.080 20 10 DICDRO CCCC[C@H](C)[C@H](C)[NH2+][C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001560927879 1060790656 /nfs/dbraw/zinc/79/06/56/1060790656.db2.gz DNDIKOICXYRIOI-ULQDDVLXSA-N 1 0 304.478 4.078 20 10 DICDRO CCCC[C@H](C)[C@@H](C)[NH2+][C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001560927877 1060791139 /nfs/dbraw/zinc/79/11/39/1060791139.db2.gz DNDIKOICXYRIOI-BBWFWOEESA-N 1 0 304.478 4.078 20 10 DICDRO CN(C)c1ccc(CC2=CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC001250432169 1060799307 /nfs/dbraw/zinc/79/93/07/1060799307.db2.gz YOLUVZXTAYZWDW-UHFFFAOYSA-N 1 0 306.453 4.127 20 10 DICDRO Cc1cc(C[NH2+]C[C@H]2CCC=CO2)c(C)n1-c1cccc(C)c1 ZINC001560964397 1060829669 /nfs/dbraw/zinc/82/96/69/1060829669.db2.gz LIMGRNHJRQKYAJ-HXUWFJFHSA-N 1 0 310.441 4.185 20 10 DICDRO CSC1CC([NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)C1 ZINC001560964101 1060830243 /nfs/dbraw/zinc/83/02/43/1060830243.db2.gz FSSPMSRWCYMOIN-UHFFFAOYSA-N 1 0 314.498 4.386 20 10 DICDRO CCO[C@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2O)C12CCCCC2 ZINC001560971191 1060835293 /nfs/dbraw/zinc/83/52/93/1060835293.db2.gz VVRZIUPZCUEEHI-WBAXXEDZSA-N 1 0 303.446 4.171 20 10 DICDRO C[N@H+](Cc1ccc2cc[nH]c2c1)Cc1cc(Cl)c(F)cc1[O-] ZINC001560980281 1060845904 /nfs/dbraw/zinc/84/59/04/1060845904.db2.gz OFHSDQSLPMJJKR-UHFFFAOYSA-N 1 0 318.779 4.298 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C(C)C)ccc1O)[C@@H](O)c1ccccc1 ZINC001560998990 1060857949 /nfs/dbraw/zinc/85/79/49/1060857949.db2.gz LBNRABWAJPPBSL-QUCCMNQESA-N 1 0 313.441 4.117 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC001561004784 1060862720 /nfs/dbraw/zinc/86/27/20/1060862720.db2.gz VWYAHOHHSGSBKJ-CYBMUJFWSA-N 1 0 314.385 4.275 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cscc2Cl)cc1Cl ZINC001561010153 1060867715 /nfs/dbraw/zinc/86/77/15/1060867715.db2.gz IPXRZHLHUDSNGI-UHFFFAOYSA-N 1 0 302.226 4.359 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CC[C@H]2CCC3(CCC3)O2)c1 ZINC001561019153 1060875124 /nfs/dbraw/zinc/87/51/24/1060875124.db2.gz UNTFRBRPESMKIT-QGZVFWFLSA-N 1 0 303.446 4.097 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2C[C@H]3[C@H]4CC[C@H](C4)[C@@]3(C)C2)cc1Cl ZINC001561027929 1060882634 /nfs/dbraw/zinc/88/26/34/1060882634.db2.gz ULIROOWTKSZFNN-WLLUSJSYSA-N 1 0 305.849 4.222 20 10 DICDRO COc1cc(O)c(C[NH2+][C@H]2CCC[C@@H](C(C)C)CC2)cc1OC ZINC001462125144 1060945265 /nfs/dbraw/zinc/94/52/65/1060945265.db2.gz ICCMFOZYYJLUAU-ZBFHGGJFSA-N 1 0 321.461 4.104 20 10 DICDRO COc1cc(O)c(C[NH2+][C@@H]2CCC[C@H](C(C)C)CC2)cc1OC ZINC001462125130 1060947644 /nfs/dbraw/zinc/94/76/44/1060947644.db2.gz ICCMFOZYYJLUAU-GOEBONIOSA-N 1 0 321.461 4.104 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)[C@@H](CCOC)c1ccccc1 ZINC001473195554 1060952344 /nfs/dbraw/zinc/95/23/44/1060952344.db2.gz DQOQSYZXVPDARN-IBGZPJMESA-N 1 0 313.441 4.382 20 10 DICDRO CCC[N@H+](CCc1c(F)cccc1F)Cc1ccccc1O ZINC001473196347 1060953381 /nfs/dbraw/zinc/95/33/81/1060953381.db2.gz XLWPHDUMWRHROK-UHFFFAOYSA-N 1 0 305.368 4.125 20 10 DICDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001462134387 1060954248 /nfs/dbraw/zinc/95/42/48/1060954248.db2.gz BYJLGBATKYOKEJ-CXAGYDPISA-N 1 0 305.462 4.319 20 10 DICDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001462204277 1061023491 /nfs/dbraw/zinc/02/34/91/1061023491.db2.gz UIRGINSDXOTXFH-DZGCQCFKSA-N 1 0 305.462 4.461 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C(C)C)[C@H]2C(C)C)c1O ZINC001462228820 1061040591 /nfs/dbraw/zinc/04/05/91/1061040591.db2.gz AZYXBDUKCCUGFY-GOEBONIOSA-N 1 0 311.853 4.167 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2C[C@H](C(C)C)[C@H]2C(C)C)c1O ZINC001462228818 1061042546 /nfs/dbraw/zinc/04/25/46/1061042546.db2.gz AZYXBDUKCCUGFY-GDBMZVCRSA-N 1 0 311.853 4.167 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1ccc(F)cc1 ZINC001473301155 1061067253 /nfs/dbraw/zinc/06/72/53/1061067253.db2.gz HKFZKTWRWWUYTM-GOSISDBHSA-N 1 0 300.421 4.441 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCSC3(CCC3)CC2)c1 ZINC001462339938 1061114965 /nfs/dbraw/zinc/11/49/65/1061114965.db2.gz HDSFFEBAOQRFLO-UHFFFAOYSA-N 1 0 305.487 4.377 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC001462355553 1061126230 /nfs/dbraw/zinc/12/62/30/1061126230.db2.gz KZBYEEWXQUSRIN-WXSAJPJJSA-N 1 0 302.506 4.406 20 10 DICDRO CCn1cc(C[N@H+](Cc2cc(C(C)C)ccc2O)C(C)C)cn1 ZINC001462394215 1061145976 /nfs/dbraw/zinc/14/59/76/1061145976.db2.gz JRDIHOBYWBKFPL-UHFFFAOYSA-N 1 0 315.461 4.143 20 10 DICDRO CC(C)[C@H]1[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC12CC=CC2 ZINC001462395320 1061148175 /nfs/dbraw/zinc/14/81/75/1061148175.db2.gz NCNPLQQUMRSUMU-AQKVLALTSA-N 1 0 310.485 4.442 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CCc2ccnc3ccccc23)c1 ZINC001462416498 1061160744 /nfs/dbraw/zinc/16/07/44/1061160744.db2.gz GVQMYYLLIHBGPI-UHFFFAOYSA-N 1 0 320.436 4.396 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]2COc2ccccc2)cc1 ZINC001473505778 1061201171 /nfs/dbraw/zinc/20/11/71/1061201171.db2.gz GPWMBCHRERJWGA-FQEVSTJZSA-N 1 0 324.468 4.186 20 10 DICDRO Cc1cc(CC[NH2+][C@H](C)c2ccccn2)c(C)n1-c1ccccc1 ZINC001462480428 1061201720 /nfs/dbraw/zinc/20/17/20/1061201720.db2.gz RFYOJTLLAREBBT-QGZVFWFLSA-N 1 0 319.452 4.382 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@]12C[C@H]1CCCC2 ZINC001462508026 1061220472 /nfs/dbraw/zinc/22/04/72/1061220472.db2.gz YPXQDDBLXIFVKD-WIYYLYMNSA-N 1 0 323.436 4.394 20 10 DICDRO COc1cc(C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)c(O)c(C(C)(C)C)c1 ZINC001462512628 1061223208 /nfs/dbraw/zinc/22/32/08/1061223208.db2.gz MIHDYRSBKOZRAA-GASCZTMLSA-N 1 0 315.457 4.096 20 10 DICDRO Cc1cccc(C)c1C[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC001462620137 1061301987 /nfs/dbraw/zinc/30/19/87/1061301987.db2.gz XFEDQSMJMAABIN-UHFFFAOYSA-N 1 0 318.411 4.280 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc1F ZINC001473918320 1061466550 /nfs/dbraw/zinc/46/65/50/1061466550.db2.gz PSTADSIMHOWSLB-OFQRWUPVSA-N 1 0 322.443 4.479 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)cc1 ZINC001473937971 1061482922 /nfs/dbraw/zinc/48/29/22/1061482922.db2.gz VOOQABXNFMJUCZ-UHFFFAOYSA-N 1 0 319.832 4.433 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccc4c(c3)CCCC4)ccc21 ZINC001473963592 1061503723 /nfs/dbraw/zinc/50/37/23/1061503723.db2.gz HFKQMTVBDOCIHM-UHFFFAOYSA-N 1 0 320.480 4.238 20 10 DICDRO Cc1cc(Cl)cc(C)c1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001473970497 1061516177 /nfs/dbraw/zinc/51/61/77/1061516177.db2.gz VFGVJQMESNWSNQ-UHFFFAOYSA-N 1 0 301.817 4.182 20 10 DICDRO CC(C)[C@H]1CCC[C@@H]([NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001473986820 1061528949 /nfs/dbraw/zinc/52/89/49/1061528949.db2.gz QVVIFCUBBRAYNP-DZGCQCFKSA-N 1 0 310.432 4.335 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H](C)SC2)cc1F ZINC001473994796 1061538069 /nfs/dbraw/zinc/53/80/69/1061538069.db2.gz GCSPMPUGZRQGMC-DZGCQCFKSA-N 1 0 310.482 4.046 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC(C)(C)c2cccs2)cc1 ZINC001474003186 1061545404 /nfs/dbraw/zinc/54/54/04/1061545404.db2.gz XMNWTPZBRNVGFG-FNORWQNLSA-N 1 0 314.498 4.395 20 10 DICDRO Fc1cccc(C2(C[NH2+]Cc3ccc(N4CCCC4)cc3)CC2)c1 ZINC001474014348 1061553968 /nfs/dbraw/zinc/55/39/68/1061553968.db2.gz KOKZYZCBSCFXQP-UHFFFAOYSA-N 1 0 324.443 4.247 20 10 DICDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC001474037260 1061579290 /nfs/dbraw/zinc/57/92/90/1061579290.db2.gz BXWAHYWRUBGRQC-NNTXTVRGSA-N 1 0 316.395 4.395 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC001474113564 1061661300 /nfs/dbraw/zinc/66/13/00/1061661300.db2.gz ROYVDNLTYRDTRX-QGZVFWFLSA-N 1 0 324.399 4.239 20 10 DICDRO CCN(Cc1ccccc1)c1ccc(CNCC(F)F)cc1 ZINC001474141243 1061686619 /nfs/dbraw/zinc/68/66/19/1061686619.db2.gz AVUBAGAICXOELZ-UHFFFAOYSA-N 1 0 304.384 4.068 20 10 DICDRO Cc1ccc(F)c(CC[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001474148796 1061693049 /nfs/dbraw/zinc/69/30/49/1061693049.db2.gz GIPIPIFKUFSTEA-UHFFFAOYSA-N 1 0 312.432 4.067 20 10 DICDRO C=Cc1ccc(CC[NH2+]Cc2cc(F)c(N(C)C)cc2F)cc1 ZINC001474155968 1061698055 /nfs/dbraw/zinc/69/80/55/1061698055.db2.gz RYOPEHVRQXITFH-UHFFFAOYSA-N 1 0 316.395 4.006 20 10 DICDRO CSCC1CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC001474159385 1061701527 /nfs/dbraw/zinc/70/15/27/1061701527.db2.gz LLSRBMYUWCWSHS-UHFFFAOYSA-N 1 0 305.487 4.023 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC001474184583 1061732771 /nfs/dbraw/zinc/73/27/71/1061732771.db2.gz GNZYSNRSUMUPCD-IEZWGBDMSA-N 1 0 302.506 4.408 20 10 DICDRO CCc1ccccc1C[NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C ZINC001474184492 1061733734 /nfs/dbraw/zinc/73/37/34/1061733734.db2.gz FGYSSBVUDZIZJR-KRWDZBQOSA-N 1 0 310.485 4.344 20 10 DICDRO Cc1ccccc1C1([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC001474189075 1061738697 /nfs/dbraw/zinc/73/86/97/1061738697.db2.gz NYBCEVJLHFHCGO-VURMDHGXSA-N 1 0 306.453 4.353 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC001474195271 1061745843 /nfs/dbraw/zinc/74/58/43/1061745843.db2.gz PXYGVEVZZWOPIV-MRXNPFEDSA-N 1 0 312.457 4.068 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H](c2ccccc2)C(C)C)c1 ZINC001474196250 1061747009 /nfs/dbraw/zinc/74/70/09/1061747009.db2.gz PNCYFSCJHQUOJZ-HNAYVOBHSA-N 1 0 313.441 4.491 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](c2ccccc2)C(C)C)c1 ZINC001474196249 1061747503 /nfs/dbraw/zinc/74/75/03/1061747503.db2.gz PNCYFSCJHQUOJZ-DNVCBOLYSA-N 1 0 313.441 4.491 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCC[C@H]1CC1(Cl)Cl ZINC001474195600 1061747524 /nfs/dbraw/zinc/74/75/24/1061747524.db2.gz BNVQQZALDKWNGA-VIFPVBQESA-N 1 0 308.636 4.109 20 10 DICDRO Cc1ccc(CC[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1C ZINC001474205378 1061760644 /nfs/dbraw/zinc/76/06/44/1061760644.db2.gz WIZYRLGNWPNMGJ-WAYWQWQTSA-N 1 0 308.469 4.215 20 10 DICDRO Cc1cc(CC[NH2+]Cc2cccs2)c(C)n1-c1ccccc1 ZINC001474228064 1061790217 /nfs/dbraw/zinc/79/02/17/1061790217.db2.gz ZLVCRWMVCDIEFZ-UHFFFAOYSA-N 1 0 310.466 4.488 20 10 DICDRO CC(C)(C)OC1CCC([NH2+]Cc2c(O)cccc2Cl)CC1 ZINC001474230316 1061792551 /nfs/dbraw/zinc/79/25/51/1061792551.db2.gz KQBVKEFOPZBRDZ-UHFFFAOYSA-N 1 0 311.853 4.262 20 10 DICDRO COCC(C)(C)C[NH2+]Cc1cc(C)n(-c2cccc(C)c2)c1C ZINC001474235192 1061798286 /nfs/dbraw/zinc/79/82/86/1061798286.db2.gz SUTHNRLUMHDBTN-UHFFFAOYSA-N 1 0 314.473 4.165 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F ZINC001474244370 1061809611 /nfs/dbraw/zinc/80/96/11/1061809611.db2.gz QLWMFESNXYTCSQ-HUUCEWRRSA-N 1 0 322.374 4.473 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]C(C)(C)c2ccc(F)cc2)cc1F ZINC001474268699 1061836094 /nfs/dbraw/zinc/83/60/94/1061836094.db2.gz QOXVPMLUMQXRLY-UHFFFAOYSA-N 1 0 322.374 4.195 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@H]1CCC(F)(F)C1 ZINC001474293104 1061862728 /nfs/dbraw/zinc/86/27/28/1061862728.db2.gz XFJNBCZOOQJUCQ-CQSZACIVSA-N 1 0 306.400 4.402 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1C[C@@H]1Cc1ccccc1 ZINC001474299890 1061870764 /nfs/dbraw/zinc/87/07/64/1061870764.db2.gz OSEUXTLLKDHVFS-OALUTQOASA-N 1 0 318.464 4.455 20 10 DICDRO C[C@H]([NH2+]Cc1c(O)cccc1Cl)c1cc(F)ccc1N(C)C ZINC001474305345 1061873757 /nfs/dbraw/zinc/87/37/57/1061873757.db2.gz KRZMQKJDOUXGOX-NSHDSACASA-N 1 0 322.811 4.102 20 10 DICDRO CC[C@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001474309837 1061876662 /nfs/dbraw/zinc/87/66/62/1061876662.db2.gz MLVUGHRSFBQVQL-ZDUSSCGKSA-N 1 0 300.368 4.146 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H]2CC(=O)c2ccccc2)c1O ZINC001474313510 1061886123 /nfs/dbraw/zinc/88/61/23/1061886123.db2.gz YUNPNBGYWJTMAI-LJQANCHMSA-N 1 0 323.436 4.192 20 10 DICDRO CO[C@]1(C)C[C@H]([N@H+](C)Cc2ccc3ccccc3c2O)C1(C)C ZINC001474327254 1061912797 /nfs/dbraw/zinc/91/27/97/1061912797.db2.gz QFAJYUCOWSDQTE-FXAWDEMLSA-N 1 0 313.441 4.181 20 10 DICDRO CC[C@H](C)[C@@H](C)[N@H+](Cc1cc(Cl)cc(OC)c1O)C1CC1 ZINC001474366995 1061995172 /nfs/dbraw/zinc/99/51/72/1061995172.db2.gz KLTXSJWSUFMUQZ-NWDGAFQWSA-N 1 0 311.853 4.453 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c(O)c1 ZINC001474376111 1062020003 /nfs/dbraw/zinc/02/00/03/1062020003.db2.gz ITQGEXXUZQLBAA-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO CC(C)[C@H]1CCCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001474390524 1062042913 /nfs/dbraw/zinc/04/29/13/1062042913.db2.gz GPYDRACRYPABMO-QGZVFWFLSA-N 1 0 310.432 4.431 20 10 DICDRO COc1ccc(O)c(C[N@H+]2CC=C(c3cc(C)cc(C)c3)CC2)c1 ZINC001474433705 1062109753 /nfs/dbraw/zinc/10/97/53/1062109753.db2.gz WPULYGRTLHMBGI-UHFFFAOYSA-N 1 0 323.436 4.307 20 10 DICDRO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001474445467 1062124666 /nfs/dbraw/zinc/12/46/66/1062124666.db2.gz FVKNKPVZKJTBEW-GFCCVEGCSA-N 1 0 307.743 4.208 20 10 DICDRO Cc1ccc(C[NH2+]Cc2cccc(C)c2Br)c(O)c1 ZINC001474446570 1062124922 /nfs/dbraw/zinc/12/49/22/1062124922.db2.gz CCAFJHHHOCZTRQ-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO CCC[C@@H](CCc1ccccc1)[NH2+]CCc1ccc(O)c(O)c1 ZINC001254486061 1062128959 /nfs/dbraw/zinc/12/89/59/1062128959.db2.gz QUZKFAPNJHYRHK-SFHVURJKSA-N 1 0 313.441 4.031 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCC[C@H](C(C)C)CC2)c(O)c1OC ZINC001474461841 1062140815 /nfs/dbraw/zinc/14/08/15/1062140815.db2.gz WJHFUINJROZKCZ-HOCLYGCPSA-N 1 0 321.461 4.104 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2cc(F)cc(C)c2C1 ZINC001474472296 1062151006 /nfs/dbraw/zinc/15/10/06/1062151006.db2.gz HWAFFNLSZMFCQT-UHFFFAOYSA-N 1 0 312.432 4.067 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@](C)(c3ccccc3)C2)cc1 ZINC001459467464 1062155285 /nfs/dbraw/zinc/15/52/85/1062155285.db2.gz OERBNYDJNZRBFM-OAQYLSRUSA-N 1 0 308.469 4.306 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@](C)(c3ccccc3)C2)cc1 ZINC001459467458 1062156237 /nfs/dbraw/zinc/15/62/37/1062156237.db2.gz OERBNYDJNZRBFM-NRFANRHFSA-N 1 0 308.469 4.306 20 10 DICDRO COc1ccc(O)c(C[NH2+]CC[C@@H]2C[C@H](C)CC(C)(C)C2)c1 ZINC001474484029 1062164761 /nfs/dbraw/zinc/16/47/61/1062164761.db2.gz MECPCIMOAXBGCI-LSDHHAIUSA-N 1 0 305.462 4.343 20 10 DICDRO CCCN(C[C@H](C)c1ccc(F)cc1)c1ccc(C[NH3+])cc1 ZINC001474495034 1062176946 /nfs/dbraw/zinc/17/69/46/1062176946.db2.gz JKYUJKBBYTVCGK-HNNXBMFYSA-N 1 0 300.421 4.305 20 10 DICDRO CC(C)CC[N@H+](Cc1ccco1)Cc1ccc(N(C)C)cc1 ZINC001474506458 1062187335 /nfs/dbraw/zinc/18/73/35/1062187335.db2.gz AIJHKJOVLQZNOS-UHFFFAOYSA-N 1 0 300.446 4.394 20 10 DICDRO COc1cc(C[NH+]2CCC3(CCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC001474510450 1062194324 /nfs/dbraw/zinc/19/43/24/1062194324.db2.gz IPINJXJRMGWXLN-UHFFFAOYSA-N 1 0 317.473 4.464 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)ccc1N(C)C ZINC001459540130 1062195026 /nfs/dbraw/zinc/19/50/26/1062195026.db2.gz JCUNDRPUJXXDNY-OAHLLOKOSA-N 1 0 312.432 4.319 20 10 DICDRO COC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)c1ccc(C)o1 ZINC001254721944 1062241773 /nfs/dbraw/zinc/24/17/73/1062241773.db2.gz XBRISWFGCYHALY-CFVMTHIKSA-N 1 0 315.413 4.128 20 10 DICDRO COc1cc(Cl)cc(C[NH+]2CCC(C)(C3CC3)CC2)c1O ZINC001474553922 1062254596 /nfs/dbraw/zinc/25/45/96/1062254596.db2.gz BPJDFYPWIRQNAB-UHFFFAOYSA-N 1 0 309.837 4.066 20 10 DICDRO CCc1cccc(C[NH2+]C[C@H]2[C@H](c3ccccc3)C2(C)C)c1O ZINC001474573323 1062278221 /nfs/dbraw/zinc/27/82/21/1062278221.db2.gz XJQSRVUYNVYVJL-OALUTQOASA-N 1 0 309.453 4.484 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)C1CCSCC1 ZINC001474585381 1062294236 /nfs/dbraw/zinc/29/42/36/1062294236.db2.gz RRKSLHHGLHYXIU-CVEARBPZSA-N 1 0 320.546 4.113 20 10 DICDRO COc1cc(C[N@@H+]2C[C@H](C)[C@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001474588823 1062302242 /nfs/dbraw/zinc/30/22/42/1062302242.db2.gz MWRJRNUFYSARHB-MELADBBJSA-N 1 0 305.462 4.175 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)ccc1N(C)C ZINC001459691688 1062309921 /nfs/dbraw/zinc/30/99/21/1062309921.db2.gz FZTUTHDWWWKDOX-FQEVSTJZSA-N 1 0 323.484 4.138 20 10 DICDRO COc1cccc(C2CC([NH2+]Cc3cc(Cl)ccc3O)C2)c1 ZINC001474609391 1062323590 /nfs/dbraw/zinc/32/35/90/1062323590.db2.gz SOGLREGKUBHQIL-UHFFFAOYSA-N 1 0 317.816 4.090 20 10 DICDRO CC[C@@H]1CCC[C@H](C[N@H+](C)CCN(C)c2ccc(OC)cc2)C1 ZINC001474612427 1062330858 /nfs/dbraw/zinc/33/08/58/1062330858.db2.gz IAKNIIUAXZTLAM-MSOLQXFVSA-N 1 0 318.505 4.280 20 10 DICDRO CCc1cccc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)c1O ZINC001474616297 1062334982 /nfs/dbraw/zinc/33/49/82/1062334982.db2.gz NHPZPEQYIJXQRU-SFHVURJKSA-N 1 0 313.466 4.245 20 10 DICDRO Oc1c(C[NH+]2CC(Cc3ccsc3)C2)ccc2ccccc21 ZINC001474642883 1062368236 /nfs/dbraw/zinc/36/82/36/1062368236.db2.gz JVJOEVFJZVQRNS-UHFFFAOYSA-N 1 0 309.434 4.281 20 10 DICDRO CCCCC[C@H]1CCC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC001459769618 1062377596 /nfs/dbraw/zinc/37/75/96/1062377596.db2.gz SLCSNNVZMYRTCZ-IBGZPJMESA-N 1 0 316.489 4.068 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)COC(C)C)c(C)n1-c1cccc(C)c1 ZINC001474664687 1062397296 /nfs/dbraw/zinc/39/72/96/1062397296.db2.gz YELPJUZINPABGY-INIZCTEOSA-N 1 0 314.473 4.306 20 10 DICDRO CCOc1ccc(N2CC[NH+]([C@H](C)c3ccccc3C)CC2)cc1 ZINC001459794137 1062405721 /nfs/dbraw/zinc/40/57/21/1062405721.db2.gz BVBWIZAKYAMLKJ-GOSISDBHSA-N 1 0 324.468 4.277 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](C)c2cccc(C)c2)c1[O-] ZINC001459808198 1062412357 /nfs/dbraw/zinc/41/23/57/1062412357.db2.gz LYIZFTKQAKWYQO-LBPRGKRZSA-N 1 0 317.816 4.407 20 10 DICDRO COC1CCC([NH2+][C@@H]2c3c(c(C)cc(C)c3O)CC2(C)C)CC1 ZINC001255455592 1062451266 /nfs/dbraw/zinc/45/12/66/1062451266.db2.gz DIBHEMCWYKGYEM-JFIBYHEFSA-N 1 0 317.473 4.180 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001255719025 1062536097 /nfs/dbraw/zinc/53/60/97/1062536097.db2.gz BDDSKPUQXPUYJQ-KGLIPLIRSA-N 1 0 301.352 4.335 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCC12CCOCC2)c1ccc(N(C)C)cc1 ZINC001459979004 1062542100 /nfs/dbraw/zinc/54/21/00/1062542100.db2.gz HJHGGXIYUZXYIM-WMZOPIPTSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@H](CSc1ccc(F)cc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC001255736225 1062561813 /nfs/dbraw/zinc/56/18/13/1062561813.db2.gz UOVGLJVJVZFZEA-CQSZACIVSA-N 1 0 318.461 4.162 20 10 DICDRO Cc1ccc(SC[C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001255753010 1062572624 /nfs/dbraw/zinc/57/26/24/1062572624.db2.gz NFYQEVUDVFLVFY-HNNXBMFYSA-N 1 0 313.466 4.200 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC001460029718 1062586315 /nfs/dbraw/zinc/58/63/15/1062586315.db2.gz AWBBESPNHPDMRC-GOSISDBHSA-N 1 0 312.432 4.271 20 10 DICDRO C[C@@H](Cc1ccccc1F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001255829014 1062616156 /nfs/dbraw/zinc/61/61/56/1062616156.db2.gz DCQQIPIKTNELGX-INIZCTEOSA-N 1 0 312.432 4.147 20 10 DICDRO C[C@@H](Cc1ccccc1F)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001255834286 1062618960 /nfs/dbraw/zinc/61/89/60/1062618960.db2.gz HACVETCOXCHTLT-GJZGRUSLSA-N 1 0 300.421 4.174 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2Cc3ccccc3C3(CCC3)C2)cc1 ZINC001460086218 1062625408 /nfs/dbraw/zinc/62/54/08/1062625408.db2.gz TUHXQESIRUNQDG-UHFFFAOYSA-N 1 0 306.453 4.190 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@@H]1CCCN(C2CCCC2)C1 ZINC001256905484 1063040830 /nfs/dbraw/zinc/04/08/30/1063040830.db2.gz RWXPKAHTBKBRMF-LJQANCHMSA-N 1 0 324.468 4.042 20 10 DICDRO CCC[C@@H](CC)[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001257264136 1063168920 /nfs/dbraw/zinc/16/89/20/1063168920.db2.gz ILDLBUIAQDPZKL-CQSZACIVSA-N 1 0 300.446 4.124 20 10 DICDRO C[C@H](CCc1ccccc1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001460998580 1063174471 /nfs/dbraw/zinc/17/44/71/1063174471.db2.gz AHKQELQROUZBFB-IEODJVTJSA-N 1 0 308.469 4.377 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H](C)N(C)c1ccccc1 ZINC001461043719 1063211483 /nfs/dbraw/zinc/21/14/83/1063211483.db2.gz HUYDEJDBMLZMMR-MRXNPFEDSA-N 1 0 321.468 4.101 20 10 DICDRO CCCCCC[C@@H](C)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001257356975 1063228503 /nfs/dbraw/zinc/22/85/03/1063228503.db2.gz DKDXPBBICBVSPB-QGZVFWFLSA-N 1 0 318.505 4.305 20 10 DICDRO C/C(=C\c1ccccc1)C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001461111801 1063263262 /nfs/dbraw/zinc/26/32/62/1063263262.db2.gz IGFSVTXPHPLPKS-GHRIWEEISA-N 1 0 306.453 4.262 20 10 DICDRO CC(C)Cc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC001461121492 1063270782 /nfs/dbraw/zinc/27/07/82/1063270782.db2.gz VVWMEGLHEJGTIS-UHFFFAOYSA-N 1 0 314.448 4.380 20 10 DICDRO Cc1[nH]c2ccc(C[NH2+]Cc3ccc4c(c3)CCCO4)cc2c1C ZINC001461120948 1063270871 /nfs/dbraw/zinc/27/08/71/1063270871.db2.gz MYRATWPDOPSJPZ-UHFFFAOYSA-N 1 0 320.436 4.400 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)cc1F ZINC001461180995 1063315115 /nfs/dbraw/zinc/31/51/15/1063315115.db2.gz IVSMJGHYTKYTKM-SCAQPMJSSA-N 1 0 304.453 4.340 20 10 DICDRO CC[C@@H]1CCCN(C(C)(C)C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC001461195589 1063323164 /nfs/dbraw/zinc/32/31/64/1063323164.db2.gz MTHABRUGKSVMOT-CQSZACIVSA-N 1 0 324.896 4.036 20 10 DICDRO CCCCCC(CCCCC)[NH2+]C[C@H](O)c1ccc(O)c(O)c1 ZINC001257550648 1063333966 /nfs/dbraw/zinc/33/39/66/1063333966.db2.gz XSLCQGYOAUYARY-IBGZPJMESA-N 1 0 323.477 4.250 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2C[C@@](C)(OC)C2(C)C)cc1C ZINC001461239090 1063357729 /nfs/dbraw/zinc/35/77/29/1063357729.db2.gz OBNQCVIZKCGRKR-IEBWSBKVSA-N 1 0 305.462 4.077 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)C1CCC(OC(C)C)CC1 ZINC001257885813 1063425977 /nfs/dbraw/zinc/42/59/77/1063425977.db2.gz VWSJMNLNEGSROD-UHFFFAOYSA-N 1 0 318.505 4.311 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](COC)c2ccccc2)cc1C ZINC001461359360 1063441845 /nfs/dbraw/zinc/44/18/45/1063441845.db2.gz LUSJOKAFWMSYPA-LJQANCHMSA-N 1 0 313.441 4.261 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc2c(c1)CCC2 ZINC001461404751 1063476997 /nfs/dbraw/zinc/47/69/97/1063476997.db2.gz MCECDFDAXBAJKF-OAHLLOKOSA-N 1 0 307.437 4.351 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(NC/C=C/c2ccc(N(C)C)cc2)c1 ZINC001461405508 1063477648 /nfs/dbraw/zinc/47/76/48/1063477648.db2.gz MNRFDIHFWRVWHI-VOTSOKGWSA-N 1 0 323.484 4.248 20 10 DICDRO CSc1ccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)cc1 ZINC001461432752 1063498817 /nfs/dbraw/zinc/49/88/17/1063498817.db2.gz FWUWHNVQSKLDQF-UHFFFAOYSA-N 1 0 307.846 4.366 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2scnc2c1)c1ccc(N(C)C)cc1 ZINC001461443953 1063511386 /nfs/dbraw/zinc/51/13/86/1063511386.db2.gz ZMEPAJHECGFEQM-CYBMUJFWSA-N 1 0 311.454 4.213 20 10 DICDRO CC(C)=CCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258093867 1063514836 /nfs/dbraw/zinc/51/48/36/1063514836.db2.gz HAYLBCNYANELFR-GOSISDBHSA-N 1 0 316.489 4.090 20 10 DICDRO c1ccc(C2CC([NH2+]Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001461459520 1063519661 /nfs/dbraw/zinc/51/96/61/1063519661.db2.gz DKSGYQMQZVKFEK-UHFFFAOYSA-N 1 0 306.453 4.323 20 10 DICDRO CCCc1nc(C)c(C[NH2+]Cc2c(C)c3ccccc3n2C)o1 ZINC001461551253 1063575451 /nfs/dbraw/zinc/57/54/51/1063575451.db2.gz IWASTTSDGWSLPT-UHFFFAOYSA-N 1 0 311.429 4.025 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@]2(C)C[C@]2(F)Cl)cc1 ZINC001461616569 1063614612 /nfs/dbraw/zinc/61/46/12/1063614612.db2.gz QEULFHXDMRZSFS-IAGOWNOFSA-N 1 0 312.860 4.327 20 10 DICDRO Cc1ccccc1C1([NH2+]Cc2ccc(N(C)C)c(F)c2)CCC1 ZINC001461615836 1063615235 /nfs/dbraw/zinc/61/52/35/1063615235.db2.gz JQYBXXYGXCRUEO-UHFFFAOYSA-N 1 0 312.432 4.369 20 10 DICDRO CO[C@H](C)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001461619012 1063616770 /nfs/dbraw/zinc/61/67/70/1063616770.db2.gz DADHSLGGSFIJOT-CYBMUJFWSA-N 1 0 307.478 4.112 20 10 DICDRO CCCCC[C@H](CC)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258446763 1063658920 /nfs/dbraw/zinc/65/89/20/1063658920.db2.gz UNRAYJVYMBPLKH-IBGZPJMESA-N 1 0 318.505 4.314 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1C ZINC001461699102 1063666702 /nfs/dbraw/zinc/66/67/02/1063666702.db2.gz ICRSFRWBRUETCE-LSDHHAIUSA-N 1 0 313.363 4.238 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C)nc2Cl)cc1 ZINC001461721902 1063678289 /nfs/dbraw/zinc/67/82/89/1063678289.db2.gz SQZZCZNJSVPASV-UHFFFAOYSA-N 1 0 317.864 4.179 20 10 DICDRO COc1cc(C[NH2+]C[C@]2(C)CC2(C)C)c(O)c(C(C)(C)C)c1 ZINC001461724840 1063679784 /nfs/dbraw/zinc/67/97/84/1063679784.db2.gz AGAMGCIQLKGTGV-IBGZPJMESA-N 1 0 305.462 4.224 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@]1(C)CCOc2ccccc21 ZINC001461781064 1063713036 /nfs/dbraw/zinc/71/30/36/1063713036.db2.gz OMGWDSXPONIZFU-NRFANRHFSA-N 1 0 320.436 4.274 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H](C)Cc1cccnc1 ZINC001258621216 1063713692 /nfs/dbraw/zinc/71/36/92/1063713692.db2.gz YVUDSASTPSXVJO-YWZLYKJASA-N 1 0 324.468 4.248 20 10 DICDRO c1ccc2c(c1)CCC[C@@H]([NH2+]Cc1ccc3c(c1)CCCO3)C2 ZINC001461788403 1063719001 /nfs/dbraw/zinc/71/90/01/1063719001.db2.gz BNCLRGMXPPPCTF-HXUWFJFHSA-N 1 0 307.437 4.049 20 10 DICDRO Cc1cccnc1[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001461813295 1063732884 /nfs/dbraw/zinc/73/28/84/1063732884.db2.gz ASMHORMYCXLMGF-QGZVFWFLSA-N 1 0 309.457 4.231 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)cc(C)n1 ZINC001461838045 1063742348 /nfs/dbraw/zinc/74/23/48/1063742348.db2.gz LQBPQXHXHHHWEM-UHFFFAOYSA-N 1 0 323.484 4.321 20 10 DICDRO CCCCO[C@@H]1C[C@H]([N@H+](C)Cc2cccc(CC)c2O)C1(C)C ZINC001461881183 1063772613 /nfs/dbraw/zinc/77/26/13/1063772613.db2.gz LRSUQZZCIPZNCE-ZWKOTPCHSA-N 1 0 319.489 4.370 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)c1 ZINC001461885206 1063775454 /nfs/dbraw/zinc/77/54/54/1063775454.db2.gz VANVHNMBGPNXNV-GUYCJALGSA-N 1 0 315.413 4.275 20 10 DICDRO C[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)[C@H]1c1ccccc1 ZINC001461933883 1063819883 /nfs/dbraw/zinc/81/98/83/1063819883.db2.gz GDBOOGOXMRYOEG-UXTXJKSZSA-N 1 0 306.453 4.459 20 10 DICDRO COc1cc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001461965050 1063846966 /nfs/dbraw/zinc/84/69/66/1063846966.db2.gz YWPIVSMJSYQZLR-STQMWFEESA-N 1 0 323.502 4.024 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC001461972904 1063850153 /nfs/dbraw/zinc/85/01/53/1063850153.db2.gz XZHDJVYTYQLPBH-GOSISDBHSA-N 1 0 317.816 4.009 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+]Cc1cc(C(C)C)ccc1O)CCC2 ZINC001461989190 1063862473 /nfs/dbraw/zinc/86/24/73/1063862473.db2.gz PHAZJLNIXCRDLO-OAHLLOKOSA-N 1 0 316.470 4.448 20 10 DICDRO CCC[N@H+](Cc1ccc(OCc2ccccc2)cc1O)C1CC1 ZINC001461991197 1063864470 /nfs/dbraw/zinc/86/44/70/1063864470.db2.gz HWDPVTLSVBQUTM-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1COc2ccccc21 ZINC001261139649 1063910782 /nfs/dbraw/zinc/91/07/82/1063910782.db2.gz UJFQQMOTWWDOTI-YCPHGPKFSA-N 1 0 309.409 4.015 20 10 DICDRO COc1cccc2cc(C[NH2+]Cc3c(O)cccc3Cl)oc21 ZINC001261256421 1063915953 /nfs/dbraw/zinc/91/59/53/1063915953.db2.gz GNVSAZJESKSSOL-UHFFFAOYSA-N 1 0 317.772 4.090 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1COCc2ccccc21 ZINC001261374205 1063922264 /nfs/dbraw/zinc/92/22/64/1063922264.db2.gz BVYBFOBINRXBNC-XYPHTWIQSA-N 1 0 309.409 4.110 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1COCc2ccccc21 ZINC001261374202 1063922606 /nfs/dbraw/zinc/92/26/06/1063922606.db2.gz BVYBFOBINRXBNC-COXVUDFISA-N 1 0 309.409 4.110 20 10 DICDRO CCc1cccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1O ZINC001462088403 1063922826 /nfs/dbraw/zinc/92/28/26/1063922826.db2.gz ABISPUPXUMTPRR-CYBMUJFWSA-N 1 0 301.352 4.117 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCC2(CCCCC2)O1 ZINC001462099668 1063929976 /nfs/dbraw/zinc/92/99/76/1063929976.db2.gz QQSXCFLMUPXQAP-IBGZPJMESA-N 1 0 316.489 4.033 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C1CCC1)[C@@H]1CCOC1 ZINC001261852403 1063949225 /nfs/dbraw/zinc/94/92/25/1063949225.db2.gz BLFKIHBDCKLKBL-NEVJAFOQSA-N 1 0 315.457 4.044 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C1CC1)[C@@H]1CCCOC1 ZINC001262207195 1063960255 /nfs/dbraw/zinc/96/02/55/1063960255.db2.gz VVUAOCSWHJDVBB-NEVJAFOQSA-N 1 0 315.457 4.044 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@@H](F)C1)c1ccc(Br)cc1O ZINC001332341547 1064113856 /nfs/dbraw/zinc/11/38/56/1064113856.db2.gz WVQQFBJCRHHDRH-WCQGTBRESA-N 1 0 316.214 4.086 20 10 DICDRO CC[C@H](C)C[N@H+](CC)Cc1ccc(Br)cc1[O-] ZINC000701175542 1064239902 /nfs/dbraw/zinc/23/99/02/1064239902.db2.gz QXISNUAJEHSKBH-NSHDSACASA-N 1 0 300.240 4.023 20 10 DICDRO CCC(CC)C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000730109298 1064414882 /nfs/dbraw/zinc/41/48/82/1064414882.db2.gz PWIAINAFMQVYML-UHFFFAOYSA-N 1 0 319.449 4.111 20 10 DICDRO Clc1cnc(S[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC001307377633 1065361782 /nfs/dbraw/zinc/36/17/82/1065361782.db2.gz PTXHHLXDVUMKLB-LBPRGKRZSA-N 1 0 310.875 4.163 20 10 DICDRO Cc1nsc(C)c1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC001307461968 1065415045 /nfs/dbraw/zinc/41/50/45/1065415045.db2.gz NIYZWTKQLICPOA-UHFFFAOYSA-N 1 0 316.470 4.410 20 10 DICDRO Oc1ccccc1C[N@H+](CC[C@@H]1C[C@H]1C1CC1)Cc1ccco1 ZINC001307567797 1065488346 /nfs/dbraw/zinc/48/83/46/1065488346.db2.gz UNUWLDDRXYCWHF-APWZRJJASA-N 1 0 311.425 4.424 20 10 DICDRO CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1cc(F)cc(C(C)=O)c1O ZINC001307657300 1065546831 /nfs/dbraw/zinc/54/68/31/1065546831.db2.gz MGQQOAKFDKWUKO-GUYCJALGSA-N 1 0 307.409 4.182 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@@H]3CCCC[C@@]32C)c1O ZINC001307976940 1065708878 /nfs/dbraw/zinc/70/88/78/1065708878.db2.gz KREICEWOXDMYDH-GUYCJALGSA-N 1 0 307.821 4.013 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2cccc(F)c2)cc1F ZINC001308187088 1065797857 /nfs/dbraw/zinc/79/78/57/1065797857.db2.gz QKYZFTFHCJOHMW-UHFFFAOYSA-N 1 0 318.411 4.143 20 10 DICDRO CN(c1ccc(C[NH2+]Cc2cnsc2)cc1)C1CCCCC1 ZINC001308232542 1065839326 /nfs/dbraw/zinc/83/93/26/1065839326.db2.gz XRGPDSCUFIQVIA-UHFFFAOYSA-N 1 0 315.486 4.202 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCc3c2cccc3O)cc1C ZINC001308255687 1065858096 /nfs/dbraw/zinc/85/80/96/1065858096.db2.gz AMRBRDLVUJKEGE-SFHVURJKSA-N 1 0 311.425 4.267 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nc2ccccc2s1 ZINC001308273007 1065872283 /nfs/dbraw/zinc/87/22/83/1065872283.db2.gz WRUMLCMVUKQMCK-GFCCVEGCSA-N 1 0 310.422 4.082 20 10 DICDRO Cc1cccc(O[C@@H](C)C[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC001308275331 1065875198 /nfs/dbraw/zinc/87/51/98/1065875198.db2.gz QXYRALMPASUGOC-POZKEBTKSA-N 1 0 324.468 4.131 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](CCCO)c1ccccc1 ZINC001308279793 1065878298 /nfs/dbraw/zinc/87/82/98/1065878298.db2.gz UYPYLHAZUOPGNS-IBGZPJMESA-N 1 0 322.452 4.090 20 10 DICDRO COc1ccc(C[NH2+]CCc2c(F)cccc2Cl)cc1C ZINC001308306800 1065901423 /nfs/dbraw/zinc/90/14/23/1065901423.db2.gz POHCEUXGQDCHSX-UHFFFAOYSA-N 1 0 307.796 4.128 20 10 DICDRO Cc1cc(C)[nH+]c(NCc2cc(C)cc(Br)c2O)c1 ZINC001308339824 1065925092 /nfs/dbraw/zinc/92/50/92/1065925092.db2.gz MCFWZLBNOXLZTJ-UHFFFAOYSA-N 1 0 321.218 4.087 20 10 DICDRO CCC1(CC)[C@H]([NH2+]Cc2c(O)cc(C)cc2Cl)C[C@@H]1OC ZINC001308341239 1065926486 /nfs/dbraw/zinc/92/64/86/1065926486.db2.gz GIBAXDOMFBMTBC-CVEARBPZSA-N 1 0 311.853 4.037 20 10 DICDRO CC(C)c1cccc(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC001308377020 1065950601 /nfs/dbraw/zinc/95/06/01/1065950601.db2.gz WSSDDYBBNLYGTK-UHFFFAOYSA-N 1 0 318.411 4.444 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC[C@H]2C2CC2)cc1 ZINC001308436859 1065987523 /nfs/dbraw/zinc/98/75/23/1065987523.db2.gz WFEVAAFESQOBLP-ICSRJNTNSA-N 1 0 300.490 4.449 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001308442316 1065990537 /nfs/dbraw/zinc/99/05/37/1065990537.db2.gz VNOOFWCKGXVXIY-INIZCTEOSA-N 1 0 321.468 4.263 20 10 DICDRO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001308444389 1065992466 /nfs/dbraw/zinc/99/24/66/1065992466.db2.gz YXHINEXQACNOJO-SFTDATJTSA-N 1 0 324.443 4.404 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C/C=C\c2ccc(F)c(F)c2)c1 ZINC001308451095 1065996989 /nfs/dbraw/zinc/99/69/89/1065996989.db2.gz UYBOBOXGASULCO-VSQXVHSFSA-N 1 0 319.351 4.043 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](CC)[C@H]2CCCCO2)cc1C ZINC001308451200 1065997131 /nfs/dbraw/zinc/99/71/31/1065997131.db2.gz VOSYFFBPJHRSCM-IEBWSBKVSA-N 1 0 305.462 4.221 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)cc1 ZINC001308455506 1065998057 /nfs/dbraw/zinc/99/80/57/1065998057.db2.gz MLDJAHGVFCGNPD-HRAATJIYSA-N 1 0 308.469 4.351 20 10 DICDRO CS[C@@H]1CCCC[C@H]1[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001308453185 1065998470 /nfs/dbraw/zinc/99/84/70/1065998470.db2.gz HLUFDRMCDOEVNG-IKSUFZCESA-N 1 0 304.503 4.030 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+]Cc3ccccc3C(C)C)C2)cc1 ZINC001308460474 1066003218 /nfs/dbraw/zinc/00/32/18/1066003218.db2.gz AKIKPFWLAYWWPK-SFHVURJKSA-N 1 0 324.468 4.187 20 10 DICDRO CCSC1(C[NH2+]Cc2ccc(N(CC)CC)c(F)c2)CC1 ZINC001308473892 1066013796 /nfs/dbraw/zinc/01/37/96/1066013796.db2.gz UCMGWULQMONDRB-UHFFFAOYSA-N 1 0 310.482 4.047 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](OC)C2CCCCC2)cc1 ZINC001308477456 1066017756 /nfs/dbraw/zinc/01/77/56/1066017756.db2.gz KOFQVSGGRUPHOQ-HXUWFJFHSA-N 1 0 318.505 4.218 20 10 DICDRO C[C@@H](CC1CCC1)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001308480735 1066018594 /nfs/dbraw/zinc/01/85/94/1066018594.db2.gz BYNZQIJLHNKDGF-LBPRGKRZSA-N 1 0 314.395 4.440 20 10 DICDRO CCC(F)(F)C(C)(C)C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001308488983 1066023484 /nfs/dbraw/zinc/02/34/84/1066023484.db2.gz KUOXFHNUFGJSHJ-BQYQJAHWSA-N 1 0 310.432 4.427 20 10 DICDRO CCCOc1ccc(C[NH2+]CC(C)(C)[C@@H]2CCCCO2)cc1C ZINC001308489782 1066024149 /nfs/dbraw/zinc/02/41/49/1066024149.db2.gz AQAPDIQYFBEXJK-IBGZPJMESA-N 1 0 319.489 4.469 20 10 DICDRO CC(F)(F)C(C)(C)C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001308492100 1066025530 /nfs/dbraw/zinc/02/55/30/1066025530.db2.gz CEUXFYJBIYYSBC-UHFFFAOYSA-N 1 0 310.432 4.448 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cccc3[nH]ccc32)c(Cl)c1 ZINC001308498665 1066029316 /nfs/dbraw/zinc/02/93/16/1066029316.db2.gz BPCZFDILZMMNDG-UHFFFAOYSA-N 1 0 300.789 4.125 20 10 DICDRO CC(C)c1nc(C[NH2+][C@@H](C)c2ccccc2O)c2ccccn21 ZINC001308507146 1066035988 /nfs/dbraw/zinc/03/59/88/1066035988.db2.gz YTNOXVYROUGZDG-AWEZNQCLSA-N 1 0 309.413 4.014 20 10 DICDRO CC(C)[C@@H](Cc1ccccc1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308520278 1066041803 /nfs/dbraw/zinc/04/18/03/1066041803.db2.gz VTMPAHNDZBSSMD-HXUWFJFHSA-N 1 0 309.453 4.369 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCCc3ccccc3C2)cc1 ZINC001308538733 1066055774 /nfs/dbraw/zinc/05/57/74/1066055774.db2.gz YUMSLPACBKDVSL-BXKJMJEDSA-N 1 0 320.480 4.303 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCSC3(CCC3)C2)cc1 ZINC001308540634 1066056656 /nfs/dbraw/zinc/05/66/56/1066056656.db2.gz NQLBWQAHJDPLMY-NJELEJDNSA-N 1 0 316.514 4.174 20 10 DICDRO FC1(F)CC[C@H](CC[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001308547328 1066060603 /nfs/dbraw/zinc/06/06/03/1066060603.db2.gz XOGWKPCNJCZJQC-OAHLLOKOSA-N 1 0 308.416 4.202 20 10 DICDRO CCOCc1cc(C[NH2+]C2(C3CCCCC3)CC2)ccc1OC ZINC001308545790 1066060746 /nfs/dbraw/zinc/06/07/46/1066060746.db2.gz ISGLLOBMPNEKGL-UHFFFAOYSA-N 1 0 317.473 4.434 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@H]32)c(C(F)(F)F)c1 ZINC001308548218 1066062279 /nfs/dbraw/zinc/06/22/79/1066062279.db2.gz XSZPQTBKGQUTFE-DJSGYFEHSA-N 1 0 312.379 4.050 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H]32)c(C(F)(F)F)c1 ZINC001308548217 1066062662 /nfs/dbraw/zinc/06/26/62/1066062662.db2.gz XSZPQTBKGQUTFE-DIOULYMOSA-N 1 0 312.379 4.050 20 10 DICDRO c1ccc(C[C@@H]2C[C@H]2C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001308551332 1066064430 /nfs/dbraw/zinc/06/44/30/1066064430.db2.gz GBZFEVMHEJVONW-RTWAWAEBSA-N 1 0 320.480 4.255 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2N(C)C)cc1C ZINC001308553535 1066065654 /nfs/dbraw/zinc/06/56/54/1066065654.db2.gz AXXBPINFUZVISJ-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO CCC1CC[NH+](Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC001308568132 1066077670 /nfs/dbraw/zinc/07/76/70/1066077670.db2.gz RAMUCLUSNLIFPI-UHFFFAOYSA-N 1 0 305.462 4.320 20 10 DICDRO CCCCO[C@@H]1C[C@H]([N@H+](C)Cc2ccc(C)cc2O)C1(C)C ZINC001308578081 1066093636 /nfs/dbraw/zinc/09/36/36/1066093636.db2.gz MKOFBKPLFNFRNG-ZWKOTPCHSA-N 1 0 305.462 4.116 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCOC3(C2)CCCCCC3)cc1Cl ZINC001308597826 1066108486 /nfs/dbraw/zinc/10/84/86/1066108486.db2.gz GRTIONFWDMBWFV-UHFFFAOYSA-N 1 0 323.864 4.279 20 10 DICDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccc(Br)cc1O ZINC001308601229 1066110676 /nfs/dbraw/zinc/11/06/76/1066110676.db2.gz RGQWGGQTOJYFGA-CQSZACIVSA-N 1 0 312.251 4.165 20 10 DICDRO CC1=CC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC001308619919 1066121872 /nfs/dbraw/zinc/12/18/72/1066121872.db2.gz QREMVIMMCFCFHN-UHFFFAOYSA-N 1 0 309.409 4.123 20 10 DICDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2c(O)cccc2Br)C1 ZINC001308619184 1066122202 /nfs/dbraw/zinc/12/22/02/1066122202.db2.gz JYFVXSCSJRLWAQ-RYUDHWBXSA-N 1 0 312.251 4.165 20 10 DICDRO Cc1cc(C[N@H+](Cc2ccccc2O)C2CCCC2)cnc1F ZINC001308634295 1066128767 /nfs/dbraw/zinc/12/87/67/1066128767.db2.gz PEIFBOFTQKOWIG-UHFFFAOYSA-N 1 0 314.404 4.180 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCCCCC2)c(C(F)(F)F)c1 ZINC001308647313 1066135711 /nfs/dbraw/zinc/13/57/11/1066135711.db2.gz IYRCLZZMADABER-UHFFFAOYSA-N 1 0 300.368 4.147 20 10 DICDRO Cc1cccc(N2CC[NH+](Cc3cc(C(C)C)ccc3O)CC2)c1 ZINC001308654492 1066138948 /nfs/dbraw/zinc/13/89/48/1066138948.db2.gz DUMGNJVWWLKRPO-UHFFFAOYSA-N 1 0 324.468 4.146 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@]2(C)CCCc3ccccc32)c1O ZINC001308679670 1066153015 /nfs/dbraw/zinc/15/30/15/1066153015.db2.gz DNWIRAJYNJDQNJ-FQEVSTJZSA-N 1 0 311.425 4.051 20 10 DICDRO C[C@H]1COc2ccccc2C[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001308686058 1066155036 /nfs/dbraw/zinc/15/50/36/1066155036.db2.gz XWOKAMZAFZKAEI-TUYSUELWSA-N 1 0 322.452 4.049 20 10 DICDRO CC[C@@H]1CC[N@H+](Cc2cc(Br)cc(C)c2O)[C@@H]1C ZINC001308704188 1066190213 /nfs/dbraw/zinc/19/02/13/1066190213.db2.gz NIIPFUJIJDENOP-VXGBXAGGSA-N 1 0 312.251 4.084 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC001308717160 1066195163 /nfs/dbraw/zinc/19/51/63/1066195163.db2.gz CDANKBSILXMGLN-KRWDZBQOSA-N 1 0 305.780 4.116 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)c(O)c(C(C)(C)C)c1 ZINC001308781525 1066254122 /nfs/dbraw/zinc/25/41/22/1066254122.db2.gz HDVPWRCWNVJETD-GOSISDBHSA-N 1 0 309.425 4.022 20 10 DICDRO Cc1ccccc1CC[N@@H+](C)Cc1cc(Cl)c(C)cc1O ZINC001308786748 1066262793 /nfs/dbraw/zinc/26/27/93/1066262793.db2.gz NNIVPFMIFIASII-UHFFFAOYSA-N 1 0 303.833 4.337 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)C2CCC(F)(F)CC2)c(Cl)c1 ZINC001308794130 1066270505 /nfs/dbraw/zinc/27/05/05/1066270505.db2.gz IQAWVUAIXJLANS-UHFFFAOYSA-N 1 0 303.780 4.364 20 10 DICDRO CCC1(c2ccccc2)C[NH+](Cc2ccc(N(C)C)cc2C)C1 ZINC001308808498 1066283995 /nfs/dbraw/zinc/28/39/95/1066283995.db2.gz DQNFEULQQVJERP-UHFFFAOYSA-N 1 0 308.469 4.225 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cncc(Cl)c1Cl ZINC001308846377 1066322448 /nfs/dbraw/zinc/32/24/48/1066322448.db2.gz QVULFWRUGHSTGX-UHFFFAOYSA-N 1 0 317.603 4.037 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCC[C@@H](C2CCOCC2)C1 ZINC001308846578 1066323564 /nfs/dbraw/zinc/32/35/64/1066323564.db2.gz UBSXRMFNJFXQNQ-RHSMWYFYSA-N 1 0 323.864 4.121 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCC[C@H](C2CCOCC2)C1 ZINC001308846579 1066323918 /nfs/dbraw/zinc/32/39/18/1066323918.db2.gz UBSXRMFNJFXQNQ-WMLDXEAASA-N 1 0 323.864 4.121 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCCC[C@@H]2C2CCC2)cc1F ZINC001308849520 1066327467 /nfs/dbraw/zinc/32/74/67/1066327467.db2.gz DQYZUUACMSUFMD-QGZVFWFLSA-N 1 0 308.416 4.185 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccnc(Oc3ccccc3)c2)c(O)c1 ZINC001308852485 1066333989 /nfs/dbraw/zinc/33/39/89/1066333989.db2.gz VPLYPGIXBFQNGR-UHFFFAOYSA-N 1 0 320.392 4.178 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C[C@H]2CCCC23CC3)c1O ZINC001308890267 1066372190 /nfs/dbraw/zinc/37/21/90/1066372190.db2.gz BHKYVHVFQVYUDF-CYBMUJFWSA-N 1 0 324.262 4.133 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@H]2CCCC3(CC3)C2)c1O ZINC001308956971 1066418218 /nfs/dbraw/zinc/41/82/18/1066418218.db2.gz UMDBJVRBZDCTQR-AWEZNQCLSA-N 1 0 324.262 4.276 20 10 DICDRO COc1c(Cl)cccc1C[NH2+]Cc1cc(C(C)C)ccc1O ZINC001308958265 1066419733 /nfs/dbraw/zinc/41/97/33/1066419733.db2.gz FXLQRJALEOGVPK-UHFFFAOYSA-N 1 0 319.832 4.467 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H]2CCSc3ccccc32)c1O ZINC000236927815 202074862 /nfs/dbraw/zinc/07/48/62/202074862.db2.gz GSMSIGOLOMPKTF-OAHLLOKOSA-N 1 0 315.438 4.118 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c1 ZINC000021502072 182274772 /nfs/dbraw/zinc/27/47/72/182274772.db2.gz GPGBAIAGNSQSPX-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3sccc32)c1 ZINC000061331117 184168590 /nfs/dbraw/zinc/16/85/90/184168590.db2.gz IOXNZUPELPKYAO-NHYWBVRUSA-N 1 0 303.427 4.191 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c(O)c1C ZINC000273356981 130111286 /nfs/dbraw/zinc/11/12/86/130111286.db2.gz CXMDGFOHKPPUQI-JKSUJKDBSA-N 1 0 303.446 4.151 20 10 DICDRO CC(C)Oc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000273420896 130119522 /nfs/dbraw/zinc/11/95/22/130119522.db2.gz RZRAHUCMLIUPFR-CYBMUJFWSA-N 1 0 303.377 4.169 20 10 DICDRO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000273430396 130121264 /nfs/dbraw/zinc/12/12/64/130121264.db2.gz VLHPDOJSFDSIII-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)c(O)c1C ZINC000273485552 130127309 /nfs/dbraw/zinc/12/73/09/130127309.db2.gz NEUQFQHMQCAYCD-ZMSDIMECSA-N 1 0 305.462 4.253 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCOC3(CCCCC3)C2)c1 ZINC000273489324 130127825 /nfs/dbraw/zinc/12/78/25/130127825.db2.gz NWXIOGZVJYTUQL-HOTGVXAUSA-N 1 0 303.446 4.233 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOC3(CCCCC3)C2)c(O)c1 ZINC000273510308 130130509 /nfs/dbraw/zinc/13/05/09/130130509.db2.gz RPKIUDKOPNKLAU-HOTGVXAUSA-N 1 0 303.446 4.233 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2ccc(F)cc2O)c1 ZINC000273510243 130130909 /nfs/dbraw/zinc/13/09/09/130130909.db2.gz RNDJKZWSJFMETL-ZDUSSCGKSA-N 1 0 302.393 4.074 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1 ZINC000273590477 130141349 /nfs/dbraw/zinc/14/13/49/130141349.db2.gz PAGVHYANKQXSBR-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2nc3c(cccc3C)o2)c(O)c1 ZINC000273609106 130144298 /nfs/dbraw/zinc/14/42/98/130144298.db2.gz VDPLBXLWMVUBML-CQSZACIVSA-N 1 0 310.397 4.044 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCO[C@H](C2CC2)C1 ZINC000274048353 130200543 /nfs/dbraw/zinc/20/05/43/130200543.db2.gz FTTMORHXDJEGLF-CTNGQTDRSA-N 1 0 323.436 4.106 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)c(O)c1 ZINC000285149030 131142756 /nfs/dbraw/zinc/14/27/56/131142756.db2.gz MEHBCXHAAGDSJF-OAHLLOKOSA-N 1 0 313.441 4.087 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(O)c1 ZINC000285398554 131164678 /nfs/dbraw/zinc/16/46/78/131164678.db2.gz XBVKHBWNZKUINM-LBPRGKRZSA-N 1 0 302.443 4.194 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000286381156 131234153 /nfs/dbraw/zinc/23/41/53/131234153.db2.gz APZXNXGZSPNWQU-JTQLQIEISA-N 1 0 309.381 4.243 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)c1 ZINC000287197469 131268503 /nfs/dbraw/zinc/26/85/03/131268503.db2.gz WCYUZJJNPZURLV-HOTGVXAUSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](CCO)c2ccc(Cl)cc2)c1 ZINC000287239768 131269962 /nfs/dbraw/zinc/26/99/62/131269962.db2.gz YRZMJAOWMQLQSC-CXAGYDPISA-N 1 0 319.832 4.128 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c1 ZINC000287239770 131270042 /nfs/dbraw/zinc/27/00/42/131270042.db2.gz YRZMJAOWMQLQSC-DYVFJYSZSA-N 1 0 319.832 4.128 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCOC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000287315647 131275008 /nfs/dbraw/zinc/27/50/08/131275008.db2.gz FEXQIIJYRCLGFD-AOIWGVFYSA-N 1 0 316.489 4.000 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)C[C@H](C)O)c1cc(Cl)cc(Cl)c1[O-] ZINC000287712689 131296248 /nfs/dbraw/zinc/29/62/48/131296248.db2.gz OEIHBBQBIKONFF-BHDSKKPTSA-N 1 0 320.260 4.147 20 10 DICDRO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000294821901 131863112 /nfs/dbraw/zinc/86/31/12/131863112.db2.gz QMLXQFOOVVAMBZ-OLZOCXBDSA-N 1 0 320.458 4.024 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cc(F)cnc2Cl)c(O)c1 ZINC000297376916 132012877 /nfs/dbraw/zinc/01/28/77/132012877.db2.gz QUCWPJDFRBIUCI-LLVKDONJSA-N 1 0 308.784 4.047 20 10 DICDRO Cc1ccc(-c2nc(C[NH2+][C@H]3CCc4cccc(O)c43)co2)cc1 ZINC000297887927 132039129 /nfs/dbraw/zinc/03/91/29/132039129.db2.gz VLLGOLXXIXYNQF-KRWDZBQOSA-N 1 0 320.392 4.133 20 10 DICDRO c1c2ccccc2[nH]c1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000299306566 132098241 /nfs/dbraw/zinc/09/82/41/132098241.db2.gz FEGWFKOUHTXZPF-UHFFFAOYSA-N 1 0 319.452 4.448 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)cc1C ZINC000035257823 331491424 /nfs/dbraw/zinc/49/14/24/331491424.db2.gz UMXRQROOVHZURM-KBPBESRZSA-N 1 0 301.352 4.214 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccc(OC)cc1 ZINC000176983447 332966987 /nfs/dbraw/zinc/96/69/87/332966987.db2.gz BEQPYLBEEWENGJ-PXAZEXFGSA-N 1 0 303.377 4.342 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(F)F)cc2)c1 ZINC000183989642 333190600 /nfs/dbraw/zinc/19/06/00/333190600.db2.gz QCLMKVSAVYVLHE-LLVKDONJSA-N 1 0 307.340 4.189 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2ccc(C(F)F)cc2)c1O ZINC000185184218 333205354 /nfs/dbraw/zinc/20/53/54/333205354.db2.gz YGIOCOQRNXXPCR-UHFFFAOYSA-N 1 0 307.340 4.018 20 10 DICDRO COc1cc(Cl)ccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185399819 333208155 /nfs/dbraw/zinc/20/81/55/333208155.db2.gz DLCVXKWBBITTTB-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COCCC(C)(C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000183929854 333324872 /nfs/dbraw/zinc/32/48/72/333324872.db2.gz AMOMJBYYGQYTEZ-AWEZNQCLSA-N 1 0 301.430 4.259 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1O ZINC000297316781 335152873 /nfs/dbraw/zinc/15/28/73/335152873.db2.gz NBMASGUTBAWCOI-GUYCJALGSA-N 1 0 314.385 4.411 20 10 DICDRO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000192790340 336261806 /nfs/dbraw/zinc/26/18/06/336261806.db2.gz KYZGVWMZNNFGJI-KGLIPLIRSA-N 1 0 315.413 4.130 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cc(F)ccc1O ZINC000368234442 336840969 /nfs/dbraw/zinc/84/09/69/336840969.db2.gz KTWXBSZVMWPXIV-HIFRSBDPSA-N 1 0 307.409 4.064 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)c(OC)c1 ZINC000390348498 336937356 /nfs/dbraw/zinc/93/73/56/336937356.db2.gz XKWAYVAUWARGBJ-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cc1O ZINC000571930880 337582221 /nfs/dbraw/zinc/58/22/21/337582221.db2.gz LNADVOOCOPHCMI-CQSZACIVSA-N 1 0 324.424 4.052 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc(F)cc(F)c1 ZINC000475190910 339440817 /nfs/dbraw/zinc/44/08/17/339440817.db2.gz MQCUUNKSMYSEGN-UHFFFAOYSA-N 1 0 300.352 4.055 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H](c2ccccn2)C2CCC2)c1O ZINC000529641274 340766253 /nfs/dbraw/zinc/76/62/53/340766253.db2.gz CLPVVDDNCDINMJ-KRWDZBQOSA-N 1 0 316.832 4.380 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1O ZINC000236934441 341204662 /nfs/dbraw/zinc/20/46/62/341204662.db2.gz TWYRMHIZPOLMEM-INIZCTEOSA-N 1 0 317.816 4.221 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000249332373 341396531 /nfs/dbraw/zinc/39/65/31/341396531.db2.gz WZJAVWVQRAJWFF-QJPTWQEYSA-N 1 0 317.351 4.173 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000273379440 341635221 /nfs/dbraw/zinc/63/52/21/341635221.db2.gz HZAVFPWAQHGTHF-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO CC[C@H]([NH2+]CCCCc1nc(C)cs1)c1ccccc1O ZINC000155589117 517825355 /nfs/dbraw/zinc/82/53/55/517825355.db2.gz XYFLTROPLGAPKQ-HNNXBMFYSA-N 1 0 304.459 4.221 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](C)c2cccs2)c1O ZINC000182549431 518277530 /nfs/dbraw/zinc/27/75/30/518277530.db2.gz NRFZNUDPRKRUIW-SECBINFHSA-N 1 0 309.818 4.161 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(COC)cc2)cc1 ZINC000124391701 520283409 /nfs/dbraw/zinc/28/34/09/520283409.db2.gz LRHCTFUHIATAQW-MRXNPFEDSA-N 1 0 312.457 4.140 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(OC)ccc2O)CCO1 ZINC000186502541 521611879 /nfs/dbraw/zinc/61/18/79/521611879.db2.gz WXZLKIUCLBTDCI-RFUYNDQBSA-N 1 0 321.461 4.035 20 10 DICDRO CCc1cnc(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)s1 ZINC000130533239 522042348 /nfs/dbraw/zinc/04/23/48/522042348.db2.gz BTEOJLWNGWNRAF-MRXNPFEDSA-N 1 0 303.475 4.012 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccccc1O ZINC000188039179 522759166 /nfs/dbraw/zinc/75/91/66/522759166.db2.gz ROOIOHGLZDVDHO-HOTGVXAUSA-N 1 0 301.361 4.096 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(N(C)C)cc1 ZINC000130448219 522926574 /nfs/dbraw/zinc/92/65/74/522926574.db2.gz UOEWRIBRQXTFDY-RTBURBONSA-N 1 0 310.441 4.186 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cccc(-n2cccn2)c1)c1ccccc1O ZINC000156151577 522938287 /nfs/dbraw/zinc/93/82/87/522938287.db2.gz YAWGWHHOUKTQMQ-DNVCBOLYSA-N 1 0 321.424 4.380 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@H](C)c1cc(F)ccc1O ZINC000186477559 524388898 /nfs/dbraw/zinc/38/88/98/524388898.db2.gz VISRNYRULYTRRY-CYBMUJFWSA-N 1 0 302.393 4.074 20 10 DICDRO COc1ccc(O)c(C[NH2+]C(C)(C)c2cccc(Cl)c2)c1 ZINC000182455948 524750708 /nfs/dbraw/zinc/75/07/08/524750708.db2.gz GUJXSFHUGJCQBO-UHFFFAOYSA-N 1 0 305.805 4.079 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3c2cccc3Cl)c1 ZINC000182471909 524774336 /nfs/dbraw/zinc/77/43/36/524774336.db2.gz ITMVCCOUJHTCFH-APPDUMDISA-N 1 0 317.816 4.392 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]C2(c3nccs3)CCCC2)c1O ZINC000182220327 524869526 /nfs/dbraw/zinc/86/95/26/524869526.db2.gz GWIBBENFRCILSM-UHFFFAOYSA-N 1 0 322.861 4.370 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)c1 ZINC000185288889 525365232 /nfs/dbraw/zinc/36/52/32/525365232.db2.gz YFDCKDOEXJVZGE-RDJZCZTQSA-N 1 0 317.429 4.358 20 10 DICDRO C[C@H]([NH2+]CCc1nc(C(C)(C)C)cs1)c1ccccc1O ZINC000183497803 525373105 /nfs/dbraw/zinc/37/31/05/525373105.db2.gz KSTSNFJFNKRESZ-LBPRGKRZSA-N 1 0 304.459 4.040 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(-c2cccnc2)c1)c1cc(F)ccc1O ZINC000364172337 525530427 /nfs/dbraw/zinc/53/04/27/525530427.db2.gz XTDWALFSTOJLBM-CQSZACIVSA-N 1 0 322.383 4.444 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccc(N(C)C)cc1 ZINC000188052608 525687808 /nfs/dbraw/zinc/68/78/08/525687808.db2.gz MYKFDLUTNVIZFX-ACJLOTCBSA-N 1 0 314.404 4.066 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)c1cc(F)ccc1O ZINC000158057488 525688930 /nfs/dbraw/zinc/68/89/30/525688930.db2.gz WFDXMSGLOZMHRL-AZOIQLNYSA-N 1 0 315.388 4.102 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1cc(Cl)ccc1O ZINC000188043442 525689034 /nfs/dbraw/zinc/68/90/34/525689034.db2.gz IJVMATBBFZJJPF-BMIGLBTASA-N 1 0 321.779 4.359 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)CCC2 ZINC000364950816 527109894 /nfs/dbraw/zinc/10/98/94/527109894.db2.gz KAAVFIHVPCPQHU-RISCZKNCSA-N 1 0 302.443 4.194 20 10 DICDRO CC[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(Cl)c1[O-] ZINC000287662836 535894074 /nfs/dbraw/zinc/89/40/74/535894074.db2.gz LTGKKGSJCGZSLF-INIZCTEOSA-N 1 0 324.896 4.349 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(C(F)(F)F)n1)c1ccccc1O ZINC000294666438 535919770 /nfs/dbraw/zinc/91/97/70/535919770.db2.gz ALWMQDXAWVGNLB-ZDUSSCGKSA-N 1 0 310.319 4.047 20 10 DICDRO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273571661 536512137 /nfs/dbraw/zinc/51/21/37/536512137.db2.gz KVJKCTCRMWWQMJ-QWHCGFSZSA-N 1 0 320.458 4.024 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(C)o1 ZINC000273389620 536806987 /nfs/dbraw/zinc/80/69/87/536806987.db2.gz DHKLZPVZPMQACE-GOEBONIOSA-N 1 0 303.402 4.030 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(C)o1 ZINC000273422432 536817791 /nfs/dbraw/zinc/81/77/91/536817791.db2.gz JPBDMIKHOLKXRM-ZBFHGGJFSA-N 1 0 303.402 4.030 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccc(C)o1 ZINC000273442526 536817837 /nfs/dbraw/zinc/81/78/37/536817837.db2.gz NBSUJYWBZDEFOD-DOMZBBRYSA-N 1 0 323.820 4.375 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1 ZINC000273590486 536902483 /nfs/dbraw/zinc/90/24/83/536902483.db2.gz PAGVHYANKQXSBR-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(OC)c1O)c1cccc(Cl)c1 ZINC000036921466 1035883453 /nfs/dbraw/zinc/88/34/53/1035883453.db2.gz LGDVTTUAIUOHGZ-HNNXBMFYSA-N 1 0 305.805 4.295 20 10 DICDRO COc1ccc(N2CCC[N@H+](C[C@H]3CCC[C@H](C)C3)CC2)cc1 ZINC001167107687 1036093502 /nfs/dbraw/zinc/09/35/02/1036093502.db2.gz GRUQKKJSWLZDIS-ROUUACIJSA-N 1 0 316.489 4.034 20 10 DICDRO CCN(C)c1ccc(C[N@H+](CC)Cc2ccccc2F)cc1 ZINC001167244481 1036315435 /nfs/dbraw/zinc/31/54/35/1036315435.db2.gz RQOTUZBRBNQLRD-UHFFFAOYSA-N 1 0 300.421 4.304 20 10 DICDRO C[N@H+](Cc1c(O)ccc2ccncc21)[C@H]1CCCc2ccccc21 ZINC000023611989 1036411567 /nfs/dbraw/zinc/41/15/67/1036411567.db2.gz OUJHCIRXJAKYKG-FQEVSTJZSA-N 1 0 318.420 4.450 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCSc2ccccc21 ZINC000083551472 1036897091 /nfs/dbraw/zinc/89/70/91/1036897091.db2.gz HRYXYULZLVRXRR-CQSZACIVSA-N 1 0 305.830 4.372 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3cccc(Cl)c3)ccc21 ZINC000050266800 1037175036 /nfs/dbraw/zinc/17/50/36/1037175036.db2.gz OUJJYXDDYHABSQ-UHFFFAOYSA-N 1 0 300.833 4.012 20 10 DICDRO Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1ccc(N(C)C)cc1 ZINC000160534491 1037186185 /nfs/dbraw/zinc/18/61/85/1037186185.db2.gz KHBRKXKPDNVMNY-IBGZPJMESA-N 1 0 310.441 4.065 20 10 DICDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1c(O)cccc1Br ZINC000706842347 1037499024 /nfs/dbraw/zinc/49/90/24/1037499024.db2.gz ASLXXZDWHGRFJY-BXUZGUMPSA-N 1 0 312.251 4.213 20 10 DICDRO CCc1nc(CC[NH2+][C@H](CC)c2ccc(N(C)C)cc2)cs1 ZINC000157099547 1037532795 /nfs/dbraw/zinc/53/27/95/1037532795.db2.gz PCPZWHXXELJMEG-QGZVFWFLSA-N 1 0 317.502 4.055 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)c(O)c1C ZINC000834883758 1037698868 /nfs/dbraw/zinc/69/88/68/1037698868.db2.gz HCEKZPHDFYGAQV-BXUZGUMPSA-N 1 0 302.245 4.244 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(Cl)cc(OC)c1O)c1ccccc1 ZINC000228672648 1038016605 /nfs/dbraw/zinc/01/66/05/1038016605.db2.gz NPRZAQAHCNRFRJ-OAHLLOKOSA-N 1 0 305.805 4.295 20 10 DICDRO CCC[N@H+](Cc1c(C)nn(C(C)C)c1C)Cc1ccccc1O ZINC000891853910 1038237658 /nfs/dbraw/zinc/23/76/58/1038237658.db2.gz UEBDZLFHJBSCSU-UHFFFAOYSA-N 1 0 315.461 4.199 20 10 DICDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)CC)cc2)C1 ZINC001167496039 1038301129 /nfs/dbraw/zinc/30/11/29/1038301129.db2.gz IZEKVXDDYJYEBU-ZWKOTPCHSA-N 1 0 306.519 4.249 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc3[nH]ccc32)cc1 ZINC000171129558 1038339017 /nfs/dbraw/zinc/33/90/17/1038339017.db2.gz UUOBUFXGDKCTPG-UHFFFAOYSA-N 1 0 307.441 4.304 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)cc1 ZINC000176636885 1038457276 /nfs/dbraw/zinc/45/72/76/1038457276.db2.gz FPJFCMLZXDLLQX-IBGZPJMESA-N 1 0 322.452 4.289 20 10 DICDRO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)[nH]1 ZINC000277247826 1038467672 /nfs/dbraw/zinc/46/76/72/1038467672.db2.gz NTJZHQPWPNHFAG-LEWSCRJBSA-N 1 0 316.449 4.052 20 10 DICDRO C[NH+](C)Cc1cccc(NCc2ccc(N3CCCCC3)cc2)c1 ZINC000121751761 1038546363 /nfs/dbraw/zinc/54/63/63/1038546363.db2.gz NJBOZTNFLUGQSS-UHFFFAOYSA-N 1 0 323.484 4.351 20 10 DICDRO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001167533715 1038552361 /nfs/dbraw/zinc/55/23/61/1038552361.db2.gz KKILVVCOWYIKPS-YWZLYKJASA-N 1 0 312.432 4.475 20 10 DICDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000230664515 1038621179 /nfs/dbraw/zinc/62/11/79/1038621179.db2.gz YJQCKZGCMRYBBN-NWANDNLSSA-N 1 0 301.455 4.480 20 10 DICDRO CS[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000230698895 1038621593 /nfs/dbraw/zinc/62/15/93/1038621593.db2.gz XJPFTYIZTXFYMW-SJLPKXTDSA-N 1 0 304.503 4.051 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Br)cc2)c1 ZINC000048010772 1038662590 /nfs/dbraw/zinc/66/25/90/1038662590.db2.gz UNTAPLCOTRGFSA-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO C[C@H](Cc1ccsc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000048557004 1038667570 /nfs/dbraw/zinc/66/75/70/1038667570.db2.gz XQQBDGTZKQBQEV-OAHLLOKOSA-N 1 0 300.471 4.069 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccccc1 ZINC000173331339 1038711943 /nfs/dbraw/zinc/71/19/43/1038711943.db2.gz MDIPZYGOJXYPOS-MRXNPFEDSA-N 1 0 312.482 4.091 20 10 DICDRO CC[C@H]([NH2+]Cc1sc(C)nc1C)c1ccc(N(C)C)cc1 ZINC000119846900 1038949662 /nfs/dbraw/zinc/94/96/62/1038949662.db2.gz UPRYYPMHAIICGU-INIZCTEOSA-N 1 0 303.475 4.067 20 10 DICDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)cn1 ZINC000161536769 1039142317 /nfs/dbraw/zinc/14/23/17/1039142317.db2.gz KMXCPMUVEWUQBQ-GOSISDBHSA-N 1 0 323.484 4.274 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOC[C@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000278568628 1039557998 /nfs/dbraw/zinc/55/79/98/1039557998.db2.gz PJTWOPXJVWBSIG-UWVAXJGDSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@H]([NH2+][C@H]1CC=CCC1)c1cc(Br)ccc1O ZINC000088747604 1039598000 /nfs/dbraw/zinc/59/80/00/1039598000.db2.gz MPMVVCNMLIOWLH-JSGCOSHPSA-N 1 0 310.235 4.304 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CSCCS1)c1ccc2ccccc2c1O ZINC000168819489 1039615511 /nfs/dbraw/zinc/61/55/11/1039615511.db2.gz IVLXRRQSBUQJFY-GXTWGEPZSA-N 1 0 319.495 4.045 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)CCC(C)C)CC2)cc1 ZINC000151608599 1039840468 /nfs/dbraw/zinc/84/04/68/1039840468.db2.gz WWRDOUGVNHDZSC-INIZCTEOSA-N 1 0 304.478 4.078 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(N(C)C)cc1 ZINC000177973808 1040842895 /nfs/dbraw/zinc/84/28/95/1040842895.db2.gz KFJUEAJGSNPJOQ-QGZVFWFLSA-N 1 0 323.484 4.204 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(N(C)C)cc1 ZINC000177973795 1040844131 /nfs/dbraw/zinc/84/41/31/1040844131.db2.gz KFJUEAJGSNPJOQ-KRWDZBQOSA-N 1 0 323.484 4.204 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](CCO)CC(C)C)c1O ZINC000808700285 1041007717 /nfs/dbraw/zinc/00/77/17/1041007717.db2.gz KAAROGOCTDCMMR-UONOGXRCSA-N 1 0 313.869 4.049 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCOCc2ccccc2)c1O ZINC000808701014 1041008886 /nfs/dbraw/zinc/00/88/86/1041008886.db2.gz VQLYHRSGLGYGOC-CQSZACIVSA-N 1 0 319.832 4.221 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)c1ccc(C)o1 ZINC000808699918 1041009356 /nfs/dbraw/zinc/00/93/56/1041009356.db2.gz DTBRZXFYURXZQF-IUODEOHRSA-N 1 0 323.820 4.294 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](C)c2ccncc2)c1O ZINC000808701512 1041010383 /nfs/dbraw/zinc/01/03/83/1041010383.db2.gz ZOIZIPSLXCKDEW-CHWSQXEVSA-N 1 0 304.821 4.203 20 10 DICDRO CCC1(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CCOCC1 ZINC000808700788 1041012142 /nfs/dbraw/zinc/01/21/42/1041012142.db2.gz RCAATSLVHLTQHM-CYBMUJFWSA-N 1 0 311.853 4.211 20 10 DICDRO Cc1ccccc1[C@H](CO)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808700733 1041012639 /nfs/dbraw/zinc/01/26/39/1041012639.db2.gz PKIIVTMIALSFKJ-GUYCJALGSA-N 1 0 319.832 4.047 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1ccc(N(C)C)cc1 ZINC000808729208 1041016031 /nfs/dbraw/zinc/01/60/31/1041016031.db2.gz VVQOEWBVNGOVBF-ZLGUVYLKSA-N 1 0 324.468 4.324 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1cccc(Cl)c1 ZINC000808733585 1041019654 /nfs/dbraw/zinc/01/96/54/1041019654.db2.gz YHIGMABKROYCIB-GUYCJALGSA-N 1 0 319.832 4.392 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1 ZINC000809729188 1041222588 /nfs/dbraw/zinc/22/25/88/1041222588.db2.gz QZBPODKGYOWOSP-HXUWFJFHSA-N 1 0 309.457 4.265 20 10 DICDRO COc1cccc(C[NH2+]Cc2csc(Cl)c2Cl)c1O ZINC000809740079 1041240560 /nfs/dbraw/zinc/24/05/60/1041240560.db2.gz KWXYJSFUPRWANY-UHFFFAOYSA-N 1 0 318.225 4.059 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(C)cc2)c1O ZINC000809740257 1041240892 /nfs/dbraw/zinc/24/08/92/1041240892.db2.gz RHWKUYDNGMRHHJ-QZTJIDSGSA-N 1 0 311.425 4.135 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)[C@H](C)c2ccc(Cl)cc2)c1O ZINC000809739898 1041241383 /nfs/dbraw/zinc/24/13/83/1041241383.db2.gz GEJVBZPPPVJUTI-QWHCGFSZSA-N 1 0 319.832 4.336 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC(c3cccnc3)CC2)c1O ZINC000809737029 1041241550 /nfs/dbraw/zinc/24/15/50/1041241550.db2.gz BLXOXVAKGNTREX-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)c1O ZINC000809739710 1041241874 /nfs/dbraw/zinc/24/18/74/1041241874.db2.gz BWGLWGUCMVMCLC-MSOLQXFVSA-N 1 0 311.425 4.217 20 10 DICDRO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@@H+]1Cc1cccc(C)c1O ZINC000809757964 1041247756 /nfs/dbraw/zinc/24/77/56/1041247756.db2.gz XXRSTQCPDQLLGG-KRWDZBQOSA-N 1 0 313.445 4.158 20 10 DICDRO Cc1cccc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c1O ZINC000809783282 1041255142 /nfs/dbraw/zinc/25/51/42/1041255142.db2.gz XDXPUBFKHYTYJT-UHFFFAOYSA-N 1 0 306.409 4.061 20 10 DICDRO CC[C@H]([NH2+]CCCc1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000166170957 1041316287 /nfs/dbraw/zinc/31/62/87/1041316287.db2.gz KRQCGPDDKWFZGI-IBGZPJMESA-N 1 0 315.461 4.031 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCOCC1)c1ccc(C(F)(F)F)cc1O ZINC000810229993 1041342898 /nfs/dbraw/zinc/34/28/98/1041342898.db2.gz PVZDPYQEOPLYHF-JSGCOSHPSA-N 1 0 317.351 4.021 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@H](C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810228549 1041343283 /nfs/dbraw/zinc/34/32/83/1041343283.db2.gz IFDCXOCDBANMPF-OSMZGAPFSA-N 1 0 317.351 4.019 20 10 DICDRO CC(C)N(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000810254937 1041358425 /nfs/dbraw/zinc/35/84/25/1041358425.db2.gz SIXHGAJQQZUZIT-QZTJIDSGSA-N 1 0 317.521 4.056 20 10 DICDRO C[C@H](Cc1cccs1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000037284858 1041469383 /nfs/dbraw/zinc/46/93/83/1041469383.db2.gz BUAZLMLOAZRGGU-OAHLLOKOSA-N 1 0 300.471 4.069 20 10 DICDRO CC[N@H+](Cc1cc(Cl)cc(C)c1O)[C@@H]1CCOC(C)(C)C1 ZINC000811511436 1041534182 /nfs/dbraw/zinc/53/41/82/1041534182.db2.gz IQAHJNOGSWOBHE-OAHLLOKOSA-N 1 0 311.853 4.134 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)N[C@@H](C)c1ccccc1)c1ccccc1O ZINC000183512385 1041583843 /nfs/dbraw/zinc/58/38/43/1041583843.db2.gz AHMJLVAKHDFGOM-JKSUJKDBSA-N 1 0 312.457 4.172 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1ccc(F)cc1[O-])CCC2 ZINC000363868864 1041584990 /nfs/dbraw/zinc/58/49/90/1041584990.db2.gz OWWURVILADNJEU-NOZJJQNGSA-N 1 0 306.406 4.024 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2c3ccccc3CC[C@@H]2C)c1 ZINC000186196850 1041627164 /nfs/dbraw/zinc/62/71/64/1041627164.db2.gz WWCOYMBTXBVPQA-YRVVQQKDSA-N 1 0 311.425 4.375 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000162360284 1041644093 /nfs/dbraw/zinc/64/40/93/1041644093.db2.gz SMSXEUOTKICTIG-CZUORRHYSA-N 1 0 303.475 4.319 20 10 DICDRO CCC[N@H+](Cc1cncc(C(F)(F)F)c1)Cc1ccccc1O ZINC000812827191 1041651309 /nfs/dbraw/zinc/65/13/09/1041651309.db2.gz KWFQXTUCHGMRPC-UHFFFAOYSA-N 1 0 324.346 4.218 20 10 DICDRO COc1ccc(N2CCC([NH2+]CCCC(C)(C)C)CC2)cc1 ZINC000812834311 1041654183 /nfs/dbraw/zinc/65/41/83/1041654183.db2.gz PEPVBAWLVBETBW-UHFFFAOYSA-N 1 0 304.478 4.080 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCc2ccccc2F)c1 ZINC000813330977 1041697497 /nfs/dbraw/zinc/69/74/97/1041697497.db2.gz KOXMLQXTDBKRSE-KGLIPLIRSA-N 1 0 317.404 4.212 20 10 DICDRO CCOCc1cc(C[NH2+]C2[C@@H](C)CCC[C@@H]2C)ccc1OC ZINC000747854126 1041700388 /nfs/dbraw/zinc/70/03/88/1041700388.db2.gz MGMAPKRMJYUPHN-GJZGRUSLSA-N 1 0 305.462 4.146 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccccc1O ZINC000310071363 1041700727 /nfs/dbraw/zinc/70/07/27/1041700727.db2.gz AGYVAHYUGCREDX-FFZOFVMBSA-N 1 0 324.468 4.096 20 10 DICDRO C[C@@H](CN1CCCCC1)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000390350937 1041715124 /nfs/dbraw/zinc/71/51/24/1041715124.db2.gz YSTKAEWRXMYJMO-HOTGVXAUSA-N 1 0 312.457 4.070 20 10 DICDRO CC[C@H]([NH2+]CC1CC(F)(F)C1)c1ccc(C(F)(F)F)cc1O ZINC000813872617 1041740287 /nfs/dbraw/zinc/74/02/87/1041740287.db2.gz IEKPWTUALWZLQY-LBPRGKRZSA-N 1 0 323.305 4.497 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)c1cc(F)ccc1O ZINC000813872998 1041740567 /nfs/dbraw/zinc/74/05/67/1041740567.db2.gz MVGUDXAXTXLQGO-RYUDHWBXSA-N 1 0 301.352 4.398 20 10 DICDRO CCc1nc(C)c(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)o1 ZINC000813886900 1041743470 /nfs/dbraw/zinc/74/34/70/1041743470.db2.gz PQMBICQWKWNYJB-ZDUSSCGKSA-N 1 0 308.809 4.145 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(F)cn2)cc1F ZINC000092747842 1041760883 /nfs/dbraw/zinc/76/08/83/1041760883.db2.gz AETUNBMKWBMBAD-CYBMUJFWSA-N 1 0 319.399 4.057 20 10 DICDRO CC(C)[N@H+](Cc1cc2c(cc1O)OCO2)[C@H](C)c1ccccc1 ZINC000814169058 1041781860 /nfs/dbraw/zinc/78/18/60/1041781860.db2.gz CQFSEKOFSXXVER-CQSZACIVSA-N 1 0 313.397 4.093 20 10 DICDRO CC[C@H]([NH2+][C@H](COC)c1ccc(Cl)cc1)c1ccccc1O ZINC000194254121 1041786046 /nfs/dbraw/zinc/78/60/46/1041786046.db2.gz VJTMCLRAQMVNMN-DLBZAZTESA-N 1 0 319.832 4.474 20 10 DICDRO CCOc1ccc(C[NH2+]C[C@@H](c2ccccc2)C2CC2)c(O)c1 ZINC000814297666 1041806904 /nfs/dbraw/zinc/80/69/04/1041806904.db2.gz KGGLBDROYHWVNV-IBGZPJMESA-N 1 0 311.425 4.074 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2cccc(F)n2)cc1 ZINC000747936330 1041813384 /nfs/dbraw/zinc/81/33/84/1041813384.db2.gz UKNMKLJQDMHCAK-UHFFFAOYSA-N 1 0 315.436 4.137 20 10 DICDRO Oc1ccccc1C[N@H+](CCC1CCOCC1)C1CCCCC1 ZINC000814624309 1041841973 /nfs/dbraw/zinc/84/19/73/1041841973.db2.gz RYEJRCMNJWMNJQ-UHFFFAOYSA-N 1 0 317.473 4.344 20 10 DICDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(N(C)C)c(C)c2)s1 ZINC000815043452 1041905452 /nfs/dbraw/zinc/90/54/52/1041905452.db2.gz SFNFWTQVYQCWAC-AWEZNQCLSA-N 1 0 317.502 4.327 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)c(C)c2)n1 ZINC000815061698 1041910112 /nfs/dbraw/zinc/91/01/12/1041910112.db2.gz DQRGKAVLPKKLQZ-FQEVSTJZSA-N 1 0 309.457 4.102 20 10 DICDRO Cc1cc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)ccc1N(C)C ZINC000815086516 1041913453 /nfs/dbraw/zinc/91/34/53/1041913453.db2.gz LBDIOWVPBCCXCN-UKRRQHHQSA-N 1 0 314.395 4.224 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccsc2C)cc1F ZINC000815123907 1041916864 /nfs/dbraw/zinc/91/68/64/1041916864.db2.gz KAPFABJSCNNQDQ-UHFFFAOYSA-N 1 0 306.450 4.332 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)ccc1Cl ZINC000828958654 1041921468 /nfs/dbraw/zinc/92/14/68/1041921468.db2.gz BBPPCBKGNYFSRG-ZDUSSCGKSA-N 1 0 318.848 4.265 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)c(O)c1 ZINC000815142606 1041924856 /nfs/dbraw/zinc/92/48/56/1041924856.db2.gz WKALRQONRGLHFV-UHFFFAOYSA-N 1 0 321.367 4.192 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1cc[nH]c(=O)c1 ZINC000815147437 1041926490 /nfs/dbraw/zinc/92/64/90/1041926490.db2.gz AJJBWNRWIHEZJG-CQSZACIVSA-N 1 0 320.392 4.011 20 10 DICDRO CSCC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815553946 1041961539 /nfs/dbraw/zinc/96/15/39/1041961539.db2.gz NYAXLTDNXDXTMT-QGZVFWFLSA-N 1 0 301.455 4.019 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCCOC2CCCCC2)c(O)c1 ZINC000815555443 1041961787 /nfs/dbraw/zinc/96/17/87/1041961787.db2.gz ZQRNORBDHTUVEL-INIZCTEOSA-N 1 0 305.462 4.399 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]Cc1nccs1 ZINC000815562496 1041963156 /nfs/dbraw/zinc/96/31/56/1041963156.db2.gz GXDPHWYLPKOAKT-QGZVFWFLSA-N 1 0 324.449 4.312 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccnc2OC(C)C)c(O)c1 ZINC000815561137 1041963309 /nfs/dbraw/zinc/96/33/09/1041963309.db2.gz ZKBVNVLXBWBCKU-OAHLLOKOSA-N 1 0 314.429 4.042 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000815577280 1041965899 /nfs/dbraw/zinc/96/58/99/1041965899.db2.gz LSHVKAOMFNPBAR-INIZCTEOSA-N 1 0 312.457 4.316 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cccc(F)c2F)c(O)c1 ZINC000815592187 1041969363 /nfs/dbraw/zinc/96/93/63/1041969363.db2.gz BFHMSGXNINWUFQ-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO CO[C@@H](C)CC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815573178 1041972926 /nfs/dbraw/zinc/97/29/26/1041972926.db2.gz ALGJVEKPPKRHHC-LPHOPBHVSA-N 1 0 313.441 4.081 20 10 DICDRO COC1CCC(CC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000815616288 1041975088 /nfs/dbraw/zinc/97/50/88/1041975088.db2.gz KQRUXDCXLILHME-GTPINHCMSA-N 1 0 305.462 4.255 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 ZINC000815632595 1041978250 /nfs/dbraw/zinc/97/82/50/1041978250.db2.gz RVZPOETUAWQCMA-LSBZLQRGSA-N 1 0 312.432 4.489 20 10 DICDRO CC[C@H](C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O)OC ZINC000815628320 1041978306 /nfs/dbraw/zinc/97/83/06/1041978306.db2.gz XPQCNHCTOWJBTO-MJGOQNOKSA-N 1 0 313.441 4.081 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC2(COC)CCC2)cc1 ZINC000815642226 1041983123 /nfs/dbraw/zinc/98/31/23/1041983123.db2.gz WCFMKHBYDITLHG-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO CCOC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000815644592 1041983279 /nfs/dbraw/zinc/98/32/79/1041983279.db2.gz GTWUTPINIRHZPI-GXTWGEPZSA-N 1 0 307.409 4.019 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1cc[nH]c(=O)c1 ZINC000815642988 1041983477 /nfs/dbraw/zinc/98/34/77/1041983477.db2.gz QJUIXCOOBXGCSS-CHWSQXEVSA-N 1 0 308.381 4.058 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1Cl ZINC000756760954 1041985898 /nfs/dbraw/zinc/98/58/98/1041985898.db2.gz QDIHONJJXMZJMD-SCLBCKFNSA-N 1 0 319.832 4.392 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)(C)O ZINC000815652061 1041986013 /nfs/dbraw/zinc/98/60/13/1041986013.db2.gz NRIYKZVPECUXIS-KDOFPFPSSA-N 1 0 322.468 4.016 20 10 DICDRO CCOc1cc(Cl)ccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756770589 1042001892 /nfs/dbraw/zinc/00/18/92/1042001892.db2.gz WKYPQFYXXPXQFC-LLVKDONJSA-N 1 0 323.795 4.434 20 10 DICDRO Cc1nc(C)c([C@@H](C)[NH2+]CCCSc2nccs2)s1 ZINC000178462985 1042025829 /nfs/dbraw/zinc/02/58/29/1042025829.db2.gz PFJUOTLHEKGORF-SECBINFHSA-N 1 0 313.517 4.049 20 10 DICDRO Oc1c(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)ccc2ccccc21 ZINC000816484379 1042055832 /nfs/dbraw/zinc/05/58/32/1042055832.db2.gz ZTUSESGMOVATQS-HXUWFJFHSA-N 1 0 319.404 4.119 20 10 DICDRO CC(C)[N@H+](Cc1ccccn1)Cc1ccc2ccccc2c1O ZINC000816493564 1042057519 /nfs/dbraw/zinc/05/75/19/1042057519.db2.gz GLOZJGWZWSNGOA-UHFFFAOYSA-N 1 0 306.409 4.351 20 10 DICDRO Cc1cc(CC[NH2+]Cc2ccc3ccccc3c2O)cc(C)c1O ZINC000816588837 1042066189 /nfs/dbraw/zinc/06/61/89/1042066189.db2.gz CAUAZOLCFLPROZ-UHFFFAOYSA-N 1 0 321.420 4.200 20 10 DICDRO CC(C)c1csc(C[NH2+]Cc2ccc3ccccc3c2O)n1 ZINC000816557460 1042067949 /nfs/dbraw/zinc/06/79/49/1042067949.db2.gz QPFPAGONUJGCMH-UHFFFAOYSA-N 1 0 312.438 4.415 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccccc2)c1 ZINC000816630690 1042078323 /nfs/dbraw/zinc/07/83/23/1042078323.db2.gz ODPUVYVBKDXLCF-LJQANCHMSA-N 1 0 309.409 4.128 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000816666190 1042078457 /nfs/dbraw/zinc/07/84/57/1042078457.db2.gz HDKYBWXDROWWJF-YEORSEQZSA-N 1 0 305.780 4.221 20 10 DICDRO CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CCO1 ZINC000817585585 1042118546 /nfs/dbraw/zinc/11/85/46/1042118546.db2.gz GUYLNJWGZLBTKM-IMFGXOCKSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@@H]([NH2+]CC1([NH3+])CCCCC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817938535 1042129662 /nfs/dbraw/zinc/12/96/62/1042129662.db2.gz MPRKLYBFCXSFSZ-SNVBAGLBSA-N 1 0 317.260 4.011 20 10 DICDRO Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955404 1042131271 /nfs/dbraw/zinc/13/12/71/1042131271.db2.gz AAJARMICPKYPPI-GFCCVEGCSA-N 1 0 317.502 4.225 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H](c2cccs2)C2CCCC2)cc1 ZINC000817955758 1042131502 /nfs/dbraw/zinc/13/15/02/1042131502.db2.gz HBVZCIGDIIOGFH-GOSISDBHSA-N 1 0 300.471 4.394 20 10 DICDRO C[C@H]([NH2+]C[C@@H](N)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000817955314 1042131594 /nfs/dbraw/zinc/13/15/94/1042131594.db2.gz VOFSAURISWUSDN-LAUBAEHRSA-N 1 0 323.484 4.028 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(Cl)c(Cl)c1 ZINC000817955846 1042131790 /nfs/dbraw/zinc/13/17/90/1042131790.db2.gz JDUHFTFMZUCBMI-NSHDSACASA-N 1 0 309.240 4.469 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000817956452 1042132261 /nfs/dbraw/zinc/13/22/61/1042132261.db2.gz ZGKQIWPBSSWQME-MRXNPFEDSA-N 1 0 318.873 4.291 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)[C@@H](C)c1ccc(Cl)cc1 ZINC000817957845 1042132888 /nfs/dbraw/zinc/13/28/88/1042132888.db2.gz PUGUNLIQCYUYDD-KGLIPLIRSA-N 1 0 302.849 4.247 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000817967795 1042133649 /nfs/dbraw/zinc/13/36/49/1042133649.db2.gz MEWBBIXUXUJSIW-LEWJYISDSA-N 1 0 323.484 4.453 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)c(O)c1C ZINC000817967431 1042133845 /nfs/dbraw/zinc/13/38/45/1042133845.db2.gz IJDARYDUKRJKBM-IFXJQAMLSA-N 1 0 310.441 4.319 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000817967797 1042134141 /nfs/dbraw/zinc/13/41/41/1042134141.db2.gz MEWBBIXUXUJSIW-NHCUHLMSSA-N 1 0 323.484 4.453 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1ccc(C)cc1O ZINC000817968121 1042134547 /nfs/dbraw/zinc/13/45/47/1042134547.db2.gz PGOMJZGDRKSGMD-RTBURBONSA-N 1 0 310.441 4.401 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)c(O)c1 ZINC000817977820 1042134768 /nfs/dbraw/zinc/13/47/68/1042134768.db2.gz PVJFSKRKDFHWNO-HNNXBMFYSA-N 1 0 310.441 4.218 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000817976711 1042135180 /nfs/dbraw/zinc/13/51/80/1042135180.db2.gz RZOKANNIIWOFNS-ZWNOBZJWSA-N 1 0 319.276 4.257 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc2c1CCCN2)c1ccc(N(C)C)cc1 ZINC000817974509 1042135257 /nfs/dbraw/zinc/13/52/57/1042135257.db2.gz BJEYFIBXEWHOOT-HXUWFJFHSA-N 1 0 323.484 4.352 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CCc3cccc(Cl)c3C2)c1O ZINC001170908511 1042154449 /nfs/dbraw/zinc/15/44/49/1042154449.db2.gz NWMUTRNXSMDOTD-HNNXBMFYSA-N 1 0 301.817 4.001 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000818615171 1042157867 /nfs/dbraw/zinc/15/78/67/1042157867.db2.gz MNXMEBBEHBGDQP-JHJVBQTASA-N 1 0 317.260 4.010 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@H]1CCc2cccc(F)c2C1 ZINC001170961241 1042247622 /nfs/dbraw/zinc/24/76/22/1042247622.db2.gz OYMBILVBVDBFIW-SFHVURJKSA-N 1 0 321.395 4.332 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@@H]1CCc2cccc(F)c2C1 ZINC001170961240 1042247715 /nfs/dbraw/zinc/24/77/15/1042247715.db2.gz OYMBILVBVDBFIW-GOSISDBHSA-N 1 0 321.395 4.332 20 10 DICDRO CC(C)N(CC[NH2+][C@@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000320073757 1042304557 /nfs/dbraw/zinc/30/45/57/1042304557.db2.gz WQDVMJFGYVQEBK-INIZCTEOSA-N 1 0 314.473 4.315 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1nc(C(F)(F)F)cs1 ZINC000279599320 1042324421 /nfs/dbraw/zinc/32/44/21/1042324421.db2.gz WBHGBGXGUIERAQ-RKDXNWHRSA-N 1 0 316.348 4.279 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2CCC(OC3CCCC3)CC2)cc1 ZINC000823608162 1042334972 /nfs/dbraw/zinc/33/49/72/1042334972.db2.gz DFUUXRAWOVJPTA-UHFFFAOYSA-N 1 0 316.489 4.113 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CCc3c(Cl)cccc3C2)c1O ZINC001171022014 1042335523 /nfs/dbraw/zinc/33/55/23/1042335523.db2.gz IOHKZJWHPPCVJA-HNNXBMFYSA-N 1 0 301.817 4.001 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(OC(C)C)cc1 ZINC000236718217 1042371350 /nfs/dbraw/zinc/37/13/50/1042371350.db2.gz ILIPXHDGYJDIBP-UHFFFAOYSA-N 1 0 312.457 4.138 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccc(C)cc1O ZINC000279961641 1042466186 /nfs/dbraw/zinc/46/61/86/1042466186.db2.gz CHKGTUMFEYRJKL-RTBURBONSA-N 1 0 313.441 4.255 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)c1O ZINC000894208010 1042513086 /nfs/dbraw/zinc/51/30/86/1042513086.db2.gz CSXJOZPMSBPCJW-UHFFFAOYSA-N 1 0 324.424 4.097 20 10 DICDRO CC[C@@H]([NH2+][C@H](CCOC)c1ccco1)c1ccc(C)cc1O ZINC000279998186 1042560816 /nfs/dbraw/zinc/56/08/16/1042560816.db2.gz FULRZLPZKOYFCC-HZPDHXFCSA-N 1 0 303.402 4.112 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(C)cc1O ZINC000280001481 1042560843 /nfs/dbraw/zinc/56/08/43/1042560843.db2.gz FXZQSHUFJCBDBD-DOTOQJQBSA-N 1 0 303.446 4.233 20 10 DICDRO CCSc1cc(C[NH2+][C@@H](CC)c2ccc(C)cc2O)ccn1 ZINC000279985162 1042560876 /nfs/dbraw/zinc/56/08/76/1042560876.db2.gz DWHOUAUBBMOUKS-INIZCTEOSA-N 1 0 316.470 4.449 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)ccc1OC)c1ccc(C)cc1O ZINC000279988688 1042561373 /nfs/dbraw/zinc/56/13/73/1042561373.db2.gz FDZXEPGSVLLKPL-INIZCTEOSA-N 1 0 303.377 4.089 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000280028717 1042562163 /nfs/dbraw/zinc/56/21/63/1042562163.db2.gz HYEAQCGMFSPUDY-LJQANCHMSA-N 1 0 313.441 4.478 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1-n1ccnc1)c1ccc(C)cc1O ZINC000280245612 1042568302 /nfs/dbraw/zinc/56/83/02/1042568302.db2.gz WHDUEHUMYRTQKX-SFHVURJKSA-N 1 0 321.424 4.127 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(N(C)C)cc1 ZINC000271847877 1042670065 /nfs/dbraw/zinc/67/00/65/1042670065.db2.gz WYQLNCNGORWSEP-KGLIPLIRSA-N 1 0 313.401 4.073 20 10 DICDRO Cc1csc(C2([NH2+][C@H](C)c3ccc(N(C)C)cc3)CCC2)n1 ZINC000271963170 1042674076 /nfs/dbraw/zinc/67/40/76/1042674076.db2.gz LNXSANYOSCYJLF-CQSZACIVSA-N 1 0 315.486 4.248 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2cc3ccccc3s2)cc1F ZINC000237128165 1042681556 /nfs/dbraw/zinc/68/15/56/1042681556.db2.gz VCDNCMIPKNVHDU-UHFFFAOYSA-N 1 0 314.429 4.396 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)cc(OC)c1O)c1ccc(F)cc1F ZINC000894282713 1042718149 /nfs/dbraw/zinc/71/81/49/1042718149.db2.gz CLDYOKMPKYTGHJ-INIZCTEOSA-N 1 0 321.367 4.228 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1O ZINC000894327059 1042847686 /nfs/dbraw/zinc/84/76/86/1042847686.db2.gz STJTXYLLCPMEGU-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO CC(C)(CC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1)C1CC1 ZINC001167982637 1042975550 /nfs/dbraw/zinc/97/55/50/1042975550.db2.gz FNAYYTLLUXRDGO-SFHVURJKSA-N 1 0 317.473 4.200 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(Br)c2)c(O)c1 ZINC000048817905 1042979467 /nfs/dbraw/zinc/97/94/67/1042979467.db2.gz JNDAYNHYXWAWPJ-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccc(C)cc1O ZINC000794805426 1043049851 /nfs/dbraw/zinc/04/98/51/1043049851.db2.gz GPYSZSXWNJDFFW-PBHICJAKSA-N 1 0 301.434 4.280 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)C[C@H](O)c1ccccc1)c1ccc(C)cc1O ZINC000794809630 1043056301 /nfs/dbraw/zinc/05/63/01/1043056301.db2.gz HAHHVQBXIKWPNM-SNRMKQJTSA-N 1 0 313.441 4.254 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(C)cc1O ZINC000794815201 1043058652 /nfs/dbraw/zinc/05/86/52/1043058652.db2.gz JLCXTJNGRPXZBU-IRFCIJBXSA-N 1 0 324.468 4.187 20 10 DICDRO CC[C@@H]([NH2+]C1(c2cccc(OC)c2)CC1)c1ccc(C)cc1O ZINC000794815435 1043059089 /nfs/dbraw/zinc/05/90/89/1043059089.db2.gz UVPQORRLBODMDJ-GOSISDBHSA-N 1 0 311.425 4.439 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(C)cc1O ZINC000794815298 1043059408 /nfs/dbraw/zinc/05/94/08/1043059408.db2.gz JTHLQZDGBYNVGB-GOSISDBHSA-N 1 0 313.445 4.253 20 10 DICDRO CCCCn1cc(C[NH2+][C@@H](CC)c2ccc(C)cc2O)c(C)n1 ZINC000794818587 1043063232 /nfs/dbraw/zinc/06/32/32/1043063232.db2.gz VNEFVUPYWYVJLL-SFHVURJKSA-N 1 0 315.461 4.247 20 10 DICDRO CC[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1ccc(C)cc1O ZINC000794820177 1043064477 /nfs/dbraw/zinc/06/44/77/1043064477.db2.gz YFCZOJWRXLSGRF-WMZOPIPTSA-N 1 0 305.462 4.337 20 10 DICDRO CC[C@@H]([NH2+]C1CCC(OC(C)C)CC1)c1ccc(C)cc1O ZINC000794819662 1043066567 /nfs/dbraw/zinc/06/65/67/1043066567.db2.gz XBETWAUSPUHTMN-LEOMRAHMSA-N 1 0 305.462 4.478 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2ccccc2n1 ZINC000178377889 1043127208 /nfs/dbraw/zinc/12/72/08/1043127208.db2.gz PTMSLLJKTMHQDV-OAHLLOKOSA-N 1 0 305.425 4.152 20 10 DICDRO C[C@@H](c1ccccc1)[N@H+](CCCCCO)Cc1ccccc1O ZINC000179645196 1043148766 /nfs/dbraw/zinc/14/87/66/1043148766.db2.gz QGZGLXASTLYQEM-KRWDZBQOSA-N 1 0 313.441 4.118 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(N2CCCC2)c1 ZINC000183553159 1043165987 /nfs/dbraw/zinc/16/59/87/1043165987.db2.gz UJFGLDQFXIIXHY-HOTGVXAUSA-N 1 0 310.441 4.404 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2O)cc1[N+](=O)[O-] ZINC000183614568 1043168157 /nfs/dbraw/zinc/16/81/57/1043168157.db2.gz FKGOCHKLXAUFSX-QWHCGFSZSA-N 1 0 300.358 4.021 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOc2cc(F)ccc21)c1ccccc1O ZINC000183671589 1043168698 /nfs/dbraw/zinc/16/86/98/1043168698.db2.gz SREDYOHMWHHSAW-MLGOLLRUSA-N 1 0 301.361 4.096 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC000185004939 1043192172 /nfs/dbraw/zinc/19/21/72/1043192172.db2.gz MOCFJWLEGXDARR-INIZCTEOSA-N 1 0 310.441 4.152 20 10 DICDRO COc1cc(C)cc(C[NH2+]C2(c3cccc(F)c3)CCC2)c1O ZINC000895074628 1043194131 /nfs/dbraw/zinc/19/41/31/1043194131.db2.gz BVMLMILEBLNTHG-UHFFFAOYSA-N 1 0 315.388 4.017 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2CCN(c3ccccc3)CC2)c1 ZINC000185104261 1043194199 /nfs/dbraw/zinc/19/41/99/1043194199.db2.gz GNVZSZHIONKTSY-MRXNPFEDSA-N 1 0 310.441 4.020 20 10 DICDRO CCCOCc1ccccc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185062984 1043195058 /nfs/dbraw/zinc/19/50/58/1043195058.db2.gz FMQTXQHIBRBNLQ-MRXNPFEDSA-N 1 0 313.441 4.478 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1cc2c(cc1O)CCCC2 ZINC000185074175 1043195230 /nfs/dbraw/zinc/19/52/30/1043195230.db2.gz SJJGJZDFZOGBGX-GFCCVEGCSA-N 1 0 316.832 4.170 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1cccc([N+](=O)[O-])c1 ZINC000185149568 1043195786 /nfs/dbraw/zinc/19/57/86/1043195786.db2.gz GJDNMHONKAVWLU-QWRGUYRKSA-N 1 0 320.776 4.366 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccnc1 ZINC000185233523 1043196153 /nfs/dbraw/zinc/19/61/53/1043196153.db2.gz DGTLSSILLXHYOB-IBGZPJMESA-N 1 0 309.457 4.095 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H]2CCCO2)c(O)c1 ZINC000185225409 1043196266 /nfs/dbraw/zinc/19/62/66/1043196266.db2.gz FJJAIQTZTAGOGV-RYGJVYDSSA-N 1 0 311.425 4.272 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000185230016 1043196328 /nfs/dbraw/zinc/19/63/28/1043196328.db2.gz VZNIHOMCKJCHCX-OLZOCXBDSA-N 1 0 303.377 4.342 20 10 DICDRO COc1ccc(Cl)cc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185205986 1043196396 /nfs/dbraw/zinc/19/63/96/1043196396.db2.gz VCOJJLUCKAEIMR-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+][C@@H](C)c2cc(OC)ccc2O)c1 ZINC000185229878 1043196442 /nfs/dbraw/zinc/19/64/42/1043196442.db2.gz IGXLEFMZKFRNKS-KBPBESRZSA-N 1 0 315.413 4.211 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccccc2)[C@@H]2CCCO2)c1 ZINC000185225037 1043196454 /nfs/dbraw/zinc/19/64/54/1043196454.db2.gz YIXOXGJQDNUQJK-XPGWFJOJSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)c1cc(F)ccc1O ZINC000185225609 1043197209 /nfs/dbraw/zinc/19/72/09/1043197209.db2.gz HSCHFRDMXFZESX-ZNZDAUKMSA-N 1 0 315.388 4.102 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cs1 ZINC000185425191 1043200893 /nfs/dbraw/zinc/20/08/93/1043200893.db2.gz XSSRGAVMKKQRNB-ZJUUUORDSA-N 1 0 310.850 4.476 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3cccnc3c2)c2c1c(F)ccc2O ZINC000866431536 1043201316 /nfs/dbraw/zinc/20/13/16/1043201316.db2.gz VZQKCZAWDFCWRG-SJKOYZFVSA-N 1 0 322.383 4.418 20 10 DICDRO CC(C)(C)OC1CCC([NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000866450411 1043203304 /nfs/dbraw/zinc/20/33/04/1043203304.db2.gz GUIYTHBDNOHWNM-GPANFISMSA-N 1 0 303.446 4.095 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccc(-n3cccn3)c2)c1 ZINC000185616391 1043204151 /nfs/dbraw/zinc/20/41/51/1043204151.db2.gz GMTOWYYEDQKLPO-HOTGVXAUSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2CCC(OC(C)(C)C)CC2)c1 ZINC000866451759 1043204352 /nfs/dbraw/zinc/20/43/52/1043204352.db2.gz XTXXULKMAANJMV-QQFBHYJXSA-N 1 0 305.462 4.478 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(-n3cccn3)c2)c(O)c1 ZINC000185616908 1043204748 /nfs/dbraw/zinc/20/47/48/1043204748.db2.gz NKSMUCYJCNFQGT-CVEARBPZSA-N 1 0 321.424 4.298 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c2ccccc2n1 ZINC000185573959 1043204866 /nfs/dbraw/zinc/20/48/66/1043204866.db2.gz UHLLULNILZPDNO-AWEZNQCLSA-N 1 0 322.408 4.108 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2CCC(OC(C)(C)C)CC2)c1O ZINC000866451786 1043205799 /nfs/dbraw/zinc/20/57/99/1043205799.db2.gz YNSFRVSKIJTEBC-NFOMZHRRSA-N 1 0 321.461 4.178 20 10 DICDRO CC(C)[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1cccnc1 ZINC000185661294 1043206626 /nfs/dbraw/zinc/20/66/26/1043206626.db2.gz LCTVWFBEDQMJDW-GUYCJALGSA-N 1 0 302.393 4.017 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2cc(OC)ccc2O)CCCC1 ZINC000185748565 1043207225 /nfs/dbraw/zinc/20/72/25/1043207225.db2.gz AOYCCWKBQMTJAE-HNNXBMFYSA-N 1 0 321.461 4.038 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc3c2CCOC3)cc1 ZINC000866477725 1043207391 /nfs/dbraw/zinc/20/73/91/1043207391.db2.gz BEWHEMQVFJZITI-MRXNPFEDSA-N 1 0 324.468 4.066 20 10 DICDRO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000186057527 1043212778 /nfs/dbraw/zinc/21/27/78/1043212778.db2.gz LVPKTKMSXUZIRD-CABCVRRESA-N 1 0 323.440 4.482 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccccc1O)c1cccc(OC)c1OC ZINC000866509025 1043213399 /nfs/dbraw/zinc/21/33/99/1043213399.db2.gz UJURQXQNYRDRKS-CJNGLKHVSA-N 1 0 315.413 4.211 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(O)c1 ZINC000186093004 1043214118 /nfs/dbraw/zinc/21/41/18/1043214118.db2.gz ZWGFKQZPMGSUHB-UONOGXRCSA-N 1 0 314.385 4.329 20 10 DICDRO CC[C@@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)c1ccccc1O ZINC000186147552 1043214491 /nfs/dbraw/zinc/21/44/91/1043214491.db2.gz YBBOHKMSAXHUAL-YZGWKJHDSA-N 1 0 311.425 4.353 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1Cl ZINC000186120592 1043215828 /nfs/dbraw/zinc/21/58/28/1043215828.db2.gz FTYMSGLFZJLHBQ-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(F)c(F)c1 ZINC000186225615 1043216832 /nfs/dbraw/zinc/21/68/32/1043216832.db2.gz HAFNICKTGVWEPC-SJKOYZFVSA-N 1 0 321.367 4.017 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000186157400 1043217002 /nfs/dbraw/zinc/21/70/02/1043217002.db2.gz MCSSMXWAFLTKMO-UWVGGRQHSA-N 1 0 308.809 4.105 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000186157419 1043217188 /nfs/dbraw/zinc/21/71/88/1043217188.db2.gz MCSSMXWAFLTKMO-ZJUUUORDSA-N 1 0 308.809 4.105 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000186216463 1043217398 /nfs/dbraw/zinc/21/73/98/1043217398.db2.gz OCNXTCOBAXGNMX-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)c2nccs2)cc1 ZINC000186747064 1043232706 /nfs/dbraw/zinc/23/27/06/1043232706.db2.gz CGKLLUKDWOXKJZ-ZIAGYGMSSA-N 1 0 303.475 4.054 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@@H](C)c2cc(Cl)ccc2O)s1 ZINC000186766098 1043233915 /nfs/dbraw/zinc/23/39/15/1043233915.db2.gz AKLPEFKDBTZGSE-KOLCDFICSA-N 1 0 310.850 4.265 20 10 DICDRO CC[C@@H]([NH2+]Cc1noc2cc(F)ccc21)c1ccc(C)cc1O ZINC000866612018 1043234134 /nfs/dbraw/zinc/23/41/34/1043234134.db2.gz AFKSBOGNGAVAGS-OAHLLOKOSA-N 1 0 314.360 4.222 20 10 DICDRO CC[C@H]([NH2+]Cc1noc2cc(F)ccc21)c1ccc(C)cc1O ZINC000866612017 1043234636 /nfs/dbraw/zinc/23/46/36/1043234636.db2.gz AFKSBOGNGAVAGS-HNNXBMFYSA-N 1 0 314.360 4.222 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2ncccc2c1)c1ccc(N(C)C)cc1 ZINC000187574540 1043246762 /nfs/dbraw/zinc/24/67/62/1043246762.db2.gz FRGKLXFOPJPMKZ-OAHLLOKOSA-N 1 0 305.425 4.152 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCC2CCOCC2)cc1C(C)C ZINC000121207555 1043248819 /nfs/dbraw/zinc/24/88/19/1043248819.db2.gz PTYOSKUFYGEXJF-UHFFFAOYSA-N 1 0 305.462 4.073 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)CC(C)(C)c2ccccc2)c1O ZINC000237227420 1043267850 /nfs/dbraw/zinc/26/78/50/1043267850.db2.gz ZYAPDHPDYSLJFZ-HNNXBMFYSA-N 1 0 313.441 4.247 20 10 DICDRO Cc1ccc(CSCC[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000783491517 1043278783 /nfs/dbraw/zinc/27/87/83/1043278783.db2.gz UKRQIDKJOOUUFZ-HNNXBMFYSA-N 1 0 301.455 4.285 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccc(Cl)cc1 ZINC000194255679 1043290755 /nfs/dbraw/zinc/29/07/55/1043290755.db2.gz DNIJYXLIGUKSGL-BDJLRTHQSA-N 1 0 323.795 4.223 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(OC)c(F)c2)cc1 ZINC000122325287 1043295969 /nfs/dbraw/zinc/29/59/69/1043295969.db2.gz JHSJDTFBSXAWAA-AWEZNQCLSA-N 1 0 316.420 4.141 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCCC1 ZINC000122344531 1043296921 /nfs/dbraw/zinc/29/69/21/1043296921.db2.gz VJBJMSMZPMEHTF-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccc(OC)c1 ZINC000122424352 1043304276 /nfs/dbraw/zinc/30/42/76/1043304276.db2.gz POGMEIKWQSHGCH-GOSISDBHSA-N 1 0 316.420 4.141 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccc(OC)c1 ZINC000122424091 1043304509 /nfs/dbraw/zinc/30/45/09/1043304509.db2.gz POGMEIKWQSHGCH-SFHVURJKSA-N 1 0 316.420 4.141 20 10 DICDRO C[C@@H]([NH2+][C@H](CO)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000268919110 1043342009 /nfs/dbraw/zinc/34/20/09/1043342009.db2.gz OPCOMDVGHIHJJL-DYESRHJHSA-N 1 0 324.468 4.061 20 10 DICDRO Cc1cc(C[N@H+](Cc2ccccc2O)[C@H](C)c2ccccc2)on1 ZINC000270787521 1043397438 /nfs/dbraw/zinc/39/74/38/1043397438.db2.gz LGAKLHURILSISM-MRXNPFEDSA-N 1 0 322.408 4.452 20 10 DICDRO CC[C@@H](CCC(F)(F)F)[NH2+]CCCSc1nccs1 ZINC000872039941 1043430391 /nfs/dbraw/zinc/43/03/91/1043430391.db2.gz WQFQHOISNSLJJD-JTQLQIEISA-N 1 0 312.426 4.336 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)s1)c1cc(F)ccc1O ZINC000872107326 1043461321 /nfs/dbraw/zinc/46/13/21/1043461321.db2.gz LLOSMYHRRAPKPP-QMMMGPOBSA-N 1 0 319.323 4.462 20 10 DICDRO Cc1nccnc1[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000872133341 1043475004 /nfs/dbraw/zinc/47/50/04/1043475004.db2.gz LWIBJRFZCVHJCQ-RDJZCZTQSA-N 1 0 324.472 4.187 20 10 DICDRO FC(F)(F)[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138219502 1043489427 /nfs/dbraw/zinc/48/94/27/1043489427.db2.gz DQXKSQSTQGDHEY-OAHLLOKOSA-N 1 0 312.379 4.061 20 10 DICDRO Cc1csc([C@H]2CC[N@H+](Cc3c(O)ccc4ccccc43)C2)n1 ZINC000872807626 1043508123 /nfs/dbraw/zinc/50/81/23/1043508123.db2.gz XCNDMPDJGRRTCL-HNNXBMFYSA-N 1 0 324.449 4.300 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)cc1C ZINC000873052540 1043514548 /nfs/dbraw/zinc/51/45/48/1043514548.db2.gz YTAOEFXXUXTAFU-INIZCTEOSA-N 1 0 315.461 4.412 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000124414166 1043520958 /nfs/dbraw/zinc/52/09/58/1043520958.db2.gz PMNMTPRUTWPYMC-OLZOCXBDSA-N 1 0 304.384 4.443 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)nc2)cc1C ZINC000873186539 1043525961 /nfs/dbraw/zinc/52/59/61/1043525961.db2.gz QRJLNIXNBJLYSM-LBPRGKRZSA-N 1 0 324.346 4.274 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(N)cc(F)c1)c1cc(Cl)ccc1O ZINC000873288463 1043533349 /nfs/dbraw/zinc/53/33/49/1043533349.db2.gz GIAZAMVCHDBJTQ-HNNXBMFYSA-N 1 0 308.784 4.008 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)cc1C ZINC000874077011 1043568646 /nfs/dbraw/zinc/56/86/46/1043568646.db2.gz NANVFVMAPXLYAV-ZDUSSCGKSA-N 1 0 305.368 4.480 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1F ZINC000124818695 1043571333 /nfs/dbraw/zinc/57/13/33/1043571333.db2.gz VTGXUNSORFCAIP-KGLIPLIRSA-N 1 0 316.420 4.312 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccnnc2)c(C)n1-c1cccc(C)c1 ZINC000926765285 1043628733 /nfs/dbraw/zinc/62/87/33/1043628733.db2.gz RXAJSYVPJWKGOC-INIZCTEOSA-N 1 0 320.440 4.043 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1[C@@H](c2ccccc2)C1(F)F)c1ccccc1O ZINC000926974473 1043665551 /nfs/dbraw/zinc/66/55/51/1043665551.db2.gz SKLRMIQRIUYWJL-SOLBZPMBSA-N 1 0 317.379 4.482 20 10 DICDRO Cc1nc2c(cccc2CC[NH2+][C@@H](C)c2ccc(C)cc2O)o1 ZINC000926976487 1043666095 /nfs/dbraw/zinc/66/60/95/1043666095.db2.gz VXKBOBRMLXRGSH-ZDUSSCGKSA-N 1 0 310.397 4.044 20 10 DICDRO CCCN(Cc1ccc2ncccc2c1)c1ccc(C[NH3+])cc1 ZINC000320214626 1043669088 /nfs/dbraw/zinc/66/90/88/1043669088.db2.gz UHKWOFYAYAVQGP-UHFFFAOYSA-N 1 0 305.425 4.110 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1cc2c(cc1O)CCCC2 ZINC000927060450 1043675407 /nfs/dbraw/zinc/67/54/07/1043675407.db2.gz CDSGDSIFFAQPSC-AUUYWEPGSA-N 1 0 322.452 4.394 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCCc3cccnc32)c1O ZINC000927061725 1043676196 /nfs/dbraw/zinc/67/61/96/1043676196.db2.gz RDNQVUAKKMVOPX-MLGOLLRUSA-N 1 0 316.832 4.477 20 10 DICDRO Oc1ccccc1C[N@H+](CCC[C@H]1CCO1)C1CCCCC1 ZINC000876522435 1043693657 /nfs/dbraw/zinc/69/36/57/1043693657.db2.gz QTJBOBFNGDPPDB-SFHVURJKSA-N 1 0 303.446 4.096 20 10 DICDRO CN(C)c1ccc(C[N@H+](CCc2cccs2)C2CC2)cc1 ZINC000729542739 1043708061 /nfs/dbraw/zinc/70/80/61/1043708061.db2.gz QHYYLEMMYXFFFL-UHFFFAOYSA-N 1 0 300.471 4.021 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2OC(F)F)c(O)c1 ZINC000876907741 1043724027 /nfs/dbraw/zinc/72/40/27/1043724027.db2.gz DWPITLAVZODSTJ-GFCCVEGCSA-N 1 0 307.340 4.153 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2OC(F)F)c(O)c1 ZINC000876907742 1043724102 /nfs/dbraw/zinc/72/41/02/1043724102.db2.gz DWPITLAVZODSTJ-LBPRGKRZSA-N 1 0 307.340 4.153 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccccc2CC(F)(F)F)c(O)c1 ZINC000877659937 1043785703 /nfs/dbraw/zinc/78/57/03/1043785703.db2.gz AWFOTANSZYLMMB-UHFFFAOYSA-N 1 0 309.331 4.095 20 10 DICDRO Cc1ccc(C[NH2+]Cc2csc(C(F)(F)F)c2)c(O)c1 ZINC000877657912 1043786727 /nfs/dbraw/zinc/78/67/27/1043786727.db2.gz KSVXSUCUJRSKON-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(CC(F)(F)F)cc1)c1ccccc1O ZINC000877757735 1043792172 /nfs/dbraw/zinc/79/21/72/1043792172.db2.gz SUMOTOASFASWLL-GFCCVEGCSA-N 1 0 309.331 4.348 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1)c1ccccc1O ZINC000877756522 1043792203 /nfs/dbraw/zinc/79/22/03/1043792203.db2.gz OZMYUQNMJHWPLF-ZHALLVOQSA-N 1 0 324.468 4.096 20 10 DICDRO Cc1cccnc1[C@H]1CCC[C@@H]([NH2+][C@H](C)c2ccccc2O)C1 ZINC000877755476 1043792909 /nfs/dbraw/zinc/79/29/09/1043792909.db2.gz CEJKFMLRQJVIGA-IXDOHACOSA-N 1 0 310.441 4.473 20 10 DICDRO Cc1c(C[N@H+]2CC[C@H](C)C(F)(F)CC2)c2ccccc2n1C ZINC001138252671 1043833487 /nfs/dbraw/zinc/83/34/87/1043833487.db2.gz PLKYVCMWOWONJO-ZDUSSCGKSA-N 1 0 306.400 4.354 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+][C@H](C)c1ccccc1O)CC3 ZINC000783533720 1043849153 /nfs/dbraw/zinc/84/91/53/1043849153.db2.gz WBFMDEOSSIBPRN-HUUCEWRRSA-N 1 0 320.436 4.390 20 10 DICDRO CC(C)Oc1ccccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001137140569 1043942766 /nfs/dbraw/zinc/94/27/66/1043942766.db2.gz GDMONVXWPUNCIW-UHFFFAOYSA-N 1 0 312.457 4.172 20 10 DICDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000879650525 1043979470 /nfs/dbraw/zinc/97/94/70/1043979470.db2.gz GCVZDNUZTILOCU-QWHCGFSZSA-N 1 0 300.358 4.021 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2cc3cnccc3o2)cc1 ZINC000879714907 1043982831 /nfs/dbraw/zinc/98/28/31/1043982831.db2.gz KYQYVXPAKRVFBY-AWEZNQCLSA-N 1 0 309.413 4.135 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2c(F)ccc(Cl)c2F)cc1 ZINC001137883990 1044040466 /nfs/dbraw/zinc/04/04/66/1044040466.db2.gz DVSIMJRBSVHVRR-UHFFFAOYSA-N 1 0 324.802 4.316 20 10 DICDRO Cc1csc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001137157340 1044051638 /nfs/dbraw/zinc/05/16/38/1044051638.db2.gz ULOJHVXFNGFIED-UHFFFAOYSA-N 1 0 300.471 4.289 20 10 DICDRO CC(C)Oc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000128980576 1044114144 /nfs/dbraw/zinc/11/41/44/1044114144.db2.gz FOGXGOUGOUYXRA-INIZCTEOSA-N 1 0 312.457 4.391 20 10 DICDRO Cc1oncc1C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000129593312 1044164096 /nfs/dbraw/zinc/16/40/96/1044164096.db2.gz IQGCBVPOCIJHKN-OAHLLOKOSA-N 1 0 322.408 4.452 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@H](C)c2ccccc2F)c1O ZINC000129720958 1044172621 /nfs/dbraw/zinc/17/26/21/1044172621.db2.gz CXZKKMCFTGUFRQ-CYBMUJFWSA-N 1 0 303.377 4.123 20 10 DICDRO FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]CCCSc2nccs2)C1 ZINC000129977073 1044188755 /nfs/dbraw/zinc/18/87/55/1044188755.db2.gz RNMVXFFUCDDVDT-GHMZBOCLSA-N 1 0 324.437 4.336 20 10 DICDRO COc1cccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)c1O ZINC000130852753 1044218872 /nfs/dbraw/zinc/21/88/72/1044218872.db2.gz PETLNCWVBNKJDB-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO C[C@@H]([NH2+]CCC1=CCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000130898259 1044218919 /nfs/dbraw/zinc/21/89/19/1044218919.db2.gz ZBJQZXOMLALQBB-QGZVFWFLSA-N 1 0 314.473 4.064 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1cc(C)c(C)cc1O ZINC000883257595 1044248485 /nfs/dbraw/zinc/24/84/85/1044248485.db2.gz GFXPIXUZUJNBGN-UHFFFAOYSA-N 1 0 311.425 4.185 20 10 DICDRO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(Cl)ccc1O ZINC000780792702 1044255887 /nfs/dbraw/zinc/25/58/87/1044255887.db2.gz IOJMYMNCOWWDDZ-KOLCDFICSA-N 1 0 307.743 4.208 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c(Cl)n1 ZINC000883302518 1044261723 /nfs/dbraw/zinc/26/17/23/1044261723.db2.gz ZYULDXFLSUAEMV-RNCFNFMXSA-N 1 0 320.795 4.226 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c(Cl)n1 ZINC000883301539 1044262017 /nfs/dbraw/zinc/26/20/17/1044262017.db2.gz BWMXXACMCQPGCW-ZDUSSCGKSA-N 1 0 304.821 4.217 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c(Cl)n1 ZINC000883302519 1044262789 /nfs/dbraw/zinc/26/27/89/1044262789.db2.gz ZYULDXFLSUAEMV-TVQRCGJNSA-N 1 0 320.795 4.226 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H](CC)c2ccc(C)cc2O)o1 ZINC000293272335 1044266910 /nfs/dbraw/zinc/26/69/10/1044266910.db2.gz CKMPWIZXJNRAEV-HNNXBMFYSA-N 1 0 302.418 4.190 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc3cccnc32)c(O)c1 ZINC000293615565 1044304359 /nfs/dbraw/zinc/30/43/59/1044304359.db2.gz GWBBJYSOBABVNM-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2OC(F)F)c1 ZINC000192744413 1044306693 /nfs/dbraw/zinc/30/66/93/1044306693.db2.gz ODXDMNJKZUMMSV-GFCCVEGCSA-N 1 0 307.340 4.153 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2nsc3ccccc23)c(O)c1 ZINC000883403017 1044306697 /nfs/dbraw/zinc/30/66/97/1044306697.db2.gz HYAHJCIRKKFUQD-ZDUSSCGKSA-N 1 0 312.438 4.470 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000192809909 1044314775 /nfs/dbraw/zinc/31/47/75/1044314775.db2.gz XSVDBJHGFSFOFA-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000192807657 1044317208 /nfs/dbraw/zinc/31/72/08/1044317208.db2.gz AILZLHREXAPYTF-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000192807638 1044318168 /nfs/dbraw/zinc/31/81/68/1044318168.db2.gz AILZLHREXAPYTF-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO c1csc(SCCC[NH2+][C@@H]2CCCc3sccc32)n1 ZINC000132261926 1044319748 /nfs/dbraw/zinc/31/97/48/1044319748.db2.gz RKFNXUUVZVFKTB-GFCCVEGCSA-N 1 0 310.513 4.354 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000475201251 1044321364 /nfs/dbraw/zinc/32/13/64/1044321364.db2.gz HLZUEGYZHWGZRM-UHFFFAOYSA-N 1 0 321.399 4.397 20 10 DICDRO C[C@@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 ZINC000132744794 1044332793 /nfs/dbraw/zinc/33/27/93/1044332793.db2.gz XXSQTPGVMCOKIG-QGZVFWFLSA-N 1 0 323.484 4.072 20 10 DICDRO CO[C@@](C)([C@@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O)C1CC1 ZINC000840858845 1044396502 /nfs/dbraw/zinc/39/65/02/1044396502.db2.gz HBQXUMSLFJBKMJ-JZKQVHKSSA-N 1 0 313.441 4.400 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOc2ccccc21)c1ccc(N(C)C)cc1 ZINC000133513266 1044404539 /nfs/dbraw/zinc/40/45/39/1044404539.db2.gz QKHGYINYZPMNQX-HNAYVOBHSA-N 1 0 310.441 4.317 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)c(O)c1 ZINC000192936233 1044404662 /nfs/dbraw/zinc/40/46/62/1044404662.db2.gz ANVVSVWTAYMUBR-LBPRGKRZSA-N 1 0 307.340 4.153 20 10 DICDRO CCC[C@H](C)CCC[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC001168068578 1044468430 /nfs/dbraw/zinc/46/84/30/1044468430.db2.gz OJLMYHYZOSTXIT-INIZCTEOSA-N 1 0 322.468 4.173 20 10 DICDRO CC(C)Oc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000134021385 1044482188 /nfs/dbraw/zinc/48/21/88/1044482188.db2.gz VWGJHDAHQBZXOQ-MRXNPFEDSA-N 1 0 312.457 4.391 20 10 DICDRO COc1ccc(N2CCC[N@H+](Cc3c(C)cccc3C)CC2)cc1 ZINC000303742923 1044506682 /nfs/dbraw/zinc/50/66/82/1044506682.db2.gz JAEOOEMVTOGGTO-UHFFFAOYSA-N 1 0 324.468 4.024 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000120871922 1044514913 /nfs/dbraw/zinc/51/49/13/1044514913.db2.gz LZQIAPOLGXQNQC-WIYYLYMNSA-N 1 0 324.468 4.010 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CCc1ccc(O)cc1)c1ccc(N(C)C)cc1 ZINC000237314443 1044521350 /nfs/dbraw/zinc/52/13/50/1044521350.db2.gz FAFHXKBVDRRKEG-JKSUJKDBSA-N 1 0 312.457 4.130 20 10 DICDRO C[C@@H]([NH2+]CCc1cscn1)c1ccc(N2CCCCC2)cc1 ZINC000134859944 1044531931 /nfs/dbraw/zinc/53/19/31/1044531931.db2.gz ZLBKKTJVUOOFKE-OAHLLOKOSA-N 1 0 315.486 4.027 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cc(C)cc(Cl)n2)c(Cl)c1 ZINC000840942728 1044544783 /nfs/dbraw/zinc/54/47/83/1044544783.db2.gz BFIBEQYAJOYNBH-UHFFFAOYSA-N 1 0 311.212 4.001 20 10 DICDRO CCSCC[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000135296186 1044545108 /nfs/dbraw/zinc/54/51/08/1044545108.db2.gz BSEBJXSRDRXFLI-MRXNPFEDSA-N 1 0 306.519 4.298 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc(OC(F)F)cc1 ZINC000295861741 1044568734 /nfs/dbraw/zinc/56/87/34/1044568734.db2.gz GPVCJTSOFVTQIV-ABAIWWIYSA-N 1 0 319.351 4.332 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1c1ccccc1)CC2 ZINC000296170470 1044596297 /nfs/dbraw/zinc/59/62/97/1044596297.db2.gz XQIDVCXPHWDWSK-WAOWUJCRSA-N 1 0 323.436 4.137 20 10 DICDRO Cc1c[nH]nc1CN(Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000886098426 1044606997 /nfs/dbraw/zinc/60/69/97/1044606997.db2.gz MDTJPPYDBNQZBG-MRXNPFEDSA-N 1 0 321.424 4.187 20 10 DICDRO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297002792 1044655514 /nfs/dbraw/zinc/65/55/14/1044655514.db2.gz SWHZMMMSOYJBJX-CZUORRHYSA-N 1 0 321.424 4.100 20 10 DICDRO C[N@H+](CCCCO)Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000138552037 1044673194 /nfs/dbraw/zinc/67/31/94/1044673194.db2.gz ICRZABWKBIUDEN-UHFFFAOYSA-N 1 0 321.505 4.192 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cc(C3CC3)no2)c1O ZINC000886683915 1044679031 /nfs/dbraw/zinc/67/90/31/1044679031.db2.gz ALKVEWDROZVIED-SNVBAGLBSA-N 1 0 306.793 4.070 20 10 DICDRO CC[C@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1ccccc1O ZINC000886773800 1044695061 /nfs/dbraw/zinc/69/50/61/1044695061.db2.gz BEKAEKOQVFQVLE-WMZOPIPTSA-N 1 0 303.446 4.172 20 10 DICDRO CC[C@@H]([NH2+][C@@H](COCC(C)C)c1ccco1)c1ccccc1O ZINC000155538780 1044703356 /nfs/dbraw/zinc/70/33/56/1044703356.db2.gz VVGSWZCYJJQYSU-SJORKVTESA-N 1 0 317.429 4.440 20 10 DICDRO CC[C@H]([NH2+][C@H](COCC(C)C)c1ccco1)c1ccccc1O ZINC000155538886 1044706322 /nfs/dbraw/zinc/70/63/22/1044706322.db2.gz VVGSWZCYJJQYSU-DLBZAZTESA-N 1 0 317.429 4.440 20 10 DICDRO CC[C@@H]([NH2+][C@H](COCC(C)C)c1ccco1)c1ccccc1O ZINC000155538996 1044706362 /nfs/dbraw/zinc/70/63/62/1044706362.db2.gz VVGSWZCYJJQYSU-IAGOWNOFSA-N 1 0 317.429 4.440 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1OCC1CC1)c1ccccc1O ZINC000155955339 1044746632 /nfs/dbraw/zinc/74/66/32/1044746632.db2.gz BHZIPGWWLPTLRH-SFHVURJKSA-N 1 0 311.425 4.422 20 10 DICDRO C[C@@H]([NH2+][C@H](C)C1CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC000126090109 1044809850 /nfs/dbraw/zinc/80/98/50/1044809850.db2.gz DMGRXDMGRPOCLH-IAGOWNOFSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C1CCOCC1 ZINC000126089856 1044812359 /nfs/dbraw/zinc/81/23/59/1044812359.db2.gz DMGRXDMGRPOCLH-DLBZAZTESA-N 1 0 316.489 4.143 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCN(Cc3ccccc3)C2)c(O)c1 ZINC000301386428 1044884138 /nfs/dbraw/zinc/88/41/38/1044884138.db2.gz ZAZPEMKRDVTFAT-HKUYNNGSSA-N 1 0 324.468 4.016 20 10 DICDRO C[C@@H](CCc1ccc(Cl)s1)[NH2+]CCc1ccc(N)cc1 ZINC000841038747 1044929037 /nfs/dbraw/zinc/92/90/37/1044929037.db2.gz PIKDBDRZGRUEFT-LBPRGKRZSA-N 1 0 308.878 4.137 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000373164910 1044945610 /nfs/dbraw/zinc/94/56/10/1044945610.db2.gz ORCCXKNIPAUHSD-NBHGPNQESA-N 1 0 324.468 4.181 20 10 DICDRO CC[C@@H]([NH2+]CCc1c[nH]c2cccc(OC)c12)c1ccccc1O ZINC000157901195 1044955483 /nfs/dbraw/zinc/95/54/83/1044955483.db2.gz YAVYYANJMNGVTM-MRXNPFEDSA-N 1 0 324.424 4.166 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c1 ZINC000373696665 1045002774 /nfs/dbraw/zinc/00/27/74/1045002774.db2.gz WCEASWWNQPGVOA-MLGOLLRUSA-N 1 0 301.361 4.014 20 10 DICDRO C[C@@H]([NH2+]Cc1cccnc1)c1ccc(N2CCCCCC2)cc1 ZINC000151095294 1045015905 /nfs/dbraw/zinc/01/59/05/1045015905.db2.gz TYBKYBPOPZUPMT-QGZVFWFLSA-N 1 0 309.457 4.313 20 10 DICDRO C[C@H]([NH2+]Cc1cccnc1)c1ccc(N2CCCCCC2)cc1 ZINC000151095226 1045017043 /nfs/dbraw/zinc/01/70/43/1045017043.db2.gz TYBKYBPOPZUPMT-KRWDZBQOSA-N 1 0 309.457 4.313 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)C1CCOCC1)c1ccccc1O ZINC000374677399 1045081640 /nfs/dbraw/zinc/08/16/40/1045081640.db2.gz JAEQSWZQUSRWER-MGPUTAFESA-N 1 0 311.425 4.211 20 10 DICDRO Cn1c2ccccc2nc1[C@@H]1CCCC[N@@H+]1Cc1ccccc1O ZINC000778998043 1045112736 /nfs/dbraw/zinc/11/27/36/1045112736.db2.gz GGAYCTZPGWLFRR-SFHVURJKSA-N 1 0 321.424 4.006 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1F ZINC000779044214 1045199051 /nfs/dbraw/zinc/19/90/51/1045199051.db2.gz LNOPAMKHAFYSPK-IBGZPJMESA-N 1 0 312.432 4.449 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)c1ccnnc1 ZINC000924854907 1045203048 /nfs/dbraw/zinc/20/30/48/1045203048.db2.gz NVDQAGMFLQVTMA-INIZCTEOSA-N 1 0 324.472 4.096 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)ccc1OC)c1cc(Cl)ccc1O ZINC000779056052 1045221219 /nfs/dbraw/zinc/22/12/19/1045221219.db2.gz OSVPGFXQJAVUHL-HNNXBMFYSA-N 1 0 323.795 4.434 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(Br)c2)c1 ZINC000048817994 1045277157 /nfs/dbraw/zinc/27/71/57/1045277157.db2.gz VEZCJDJHQXICJX-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]C1(c2ccc(F)cc2F)CCCC1 ZINC000779102937 1045279644 /nfs/dbraw/zinc/27/96/44/1045279644.db2.gz SESIEPBRTJXLFY-UHFFFAOYSA-N 1 0 321.342 4.369 20 10 DICDRO CO[C@@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000779150852 1045322944 /nfs/dbraw/zinc/32/29/44/1045322944.db2.gz YFGRZAYWABQQEQ-FZKQIMNGSA-N 1 0 319.832 4.220 20 10 DICDRO CSCc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000188722257 1045339163 /nfs/dbraw/zinc/33/91/63/1045339163.db2.gz ZDUDOBKHXNFQCT-OAHLLOKOSA-N 1 0 314.498 4.466 20 10 DICDRO CCC[N@H+](Cc1coc(-c2ccccc2)n1)Cc1ccccc1O ZINC000076073982 1045343607 /nfs/dbraw/zinc/34/36/07/1045343607.db2.gz MRHZKFQLUMJOOW-UHFFFAOYSA-N 1 0 322.408 4.459 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccc(F)nc1)C1CCCCC1 ZINC000189279032 1045344941 /nfs/dbraw/zinc/34/49/41/1045344941.db2.gz IVCGQCAOLVJVQR-UHFFFAOYSA-N 1 0 314.404 4.261 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ncccc1Cl)C1CCCC1 ZINC000528378362 1045347336 /nfs/dbraw/zinc/34/73/36/1045347336.db2.gz DLVMUFIYDRCXAB-UHFFFAOYSA-N 1 0 316.832 4.385 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc(Cl)cc2F)c1O ZINC000779187132 1045362181 /nfs/dbraw/zinc/36/21/81/1045362181.db2.gz ZKGMYTJIPZTUNY-UHFFFAOYSA-N 1 0 314.187 4.436 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1ncccc1Cl ZINC000528491974 1045369893 /nfs/dbraw/zinc/36/98/93/1045369893.db2.gz YCXJPBKSUBODLG-UHFFFAOYSA-N 1 0 304.821 4.243 20 10 DICDRO COc1cccc(F)c1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC001120363708 1045536991 /nfs/dbraw/zinc/53/69/91/1045536991.db2.gz IKJULMGRDFQARU-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CC3CCC2CC3)c1 ZINC000381908442 1045585199 /nfs/dbraw/zinc/58/51/99/1045585199.db2.gz NDMNVOMUHFSJMS-CYSCTCCASA-N 1 0 303.446 4.266 20 10 DICDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000751600129 1045620049 /nfs/dbraw/zinc/62/00/49/1045620049.db2.gz GXKABYRFLJOWRQ-CRAIPNDOSA-N 1 0 318.420 4.318 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC(F)(F)C2)c2c1c(F)ccc2O ZINC000800494527 1045631843 /nfs/dbraw/zinc/63/18/43/1045631843.db2.gz XETVRVPVUXPUMG-NTZNESFSSA-N 1 0 313.363 4.495 20 10 DICDRO CC[C@@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccccc1O ZINC000800495433 1045632381 /nfs/dbraw/zinc/63/23/81/1045632381.db2.gz NRUYAERKLMFEES-DOTOQJQBSA-N 1 0 301.817 4.254 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC2CCC(F)(F)CC2)c2c1c(F)ccc2O ZINC000800499871 1045634879 /nfs/dbraw/zinc/63/48/79/1045634879.db2.gz NTQVYPAVRDXGCN-ZWNOBZJWSA-N 1 0 313.363 4.495 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCCC23CCOCC3)cc1 ZINC000800498421 1045634946 /nfs/dbraw/zinc/63/49/46/1045634946.db2.gz JRGGQGGFDCIHKF-LPHOPBHVSA-N 1 0 316.489 4.143 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCCC23CCOCC3)cc1 ZINC000800498423 1045635193 /nfs/dbraw/zinc/63/51/93/1045635193.db2.gz JRGGQGGFDCIHKF-VQIMIIECSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCC12CCOCC2)c1cc(Cl)ccc1O ZINC000800498481 1045635585 /nfs/dbraw/zinc/63/55/85/1045635585.db2.gz LCOLAJUTHTUITC-NVXWUHKLSA-N 1 0 323.864 4.436 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCC12CCOCC2)c1ccc(N(C)C)cc1 ZINC000800498248 1045635689 /nfs/dbraw/zinc/63/56/89/1045635689.db2.gz GAZACDSNTOWKKZ-MOPGFXCFSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCc2cccc3[nH]ccc32)c2c1c(F)ccc2O ZINC000800499977 1045635759 /nfs/dbraw/zinc/63/57/59/1045635759.db2.gz LVJOOSSHPZAKQG-SJCJKPOMSA-N 1 0 324.399 4.393 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](C)c2cc3ccccc3o2)c1 ZINC000191130060 1045658777 /nfs/dbraw/zinc/65/87/77/1045658777.db2.gz GWNAXGDALAPQKS-CYBMUJFWSA-N 1 0 311.381 4.388 20 10 DICDRO FC(F)(F)[C@H]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000752265655 1045669905 /nfs/dbraw/zinc/66/99/05/1045669905.db2.gz LDHLLZCNZKPEBF-DOMZBBRYSA-N 1 0 313.363 4.080 20 10 DICDRO FCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000800966872 1045670946 /nfs/dbraw/zinc/67/09/46/1045670946.db2.gz DYSYPZLJJDUNDA-HKUYNNGSSA-N 1 0 304.453 4.295 20 10 DICDRO Cc1cc(C)cc([C@@H](O)C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000800992856 1045678086 /nfs/dbraw/zinc/67/80/86/1045678086.db2.gz UIYWYPDUZYJPRY-UGSOOPFHSA-N 1 0 319.832 4.047 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3ccccc3OC2)c(O)c1C ZINC000800987449 1045678567 /nfs/dbraw/zinc/67/85/67/1045678567.db2.gz XVQCBLHWTWSDQJ-RDJZCZTQSA-N 1 0 311.425 4.053 20 10 DICDRO CCCC[N@H+](CCc1csc(C)n1)Cc1ccccc1O ZINC000801597575 1045749556 /nfs/dbraw/zinc/74/95/56/1045749556.db2.gz JNRIVEIUSQUOIP-UHFFFAOYSA-N 1 0 304.459 4.002 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CC1(Cl)Cl ZINC000801596552 1045749772 /nfs/dbraw/zinc/74/97/72/1045749772.db2.gz FHDNJNCWEKXPOZ-CYBMUJFWSA-N 1 0 302.245 4.188 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1O)C1(C)CC1 ZINC000753551571 1045760726 /nfs/dbraw/zinc/76/07/26/1045760726.db2.gz NTLXSDWSNXRSKW-HNNXBMFYSA-N 1 0 311.425 4.249 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]C2(C)CCC(F)(F)CC2)c1O ZINC000753568642 1045763011 /nfs/dbraw/zinc/76/30/11/1045763011.db2.gz HFCJHVNOXILSQS-UHFFFAOYSA-N 1 0 303.780 4.412 20 10 DICDRO CCN(Cc1ccccc1O)Cc1c(Cl)cncc1Cl ZINC001137610315 1045906411 /nfs/dbraw/zinc/90/64/11/1045906411.db2.gz MJVJMGOCEUVRFP-UHFFFAOYSA-N 1 0 311.212 4.116 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H]2c2ccccc2C)c1O ZINC000754728207 1045920609 /nfs/dbraw/zinc/92/06/09/1045920609.db2.gz XMAQGZTZUKTEGX-SFHVURJKSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H]2c2cccc(C)c2)c1O ZINC000754727630 1045921483 /nfs/dbraw/zinc/92/14/83/1045921483.db2.gz LAVIRVSPJBPCDK-SFHVURJKSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@H]2c2ccccc2C)c1O ZINC000754728205 1045921592 /nfs/dbraw/zinc/92/15/92/1045921592.db2.gz XMAQGZTZUKTEGX-GOSISDBHSA-N 1 0 311.425 4.355 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(OC(F)F)c1 ZINC000192720825 1045926124 /nfs/dbraw/zinc/92/61/24/1045926124.db2.gz KCWHINAKCDVXMI-RYUDHWBXSA-N 1 0 307.340 4.405 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2F)c1 ZINC000192707344 1045927322 /nfs/dbraw/zinc/92/73/22/1045927322.db2.gz BSJDKHWXRJJSML-MNOVXSKESA-N 1 0 307.340 4.091 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)C/C(C)=C\c2ccccc2)c1O ZINC000754858120 1045934796 /nfs/dbraw/zinc/93/47/96/1045934796.db2.gz QVBMIJQZECSNBY-YBEGLDIGSA-N 1 0 311.425 4.245 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c2c1c(F)ccc2O ZINC000802309694 1045952584 /nfs/dbraw/zinc/95/25/84/1045952584.db2.gz UDUAQDGRYVZGNP-JHZZJYKESA-N 1 0 321.436 4.263 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000193009356 1045960590 /nfs/dbraw/zinc/96/05/90/1045960590.db2.gz TYESMMHSDMZPGS-UONOGXRCSA-N 1 0 316.420 4.312 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000193009338 1045960687 /nfs/dbraw/zinc/96/06/87/1045960687.db2.gz TYESMMHSDMZPGS-KGLIPLIRSA-N 1 0 316.420 4.312 20 10 DICDRO Cc1cc(C[NH+]2CCC(F)(F)CC2)ccc1N1CCCCC1 ZINC000829367981 1045971438 /nfs/dbraw/zinc/97/14/38/1045971438.db2.gz ZFXPUCOSZGVRDT-UHFFFAOYSA-N 1 0 308.416 4.216 20 10 DICDRO Cc1cc(C[N@H+](C)CCc2ccncc2)c(C)n1-c1ccccc1 ZINC001137858002 1045987541 /nfs/dbraw/zinc/98/75/41/1045987541.db2.gz SIPHTYGAGDDKLE-UHFFFAOYSA-N 1 0 319.452 4.164 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2ccc(C)s2)c1 ZINC000080241005 1046011918 /nfs/dbraw/zinc/01/19/18/1046011918.db2.gz VUHPUALNOLTXBC-DGCLKSJQSA-N 1 0 305.443 4.053 20 10 DICDRO CCCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000829966948 1046027327 /nfs/dbraw/zinc/02/73/27/1046027327.db2.gz BNOQULHIKJGISU-QGZVFWFLSA-N 1 0 318.505 4.312 20 10 DICDRO CCCC[N@H+](Cc1ccc(COC)cc1)Cc1ccccc1O ZINC000802657742 1046030357 /nfs/dbraw/zinc/03/03/57/1046030357.db2.gz PTIJTWRWJWEUPR-UHFFFAOYSA-N 1 0 313.441 4.341 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)CCS1 ZINC000756146728 1046054744 /nfs/dbraw/zinc/05/47/44/1046054744.db2.gz LTHLAGMGLIUBQQ-OAHLLOKOSA-N 1 0 313.466 4.387 20 10 DICDRO C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)c1cc(Cl)ccc1O ZINC000756342963 1046068070 /nfs/dbraw/zinc/06/80/70/1046068070.db2.gz MACYQQSHEBVDSJ-GFCCVEGCSA-N 1 0 314.816 4.420 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCc2ccccc2F)c2c1c(F)ccc2O ZINC000756358312 1046069203 /nfs/dbraw/zinc/06/92/03/1046069203.db2.gz WFKSJFWPEQGLGG-NHYWBVRUSA-N 1 0 303.352 4.051 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(OC(F)F)cc2)c(O)c1 ZINC000756362785 1046069279 /nfs/dbraw/zinc/06/92/79/1046069279.db2.gz LUUCQYSLEISCIS-CYBMUJFWSA-N 1 0 321.367 4.195 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCSCc2ccccc2F)c(O)c1 ZINC000756354737 1046070015 /nfs/dbraw/zinc/07/00/15/1046070015.db2.gz CDKRDZPNKVKILL-CQSZACIVSA-N 1 0 319.445 4.424 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)ccc1F ZINC000756367230 1046071413 /nfs/dbraw/zinc/07/14/13/1046071413.db2.gz YHGLWQQXSDWCLC-XHDPSFHLSA-N 1 0 303.352 4.317 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)cc1F ZINC000756362747 1046071437 /nfs/dbraw/zinc/07/14/37/1046071437.db2.gz CKAGAJBZNZNALG-XHDPSFHLSA-N 1 0 303.352 4.317 20 10 DICDRO C[C@H](Cc1ccco1)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000756381100 1046073894 /nfs/dbraw/zinc/07/38/94/1046073894.db2.gz WXBDPWFXNMETLX-MNOVXSKESA-N 1 0 324.218 4.030 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(OC(C)C)cc2)c(O)c1 ZINC000756382886 1046074179 /nfs/dbraw/zinc/07/41/79/1046074179.db2.gz FXQOCCZVYKJINN-INIZCTEOSA-N 1 0 313.441 4.381 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1F ZINC000756376669 1046074206 /nfs/dbraw/zinc/07/42/06/1046074206.db2.gz GWDQERFECBCGTF-YGRLFVJLSA-N 1 0 319.351 4.017 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c(O)c1C ZINC000756396881 1046076024 /nfs/dbraw/zinc/07/60/24/1046076024.db2.gz MWKASRMDMFAJLC-UONOGXRCSA-N 1 0 313.397 4.150 20 10 DICDRO C[C@H]([NH2+]CCc1c(F)cccc1F)c1cc(Cl)ccc1O ZINC000756422977 1046078067 /nfs/dbraw/zinc/07/80/67/1046078067.db2.gz PNVGFVKBTLCENS-JTQLQIEISA-N 1 0 311.759 4.217 20 10 DICDRO Cc1ccc(OCCCC[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756416016 1046080004 /nfs/dbraw/zinc/08/00/04/1046080004.db2.gz FZEFPZWIJIOVCD-HNNXBMFYSA-N 1 0 317.404 4.350 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccnc2OC(C)C)c(O)c1C ZINC000756422775 1046080104 /nfs/dbraw/zinc/08/01/04/1046080104.db2.gz ODUBKCQXHQJROE-HNNXBMFYSA-N 1 0 314.429 4.042 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756434889 1046080681 /nfs/dbraw/zinc/08/06/81/1046080681.db2.gz VEPXYHWVCWUVTM-WBMJQRKESA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCOCCc2ccccc2)c1 ZINC000756434263 1046080838 /nfs/dbraw/zinc/08/08/38/1046080838.db2.gz KMNUGRAZIWMOQV-KRWDZBQOSA-N 1 0 313.441 4.001 20 10 DICDRO CO[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccccc1 ZINC000756445202 1046081701 /nfs/dbraw/zinc/08/17/01/1046081701.db2.gz LGUFZPBPSFIJKY-SRCQZFHVSA-N 1 0 315.388 4.057 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)CCC3)c1 ZINC000756454973 1046084899 /nfs/dbraw/zinc/08/48/99/1046084899.db2.gz GWPPAKYGXNKHOD-KBPBESRZSA-N 1 0 311.425 4.301 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1 ZINC000756454236 1046085153 /nfs/dbraw/zinc/08/51/53/1046085153.db2.gz BPBXVRONJUYOJV-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(Br)cc1O ZINC000756473653 1046087323 /nfs/dbraw/zinc/08/73/23/1046087323.db2.gz DKQUJBQXMAWUNP-NEPJUHHUSA-N 1 0 310.235 4.162 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3cc(F)ccc32)c2c1c(F)ccc2O ZINC000756489251 1046088497 /nfs/dbraw/zinc/08/84/97/1046088497.db2.gz HTIDWKSRHQOLDD-GTTSAUCSSA-N 1 0 315.363 4.496 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCCOC2CCCC2)c2c1c(F)ccc2O ZINC000756501135 1046090580 /nfs/dbraw/zinc/09/05/80/1046090580.db2.gz BEHIIPRTZQBEDJ-WFASDCNBSA-N 1 0 307.409 4.019 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc2c(cc1O)CCCC2 ZINC000756515048 1046095045 /nfs/dbraw/zinc/09/50/45/1046095045.db2.gz LBWMAVIKWWTHMA-CQSZACIVSA-N 1 0 323.436 4.057 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)c2ccccc2F)c1 ZINC000756513625 1046095129 /nfs/dbraw/zinc/09/51/29/1046095129.db2.gz PCSAZVWPRDACFG-ZDUSSCGKSA-N 1 0 317.404 4.168 20 10 DICDRO C[C@H]([NH2+]C[C@@H](O)C1CCCCC1)c1ccc2ccccc2c1O ZINC000756534874 1046095609 /nfs/dbraw/zinc/09/56/09/1046095609.db2.gz LIEFZHHEBTZQCH-IFXJQAMLSA-N 1 0 313.441 4.137 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000756531862 1046097172 /nfs/dbraw/zinc/09/71/72/1046097172.db2.gz AKGQDEBHRWPCKQ-JENIJYKNSA-N 1 0 324.468 4.187 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1cc(Cl)ccc1O ZINC000756554276 1046098998 /nfs/dbraw/zinc/09/89/98/1046098998.db2.gz ORIJQTBEPUZFBH-OLZOCXBDSA-N 1 0 317.816 4.263 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCOc3ccccc32)c(O)c1C ZINC000756548763 1046099133 /nfs/dbraw/zinc/09/91/33/1046099133.db2.gz DRMZHRBPVIRFMT-HZPDHXFCSA-N 1 0 311.425 4.226 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000756582345 1046101862 /nfs/dbraw/zinc/10/18/62/1046101862.db2.gz HOETUUYZHXAQPD-DLBZAZTESA-N 1 0 310.441 4.020 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCN(c3ccccc3)C2)c1 ZINC000756581523 1046103959 /nfs/dbraw/zinc/10/39/59/1046103959.db2.gz DCDIPBJCIUIGTG-SJORKVTESA-N 1 0 310.441 4.020 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2c[nH]c3ccc(F)cc23)c1 ZINC000756589956 1046104138 /nfs/dbraw/zinc/10/41/38/1046104138.db2.gz NLNXHOBJUGPVNJ-CYBMUJFWSA-N 1 0 312.388 4.214 20 10 DICDRO CS[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC000756587516 1046104461 /nfs/dbraw/zinc/10/44/61/1046104461.db2.gz ASSCDKHKOUGVRL-CZXHOFHRSA-N 1 0 309.450 4.343 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)C12CCC2 ZINC000756613715 1046110094 /nfs/dbraw/zinc/11/00/94/1046110094.db2.gz QJYYNJFVLNNRLD-DLKVLKDVSA-N 1 0 319.420 4.017 20 10 DICDRO Cc1ccccc1[C@@H](CO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756635022 1046113994 /nfs/dbraw/zinc/11/39/94/1046113994.db2.gz DFMBPPDIDCEPPF-FOIQADDNSA-N 1 0 321.420 4.238 20 10 DICDRO CCO[C@@H](CC[NH2+][C@H](C)c1cc(F)ccc1O)C1CCCC1 ZINC000756638090 1046114562 /nfs/dbraw/zinc/11/45/62/1046114562.db2.gz RNNFNSRUESHHAB-ACJLOTCBSA-N 1 0 309.425 4.167 20 10 DICDRO CC[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)Oc1ccccc1F ZINC000756638219 1046114623 /nfs/dbraw/zinc/11/46/23/1046114623.db2.gz NPUSCXQLKTUCAA-TZMCWYRMSA-N 1 0 321.367 4.179 20 10 DICDRO CCO[C@H](CC[NH2+][C@H](C)c1ccc(C)cc1O)C1CCCC1 ZINC000756635696 1046114780 /nfs/dbraw/zinc/11/47/80/1046114780.db2.gz HDMULXJSKDDBEX-DNVCBOLYSA-N 1 0 305.462 4.337 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CC2(CCO)CCCCC2)c2c1c(F)ccc2O ZINC000756647485 1046115577 /nfs/dbraw/zinc/11/55/77/1046115577.db2.gz GZMVNTHQSXPRBM-DZGCQCFKSA-N 1 0 321.436 4.002 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCCC1 ZINC000756644558 1046115758 /nfs/dbraw/zinc/11/57/58/1046115758.db2.gz BEXVVQSWOKOUMC-INIZCTEOSA-N 1 0 305.462 4.257 20 10 DICDRO COc1ccc(CC[NH2+][C@@H](C)c2cc(C)ccc2O)c(Cl)c1 ZINC000756646784 1046116301 /nfs/dbraw/zinc/11/63/01/1046116301.db2.gz PHLBBJXNEKZJQG-ZDUSSCGKSA-N 1 0 319.832 4.256 20 10 DICDRO C[C@@H]([NH2+]CCNc1ccccc1)c1cc2c(cc1O)CCCC2 ZINC000756640448 1046116386 /nfs/dbraw/zinc/11/63/86/1046116386.db2.gz BGJJAEKDVUKDJL-OAHLLOKOSA-N 1 0 310.441 4.034 20 10 DICDRO COCCC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000756648152 1046116513 /nfs/dbraw/zinc/11/65/13/1046116513.db2.gz ZCADYHIGVBLDTB-DZGCQCFKSA-N 1 0 321.436 4.266 20 10 DICDRO C[C@H]([NH2+]CCNc1ccccc1)c1ccc2ccccc2c1O ZINC000756644222 1046116672 /nfs/dbraw/zinc/11/66/72/1046116672.db2.gz ZNSNLPPSQFUXQQ-HNNXBMFYSA-N 1 0 306.409 4.308 20 10 DICDRO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CCO1 ZINC000756665986 1046118043 /nfs/dbraw/zinc/11/80/43/1046118043.db2.gz XYLHPJLFZOQLNC-JNAXZKDPSA-N 1 0 317.473 4.125 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H](CCO)C2CCCCC2)c2c1c(F)ccc2O ZINC000756659874 1046118311 /nfs/dbraw/zinc/11/83/11/1046118311.db2.gz GZBDQLKKYZLPDZ-UHOFOFEASA-N 1 0 321.436 4.001 20 10 DICDRO c1cc2c(s1)CC[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC001138215878 1046120160 /nfs/dbraw/zinc/12/01/60/1046120160.db2.gz ZRUWJZABFPIKON-UHFFFAOYSA-N 1 0 312.482 4.297 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[C@H](c3ccccc3)C2)c1 ZINC000756675380 1046120597 /nfs/dbraw/zinc/12/05/97/1046120597.db2.gz FNQZCNDIZLNETK-XIRDDKMYSA-N 1 0 311.425 4.388 20 10 DICDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756684670 1046120631 /nfs/dbraw/zinc/12/06/31/1046120631.db2.gz PESBLSZQVLZACI-LRDDRELGSA-N 1 0 317.816 4.447 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756675980 1046120748 /nfs/dbraw/zinc/12/07/48/1046120748.db2.gz KDKFKYYZPAORPO-SLEUVZQESA-N 1 0 300.377 4.134 20 10 DICDRO C[N@H+](CCc1ccccc1)Cc1ccc(N2CCCCC2)cc1 ZINC001138213827 1046120972 /nfs/dbraw/zinc/12/09/72/1046120972.db2.gz BDQJHLKMNQNOSJ-UHFFFAOYSA-N 1 0 308.469 4.351 20 10 DICDRO COc1cccc(C[C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000756708597 1046121646 /nfs/dbraw/zinc/12/16/46/1046121646.db2.gz RXICTRKZTORKIZ-GOEBONIOSA-N 1 0 313.441 4.299 20 10 DICDRO COc1cccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000756708599 1046122259 /nfs/dbraw/zinc/12/22/59/1046122259.db2.gz RXICTRKZTORKIZ-ZBFHGGJFSA-N 1 0 313.441 4.299 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1cc(Cl)ccc1O ZINC000756706110 1046122605 /nfs/dbraw/zinc/12/26/05/1046122605.db2.gz GWOBWLRESDWVNI-XIKOKIGWSA-N 1 0 317.816 4.010 20 10 DICDRO CC(C)[N@H+](CCCCCO)Cc1ccc(N2CCCCC2)cc1 ZINC001138222243 1046122623 /nfs/dbraw/zinc/12/26/23/1046122623.db2.gz NRCVOSOHJMUSJQ-UHFFFAOYSA-N 1 0 318.505 4.050 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1N(C)C)c1ccc2ccccc2c1O ZINC000756731147 1046124022 /nfs/dbraw/zinc/12/40/22/1046124022.db2.gz YBIINPOLIKEWIB-OAHLLOKOSA-N 1 0 320.436 4.462 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCO[C@H]2C(C)C)c(O)c1C ZINC000756736905 1046124046 /nfs/dbraw/zinc/12/40/46/1046124046.db2.gz POCRNVLXESNKOC-FCEWJHQRSA-N 1 0 305.462 4.111 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1cccc(Cl)c1 ZINC000756731185 1046124276 /nfs/dbraw/zinc/12/42/76/1046124276.db2.gz FNJQKJKBXFZOOC-FZKQIMNGSA-N 1 0 319.832 4.392 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CC(C)(C)[C@@H]2CCCCO2)c2c1c(F)ccc2O ZINC000756757213 1046125711 /nfs/dbraw/zinc/12/57/11/1046125711.db2.gz MHUGQYYRXFIDCU-INWMFGNUSA-N 1 0 321.436 4.265 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](Cc2ccccc2)C2CC2)c1 ZINC000756739706 1046125925 /nfs/dbraw/zinc/12/59/25/1046125925.db2.gz WZHOSAZDISEHQS-IFXJQAMLSA-N 1 0 311.425 4.073 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2COc3c2cccc3Cl)c1 ZINC000756757382 1046125972 /nfs/dbraw/zinc/12/59/72/1046125972.db2.gz MZTKWMZULLVBDM-NHYWBVRUSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccccc2Cl)c(O)c1C ZINC000756741283 1046126061 /nfs/dbraw/zinc/12/60/61/1046126061.db2.gz WZWVIDZNSVKQIU-CXAGYDPISA-N 1 0 319.832 4.047 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCNc2ccc3ccccc3n2)c(O)c1 ZINC000756744769 1046126658 /nfs/dbraw/zinc/12/66/58/1046126658.db2.gz CAPRIUZOJUQDGA-HNNXBMFYSA-N 1 0 321.424 4.012 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)c(O)c1C ZINC000756756186 1046126688 /nfs/dbraw/zinc/12/66/88/1046126688.db2.gz FYNVYTACZADZOT-BLLLJJGKSA-N 1 0 317.816 4.447 20 10 DICDRO Cc1c(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c2ccccc2n1C ZINC001138252429 1046129150 /nfs/dbraw/zinc/12/91/50/1046129150.db2.gz HDNOHFYMFPIMME-MRXNPFEDSA-N 1 0 310.363 4.056 20 10 DICDRO Cc1c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c2ccccc2n1C ZINC001138256621 1046129783 /nfs/dbraw/zinc/12/97/83/1046129783.db2.gz CVIOJGPEPOMZMK-SFHVURJKSA-N 1 0 320.436 4.140 20 10 DICDRO CC(C)[C@H](O)C(C)(C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756769292 1046130587 /nfs/dbraw/zinc/13/05/87/1046130587.db2.gz DONOWSKAMPCJHT-KUHUBIRLSA-N 1 0 315.457 4.239 20 10 DICDRO Cc1ccccc1OCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000195689456 1046131089 /nfs/dbraw/zinc/13/10/89/1046131089.db2.gz YSHHNTMHLXYMKD-UHFFFAOYSA-N 1 0 324.468 4.154 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1c(C)n(C)c3ccccc31)C2 ZINC001138256837 1046131729 /nfs/dbraw/zinc/13/17/29/1046131729.db2.gz MKOMCZJEIQTEAR-UHFFFAOYSA-N 1 0 306.409 4.011 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c2ccccc2n1C ZINC001138256996 1046131811 /nfs/dbraw/zinc/13/18/11/1046131811.db2.gz RMJBIHYMGVJBLJ-ZDUSSCGKSA-N 1 0 310.363 4.261 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC2(c3ccc(F)cc3F)CC2)c(O)c1 ZINC000756777797 1046131768 /nfs/dbraw/zinc/13/17/68/1046131768.db2.gz LCJZFIJLWOGTKI-CYBMUJFWSA-N 1 0 317.379 4.361 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756779030 1046131955 /nfs/dbraw/zinc/13/19/55/1046131955.db2.gz IHENGSTUWBPXMT-MEBBXXQBSA-N 1 0 319.351 4.017 20 10 DICDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2F)CC1)c1cc(F)ccc1O ZINC000756780508 1046132283 /nfs/dbraw/zinc/13/22/83/1046132283.db2.gz YVJGPIPUQJYKLP-LLVKDONJSA-N 1 0 321.342 4.192 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCCc2cccs2)c2c1c(F)ccc2O ZINC000756780971 1046133294 /nfs/dbraw/zinc/13/32/94/1046133294.db2.gz ZLFGMMPZXHDGCG-RISCZKNCSA-N 1 0 305.418 4.364 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756782437 1046133758 /nfs/dbraw/zinc/13/37/58/1046133758.db2.gz RBHBOXPYWLYMOO-FMTVUPSXSA-N 1 0 321.367 4.097 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCCC(=O)OC(C)(C)C)c(O)c1C ZINC000756787768 1046136050 /nfs/dbraw/zinc/13/60/50/1046136050.db2.gz RRKDGAKGSAUILS-OAHLLOKOSA-N 1 0 321.461 4.172 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2(c3ccc(Cl)cc3)CC2)c1 ZINC000756826703 1046140507 /nfs/dbraw/zinc/14/05/07/1046140507.db2.gz JOQINJVCTWYPCY-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)c(O)c1C ZINC000756864421 1046145834 /nfs/dbraw/zinc/14/58/34/1046145834.db2.gz MIVMSGVZYJVOFJ-ULQDDVLXSA-N 1 0 305.462 4.253 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccs2)c(OC)c1 ZINC001138389352 1046161873 /nfs/dbraw/zinc/16/18/73/1046161873.db2.gz MVQXVJXSDFQZDI-UHFFFAOYSA-N 1 0 318.486 4.235 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2nccc3c2CCCC3)c(O)c1C ZINC000903182985 1046185206 /nfs/dbraw/zinc/18/52/06/1046185206.db2.gz WQWAQJGUGIXXRX-HNNXBMFYSA-N 1 0 310.441 4.134 20 10 DICDRO CC[N@H+](Cc1c[nH]nc1-c1ccc(C)cc1)Cc1ccccc1O ZINC001138450098 1046186961 /nfs/dbraw/zinc/18/69/61/1046186961.db2.gz NHZGCDFEFPWOFM-UHFFFAOYSA-N 1 0 321.424 4.113 20 10 DICDRO Cc1ccc([C@@H](C)Nc2ccc(C[NH+](C)C)c(F)c2)c(O)c1C ZINC000757612263 1046193168 /nfs/dbraw/zinc/19/31/68/1046193168.db2.gz JPAODHXDLQRYDK-CQSZACIVSA-N 1 0 316.420 4.383 20 10 DICDRO Cc1ccc([C@@H](C)Nc2ccc(C[NH+](C)C)c(F)c2)c(O)c1 ZINC000757614618 1046193928 /nfs/dbraw/zinc/19/39/28/1046193928.db2.gz PZXSTBWCOMBCPO-CYBMUJFWSA-N 1 0 302.393 4.074 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccco1 ZINC000757640279 1046196209 /nfs/dbraw/zinc/19/62/09/1046196209.db2.gz XEOSNPDDMKSZOM-SMDDNHRTSA-N 1 0 309.793 4.067 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)ccc1OC ZINC001138489725 1046198920 /nfs/dbraw/zinc/19/89/20/1046198920.db2.gz YZEPIQAFYOGUHE-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1C ZINC000903234928 1046202219 /nfs/dbraw/zinc/20/22/19/1046202219.db2.gz SKICYXWSHXVMBI-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000757707670 1046204550 /nfs/dbraw/zinc/20/45/50/1046204550.db2.gz UPOHBYNBRJDLQZ-GOSISDBHSA-N 1 0 321.420 4.158 20 10 DICDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)Cc1ccccc1O ZINC000757743505 1046209011 /nfs/dbraw/zinc/20/90/11/1046209011.db2.gz QWMNEQQVIMGSSK-UHFFFAOYSA-N 1 0 314.385 4.021 20 10 DICDRO CCc1noc(C)c1C[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000757800055 1046214991 /nfs/dbraw/zinc/21/49/91/1046214991.db2.gz IRJMENNRPAWTAT-UHFFFAOYSA-N 1 0 315.461 4.024 20 10 DICDRO C[N@H+](CCc1ccccn1)Cc1cc(-c2ccccc2)ccc1O ZINC000757887794 1046223929 /nfs/dbraw/zinc/22/39/29/1046223929.db2.gz UYBCOVRPABTULM-UHFFFAOYSA-N 1 0 318.420 4.129 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H](C)Cc2ccc(Cl)cc2)c(O)c1 ZINC001168167595 1046233365 /nfs/dbraw/zinc/23/33/65/1046233365.db2.gz PZCBPXHOLIUUOA-AWEZNQCLSA-N 1 0 303.833 4.383 20 10 DICDRO COc1cccc(C[NH2+]C2(Cc3ccccc3)CCCC2)c1O ZINC000757978582 1046233678 /nfs/dbraw/zinc/23/36/78/1046233678.db2.gz IUZNFIOTGOTUFW-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000903334672 1046245888 /nfs/dbraw/zinc/24/58/88/1046245888.db2.gz FDVWXRKZEFGUTN-LHSJRXKWSA-N 1 0 322.452 4.468 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000903334673 1046246982 /nfs/dbraw/zinc/24/69/82/1046246982.db2.gz FDVWXRKZEFGUTN-QKKBWIMNSA-N 1 0 322.452 4.468 20 10 DICDRO CCc1noc(C)c1C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000758141477 1046249404 /nfs/dbraw/zinc/24/94/04/1046249404.db2.gz FPFUZUHOPHBSOC-UHFFFAOYSA-N 1 0 315.461 4.022 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cnn(CC3CCC3)c2)c(O)c1 ZINC000903404872 1046267437 /nfs/dbraw/zinc/26/74/37/1046267437.db2.gz MPZFAFLNRNPGIJ-HUUCEWRRSA-N 1 0 313.445 4.109 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC000026237334 1046310438 /nfs/dbraw/zinc/31/04/38/1046310438.db2.gz ASAXJHTWQQSHPD-SFHVURJKSA-N 1 0 318.420 4.148 20 10 DICDRO Cc1ccc(C(C)(C)[NH2+]Cc2ccc(N3CCCCC3)cc2)cn1 ZINC000759186335 1046330301 /nfs/dbraw/zinc/33/03/01/1046330301.db2.gz RLYJKHZDUVKIRJ-UHFFFAOYSA-N 1 0 323.484 4.405 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)CC2 ZINC000689267428 1046347204 /nfs/dbraw/zinc/34/72/04/1046347204.db2.gz RZZRAZIUUASQCB-CQSZACIVSA-N 1 0 308.208 4.476 20 10 DICDRO CCc1cccnc1[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000780708771 1046400558 /nfs/dbraw/zinc/40/05/58/1046400558.db2.gz HRQCGMPJJOYOGI-MRXNPFEDSA-N 1 0 309.457 4.095 20 10 DICDRO Cc1cc(O)c(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)cc1C ZINC000780793879 1046406448 /nfs/dbraw/zinc/40/64/48/1046406448.db2.gz WHSZOTHAQLQAPY-JSGCOSHPSA-N 1 0 301.352 4.172 20 10 DICDRO CC(C)OC1CCC([NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000090771742 1046422591 /nfs/dbraw/zinc/42/25/91/1046422591.db2.gz BPWQNOFZLYYHDF-LSJNQWAISA-N 1 0 304.478 4.139 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000090886847 1046427250 /nfs/dbraw/zinc/42/72/50/1046427250.db2.gz IQRJUTOUPZUWSW-SJCJKPOMSA-N 1 0 301.434 4.159 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c1O ZINC000827962522 1046476096 /nfs/dbraw/zinc/47/60/96/1046476096.db2.gz NNHDVRNSJQDNTD-AWEZNQCLSA-N 1 0 311.425 4.130 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)cc1Cl ZINC001139597216 1046482899 /nfs/dbraw/zinc/48/28/99/1046482899.db2.gz QOLBQILPNUWYKT-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)ccc1N(C)C ZINC001139673566 1046496726 /nfs/dbraw/zinc/49/67/26/1046496726.db2.gz SREOAQYEAKJLQZ-GOSISDBHSA-N 1 0 312.432 4.190 20 10 DICDRO Oc1ccccc1C[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000795610365 1046496958 /nfs/dbraw/zinc/49/69/58/1046496958.db2.gz YHNMHOWKDHJBJP-UHFFFAOYSA-N 1 0 305.780 4.163 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1c(C)cc(O)cc1C ZINC001139716620 1046504763 /nfs/dbraw/zinc/50/47/63/1046504763.db2.gz ZSAURNIAVNEVRR-UHFFFAOYSA-N 1 0 312.457 4.097 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000782529681 1046533261 /nfs/dbraw/zinc/53/32/61/1046533261.db2.gz SIOGPRBYXLVDII-HUUCEWRRSA-N 1 0 314.395 4.272 20 10 DICDRO Cc1ccc2cc(C[NH2+]Cc3ccc(N(C)C)cc3C)ccc2n1 ZINC000782529035 1046533333 /nfs/dbraw/zinc/53/33/33/1046533333.db2.gz DFVYRLBAGCFZGT-UHFFFAOYSA-N 1 0 319.452 4.207 20 10 DICDRO CSCc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000782534787 1046533983 /nfs/dbraw/zinc/53/39/83/1046533983.db2.gz IBWGFNPFFBHFPT-UHFFFAOYSA-N 1 0 307.846 4.198 20 10 DICDRO Fc1cc(Cl)ccc1C[NH2+]CCCSc1nccs1 ZINC000782531883 1046534013 /nfs/dbraw/zinc/53/40/13/1046534013.db2.gz SIOVWTIFKKRYIB-UHFFFAOYSA-N 1 0 316.854 4.208 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cnc(C)s2)cc1 ZINC000179134372 1046550677 /nfs/dbraw/zinc/55/06/77/1046550677.db2.gz UEDRNKUWTIKCEL-ZDUSSCGKSA-N 1 0 303.475 4.149 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2CC[C@@](C)(c3ccccc3)C2)c1 ZINC000783251290 1046569017 /nfs/dbraw/zinc/56/90/17/1046569017.db2.gz JNPBUSVKRRHPBV-YLJYHZDGSA-N 1 0 311.425 4.001 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CC[C@@](C)(c3ccccc3)C2)c1 ZINC000783251286 1046570245 /nfs/dbraw/zinc/57/02/45/1046570245.db2.gz JNPBUSVKRRHPBV-FXAWDEMLSA-N 1 0 311.425 4.001 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC=CO1)c1ccc(N2CCCCC2)cc1 ZINC000783311122 1046581615 /nfs/dbraw/zinc/58/16/15/1046581615.db2.gz UHGZBBFVGGXUTQ-QFBILLFUSA-N 1 0 300.446 4.020 20 10 DICDRO CC(C)[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000783330338 1046582091 /nfs/dbraw/zinc/58/20/91/1046582091.db2.gz LZELFUXCWBMSDS-SWLSCSKDSA-N 1 0 302.384 4.380 20 10 DICDRO Cc1ccc2cc(C[N@@H+](C)Cc3ccc(N(C)C)cc3)ccc2n1 ZINC000783498578 1046600840 /nfs/dbraw/zinc/60/08/40/1046600840.db2.gz LPEYCKFUTYAIMB-UHFFFAOYSA-N 1 0 319.452 4.241 20 10 DICDRO Cc1ccc([C@H](C[NH2+][C@@H](C)c2ccccc2O)N2CCCC2)cc1 ZINC000783507315 1046601707 /nfs/dbraw/zinc/60/17/07/1046601707.db2.gz CBAZYAONTXMGBM-PXNSSMCTSA-N 1 0 324.468 4.188 20 10 DICDRO C[C@H]([NH2+]CCc1ccccc1Br)c1ccccc1O ZINC000783510011 1046602026 /nfs/dbraw/zinc/60/20/26/1046602026.db2.gz YHMGOUCLXZSVLO-LBPRGKRZSA-N 1 0 320.230 4.048 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1ccccc1O ZINC000783504663 1046602212 /nfs/dbraw/zinc/60/22/12/1046602212.db2.gz IJRNYXOHBYIZCT-FASAQXTFSA-N 1 0 315.388 4.102 20 10 DICDRO C[C@@H]([NH2+][C@@H]1COc2c1ccc(Cl)c2Cl)c1ccccc1O ZINC000783519278 1046603874 /nfs/dbraw/zinc/60/38/74/1046603874.db2.gz RBVHPOPWDQXEHK-NOZJJQNGSA-N 1 0 324.207 4.483 20 10 DICDRO C[C@H]([NH2+]CC1(c2cccc(Cl)c2)CC1)c1ccccc1O ZINC000783514792 1046604127 /nfs/dbraw/zinc/60/41/27/1046604127.db2.gz UBBPGWZXYRBRMA-ZDUSSCGKSA-N 1 0 301.817 4.428 20 10 DICDRO CSCc1cc(F)ccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000783519980 1046604303 /nfs/dbraw/zinc/60/43/03/1046604303.db2.gz ODYUORHZRMQXQA-LBPRGKRZSA-N 1 0 305.418 4.245 20 10 DICDRO COc1ccccc1C[C@H]([NH2+][C@H](C)c1ccccc1O)C(C)C ZINC000783517403 1046604394 /nfs/dbraw/zinc/60/43/94/1046604394.db2.gz JHTXSAUXFCYZLZ-QAPCUYQASA-N 1 0 313.441 4.319 20 10 DICDRO C[C@H]([NH2+]CC1(c2ccccc2Cl)CC1)c1ccccc1O ZINC000783526089 1046605607 /nfs/dbraw/zinc/60/56/07/1046605607.db2.gz RQAZPMXRUHRZFX-ZDUSSCGKSA-N 1 0 301.817 4.428 20 10 DICDRO COc1ccccc1[C@H]1CC[N@H+](Cc2c(C)ccc(C)c2O)C1 ZINC001140178763 1046609058 /nfs/dbraw/zinc/60/90/58/1046609058.db2.gz WWSZQDJSJVXYJE-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)c2nc(C)cs2)cc1 ZINC000248488684 1046618063 /nfs/dbraw/zinc/61/80/63/1046618063.db2.gz GUGLUIUNYMPCGO-DZGCQCFKSA-N 1 0 317.502 4.362 20 10 DICDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(C)c(C)cc2O)s1 ZINC000093275119 1046620864 /nfs/dbraw/zinc/62/08/64/1046620864.db2.gz DTCUEMLKGIJABU-CYBMUJFWSA-N 1 0 304.459 4.275 20 10 DICDRO CC(C)COc1cccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000834531027 1046627030 /nfs/dbraw/zinc/62/70/30/1046627030.db2.gz NYSOKCSRVOCIHE-GOSISDBHSA-N 1 0 311.425 4.204 20 10 DICDRO CC(C)COc1ccccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834526935 1046627069 /nfs/dbraw/zinc/62/70/69/1046627069.db2.gz QUDUHTJCNJKNNH-QGZVFWFLSA-N 1 0 311.425 4.204 20 10 DICDRO COC1CCC([N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000093414852 1046628037 /nfs/dbraw/zinc/62/80/37/1046628037.db2.gz GIBLFSPYYZEVPX-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccsc1 ZINC000834549203 1046628262 /nfs/dbraw/zinc/62/82/62/1046628262.db2.gz YHJLKRMVJSBUKY-KRWDZBQOSA-N 1 0 300.471 4.371 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCCOc3ccc(F)cc31)CC2 ZINC000834540513 1046629094 /nfs/dbraw/zinc/62/90/94/1046629094.db2.gz BMZPOEDYFRSNLJ-JKSUJKDBSA-N 1 0 313.372 4.022 20 10 DICDRO C[C@@H](NC(C)(C)C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834584988 1046633457 /nfs/dbraw/zinc/63/34/57/1046633457.db2.gz BMSRWSQTPWTWLQ-QAPCUYQASA-N 1 0 324.468 4.099 20 10 DICDRO C[C@H](NC(C)(C)C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834584987 1046634012 /nfs/dbraw/zinc/63/40/12/1046634012.db2.gz BMSRWSQTPWTWLQ-MAUKXSAKSA-N 1 0 324.468 4.099 20 10 DICDRO C[C@@H](CCCc1cccnc1)[NH2+]CCCSc1nccs1 ZINC000834594020 1046635110 /nfs/dbraw/zinc/63/51/10/1046635110.db2.gz OHMUVQQBEUMWOG-AWEZNQCLSA-N 1 0 321.515 4.021 20 10 DICDRO CO[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccc(Cl)cc1 ZINC000834602008 1046635380 /nfs/dbraw/zinc/63/53/80/1046635380.db2.gz HHGNWOBGHUGVBI-DOTOQJQBSA-N 1 0 317.816 4.010 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CC3(CCC3)Oc3ccccc31)CC2 ZINC000834619071 1046639884 /nfs/dbraw/zinc/63/98/84/1046639884.db2.gz AWFQHPQEBHPMMZ-DLBZAZTESA-N 1 0 321.420 4.416 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cc(F)ccc1F ZINC000834669002 1046646349 /nfs/dbraw/zinc/64/63/49/1046646349.db2.gz QATFKVLQCAPUAR-HZPDHXFCSA-N 1 0 303.352 4.399 20 10 DICDRO CO[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1Cl ZINC000834681028 1046647958 /nfs/dbraw/zinc/64/79/58/1046647958.db2.gz SXQDJQLQNDGKJD-NVXWUHKLSA-N 1 0 317.816 4.010 20 10 DICDRO C[N@H+](Cc1cccc2cccnc21)Cc1c(O)cccc1Cl ZINC001140341316 1046666555 /nfs/dbraw/zinc/66/65/55/1046666555.db2.gz HOFDIDNBTLFZLS-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H](c1ccccc1)C(F)(F)F)CC2 ZINC000834774440 1046668460 /nfs/dbraw/zinc/66/84/60/1046668460.db2.gz PCFHFHMKAJKPDH-LSDHHAIUSA-N 1 0 321.342 4.315 20 10 DICDRO CC[N@H+](CCc1ccc(OC)cc1)Cc1c(O)cccc1Cl ZINC001140342072 1046668642 /nfs/dbraw/zinc/66/86/42/1046668642.db2.gz SLQCSYWCYKFMAA-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)cn1 ZINC001140341798 1046668470 /nfs/dbraw/zinc/66/84/70/1046668470.db2.gz HUGBBNZVIUCNCJ-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1c(O)cccc1Cl)CCC2 ZINC001140342806 1046668907 /nfs/dbraw/zinc/66/89/07/1046668907.db2.gz YZLNXTDXEPMOSF-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO Cc1cc(C(F)(F)F)ccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834779121 1046670213 /nfs/dbraw/zinc/67/02/13/1046670213.db2.gz IDZYQZOZASCMSA-HNNXBMFYSA-N 1 0 321.342 4.497 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCCc3c(F)cc(F)cc31)CC2 ZINC000834814177 1046673494 /nfs/dbraw/zinc/67/34/94/1046673494.db2.gz FZHSPAMZTJXKIK-IAGOWNOFSA-N 1 0 315.363 4.325 20 10 DICDRO C[C@H]([NH2+]CCCC(C)(F)F)c1ccc(Br)cc1O ZINC000834818447 1046675593 /nfs/dbraw/zinc/67/55/93/1046675593.db2.gz LTKIZFTURLIKKI-VIFPVBQESA-N 1 0 322.193 4.241 20 10 DICDRO C[C@@H]([NH2+]CCCC1CCOCC1)c1cc2c(cc1O)CCCC2 ZINC000834819127 1046676070 /nfs/dbraw/zinc/67/60/70/1046676070.db2.gz SKYLHSCXQBZUOW-OAHLLOKOSA-N 1 0 317.473 4.128 20 10 DICDRO C[C@@H]([NH2+]CCCC1CCOCC1)c1ccc2ccccc2c1O ZINC000834818415 1046676098 /nfs/dbraw/zinc/67/60/98/1046676098.db2.gz LHXKTDHSMPRQEU-OAHLLOKOSA-N 1 0 313.441 4.403 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCn2ccnc21)c1ccc(N2CCCCCC2)cc1 ZINC000834834667 1046679816 /nfs/dbraw/zinc/67/98/16/1046679816.db2.gz DWVJRXWMDGQWID-APWZRJJASA-N 1 0 324.472 4.059 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CC)COCC(F)(F)F)c1ccc(C)cc1O ZINC000834843796 1046684467 /nfs/dbraw/zinc/68/44/67/1046684467.db2.gz LZTTVGNVSRUWGU-GXTWGEPZSA-N 1 0 319.367 4.099 20 10 DICDRO Cc1cccnc1CCC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000834882471 1046695442 /nfs/dbraw/zinc/69/54/42/1046695442.db2.gz ATVPXYHTPBNOFF-AWEZNQCLSA-N 1 0 318.848 4.341 20 10 DICDRO C[C@@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1cc(Cl)ccc1O ZINC000834884562 1046696278 /nfs/dbraw/zinc/69/62/78/1046696278.db2.gz NNWRIUGOAMKMQE-PRHODGIISA-N 1 0 308.636 4.280 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c1O ZINC000834883215 1046696446 /nfs/dbraw/zinc/69/64/46/1046696446.db2.gz NONRVPYYKUPWLS-UONOGXRCSA-N 1 0 323.864 4.354 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c1O ZINC000834883212 1046696893 /nfs/dbraw/zinc/69/68/93/1046696893.db2.gz NONRVPYYKUPWLS-KGLIPLIRSA-N 1 0 323.864 4.354 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1cc(Cl)ccc1O ZINC000834884563 1046697072 /nfs/dbraw/zinc/69/70/72/1046697072.db2.gz NNWRIUGOAMKMQE-QPUJVOFHSA-N 1 0 308.636 4.280 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)[C@@H]1C[C@H]1c1cccs1 ZINC000841762333 1046697664 /nfs/dbraw/zinc/69/76/64/1046697664.db2.gz ITRZHTVFQWPNAO-FRRDWIJNSA-N 1 0 324.540 4.469 20 10 DICDRO CCOC1CC(CN(c2ccc(OC)cc2)[C@@H](C)C2CC2)C1 ZINC000795955734 1046701317 /nfs/dbraw/zinc/70/13/17/1046701317.db2.gz KDIIOQAHZKXKSP-XVTSOASTSA-N 1 0 303.446 4.115 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCO[C@@H](C(C)C)C2)c(O)c1C ZINC000834887117 1046701515 /nfs/dbraw/zinc/70/15/15/1046701515.db2.gz YHGSJLOVRBBNDK-XYJFISCASA-N 1 0 305.462 4.111 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1nccn1CC)c1cc(Cl)ccc1O ZINC000834894920 1046705212 /nfs/dbraw/zinc/70/52/12/1046705212.db2.gz MZEIYJPMINWMEX-SMDDNHRTSA-N 1 0 307.825 4.064 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc(N2CCCCC2)cc1 ZINC000834895714 1046705380 /nfs/dbraw/zinc/70/53/80/1046705380.db2.gz CVOGJVZYGSCACE-GJYPPUQNSA-N 1 0 324.472 4.230 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1O ZINC000834896015 1046706218 /nfs/dbraw/zinc/70/62/18/1046706218.db2.gz GYIXWOJSCMNNCE-NOZJJQNGSA-N 1 0 307.315 4.148 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCc3cc(F)c(F)c(F)c31)CC2 ZINC000834897194 1046707971 /nfs/dbraw/zinc/70/79/71/1046707971.db2.gz RHWQASFKBLWFAO-OLZOCXBDSA-N 1 0 319.326 4.074 20 10 DICDRO CCCc1ncc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000834898204 1046710106 /nfs/dbraw/zinc/71/01/06/1046710106.db2.gz ACVJQEVBOBHCDD-LLVKDONJSA-N 1 0 308.809 4.145 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCN(C)c3ccccc32)c(O)c1 ZINC000834902628 1046711221 /nfs/dbraw/zinc/71/12/21/1046711221.db2.gz HRNSVMWZPGTPOB-MAUKXSAKSA-N 1 0 310.441 4.323 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)cn1 ZINC000834902398 1046714053 /nfs/dbraw/zinc/71/40/53/1046714053.db2.gz HQGJECBDGFIAHQ-HNNXBMFYSA-N 1 0 310.441 4.134 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000834908819 1046715853 /nfs/dbraw/zinc/71/58/53/1046715853.db2.gz HMLCIVDTDTYWGY-DOMZBBRYSA-N 1 0 311.853 4.292 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccc2ccccc2c1O ZINC000834911120 1046717418 /nfs/dbraw/zinc/71/74/18/1046717418.db2.gz RSOHKPVWDJOOED-LSDHHAIUSA-N 1 0 313.441 4.401 20 10 DICDRO CC[C@H]([NH2+]CCC[NH+](C(C)C)C(C)C)c1ccc(F)cc1[O-] ZINC000796779440 1046733254 /nfs/dbraw/zinc/73/32/54/1046733254.db2.gz MJYRHRYFMUAXAG-KRWDZBQOSA-N 1 0 310.457 4.081 20 10 DICDRO Oc1cc(Cl)ccc1C[NH+]1CCC(c2ccccc2)CC1 ZINC001140463151 1046736163 /nfs/dbraw/zinc/73/61/63/1046736163.db2.gz VCPTVRARBKGJGI-UHFFFAOYSA-N 1 0 301.817 4.425 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001140466227 1046738867 /nfs/dbraw/zinc/73/88/67/1046738867.db2.gz BVUZLWSEIZTPLY-INIZCTEOSA-N 1 0 302.805 4.168 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001140466495 1046739752 /nfs/dbraw/zinc/73/97/52/1046739752.db2.gz HMNBQBONFSFZJJ-OAHLLOKOSA-N 1 0 301.817 4.110 20 10 DICDRO CC[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000835041479 1046747080 /nfs/dbraw/zinc/74/70/80/1046747080.db2.gz MEJHTSBCFIGCRV-LKGOPFMKSA-N 1 0 313.445 4.112 20 10 DICDRO CC(C)OC1CCC([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835040443 1046747446 /nfs/dbraw/zinc/74/74/46/1046747446.db2.gz COJOZYJWUUMVSF-WAYWQWQTSA-N 1 0 316.489 4.092 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cc1 ZINC000835048665 1046748585 /nfs/dbraw/zinc/74/85/85/1046748585.db2.gz KGDULVTZNXIHRU-BWPKMQGJSA-N 1 0 312.379 4.040 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH+]2CCC(c3cccnc3)CC2)cc1 ZINC000835053978 1046751915 /nfs/dbraw/zinc/75/19/15/1046751915.db2.gz QRBCSHVYNWFTOZ-PLNGDYQASA-N 1 0 321.468 4.040 20 10 DICDRO CCc1ccc([C@@H](O)C[NH2+][C@H](CC)c2ccc(C)cc2O)cc1 ZINC000797014676 1046771291 /nfs/dbraw/zinc/77/12/91/1046771291.db2.gz CCUSEDGHONXMGD-QUCCMNQESA-N 1 0 313.441 4.037 20 10 DICDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1 ZINC000797058472 1046782158 /nfs/dbraw/zinc/78/21/58/1046782158.db2.gz FMEPOAPFWDXSLS-SNUQEOBHSA-N 1 0 319.832 4.127 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1ccc(C)cc1)c1ccc(C)cc1O ZINC000797060365 1046783984 /nfs/dbraw/zinc/78/39/84/1046783984.db2.gz LYGKDSLSSYWHFS-QSFXBCCZSA-N 1 0 313.441 4.172 20 10 DICDRO C[C@H]([NH2+][C@H]1CSC[C@@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000797067189 1046784466 /nfs/dbraw/zinc/78/44/66/1046784466.db2.gz XRGNNQXPUXOMKN-BXWFABGCSA-N 1 0 318.530 4.469 20 10 DICDRO C[C@H]([NH2+][C@H]1CSC[C@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000797067192 1046784959 /nfs/dbraw/zinc/78/49/59/1046784959.db2.gz XRGNNQXPUXOMKN-GJYPPUQNSA-N 1 0 318.530 4.469 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CC2(C(F)(F)F)CC2)c2c1c(F)ccc2O ZINC000797072134 1046786354 /nfs/dbraw/zinc/78/63/54/1046786354.db2.gz WYXZMGIXFAETFH-SCZZXKLOSA-N 1 0 303.299 4.012 20 10 DICDRO CC[C@H]([NH2+]CC1(c2ccccn2)CCC1)c1ccc(N(C)C)cc1 ZINC000797097792 1046790398 /nfs/dbraw/zinc/79/03/98/1046790398.db2.gz CLCLCMOTGLMPDA-IBGZPJMESA-N 1 0 323.484 4.310 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(c3ccccn3)CCC2)cc1 ZINC000797102444 1046790829 /nfs/dbraw/zinc/79/08/29/1046790829.db2.gz ZTOUEJPRTXZBDV-QGZVFWFLSA-N 1 0 323.484 4.310 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001140623218 1046816129 /nfs/dbraw/zinc/81/61/29/1046816129.db2.gz LQKFKQJVMCUVLI-MRXNPFEDSA-N 1 0 303.352 4.316 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cccc(-c3ccncc3)c1)CC2 ZINC001137394088 1046918722 /nfs/dbraw/zinc/91/87/22/1046918722.db2.gz YSTLKIQGHDQMII-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCN2C2CCCCC2)c(O)c1 ZINC000798002296 1046919805 /nfs/dbraw/zinc/91/98/05/1046919805.db2.gz CTCSEUMOALKHKS-AEFFLSMTSA-N 1 0 316.489 4.148 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)c1O ZINC000798086230 1046926833 /nfs/dbraw/zinc/92/68/33/1046926833.db2.gz LZGHALNLBAEHCF-JCNLHEQBSA-N 1 0 301.817 4.390 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001140850839 1046929281 /nfs/dbraw/zinc/92/92/81/1046929281.db2.gz WLKWUDBHOAFATA-GOSISDBHSA-N 1 0 324.468 4.228 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2cccc(F)c2)c(Cl)c1 ZINC001140921862 1046951777 /nfs/dbraw/zinc/95/17/77/1046951777.db2.gz SYUNDACLIKSXQV-UHFFFAOYSA-N 1 0 306.812 4.177 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)CCc2cccs2)c(Cl)c1 ZINC001140923943 1046951837 /nfs/dbraw/zinc/95/18/37/1046951837.db2.gz LUMOOFXQSWBCSK-UHFFFAOYSA-N 1 0 308.878 4.142 20 10 DICDRO Cc1ccc(OC2CC[NH+](Cc3ccc(C)cc3O)CC2)cc1 ZINC001140949789 1046957400 /nfs/dbraw/zinc/95/74/00/1046957400.db2.gz KYPGHDQPQIRXHE-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c(O)c1 ZINC001140950744 1046960103 /nfs/dbraw/zinc/96/01/03/1046960103.db2.gz GJHRLGZKUMQRCI-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO COc1ccccc1C1CC[NH+](Cc2ccc(C)cc2O)CC1 ZINC001140950874 1046960297 /nfs/dbraw/zinc/96/02/97/1046960297.db2.gz MKDSRKUUQWFNNR-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO COc1cccc(C2CC[NH+](Cc3ccc(C)cc3O)CC2)c1 ZINC001140953618 1046960943 /nfs/dbraw/zinc/96/09/43/1046960943.db2.gz DVDKOYJCIMXZGJ-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO CCCc1ccc(C[NH2+][C@@H]2CCN(c3ccc(OC)cc3)C2)cc1 ZINC001203089494 1046990466 /nfs/dbraw/zinc/99/04/66/1046990466.db2.gz GQGJZNRYEJQIPK-LJQANCHMSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cccc(CNc2ccc(Cl)c(C[NH+](C)C)c2)c1O ZINC000798962805 1046992260 /nfs/dbraw/zinc/99/22/60/1046992260.db2.gz ZZDFNPMGWCIQLE-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC001141158594 1047030899 /nfs/dbraw/zinc/03/08/99/1047030899.db2.gz FZWQCWYALRAOLP-MRXNPFEDSA-N 1 0 303.789 4.088 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1cc(Cl)ccc1O ZINC000799728927 1047059506 /nfs/dbraw/zinc/05/95/06/1047059506.db2.gz NOPNZKJXCTZXFU-GFCCVEGCSA-N 1 0 314.816 4.420 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCC(OC)CC2)cc1)[C@@H](C)C(C)C ZINC000827510805 1047100512 /nfs/dbraw/zinc/10/05/12/1047100512.db2.gz HQOUOIBUKKZUNA-KRWDZBQOSA-N 1 0 318.505 4.168 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)C2CCC(F)CC2)c1O ZINC000827537412 1047114717 /nfs/dbraw/zinc/11/47/17/1047114717.db2.gz AROALDYKBNYLON-CDWSIMAYSA-N 1 0 315.816 4.061 20 10 DICDRO CN(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC001116489381 1047148115 /nfs/dbraw/zinc/14/81/15/1047148115.db2.gz YHTLFPAMJNQKFG-PMACEKPBSA-N 1 0 324.468 4.022 20 10 DICDRO COC1CCN(c2ccc(C[N@H+]3[C@H](C)CCC[C@@H]3C)cc2)CC1 ZINC000827778315 1047154091 /nfs/dbraw/zinc/15/40/91/1047154091.db2.gz UEGFTBPFQNKCRR-CALCHBBNSA-N 1 0 316.489 4.065 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCC[C@@H]1N(C)C)c1ccc2ccccc2c1O ZINC001116565392 1047156867 /nfs/dbraw/zinc/15/68/67/1047156867.db2.gz QUZYJHVAVZPLLM-JVPBZIDWSA-N 1 0 312.457 4.069 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc(Cl)nc1 ZINC001116565199 1047157194 /nfs/dbraw/zinc/15/71/94/1047157194.db2.gz KOUDCMXHWPRJSP-YPMHNXCESA-N 1 0 302.805 4.087 20 10 DICDRO COc1ccccc1C1([NH2+][C@@H](C)c2cc(F)ccc2O)CCC1 ZINC001116568435 1047158561 /nfs/dbraw/zinc/15/85/61/1047158561.db2.gz QHIABYJQMOBQJX-ZDUSSCGKSA-N 1 0 315.388 4.270 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)COc2ccccc2F)c(O)c1C ZINC001116584492 1047160103 /nfs/dbraw/zinc/16/01/03/1047160103.db2.gz GWWSMNVHZDGELG-DZGCQCFKSA-N 1 0 317.404 4.266 20 10 DICDRO COCCC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CCCC1 ZINC001116584365 1047160154 /nfs/dbraw/zinc/16/01/54/1047160154.db2.gz FDHPZJGQGDOQKU-CVEARBPZSA-N 1 0 317.473 4.435 20 10 DICDRO CCCNc1ccc(C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001116797407 1047177373 /nfs/dbraw/zinc/17/73/73/1047177373.db2.gz SAIGERGKLLPEFX-UHFFFAOYSA-N 1 0 323.484 4.399 20 10 DICDRO C[N@H+](CC1=CCSC1)Cc1cc(-c2ccccc2)ccc1O ZINC000827806523 1047178976 /nfs/dbraw/zinc/17/89/76/1047178976.db2.gz TULYIOFQZPZFNN-UHFFFAOYSA-N 1 0 311.450 4.164 20 10 DICDRO CCN(C)c1ccc(C[N@H+](C)Cc2cc3ccccc3[nH]2)cc1 ZINC001116820413 1047180383 /nfs/dbraw/zinc/18/03/83/1047180383.db2.gz CJQRLVLMQYTIJI-UHFFFAOYSA-N 1 0 307.441 4.256 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cnc3ccc(C)cc3c2)c1 ZINC000839540796 1047246264 /nfs/dbraw/zinc/24/62/64/1047246264.db2.gz WFWNIBPHJKOZRL-AWEZNQCLSA-N 1 0 322.408 4.108 20 10 DICDRO COc1cc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c(O)cc1C ZINC000840139535 1047287894 /nfs/dbraw/zinc/28/78/94/1047287894.db2.gz JNTUGKUSJDBWGV-GOSISDBHSA-N 1 0 313.397 4.029 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000840140703 1047289522 /nfs/dbraw/zinc/28/95/22/1047289522.db2.gz SJPZHPFBTLNJCD-IBGZPJMESA-N 1 0 320.392 4.261 20 10 DICDRO C[C@@H](CCOCc1ccccc1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000389927842 1047293832 /nfs/dbraw/zinc/29/38/32/1047293832.db2.gz FQZTYRSRLVFCEN-GJZGRUSLSA-N 1 0 317.404 4.177 20 10 DICDRO C[C@H]([NH2+]CCOCc1ccccc1)c1ccc2ccccc2c1O ZINC000390192900 1047294373 /nfs/dbraw/zinc/29/43/73/1047294373.db2.gz ODWQYEJFOVATLX-INIZCTEOSA-N 1 0 321.420 4.413 20 10 DICDRO C[C@@H]([NH2+]CCOCc1ccccc1)c1ccc2ccccc2c1O ZINC000390192901 1047295033 /nfs/dbraw/zinc/29/50/33/1047295033.db2.gz ODWQYEJFOVATLX-MRXNPFEDSA-N 1 0 321.420 4.413 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCN1Cc1ccccc1)c1ccccc1O ZINC000390569511 1047298323 /nfs/dbraw/zinc/29/83/23/1047298323.db2.gz RWAXVYHONHRBLQ-QUCCMNQESA-N 1 0 324.468 4.098 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@@H]3CCCc4ccccc43)ccc21 ZINC000390586979 1047299828 /nfs/dbraw/zinc/29/98/28/1047299828.db2.gz FQUYZGVFPXWFDY-HXUWFJFHSA-N 1 0 306.453 4.236 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)N1CCCCC1 ZINC000390933121 1047301832 /nfs/dbraw/zinc/30/18/32/1047301832.db2.gz MWKPSOHDDMJIEG-CVEARBPZSA-N 1 0 312.457 4.070 20 10 DICDRO C[C@@H]([NH2+]CC1(CO)CCCCC1)c1ccc2ccccc2c1O ZINC000391191205 1047303094 /nfs/dbraw/zinc/30/30/94/1047303094.db2.gz YSDRJLUVLIFZQB-OAHLLOKOSA-N 1 0 313.441 4.139 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](c2ccccc2)N2CCCC2)c1 ZINC000392231584 1047307399 /nfs/dbraw/zinc/30/73/99/1047307399.db2.gz XALCXZRZRHEDHF-YLJYHZDGSA-N 1 0 324.468 4.188 20 10 DICDRO CC(C)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000393396333 1047309719 /nfs/dbraw/zinc/30/97/19/1047309719.db2.gz USCDPBJFLKJGEZ-LJQANCHMSA-N 1 0 300.421 4.379 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)c1 ZINC000393378666 1047309763 /nfs/dbraw/zinc/30/97/63/1047309763.db2.gz BSDGPDMHVMYRMR-GOSISDBHSA-N 1 0 303.377 4.027 20 10 DICDRO CC[C@H](C)[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)OC ZINC000394444150 1047311488 /nfs/dbraw/zinc/31/14/88/1047311488.db2.gz LYGOOYVXRPBWEU-PMUMKWKESA-N 1 0 301.430 4.257 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1cccc2c1CCOC2 ZINC001118932725 1047318023 /nfs/dbraw/zinc/31/80/23/1047318023.db2.gz BZQVIKXJZPDRPY-KBXCAEBGSA-N 1 0 323.436 4.111 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c(O)c1 ZINC000725844268 1047319129 /nfs/dbraw/zinc/31/91/29/1047319129.db2.gz QAXCQOHQCMNKSM-HXUWFJFHSA-N 1 0 323.392 4.263 20 10 DICDRO CC(C)Oc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000725845710 1047319817 /nfs/dbraw/zinc/31/98/17/1047319817.db2.gz IDVZZNUCWIZAQY-UHFFFAOYSA-N 1 0 305.805 4.123 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c(O)c1 ZINC000398170952 1047328313 /nfs/dbraw/zinc/32/83/13/1047328313.db2.gz FPLGHHZHACOKDE-JENIJYKNSA-N 1 0 324.468 4.014 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)[C@@H]1CCCOC1 ZINC001119345605 1047329733 /nfs/dbraw/zinc/32/97/33/1047329733.db2.gz XLLCGDGXSGCOSH-XUWVNRHRSA-N 1 0 303.446 4.044 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](c2ccncc2)C2CC2)cc1 ZINC000898324905 1047337651 /nfs/dbraw/zinc/33/76/51/1047337651.db2.gz LXLRVROCAAAPPW-HXUWFJFHSA-N 1 0 309.457 4.169 20 10 DICDRO CC[C@@H]([NH2+]C1CCC(C(F)F)CC1)c1ccc(F)cc1[O-] ZINC000840806781 1047338055 /nfs/dbraw/zinc/33/80/55/1047338055.db2.gz LRVLOZPZFILBHQ-MMWSSPAHSA-N 1 0 301.352 4.396 20 10 DICDRO CCC[C@@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCOC1 ZINC000796489623 1047339963 /nfs/dbraw/zinc/33/99/63/1047339963.db2.gz BERGPXHJUVKOEZ-HXUWFJFHSA-N 1 0 311.425 4.108 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccnc(Cl)c1 ZINC000726231409 1047341834 /nfs/dbraw/zinc/34/18/34/1047341834.db2.gz PBGATCSBGMFZCV-UHFFFAOYSA-N 1 0 317.864 4.212 20 10 DICDRO COCC[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000840839465 1047343295 /nfs/dbraw/zinc/34/32/95/1047343295.db2.gz XBDYZXIYKVBSKB-CVEARBPZSA-N 1 0 322.468 4.139 20 10 DICDRO C[C@H]([NH2+]Cc1cnccc1C(C)(C)C)c1cc(F)ccc1O ZINC000840855078 1047345967 /nfs/dbraw/zinc/34/59/67/1047345967.db2.gz CLMFACHTLQWWSK-LBPRGKRZSA-N 1 0 302.393 4.075 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CC(C)(C)c2cccnc2)c2c1c(F)ccc2O ZINC000840890571 1047354213 /nfs/dbraw/zinc/35/42/13/1047354213.db2.gz ATPJWKYBAVPPJQ-WFASDCNBSA-N 1 0 314.404 4.042 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)c1cccnc1)c1cc(Cl)ccc1O ZINC000840891490 1047354747 /nfs/dbraw/zinc/35/47/47/1047354747.db2.gz HUNSMGGVNDCIOG-LBPRGKRZSA-N 1 0 304.821 4.069 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2cccnc2)c2c1c(F)ccc2O ZINC000840890565 1047355298 /nfs/dbraw/zinc/35/52/98/1047355298.db2.gz ATPJWKYBAVPPJQ-DOMZBBRYSA-N 1 0 314.404 4.042 20 10 DICDRO Cc1cncc([C@H](C)[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)c1 ZINC000840892715 1047356505 /nfs/dbraw/zinc/35/65/05/1047356505.db2.gz CBHAOPCGBAACOG-SJORKVTESA-N 1 0 311.473 4.046 20 10 DICDRO Cc1nc([C@H](C)[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)cs1 ZINC000840894402 1047356782 /nfs/dbraw/zinc/35/67/82/1047356782.db2.gz RBGQIQSUDZJYFA-KGLIPLIRSA-N 1 0 317.502 4.108 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)cc1F ZINC000840895260 1047357572 /nfs/dbraw/zinc/35/75/72/1047357572.db2.gz ZZOORAKXBPUSRT-UHFFFAOYSA-N 1 0 323.795 4.182 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)c(Cl)c1 ZINC000840906425 1047358349 /nfs/dbraw/zinc/35/83/49/1047358349.db2.gz HCHMNSQWKCECIE-MLGOLLRUSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2C)n1 ZINC000840914885 1047359142 /nfs/dbraw/zinc/35/91/42/1047359142.db2.gz HTWAKELXNJYZTI-FQEVSTJZSA-N 1 0 309.457 4.102 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1nc(C)cs1 ZINC000840934511 1047361764 /nfs/dbraw/zinc/36/17/64/1047361764.db2.gz RBROBOOQFVFXBZ-MRXNPFEDSA-N 1 0 303.475 4.067 20 10 DICDRO CCSc1cc(C[NH2+]Cc2c(O)cc(C)cc2Cl)ccn1 ZINC000840938858 1047361877 /nfs/dbraw/zinc/36/18/77/1047361877.db2.gz IDIWWZFHCJMRDJ-UHFFFAOYSA-N 1 0 322.861 4.151 20 10 DICDRO CSCc1ccc(C[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000796515098 1047366150 /nfs/dbraw/zinc/36/61/50/1047366150.db2.gz XYGPAJUNQSUYEB-UHFFFAOYSA-N 1 0 307.846 4.198 20 10 DICDRO CCOCc1cc(C[NH2+]C(C2CCC2)C2CCC2)ccc1OC ZINC000796516364 1047366559 /nfs/dbraw/zinc/36/65/59/1047366559.db2.gz ROLWTGGMEMEAHK-UHFFFAOYSA-N 1 0 317.473 4.290 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(CSC)cc2)cc1C ZINC000796514892 1047367388 /nfs/dbraw/zinc/36/73/88/1047367388.db2.gz UPUWYXIJAWKUOG-UHFFFAOYSA-N 1 0 301.455 4.156 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2(c3ccc(F)cc3)CCC2)c1 ZINC000726605255 1047369133 /nfs/dbraw/zinc/36/91/33/1047369133.db2.gz ARDMMTLUGVVYSX-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO CC[NH2+]Cc1ccccc1NCc1cc(Cl)cc(C)c1O ZINC000841042948 1047374385 /nfs/dbraw/zinc/37/43/85/1047374385.db2.gz MBRGXPSAJPBWGW-UHFFFAOYSA-N 1 0 304.821 4.076 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCC23CCCCC3)cc1F ZINC001203118412 1047393303 /nfs/dbraw/zinc/39/33/03/1047393303.db2.gz GQJYPUUWLHYIHJ-GOSISDBHSA-N 1 0 304.453 4.484 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C2CCC(C)(O)CC2)cc1 ZINC000749296709 1047409236 /nfs/dbraw/zinc/40/92/36/1047409236.db2.gz TUOJOZIQAZEGTE-UHFFFAOYSA-N 1 0 318.505 4.096 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000841753509 1047451587 /nfs/dbraw/zinc/45/15/87/1047451587.db2.gz UXTPLTHGSQTWKU-JTQLQIEISA-N 1 0 311.212 4.253 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841757254 1047453916 /nfs/dbraw/zinc/45/39/16/1047453916.db2.gz COYSTNILIZJRJQ-UWVGGRQHSA-N 1 0 310.850 4.476 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)c1O ZINC000841762072 1047454854 /nfs/dbraw/zinc/45/48/54/1047454854.db2.gz USQLQKMKIIPREZ-SJKOYZFVSA-N 1 0 317.816 4.276 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[N@H+](C)Cc2ccc(C)s2)c1O ZINC000750043264 1047455367 /nfs/dbraw/zinc/45/53/67/1047455367.db2.gz GUNORMDPPLASJZ-UHFFFAOYSA-N 1 0 323.845 4.250 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2(c3cccc(C)c3)CCC2)c1 ZINC000842748131 1047501904 /nfs/dbraw/zinc/50/19/04/1047501904.db2.gz XJFDLFVCJGUCML-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO CCOc1cccc(C[NH2+]C2(c3cccc(C)c3)CCC2)c1O ZINC000842745546 1047501955 /nfs/dbraw/zinc/50/19/55/1047501955.db2.gz KKZIIBWZQRXRHB-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO C[C@@H](C[NH2+][C@H](C)c1ccc(Br)cc1O)CC(F)F ZINC000842889818 1047512742 /nfs/dbraw/zinc/51/27/42/1047512742.db2.gz HISIZQMCVDWDIN-RKDXNWHRSA-N 1 0 322.193 4.097 20 10 DICDRO COc1ccccc1C1([NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000842900181 1047512821 /nfs/dbraw/zinc/51/28/21/1047512821.db2.gz FYGNQSAMYGYPPD-OAHLLOKOSA-N 1 0 310.441 4.101 20 10 DICDRO C[C@H]([NH2+][C@H]1CCS[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000842928416 1047513959 /nfs/dbraw/zinc/51/39/59/1047513959.db2.gz KDKFDSSCXJUTMF-DAYGRLMNSA-N 1 0 304.503 4.222 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCO)c1ccccc1F)c1ccc(C)cc1O ZINC000842924660 1047513936 /nfs/dbraw/zinc/51/39/36/1047513936.db2.gz RQMKCOWDSFEDAN-MSOLQXFVSA-N 1 0 317.404 4.004 20 10 DICDRO C[C@H]([NH2+][C@H]1CCS[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000842928418 1047514005 /nfs/dbraw/zinc/51/40/05/1047514005.db2.gz KDKFDSSCXJUTMF-MPGHIAIKSA-N 1 0 304.503 4.222 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CCC(C(F)(F)F)CC2)c1O ZINC001143104199 1047530700 /nfs/dbraw/zinc/53/07/00/1047530700.db2.gz QMABPZCILAHJOH-UHFFFAOYSA-N 1 0 315.379 4.464 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c1O ZINC001143110549 1047531800 /nfs/dbraw/zinc/53/18/00/1047531800.db2.gz IVEYQLNMBLPCGY-INIZCTEOSA-N 1 0 324.468 4.464 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@H](c3ccncc3)C2)c1O ZINC001143110963 1047532837 /nfs/dbraw/zinc/53/28/37/1047532837.db2.gz UEJXMUGQNQHXOZ-INIZCTEOSA-N 1 0 310.441 4.074 20 10 DICDRO COc1ccccc1C[N@H+](C)Cc1cccc(C(C)(C)C)c1O ZINC001143111079 1047532848 /nfs/dbraw/zinc/53/28/48/1047532848.db2.gz WSMMCUNATZZPLH-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO c1cncc([C@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)c1 ZINC000843419796 1047548509 /nfs/dbraw/zinc/54/85/09/1047548509.db2.gz UEVFVICYOSVGSD-FQEVSTJZSA-N 1 0 321.468 4.061 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)cc1F ZINC000192796137 1047633054 /nfs/dbraw/zinc/63/30/54/1047633054.db2.gz PFJZKRHSMPQJHP-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO COc1ccc(N2CCC[N@H+](CCCCC(C)C)CC2)cc1 ZINC001204382306 1047636700 /nfs/dbraw/zinc/63/67/00/1047636700.db2.gz TVVAMIBDDDAWKC-UHFFFAOYSA-N 1 0 304.478 4.034 20 10 DICDRO Cc1cc(C)[nH+]c(NCc2cc(Cl)c3cccnc3c2O)c1 ZINC001157723765 1047750651 /nfs/dbraw/zinc/75/06/51/1047750651.db2.gz BYAOGOFLZTUYKW-UHFFFAOYSA-N 1 0 313.788 4.218 20 10 DICDRO Oc1c(CNc2[nH+]ccc3[nH]ccc32)cc(Cl)c2cccnc12 ZINC001157723775 1047751045 /nfs/dbraw/zinc/75/10/45/1047751045.db2.gz CGARKUDIFXNPAF-UHFFFAOYSA-N 1 0 324.771 4.082 20 10 DICDRO c1cc(Nc2ccc(C[NH+]3CCCCC3)cc2)cc2c1NCC2 ZINC001159522924 1047859504 /nfs/dbraw/zinc/85/95/04/1047859504.db2.gz PZECXXQEKMDUGA-UHFFFAOYSA-N 1 0 307.441 4.384 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@]1(c2ccccc2)CC1(C)C ZINC001183065925 1047888795 /nfs/dbraw/zinc/88/87/95/1047888795.db2.gz RRVFJHNOSIZNLT-OAQYLSRUSA-N 1 0 308.469 4.476 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+]Cc1c(C)c2ccccc2n1C ZINC000479453683 1047898345 /nfs/dbraw/zinc/89/83/45/1047898345.db2.gz KJBCICNYRIXNJX-SFHVURJKSA-N 1 0 320.436 4.272 20 10 DICDRO CCc1cccc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c1O ZINC001183188502 1047902343 /nfs/dbraw/zinc/90/23/43/1047902343.db2.gz MGPYFFISFHAHHO-UHFFFAOYSA-N 1 0 317.379 4.402 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)COCC2CCCCC2)ccc1N(C)C ZINC001198001070 1047912263 /nfs/dbraw/zinc/91/22/63/1047912263.db2.gz MHSUJXJHZRLQJA-QGZVFWFLSA-N 1 0 318.505 4.136 20 10 DICDRO COc1cc(C)cc(C[NH2+]CCCc2ccc(C)cc2C)c1O ZINC001183312421 1047916668 /nfs/dbraw/zinc/91/66/68/1047916668.db2.gz JWNIXZFGHLRCSP-UHFFFAOYSA-N 1 0 313.441 4.048 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)cc1 ZINC001198271958 1047943003 /nfs/dbraw/zinc/94/30/03/1047943003.db2.gz YXQXMLWJOGCAOD-SDQNTSPESA-N 1 0 306.453 4.430 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(Cl)nc(Cl)c1)c1ccc(N(C)C)cc1 ZINC000775834242 1047943192 /nfs/dbraw/zinc/94/31/92/1047943192.db2.gz MLOPUHALXXACJS-LLVKDONJSA-N 1 0 324.255 4.305 20 10 DICDRO CCc1cc(C[NH+]2CCC(C)(OC)CC2)c(O)c(C(C)(C)C)c1 ZINC000774649803 1047944743 /nfs/dbraw/zinc/94/47/43/1047944743.db2.gz YROGCTKRGDABDS-UHFFFAOYSA-N 1 0 319.489 4.253 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c(O)cc1Br ZINC001250120780 1047953724 /nfs/dbraw/zinc/95/37/24/1047953724.db2.gz QAVOSARCQRETSU-STQMWFEESA-N 1 0 324.262 4.085 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c(O)cc1Br ZINC001250129109 1047962211 /nfs/dbraw/zinc/96/22/11/1047962211.db2.gz XWMAPTLQAMBEEN-DOMZBBRYSA-N 1 0 324.262 4.228 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2C[C@H]3C[C@@]3(c3ccccc3)C2)cc1Cl ZINC001183799030 1047966388 /nfs/dbraw/zinc/96/63/88/1047966388.db2.gz IYWKONCXTSYNEC-APWZRJJASA-N 1 0 313.828 4.128 20 10 DICDRO Cc1cc(C[N@@H+]2CCCC3(CCC3)C2)c(O)cc1Br ZINC001250133119 1047973317 /nfs/dbraw/zinc/97/33/17/1047973317.db2.gz IOEQLDWZWHJYEC-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO Nc1ccc(Nc2ccc3c(c2)CC[C@@H]([NH+]2CCCC2)CC3)cc1 ZINC001160358305 1048039354 /nfs/dbraw/zinc/03/93/54/1048039354.db2.gz HLIGHYCQJJMWBF-NRFANRHFSA-N 1 0 321.468 4.356 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC1(c2ccccc2)CC1 ZINC001199207803 1048043862 /nfs/dbraw/zinc/04/38/62/1048043862.db2.gz AUVIBYQUIYCIMP-UHFFFAOYSA-N 1 0 304.437 4.308 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](C)N2CCCC[C@H]2C)cc1C ZINC001199296687 1048053692 /nfs/dbraw/zinc/05/36/92/1048053692.db2.gz XOYFHVXGZWFOIC-QZTJIDSGSA-N 1 0 318.505 4.136 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](CC)c2ccccc2OC)c(O)c1 ZINC000775975205 1048068782 /nfs/dbraw/zinc/06/87/82/1048068782.db2.gz HQAHJUPQUPWACJ-KRWDZBQOSA-N 1 0 315.413 4.040 20 10 DICDRO COc1ccc2c(cc[nH+]c2NCc2c(C)cc(C)cc2O)c1 ZINC001160807755 1048085567 /nfs/dbraw/zinc/08/55/67/1048085567.db2.gz BSPIROCBQNZFMK-UHFFFAOYSA-N 1 0 308.381 4.178 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)cc1C ZINC000776012188 1048087901 /nfs/dbraw/zinc/08/79/01/1048087901.db2.gz FHUNQRSBQUMMNJ-GXTWGEPZSA-N 1 0 301.352 4.172 20 10 DICDRO CC[C@@H]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC001199830340 1048104827 /nfs/dbraw/zinc/10/48/27/1048104827.db2.gz JAOIRNWSBCJWKG-IAGOWNOFSA-N 1 0 300.490 4.375 20 10 DICDRO c1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001199972689 1048128120 /nfs/dbraw/zinc/12/81/20/1048128120.db2.gz YBPFEJFKDPNLPT-HXUWFJFHSA-N 1 0 322.452 4.290 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@H]1CCC=CO1)C1CCCCC1 ZINC000774821702 1048131853 /nfs/dbraw/zinc/13/18/53/1048131853.db2.gz QEADURXXJVHIMG-GOSISDBHSA-N 1 0 301.430 4.220 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCc3c2cccc3O)cc1 ZINC000105487212 1048138041 /nfs/dbraw/zinc/13/80/41/1048138041.db2.gz UUAIRWFSXSUWJI-IBGZPJMESA-N 1 0 310.441 4.016 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc3ccccc3n2)c1O ZINC000776087390 1048141149 /nfs/dbraw/zinc/14/11/49/1048141149.db2.gz UWKJQOBNKQOGSH-UHFFFAOYSA-N 1 0 312.800 4.192 20 10 DICDRO CC(C)(C)c1nc(C[NH2+]Cc2cccc(Cl)c2[O-])cs1 ZINC000776151612 1048231195 /nfs/dbraw/zinc/23/11/95/1048231195.db2.gz QYEDMBUGGNLMNM-UHFFFAOYSA-N 1 0 310.850 4.089 20 10 DICDRO Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2cccc(C)c2O)c1C ZINC000776173757 1048267092 /nfs/dbraw/zinc/26/70/92/1048267092.db2.gz JKKHFJYHMIBRDB-UHFFFAOYSA-N 1 0 308.425 4.397 20 10 DICDRO C[C@H](CC[NH2+]CCCSc1nccs1)c1ccccc1 ZINC000775025745 1048313465 /nfs/dbraw/zinc/31/34/65/1048313465.db2.gz WCWQSSQKRFRAKP-CQSZACIVSA-N 1 0 306.500 4.409 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC001201693717 1048359782 /nfs/dbraw/zinc/35/97/82/1048359782.db2.gz QBQZOZKFCFYECC-HNNXBMFYSA-N 1 0 307.441 4.295 20 10 DICDRO Oc1ccc(Cl)cc1C[NH+]1CCC(c2ccccc2)CC1 ZINC001203656125 1048387122 /nfs/dbraw/zinc/38/71/22/1048387122.db2.gz IVXBPEYIOQZCQN-UHFFFAOYSA-N 1 0 301.817 4.425 20 10 DICDRO Cc1cc(C[N@@H+]2CCSC[C@H]2C(C)(C)C)ccc1N(C)C ZINC001175698556 1048401144 /nfs/dbraw/zinc/40/11/44/1048401144.db2.gz QUMMYFHZACMQNF-KRWDZBQOSA-N 1 0 306.519 4.025 20 10 DICDRO C[C@H]([NH2+]CCOc1cccc2ccccc21)c1ccccc1O ZINC000775128398 1048403550 /nfs/dbraw/zinc/40/35/50/1048403550.db2.gz AUKKCFCSPMCZKC-HNNXBMFYSA-N 1 0 307.393 4.275 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000775139947 1048427799 /nfs/dbraw/zinc/42/77/99/1048427799.db2.gz GVNSWCHIMSPLLB-GDBMZVCRSA-N 1 0 314.395 4.483 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)CCCC(F)(F)F ZINC000775140964 1048434110 /nfs/dbraw/zinc/43/41/10/1048434110.db2.gz QXEKCVFIDFTWRD-CYBMUJFWSA-N 1 0 302.384 4.483 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)C1CCC2(CCOCC2)CC1 ZINC000775145808 1048444685 /nfs/dbraw/zinc/44/46/85/1048444685.db2.gz FRUSCUQTUNALAL-UHFFFAOYSA-N 1 0 316.489 4.101 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]Cc1ccc(Cl)cn1 ZINC000776254398 1048469319 /nfs/dbraw/zinc/46/93/19/1048469319.db2.gz DUAYQBUCGJUCDP-UHFFFAOYSA-N 1 0 324.811 4.397 20 10 DICDRO Cc1ccc(C[NH2+]Cc2cccc(C)c2O)c(OC(C)(C)C)c1 ZINC000776248648 1048472116 /nfs/dbraw/zinc/47/21/16/1048472116.db2.gz MFSMKWMPJWDMHK-UHFFFAOYSA-N 1 0 313.441 4.476 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c1 ZINC001203678921 1048483975 /nfs/dbraw/zinc/48/39/75/1048483975.db2.gz VLYYHLWLBCMKCF-CYBMUJFWSA-N 1 0 317.816 4.044 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@]2(C)CC2(Cl)Cl)cc1C ZINC001202458095 1048557229 /nfs/dbraw/zinc/55/72/29/1048557229.db2.gz ZXKZAMDAWAEJKV-OAHLLOKOSA-N 1 0 316.272 4.457 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](Cc2ccccc2)C(C)C)cc1 ZINC001176130065 1048578956 /nfs/dbraw/zinc/57/89/56/1048578956.db2.gz RESHTHXBPQZBGY-NRFANRHFSA-N 1 0 310.485 4.500 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Br)cc2)c(O)c1 ZINC000042352862 1048579876 /nfs/dbraw/zinc/57/98/76/1048579876.db2.gz ZIZNSZRLHIQYLK-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2cccnc2)c(C)n1-c1ccccc1 ZINC001137854399 1048580344 /nfs/dbraw/zinc/58/03/44/1048580344.db2.gz UWZHYWMANCVALX-UHFFFAOYSA-N 1 0 305.425 4.121 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2noc3ccccc23)cc1 ZINC000850343717 1048636960 /nfs/dbraw/zinc/63/69/60/1048636960.db2.gz ZDURFJNXXADCAE-UHFFFAOYSA-N 1 0 323.440 4.006 20 10 DICDRO C[C@]1(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1(F)F ZINC000850380278 1048644450 /nfs/dbraw/zinc/64/44/50/1048644450.db2.gz DCEKITDOQVOUFG-KRWDZBQOSA-N 1 0 308.416 4.202 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000850391039 1048646657 /nfs/dbraw/zinc/64/66/57/1048646657.db2.gz BKXUGQJESSZRLY-UHFFFAOYSA-N 1 0 301.764 4.103 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H]2CCCc3c(C)cccc32)c1O ZINC000850411768 1048649651 /nfs/dbraw/zinc/64/96/51/1048649651.db2.gz KDZVQXBVSUBWSB-GOSISDBHSA-N 1 0 311.425 4.267 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1cc2cnccc2o1 ZINC000850435499 1048656363 /nfs/dbraw/zinc/65/63/63/1048656363.db2.gz ARMIFZSERCLCSM-LLVKDONJSA-N 1 0 319.455 4.117 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1cc2cnccc2o1 ZINC000850435500 1048656739 /nfs/dbraw/zinc/65/67/39/1048656739.db2.gz ARMIFZSERCLCSM-NSHDSACASA-N 1 0 319.455 4.117 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCCO2)c1ccc(N(C)C)cc1 ZINC000850463603 1048665903 /nfs/dbraw/zinc/66/59/03/1048665903.db2.gz WLTDXHOMOKVXTR-HZPDHXFCSA-N 1 0 324.468 4.489 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)c1cccs1 ZINC000850488204 1048670632 /nfs/dbraw/zinc/67/06/32/1048670632.db2.gz LVNNYKCVGXGCGL-WMLDXEAASA-N 1 0 316.470 4.076 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)c1cccs1 ZINC000850488201 1048670870 /nfs/dbraw/zinc/67/08/70/1048670870.db2.gz LVNNYKCVGXGCGL-PBHICJAKSA-N 1 0 316.470 4.076 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2noc3ccccc23)cc1 ZINC000850483677 1048671258 /nfs/dbraw/zinc/67/12/58/1048671258.db2.gz QSGMPIIOWJRXQM-HNNXBMFYSA-N 1 0 323.440 4.177 20 10 DICDRO CC[C@H]([NH2+]CCc1ccnc2ccccc12)c1ccccc1O ZINC000850508660 1048674981 /nfs/dbraw/zinc/67/49/81/1048674981.db2.gz WIKWOKVDGWHYRF-SFHVURJKSA-N 1 0 306.409 4.224 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccccc1O ZINC000850521170 1048676783 /nfs/dbraw/zinc/67/67/83/1048676783.db2.gz ONYFUSYQYBKWJG-MRXNPFEDSA-N 1 0 315.388 4.313 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)COc2c(F)cccc2F)c1 ZINC000850522996 1048676831 /nfs/dbraw/zinc/67/68/31/1048676831.db2.gz VEPCNCWKIBGRJN-CHWSQXEVSA-N 1 0 321.367 4.097 20 10 DICDRO CC[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(C(F)(F)F)cc1O ZINC000850536623 1048684208 /nfs/dbraw/zinc/68/42/08/1048684208.db2.gz MBIROYQUQDXMNC-YPMHNXCESA-N 1 0 323.305 4.497 20 10 DICDRO COCc1csc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000850532681 1048684625 /nfs/dbraw/zinc/68/46/25/1048684625.db2.gz NJSNLKAYXAFMIW-ZDUSSCGKSA-N 1 0 305.443 4.068 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cc2c(cc1O)CCCC2 ZINC000850543386 1048686288 /nfs/dbraw/zinc/68/62/88/1048686288.db2.gz ILRJIWMIZSZCCC-XCLFUZPHSA-N 1 0 323.436 4.315 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cc(Cl)ccc1O ZINC000850543081 1048687174 /nfs/dbraw/zinc/68/71/74/1048687174.db2.gz XZPJESPLFRHQTD-SJORKVTESA-N 1 0 317.816 4.479 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl)C1CC1 ZINC000850540419 1048687242 /nfs/dbraw/zinc/68/72/42/1048687242.db2.gz MNYLMZIKCUXTBA-UGSOOPFHSA-N 1 0 322.880 4.016 20 10 DICDRO CCSC1(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000850551000 1048689271 /nfs/dbraw/zinc/68/92/71/1048689271.db2.gz FYYNTJJGAFHUKU-ZDUSSCGKSA-N 1 0 301.455 4.482 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC2SCCS2)c1O ZINC000850568879 1048695701 /nfs/dbraw/zinc/69/57/01/1048695701.db2.gz MGPRTXDSNOWVIF-SNVBAGLBSA-N 1 0 317.907 4.201 20 10 DICDRO CC[C@@H]([NH2+]CCC1SCCS1)c1cc(Cl)ccc1O ZINC000850569137 1048695950 /nfs/dbraw/zinc/69/59/50/1048695950.db2.gz VEIKZNKDNDVKLZ-GFCCVEGCSA-N 1 0 317.907 4.283 20 10 DICDRO CCCCCC[C@@H](C)[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000850567307 1048696905 /nfs/dbraw/zinc/69/69/05/1048696905.db2.gz ZDSAGMFMSZSBRO-QGZVFWFLSA-N 1 0 318.505 4.096 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c1C ZINC000850579187 1048699388 /nfs/dbraw/zinc/69/93/88/1048699388.db2.gz TVCIQLUJGORVPF-XHDPSFHLSA-N 1 0 315.388 4.186 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@@H](C)O)c1cc(Cl)ccc1O ZINC000850585524 1048700628 /nfs/dbraw/zinc/70/06/28/1048700628.db2.gz YXQMBXPQORTMNW-PZPSRYQVSA-N 1 0 319.832 4.208 20 10 DICDRO CC(C)c1ncc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000775361878 1048703761 /nfs/dbraw/zinc/70/37/61/1048703761.db2.gz GSKXWNASCGGVOX-CYBMUJFWSA-N 1 0 303.475 4.183 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CC(C)(C)O2)c1ccc(N(C)C)cc1 ZINC000775364437 1048704850 /nfs/dbraw/zinc/70/48/50/1048704850.db2.gz QOHHFIHWZVPJKT-OAHLLOKOSA-N 1 0 324.468 4.317 20 10 DICDRO COc1ccc([C@@H](C)C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000775365708 1048707736 /nfs/dbraw/zinc/70/77/36/1048707736.db2.gz WCZKNKGUOKRKRX-JKSUJKDBSA-N 1 0 312.457 4.216 20 10 DICDRO COc1ccc([C@H](C)C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000775365706 1048708793 /nfs/dbraw/zinc/70/87/93/1048708793.db2.gz WCZKNKGUOKRKRX-HZPDHXFCSA-N 1 0 312.457 4.216 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCc2ccc(Cl)cc2)c1 ZINC000775373742 1048716525 /nfs/dbraw/zinc/71/65/25/1048716525.db2.gz VSODKBAFXYJRNV-CYBMUJFWSA-N 1 0 319.832 4.338 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)[C@H](OC)c2ccccc2F)cc1C ZINC000776498929 1048727307 /nfs/dbraw/zinc/72/73/07/1048727307.db2.gz QZTMBUMOASYTEE-KUHUBIRLSA-N 1 0 317.404 4.009 20 10 DICDRO CO[C@@H]1CCC[C@H]1C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000775417516 1048793534 /nfs/dbraw/zinc/79/35/34/1048793534.db2.gz MTOYMPLZUGFXDF-IMFGXOCKSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@H](CSC)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000775424161 1048809678 /nfs/dbraw/zinc/80/96/78/1048809678.db2.gz UYJFCWYZKUCBRA-NVXWUHKLSA-N 1 0 306.519 4.469 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCCCc2ccccc2)cc1 ZINC001177153639 1048841052 /nfs/dbraw/zinc/84/10/52/1048841052.db2.gz VBFBGCYHTXEXGC-WQLSENKSSA-N 1 0 308.469 4.378 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCc2cc(Cl)ccc21 ZINC001203363414 1048882591 /nfs/dbraw/zinc/88/25/91/1048882591.db2.gz QDLSXILAKUUEEA-OAHLLOKOSA-N 1 0 308.208 4.476 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCO2)c1cc(F)ccc1O ZINC000853239488 1048889685 /nfs/dbraw/zinc/88/96/85/1048889685.db2.gz BWSMYYBWCAULHH-QWHCGFSZSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000853239784 1048890900 /nfs/dbraw/zinc/89/09/00/1048890900.db2.gz DMWYKIMHKGNOEB-HUUCEWRRSA-N 1 0 311.425 4.437 20 10 DICDRO CC[C@H]1C[C@@H](C[N@H+](C)Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000780755538 1048912668 /nfs/dbraw/zinc/91/26/68/1048912668.db2.gz WQRCIGGGLHOMQA-ICSRJNTNSA-N 1 0 318.505 4.170 20 10 DICDRO CC[C@H]1C[C@H](C[N@H+](C)Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000780755539 1048913555 /nfs/dbraw/zinc/91/35/55/1048913555.db2.gz WQRCIGGGLHOMQA-QUCCMNQESA-N 1 0 318.505 4.170 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCC(C)(C)O2)c1ccccc1O ZINC001203536186 1048924471 /nfs/dbraw/zinc/92/44/71/1048924471.db2.gz HYQZRFZAFPFFPI-CQSZACIVSA-N 1 0 311.425 4.347 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2O)c(OC(F)F)cc1C ZINC001203541555 1048924686 /nfs/dbraw/zinc/92/46/86/1048924686.db2.gz FEGFIKNFOOLFST-ZDUSSCGKSA-N 1 0 321.367 4.461 20 10 DICDRO CCOc1ccccc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001203541318 1048925053 /nfs/dbraw/zinc/92/50/53/1048925053.db2.gz TULCTFDIOYNHFF-UHFFFAOYSA-N 1 0 324.468 4.318 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(Oc2ccc(Cl)cc2)CC1 ZINC001203550220 1048927157 /nfs/dbraw/zinc/92/71/57/1048927157.db2.gz MXBYHKNPVCFJHO-UHFFFAOYSA-N 1 0 317.816 4.089 20 10 DICDRO CCOc1cccc(C[N@H+](C)C23CC4CC(CC(C4)C2)C3)c1O ZINC001203609295 1048939579 /nfs/dbraw/zinc/93/95/79/1048939579.db2.gz PAOWZTCGLIIKJO-UHFFFAOYSA-N 1 0 315.457 4.192 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCc3cccc(Cl)c3C2)c1O ZINC001203614933 1048941960 /nfs/dbraw/zinc/94/19/60/1048941960.db2.gz HMZSPTPCIFGXFV-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c(O)c1 ZINC001203628935 1048943077 /nfs/dbraw/zinc/94/30/77/1048943077.db2.gz LWKBYKXYLCWTFK-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1ccc(OC)cc1O ZINC001203634739 1048944710 /nfs/dbraw/zinc/94/47/10/1048944710.db2.gz SWYVEWGBBIRXPF-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000854225791 1048954000 /nfs/dbraw/zinc/95/40/00/1048954000.db2.gz KUUFOGNEQVUHEC-UXHICEINSA-N 1 0 309.457 4.063 20 10 DICDRO CC[C@H]([NH2+]CC1([NH3+])CCCC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000854223100 1048955090 /nfs/dbraw/zinc/95/50/90/1048955090.db2.gz NFSOXOFGYGLBNN-LBPRGKRZSA-N 1 0 317.260 4.011 20 10 DICDRO CC[C@](C)([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1 ZINC001177885804 1048957776 /nfs/dbraw/zinc/95/77/76/1048957776.db2.gz SYVVPKSRXKQXPS-IBGZPJMESA-N 1 0 318.411 4.446 20 10 DICDRO COc1ccc(O)c(C[N@H+](Cc2cccc(C)c2C)C2CC2)c1 ZINC001203680866 1048960861 /nfs/dbraw/zinc/96/08/61/1048960861.db2.gz HSIOVUJKMSNZMF-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001203681187 1048961789 /nfs/dbraw/zinc/96/17/89/1048961789.db2.gz PVCZFSYLXXFQOG-INIZCTEOSA-N 1 0 319.351 4.016 20 10 DICDRO C[C@@H]1COC[C@@H]1[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001203769986 1048994217 /nfs/dbraw/zinc/99/42/17/1048994217.db2.gz BFKARQNAAWIXHB-DYVFJYSZSA-N 1 0 319.489 4.112 20 10 DICDRO Cc1csc(C2([NH2+]Cc3cc(Cl)ccc3O)CCCC2)n1 ZINC000112711122 1048994975 /nfs/dbraw/zinc/99/49/75/1048994975.db2.gz ADRMYTOILYPHFP-UHFFFAOYSA-N 1 0 322.861 4.370 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](COC)c2ccccc2)cc1 ZINC001178207445 1048999438 /nfs/dbraw/zinc/99/94/38/1048999438.db2.gz CYIWOFIQKMCGAM-FQEVSTJZSA-N 1 0 312.457 4.010 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(Cl)ccc1O ZINC000775484515 1049002624 /nfs/dbraw/zinc/00/26/24/1049002624.db2.gz DCLOBYCNKUVWSU-QGZVFWFLSA-N 1 0 318.848 4.353 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C1(C)Cc2ccccc2C1 ZINC001178218709 1049004646 /nfs/dbraw/zinc/00/46/46/1049004646.db2.gz XJIGJEYWANZRIR-UHFFFAOYSA-N 1 0 304.437 4.134 20 10 DICDRO Cc1cc(C)c(O)c(C[NH+]2CCC(c3ccsc3)CC2)c1 ZINC000776782800 1049011457 /nfs/dbraw/zinc/01/14/57/1049011457.db2.gz ZPZHLJTWNSFDHZ-UHFFFAOYSA-N 1 0 301.455 4.450 20 10 DICDRO Oc1ccc(C[NH+]2CCC(c3ccccc3Cl)CC2)cc1O ZINC001203878544 1049021199 /nfs/dbraw/zinc/02/11/99/1049021199.db2.gz BOWCNEUKTSJZHI-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO C[N@H+](Cc1ccc(O)c(O)c1)Cc1ccc(Cl)c(Cl)c1 ZINC001203877105 1049021461 /nfs/dbraw/zinc/02/14/61/1049021461.db2.gz DEKDTCOZONZKAE-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO CC[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775496215 1049024460 /nfs/dbraw/zinc/02/44/60/1049024460.db2.gz HLKFXDWEQWZKPK-ZDUSSCGKSA-N 1 0 319.276 4.082 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(NCc2cc(Cl)cc(F)c2O)c1 ZINC001178386594 1049025570 /nfs/dbraw/zinc/02/55/70/1049025570.db2.gz GIPAPAHUEORCMI-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CCc1ccc(OC)cc1)c1ccccc1O ZINC000775497069 1049029425 /nfs/dbraw/zinc/02/94/25/1049029425.db2.gz MEFRCBBQAKUXLW-HNAYVOBHSA-N 1 0 313.441 4.463 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1F ZINC000113312985 1049031734 /nfs/dbraw/zinc/03/17/34/1049031734.db2.gz WSZJXBKVIIPAFA-LLVKDONJSA-N 1 0 308.347 4.021 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCOc2ccc(F)cc21)c1ccccc1O ZINC000775496684 1049031962 /nfs/dbraw/zinc/03/19/62/1049031962.db2.gz JBLIDGZAFVXSQP-IAGOWNOFSA-N 1 0 315.388 4.486 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775497854 1049032580 /nfs/dbraw/zinc/03/25/80/1049032580.db2.gz WSMQIGJHHRNTNM-ZWNOBZJWSA-N 1 0 319.276 4.080 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2cccc3cc[nH]c32)cc1 ZINC001178496741 1049038398 /nfs/dbraw/zinc/03/83/98/1049038398.db2.gz IXKWFKJCVHOVIA-PLNGDYQASA-N 1 0 305.425 4.037 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCC1Cc2ccccc2C1 ZINC001178492758 1049039299 /nfs/dbraw/zinc/03/92/99/1049039299.db2.gz OEIFJPMEABEGLA-UHFFFAOYSA-N 1 0 318.464 4.381 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cc(Cl)ccc1O ZINC000775501572 1049040439 /nfs/dbraw/zinc/04/04/39/1049040439.db2.gz IAOLOMQRLUADNZ-HZPDHXFCSA-N 1 0 317.816 4.479 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCOc2cccc(F)c2)c(Cl)c1 ZINC001203961295 1049045913 /nfs/dbraw/zinc/04/59/13/1049045913.db2.gz OOPWTQBAVKCQAJ-UHFFFAOYSA-N 1 0 323.795 4.052 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)Oc1ccc(F)cc1)c1ccccc1O ZINC000775509316 1049048816 /nfs/dbraw/zinc/04/88/16/1049048816.db2.gz PCSPMAWZZVKZPI-DYVFJYSZSA-N 1 0 303.377 4.040 20 10 DICDRO C[C@@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC001178523999 1049049576 /nfs/dbraw/zinc/04/95/76/1049049576.db2.gz DSKCALFYFBCVCS-ZRUQZJFASA-N 1 0 316.395 4.395 20 10 DICDRO COc1ccc2ccccc2c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001203991580 1049053983 /nfs/dbraw/zinc/05/39/83/1049053983.db2.gz PVNIQOQMHHPUQK-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO CC[C@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1cc(Cl)ccc1O ZINC000775511101 1049054287 /nfs/dbraw/zinc/05/42/87/1049054287.db2.gz BEJOUNSZZWLXKD-GJZGRUSLSA-N 1 0 323.820 4.375 20 10 DICDRO CC[C@@H]([NH2+][C@H](COC)c1ccc(C)o1)c1cc(Cl)ccc1O ZINC000775511102 1049055335 /nfs/dbraw/zinc/05/53/35/1049055335.db2.gz BEJOUNSZZWLXKD-HUUCEWRRSA-N 1 0 323.820 4.375 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCO[C@@H]2CC(C)C)cc1 ZINC001178542841 1049056065 /nfs/dbraw/zinc/05/60/65/1049056065.db2.gz STRJLHOLTITCEQ-VQTJNVASSA-N 1 0 318.505 4.216 20 10 DICDRO CCN(C)c1ccc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)cc1 ZINC000773755354 1049056240 /nfs/dbraw/zinc/05/62/40/1049056240.db2.gz HTTXMPGOMBUIMD-CQSZACIVSA-N 1 0 317.502 4.409 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1SCCc2ccccc21)c1ccccc1O ZINC000775512986 1049058093 /nfs/dbraw/zinc/05/80/93/1049058093.db2.gz VHBNPQXKZFYPQK-PKOBYXMFSA-N 1 0 313.466 4.464 20 10 DICDRO Fc1ccc([C@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001178623901 1049067280 /nfs/dbraw/zinc/06/72/80/1049067280.db2.gz BSSCWTDXTYPTKF-LPHOPBHVSA-N 1 0 311.400 4.187 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccnc(SC)c1)c1cc(Cl)ccc1O ZINC000775520136 1049074945 /nfs/dbraw/zinc/07/49/45/1049074945.db2.gz QALLXEXFQGEQRC-CQSZACIVSA-N 1 0 322.861 4.403 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CC[C@@H](C)SC2)c(C)n1-c1ccccc1 ZINC001203357248 1049075655 /nfs/dbraw/zinc/07/56/55/1049075655.db2.gz INOQBWIZUQLKMR-CRAIPNDOSA-N 1 0 314.498 4.468 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)C)C1)c1cc(Cl)ccc1O ZINC000775518556 1049075868 /nfs/dbraw/zinc/07/58/68/1049075868.db2.gz CVEDSCZKSVZYOR-UKPHBRMFSA-N 1 0 311.853 4.290 20 10 DICDRO CC[C@H]([NH2+]CCc1cnc(C)s1)c1cc(Cl)ccc1O ZINC000775522711 1049082390 /nfs/dbraw/zinc/08/23/90/1049082390.db2.gz YMPSNHJUQVNLHK-AWEZNQCLSA-N 1 0 310.850 4.094 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCO[C@@H](C(C)C)C1 ZINC001178758881 1049082393 /nfs/dbraw/zinc/08/23/93/1049082393.db2.gz LZLZECLRAWEGRI-OXQOHEQNSA-N 1 0 314.473 4.028 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)c1cccc(OC)c1)c1ccccc1O ZINC000775525086 1049088662 /nfs/dbraw/zinc/08/86/62/1049088662.db2.gz XSGQFWCNGMENRT-GOSISDBHSA-N 1 0 313.441 4.419 20 10 DICDRO CC[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccccc1O ZINC000775525143 1049088713 /nfs/dbraw/zinc/08/87/13/1049088713.db2.gz DNOKXPAITUNQIC-GJZGRUSLSA-N 1 0 303.789 4.220 20 10 DICDRO CC[C@H]([NH2+][C@@H](COC)c1ccccc1)c1cc(Cl)ccc1O ZINC000775524968 1049088913 /nfs/dbraw/zinc/08/89/13/1049088913.db2.gz VGTTVLZKZWQXBB-IRXDYDNUSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)Cc1ccc(OC)cc1)c1ccccc1O ZINC000775524722 1049089146 /nfs/dbraw/zinc/08/91/46/1049089146.db2.gz HHUIBYOCOXNGOL-HNAYVOBHSA-N 1 0 313.441 4.320 20 10 DICDRO CC[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccccc1O ZINC000775525142 1049089407 /nfs/dbraw/zinc/08/94/07/1049089407.db2.gz DNOKXPAITUNQIC-CABCVRRESA-N 1 0 303.789 4.220 20 10 DICDRO C[C@@H]([NH2+]CCOC(C)(C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000776891685 1049095725 /nfs/dbraw/zinc/09/57/25/1049095725.db2.gz XGETZGWMOQIBPR-OAHLLOKOSA-N 1 0 322.468 4.282 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC[C@@H]1CCc2ccccc21 ZINC001178831263 1049096182 /nfs/dbraw/zinc/09/61/82/1049096182.db2.gz MVJICSPFRQIJHZ-AWEZNQCLSA-N 1 0 301.817 4.255 20 10 DICDRO CC[N@H+](Cc1ccc(SC)cc1)Cc1ccc(N(C)C)cc1 ZINC001204146798 1049098716 /nfs/dbraw/zinc/09/87/16/1049098716.db2.gz ROPGSMWKHFPUCL-UHFFFAOYSA-N 1 0 314.498 4.497 20 10 DICDRO CCCC[N@H+](Cc1cncc(Cl)c1)Cc1ccccc1O ZINC000856742031 1049102705 /nfs/dbraw/zinc/10/27/05/1049102705.db2.gz VUCFPHFDOALWIT-UHFFFAOYSA-N 1 0 304.821 4.243 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CC[C@@H]1CC1(F)F ZINC000856802418 1049106601 /nfs/dbraw/zinc/10/66/01/1049106601.db2.gz OVTBXTQVSPFDSJ-MRXNPFEDSA-N 1 0 303.352 4.194 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@](C)(CC)c2nc(C)cs2)cc1 ZINC000773787363 1049115502 /nfs/dbraw/zinc/11/55/02/1049115502.db2.gz OMPBEMJWLONTMP-GOSISDBHSA-N 1 0 317.502 4.323 20 10 DICDRO CC[N@H+](Cc1ccncc1)Cc1ccc(N(C)C)c2ccccc12 ZINC001204233203 1049116011 /nfs/dbraw/zinc/11/60/11/1049116011.db2.gz OUZGBLNMZBCROQ-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cc(F)cc(F)c1 ZINC001204234626 1049116159 /nfs/dbraw/zinc/11/61/59/1049116159.db2.gz TVCBZRWLLDFYFA-UHFFFAOYSA-N 1 0 316.395 4.197 20 10 DICDRO CC[C@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(C(F)(F)F)cc1O ZINC000857059438 1049124336 /nfs/dbraw/zinc/12/43/36/1049124336.db2.gz PQSXPFZQLXSJHO-JQWIXIFHSA-N 1 0 323.305 4.497 20 10 DICDRO Oc1c(C[NH2+]CC[C@@H]2CC2(Cl)Cl)ccc2ccccc21 ZINC000857062346 1049124942 /nfs/dbraw/zinc/12/49/42/1049124942.db2.gz KABRERBMKGXQAP-CYBMUJFWSA-N 1 0 310.224 4.219 20 10 DICDRO CCN(C)c1ccc(C[N@H+](CCc2nccs2)C(C)C)cc1 ZINC000773788864 1049125331 /nfs/dbraw/zinc/12/53/31/1049125331.db2.gz GRPRZKYOGSNRSD-UHFFFAOYSA-N 1 0 317.502 4.052 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000857080058 1049125721 /nfs/dbraw/zinc/12/57/21/1049125721.db2.gz CKXXGFDIPPFSOS-BMIGLBTASA-N 1 0 319.351 4.017 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)c(O)c1 ZINC000857082905 1049127672 /nfs/dbraw/zinc/12/76/72/1049127672.db2.gz RSLVTIJIJTXKMX-VXGBXAGGSA-N 1 0 302.245 4.244 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@]1(C)C[C@@]1(F)Cl ZINC001179095003 1049130079 /nfs/dbraw/zinc/13/00/79/1049130079.db2.gz GEUWUOCIZNDPJW-SJORKVTESA-N 1 0 308.828 4.281 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cc(COC)cs2)cc1C ZINC001179168820 1049138798 /nfs/dbraw/zinc/13/87/98/1049138798.db2.gz KELZUMSQAGGVSD-UHFFFAOYSA-N 1 0 319.470 4.282 20 10 DICDRO CC[C@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccccc1O ZINC000775548399 1049139490 /nfs/dbraw/zinc/13/94/90/1049139490.db2.gz YPXVCPBKLYHIAP-KRWDZBQOSA-N 1 0 302.393 4.156 20 10 DICDRO COCC[N@H+](Cc1ccc(Cl)cc1O)[C@@H](C)c1ccccc1 ZINC001204315250 1049140404 /nfs/dbraw/zinc/14/04/04/1049140404.db2.gz TZKMVJMCAOMZRL-AWEZNQCLSA-N 1 0 319.832 4.255 20 10 DICDRO c1ccc([C@H]2CCC[N@H+]2Cc2ccc(N3CCCC3)cc2)nc1 ZINC001204325776 1049141871 /nfs/dbraw/zinc/14/18/71/1049141871.db2.gz AJTOYQQLCXLGTL-HXUWFJFHSA-N 1 0 307.441 4.019 20 10 DICDRO Fc1ccccc1[C@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204327515 1049142156 /nfs/dbraw/zinc/14/21/56/1049142156.db2.gz WUHFLTIYQVBSBL-SFHVURJKSA-N 1 0 324.443 4.415 20 10 DICDRO FC1CC2(C1)CC[NH+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001204323166 1049142556 /nfs/dbraw/zinc/14/25/56/1049142556.db2.gz FMCSJMINCCCYSR-UHFFFAOYSA-N 1 0 302.437 4.001 20 10 DICDRO c1cc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCCC3)cc2)ccn1 ZINC001204326031 1049142817 /nfs/dbraw/zinc/14/28/17/1049142817.db2.gz DCXYNXMPKHTLEU-FQEVSTJZSA-N 1 0 307.441 4.019 20 10 DICDRO FC1(F)CC2(C1)CC[NH+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001204326498 1049142966 /nfs/dbraw/zinc/14/29/66/1049142966.db2.gz YLNVRFQKCMAYAN-UHFFFAOYSA-N 1 0 320.427 4.298 20 10 DICDRO CC[C@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000775550823 1049143222 /nfs/dbraw/zinc/14/32/22/1049143222.db2.gz CGJKTJWGKSVHKH-IOASZLSFSA-N 1 0 311.853 4.292 20 10 DICDRO CC[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000775554588 1049147398 /nfs/dbraw/zinc/14/73/98/1049147398.db2.gz BVDUYCNEGSGPAV-GOEBONIOSA-N 1 0 311.853 4.436 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)C1CCC(F)CC1 ZINC001179259647 1049149600 /nfs/dbraw/zinc/14/96/00/1049149600.db2.gz WOITUMLCGIJPGN-QQFBHYJXSA-N 1 0 302.437 4.493 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1csc(C(F)(F)F)c1 ZINC001179298777 1049151070 /nfs/dbraw/zinc/15/10/70/1049151070.db2.gz DQMDGHINDVARGM-UHFFFAOYSA-N 1 0 321.751 4.416 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1nnc(C)s1)c1cc(Cl)ccc1O ZINC000775555923 1049153637 /nfs/dbraw/zinc/15/36/37/1049153637.db2.gz SMZKKBMNNSXUJL-UFBFGSQYSA-N 1 0 311.838 4.007 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2[C@H](C)O[C@H](C)[C@H]2C)cc1 ZINC001179348150 1049154845 /nfs/dbraw/zinc/15/48/45/1049154845.db2.gz POVHKSBEOPFTPO-WWNBULGVSA-N 1 0 318.505 4.215 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)cc1 ZINC000773815123 1049170200 /nfs/dbraw/zinc/17/02/00/1049170200.db2.gz ZCOSJHUHSBEQSP-CTNGQTDRSA-N 1 0 324.468 4.010 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2c(F)cccc2OC)cc1 ZINC000773813803 1049171092 /nfs/dbraw/zinc/17/10/92/1049171092.db2.gz WEVBOFZEOIKUMK-CQSZACIVSA-N 1 0 316.420 4.141 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2ccc(OC)c(F)c2)cc1 ZINC000773816312 1049175401 /nfs/dbraw/zinc/17/54/01/1049175401.db2.gz FVKWRCMKEHGWCA-CQSZACIVSA-N 1 0 316.420 4.141 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c(C)n1 ZINC000775563475 1049177127 /nfs/dbraw/zinc/17/71/27/1049177127.db2.gz SBUHTLLOOYIGRI-UHFFFAOYSA-N 1 0 323.484 4.321 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(C)nc2C)cc1 ZINC000775563493 1049177493 /nfs/dbraw/zinc/17/74/93/1049177493.db2.gz SQQVCNSXRASTAU-UHFFFAOYSA-N 1 0 311.473 4.177 20 10 DICDRO CCC1(CC)C[N@H+](Cc2ccc(N(C)C)c(C)c2)CCS1 ZINC001193131835 1049182605 /nfs/dbraw/zinc/18/26/05/1049182605.db2.gz WVHIVJNEMBKGGV-UHFFFAOYSA-N 1 0 306.519 4.169 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC001204543438 1049187260 /nfs/dbraw/zinc/18/72/60/1049187260.db2.gz QMISVHIBLJUJIX-UWJYYQICSA-N 1 0 308.469 4.439 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC001204543433 1049188035 /nfs/dbraw/zinc/18/80/35/1049188035.db2.gz QMISVHIBLJUJIX-LAUBAEHRSA-N 1 0 308.469 4.439 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c1 ZINC001204543704 1049188312 /nfs/dbraw/zinc/18/83/12/1049188312.db2.gz UUBABVKMYDZHCJ-WMZOPIPTSA-N 1 0 305.487 4.376 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)cc1 ZINC000776953535 1049189895 /nfs/dbraw/zinc/18/98/95/1049189895.db2.gz NYNAUCXFQLUDQS-ICSRJNTNSA-N 1 0 318.505 4.216 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@H]2Cc2ccccc2)cc1 ZINC001204580110 1049191485 /nfs/dbraw/zinc/19/14/85/1049191485.db2.gz LBAVSBDWWXQKGT-JLXBBBJOSA-N 1 0 306.453 4.083 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C2(c3ccc(OC)cc3)CC2)cc1 ZINC000776959847 1049195477 /nfs/dbraw/zinc/19/54/77/1049195477.db2.gz DFDZXTYQKOONOX-MRXNPFEDSA-N 1 0 324.468 4.491 20 10 DICDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(C)cc2O)C12CCCCC2 ZINC001204616374 1049201872 /nfs/dbraw/zinc/20/18/72/1049201872.db2.gz VJTKKKCXZZPTJB-RTBURBONSA-N 1 0 317.473 4.260 20 10 DICDRO COc1ccc(C[NH+]2CCC(CCC(C)C)CC2)c(O)c1OC ZINC001204640523 1049208593 /nfs/dbraw/zinc/20/85/93/1049208593.db2.gz NEOCUTCTVUYLHO-UHFFFAOYSA-N 1 0 321.461 4.058 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2cncc(Cl)c2Cl)cc1 ZINC001179844854 1049212993 /nfs/dbraw/zinc/21/29/93/1049212993.db2.gz DVMWHCDOPDKWRT-UHFFFAOYSA-N 1 0 324.255 4.086 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@H](c2cccs2)C2CC2)cc1F ZINC000858089979 1049216284 /nfs/dbraw/zinc/21/62/84/1049216284.db2.gz GXUXUNUENPNXAQ-KRWDZBQOSA-N 1 0 322.424 4.333 20 10 DICDRO Cc1oc2ccccc2c1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001179845433 1049216479 /nfs/dbraw/zinc/21/64/79/1049216479.db2.gz TXZXFRJGABMIEB-UHFFFAOYSA-N 1 0 308.425 4.439 20 10 DICDRO CCOc1c(Cl)cccc1C[NH2+]Cc1cc(C)ccc1O ZINC000858239882 1049229175 /nfs/dbraw/zinc/22/91/75/1049229175.db2.gz VRRVFRHRHSPTSZ-UHFFFAOYSA-N 1 0 305.805 4.043 20 10 DICDRO COCc1ccccc1/C=C(\C)C[NH2+]Cc1cc(C)ccc1O ZINC000858239440 1049229128 /nfs/dbraw/zinc/22/91/28/1049229128.db2.gz NRFSGDGXCYNAIS-LFIBNONCSA-N 1 0 311.425 4.040 20 10 DICDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2cccc(CC)c2O)C1(CC)CC ZINC001179953709 1049234267 /nfs/dbraw/zinc/23/42/67/1049234267.db2.gz YURSICGNNKKGEG-MSOLQXFVSA-N 1 0 319.489 4.370 20 10 DICDRO COc1ccc(N2CCC([NH2+]CC[C@H]3CC=CCC3)CC2)cc1 ZINC000858272874 1049234850 /nfs/dbraw/zinc/23/48/50/1049234850.db2.gz WITPQZBHJPOBAT-KRWDZBQOSA-N 1 0 314.473 4.000 20 10 DICDRO Cc1cc(C[NH2+]Cc2cncn2C(C)C)c(C)n1-c1ccccc1 ZINC000858295314 1049236971 /nfs/dbraw/zinc/23/69/71/1049236971.db2.gz YNRJRCJFXSOQNR-UHFFFAOYSA-N 1 0 322.456 4.161 20 10 DICDRO CCc1nocc1C[NH2+]Cc1cc(C)n(-c2cccc(C)c2)c1C ZINC000858294409 1049237469 /nfs/dbraw/zinc/23/74/69/1049237469.db2.gz YMBOZQVQCFCDGZ-UHFFFAOYSA-N 1 0 323.440 4.243 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(F)nc2C)c(C)n1-c1ccccc1 ZINC000858295132 1049237743 /nfs/dbraw/zinc/23/77/43/1049237743.db2.gz WCJPOJCCOQBGNB-UHFFFAOYSA-N 1 0 323.415 4.226 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)c1O ZINC000858338233 1049242603 /nfs/dbraw/zinc/24/26/03/1049242603.db2.gz TZRXJGUZULTDKE-MRXNPFEDSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1ccc(C[N@H+]2CCN(c3ccc(C)c(C)c3)C[C@@H]2C)c(O)c1 ZINC001204731004 1049244238 /nfs/dbraw/zinc/24/42/38/1049244238.db2.gz ZVQVYZJZQYOOIF-SFHVURJKSA-N 1 0 324.468 4.028 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(N(C)C)cc1 ZINC000858484271 1049262409 /nfs/dbraw/zinc/26/24/09/1049262409.db2.gz NBMLVOLIVVPABQ-FOIQADDNSA-N 1 0 309.457 4.340 20 10 DICDRO CC[C@@H](C)[C@@H](C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C)OC ZINC001180077743 1049274704 /nfs/dbraw/zinc/27/47/04/1049274704.db2.gz UDBHHEUYRHGIAP-VQIMIIECSA-N 1 0 306.494 4.024 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-])c1ccns1 ZINC000858576376 1049277907 /nfs/dbraw/zinc/27/79/07/1049277907.db2.gz JWAMSPLRPSUDQW-IUCAKERBSA-N 1 0 316.348 4.279 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]C1(c3c(F)cccc3F)CCC1)CC2 ZINC000858603674 1049284848 /nfs/dbraw/zinc/28/48/48/1049284848.db2.gz FQXSCQMOWDUEET-HNNXBMFYSA-N 1 0 315.363 4.327 20 10 DICDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2cccc(F)c2[O-])C12CCCCC2 ZINC001180098285 1049285091 /nfs/dbraw/zinc/28/50/91/1049285091.db2.gz KTSOAAWYYLPWDU-IRXDYDNUSA-N 1 0 321.436 4.091 20 10 DICDRO CC(C)CC[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001180166232 1049306079 /nfs/dbraw/zinc/30/60/79/1049306079.db2.gz LYOIQRKUHGPNTK-UHFFFAOYSA-N 1 0 302.384 4.249 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1c(O)cc(C)cc1Cl ZINC001180194510 1049313361 /nfs/dbraw/zinc/31/33/61/1049313361.db2.gz GAAQTFPSTQRLIP-UHFFFAOYSA-N 1 0 319.832 4.472 20 10 DICDRO C[C@@H]([NH2+]Cc1cccnc1C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000859258554 1049327134 /nfs/dbraw/zinc/32/71/34/1049327134.db2.gz PPNGFFWIDKABGO-GFCCVEGCSA-N 1 0 323.362 4.017 20 10 DICDRO CCCO[C@H]1CCC[N@H+](Cc2cc(C(C)C)ccc2O)CC1 ZINC001180288136 1049336687 /nfs/dbraw/zinc/33/66/87/1049336687.db2.gz BXQLAFNRBYJVBJ-SFHVURJKSA-N 1 0 305.462 4.297 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1c2ccccc2CC[C@H]1C ZINC001180326741 1049343509 /nfs/dbraw/zinc/34/35/09/1049343509.db2.gz PWZHKGDQKQZMDZ-VFNWGFHPSA-N 1 0 308.469 4.474 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001180540260 1049379078 /nfs/dbraw/zinc/37/90/78/1049379078.db2.gz KAGLAGJWOSCUHF-DKRLNXSXSA-N 1 0 324.468 4.467 20 10 DICDRO CN(C)c1ccc(C[N@H+](CC2Cc3ccccc3C2)C2CC2)cc1 ZINC001180557729 1049380373 /nfs/dbraw/zinc/38/03/73/1049380373.db2.gz GEBLIJAYBMNFAV-UHFFFAOYSA-N 1 0 320.480 4.132 20 10 DICDRO Cc1cc(C[N@H+](Cc2ccccc2O)C2CCCCC2)sn1 ZINC001205143420 1049391743 /nfs/dbraw/zinc/39/17/43/1049391743.db2.gz KSURTASKPHGSPJ-UHFFFAOYSA-N 1 0 316.470 4.492 20 10 DICDRO CSc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(O)cc1O ZINC001204279970 1049406897 /nfs/dbraw/zinc/40/68/97/1049406897.db2.gz GTSMGJRGUBFAJF-MRXNPFEDSA-N 1 0 315.438 4.157 20 10 DICDRO CSc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(O)cc1O ZINC001204279969 1049407204 /nfs/dbraw/zinc/40/72/04/1049407204.db2.gz GTSMGJRGUBFAJF-INIZCTEOSA-N 1 0 315.438 4.157 20 10 DICDRO CCCCC[N@H+](CCCOC)Cc1c(O)cc(C)cc1Cl ZINC001180802371 1049408200 /nfs/dbraw/zinc/40/82/00/1049408200.db2.gz ODWZRMJOXODXIB-UHFFFAOYSA-N 1 0 313.869 4.383 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)cc1Cl ZINC001205292022 1049428693 /nfs/dbraw/zinc/42/86/93/1049428693.db2.gz VKZCSZAZYUCAGU-PXAZEXFGSA-N 1 0 316.832 4.332 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2CCC[C@@H](C(C)C)CC2)c1O ZINC001181072396 1049441412 /nfs/dbraw/zinc/44/14/12/1049441412.db2.gz HGEGMPGQMJXHSQ-WBVHZDCISA-N 1 0 305.462 4.404 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CCc2ccc3[nH]ccc3c2)c1 ZINC001181155013 1049448543 /nfs/dbraw/zinc/44/85/43/1049448543.db2.gz XYZBEMPQOQZARF-UHFFFAOYSA-N 1 0 308.425 4.329 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)C1CC1 ZINC001181223069 1049455523 /nfs/dbraw/zinc/45/55/23/1049455523.db2.gz MSZPSBOXWUAMNB-ZIAGYGMSSA-N 1 0 306.881 4.464 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2CCC[C@@H](C(C)(C)C)CC2)c1 ZINC001205427748 1049467468 /nfs/dbraw/zinc/46/74/68/1049467468.db2.gz WEXUNMMHEDZKKO-HZPDHXFCSA-N 1 0 305.462 4.485 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1cc2ccccc2[nH]1 ZINC000775634300 1049470702 /nfs/dbraw/zinc/47/07/02/1049470702.db2.gz NEFHTEHTOVRQED-HNNXBMFYSA-N 1 0 307.441 4.393 20 10 DICDRO CCCN(C[C@H](C)c1cc(F)cc(F)c1)c1ccc(C[NH3+])cc1 ZINC001181444909 1049476607 /nfs/dbraw/zinc/47/66/07/1049476607.db2.gz ICJJJOUJLRJSGH-AWEZNQCLSA-N 1 0 318.411 4.444 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)Cc1ccccc1F ZINC001181445750 1049477366 /nfs/dbraw/zinc/47/73/66/1049477366.db2.gz RJXHFYMAJCGWPG-HNNXBMFYSA-N 1 0 300.421 4.132 20 10 DICDRO Cc1c(F)nccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000862221793 1049478440 /nfs/dbraw/zinc/47/84/40/1049478440.db2.gz GGAKJLQLXYLMQJ-UHFFFAOYSA-N 1 0 315.436 4.006 20 10 DICDRO CCCC[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C1CCC1 ZINC001181534232 1049488133 /nfs/dbraw/zinc/48/81/33/1049488133.db2.gz HOLYHFMSCDMFSF-QGZVFWFLSA-N 1 0 310.432 4.479 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1ccnc(F)c1C ZINC000862355453 1049488558 /nfs/dbraw/zinc/48/85/58/1049488558.db2.gz IZAIRPRGHDIGRZ-UHFFFAOYSA-N 1 0 302.393 4.037 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)cc1 ZINC001205526550 1049491114 /nfs/dbraw/zinc/49/11/14/1049491114.db2.gz ACXGGOXQKZMYDU-BXKJMJEDSA-N 1 0 324.443 4.337 20 10 DICDRO CO[C@H](C)[C@@H](C)[NH2+]Cc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 ZINC001205531082 1049492804 /nfs/dbraw/zinc/49/28/04/1049492804.db2.gz WKNSYQHJPNEWAL-RRFJBIMHSA-N 1 0 324.896 4.089 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)Cc2ccc3ccccc3c2)c1 ZINC000775646414 1049499656 /nfs/dbraw/zinc/49/96/56/1049499656.db2.gz JQDOLTLEQDRFKW-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO COc1ccc(O)c(C[N@H+](C(C)C)[C@H](C)c2ccsc2)c1 ZINC000817416142 1049509664 /nfs/dbraw/zinc/50/96/64/1049509664.db2.gz LJAJFAQUKYRJQF-CYBMUJFWSA-N 1 0 305.443 4.434 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2cccc(Br)c2)c1O ZINC000775649122 1049516165 /nfs/dbraw/zinc/51/61/65/1049516165.db2.gz LKIRDBYEVKVTPU-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1ccc(OC2CC[NH+](Cc3cccc(C)c3O)CC2)cc1 ZINC000775653640 1049522258 /nfs/dbraw/zinc/52/22/58/1049522258.db2.gz KZHLYCYZWDSFQM-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC000775652525 1049525870 /nfs/dbraw/zinc/52/58/70/1049525870.db2.gz MMPBUBYRVHXXJW-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1ccc(C(=O)C2CC[NH+](Cc3cccc(C)c3O)CC2)cc1 ZINC000775659120 1049534410 /nfs/dbraw/zinc/53/44/10/1049534410.db2.gz XOCKUDSZARXZLR-UHFFFAOYSA-N 1 0 323.436 4.104 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CCO[C@@H]3CCC[C@@H]31)oc1ccccc12 ZINC000863305856 1049554559 /nfs/dbraw/zinc/55/45/59/1049554559.db2.gz CNIWLQZFNPSGSN-QFBILLFUSA-N 1 0 323.392 4.045 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(F)c2cccnc12 ZINC000152006867 1049562312 /nfs/dbraw/zinc/56/23/12/1049562312.db2.gz CKROMYXQANLCCS-UHFFFAOYSA-N 1 0 323.415 4.038 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@H]2CC3CCC2CC3)c1O ZINC001205943387 1049608129 /nfs/dbraw/zinc/60/81/29/1049608129.db2.gz QBMYZPUWVAFQSY-QOZQQMKHSA-N 1 0 324.262 4.131 20 10 DICDRO CC(F)(F)c1ccc(C[NH2+]Cc2ccc(Cl)cc2O)cc1 ZINC001206014693 1049629205 /nfs/dbraw/zinc/62/92/05/1049629205.db2.gz FVNNRLNNHKWGCF-UHFFFAOYSA-N 1 0 311.759 4.447 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCCC[C@H]2c2ccco2)c1 ZINC000775698259 1049630413 /nfs/dbraw/zinc/63/04/13/1049630413.db2.gz NIZCUANUAOSQJI-INIZCTEOSA-N 1 0 301.386 4.111 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)[C@H]1C ZINC001206016899 1049630446 /nfs/dbraw/zinc/63/04/46/1049630446.db2.gz SKNPLKBACQVPPE-IRXDYDNUSA-N 1 0 306.453 4.090 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@]12C[C@H]1CCCC2 ZINC000864052923 1049638630 /nfs/dbraw/zinc/63/86/30/1049638630.db2.gz DETHPOAVGGGRCK-WRSAYESZSA-N 1 0 308.416 4.089 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)c1 ZINC000775706992 1049639196 /nfs/dbraw/zinc/63/91/96/1049639196.db2.gz SXVJNYXHFMIRQH-UGSOOPFHSA-N 1 0 315.388 4.123 20 10 DICDRO CCc1cccc(C[N@H+](C)Cc2ccc(OC)c(Cl)c2)c1O ZINC001182423422 1049642367 /nfs/dbraw/zinc/64/23/67/1049642367.db2.gz DQBXKKJYYOFIQD-UHFFFAOYSA-N 1 0 319.832 4.249 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC001182423715 1049642700 /nfs/dbraw/zinc/64/27/00/1049642700.db2.gz IGSRLQWFWBAYGC-BEVDRBHNSA-N 1 0 300.490 4.160 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC(C)(C)C[C@H]1C ZINC001182423746 1049642976 /nfs/dbraw/zinc/64/29/76/1049642976.db2.gz INPVTMMSLWFRGR-JTDSTZFVSA-N 1 0 302.506 4.406 20 10 DICDRO COc1cc(O)c(C[N@H+](C)[C@@H]2CCC[C@H]2C(C)(C)C)cc1OC ZINC001182444038 1049654074 /nfs/dbraw/zinc/65/40/74/1049654074.db2.gz MZBFVCCYKDEFOV-HUUCEWRRSA-N 1 0 321.461 4.056 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)C2CC(OC(C)(C)C)C2)c(Cl)c1 ZINC001182445134 1049655190 /nfs/dbraw/zinc/65/51/90/1049655190.db2.gz WPGHYSRMMAHURK-UHFFFAOYSA-N 1 0 311.853 4.132 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)c1 ZINC000775724907 1049668595 /nfs/dbraw/zinc/66/85/95/1049668595.db2.gz LHTFBSSHQMCRRD-BFUOFWGJSA-N 1 0 315.388 4.123 20 10 DICDRO CC[C@H]([NH2+]C[C@H](O)c1ccc(C)cc1)c1cc(Cl)ccc1O ZINC000774485622 1049675300 /nfs/dbraw/zinc/67/53/00/1049675300.db2.gz QDOVNCPJKLMTOS-WMZOPIPTSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc(C)cc1)c1cc(Cl)ccc1O ZINC000774492235 1049675612 /nfs/dbraw/zinc/67/56/12/1049675612.db2.gz QDOVNCPJKLMTOS-SJLPKXTDSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCN(Cc2ccccc2)C1)c1ccc(C)cc1O ZINC000794795498 1049694051 /nfs/dbraw/zinc/69/40/51/1049694051.db2.gz PWQMGNVPBNYNCA-AZUAARDMSA-N 1 0 324.468 4.016 20 10 DICDRO CCc1ccc([C@H](COC)[NH2+][C@@H](CC)c2ccc(C)cc2O)o1 ZINC000794802430 1049696782 /nfs/dbraw/zinc/69/67/82/1049696782.db2.gz ODMMYMWUDRXMHT-IRXDYDNUSA-N 1 0 317.429 4.284 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1)c1ccc(C)cc1O ZINC000794791888 1049698241 /nfs/dbraw/zinc/69/82/41/1049698241.db2.gz JXXHYLMQJANMJO-FUHWJXTLSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)c1c(C)nn(C)c1C ZINC000794802096 1049698925 /nfs/dbraw/zinc/69/89/25/1049698925.db2.gz MQQIFHJOJZLVND-IRXDYDNUSA-N 1 0 315.461 4.243 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccc(C)cc1O ZINC000794801609 1049699123 /nfs/dbraw/zinc/69/91/23/1049699123.db2.gz JTYGZDMXBAVHPN-LJQANCHMSA-N 1 0 312.457 4.316 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1C1CC1 ZINC001206319981 1049712524 /nfs/dbraw/zinc/71/25/24/1049712524.db2.gz GHCZVOOWEWNTQH-IPZZXCBHSA-N 1 0 300.490 4.016 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@H]2Cc2cc(F)ccc2F)c(O)c1 ZINC001206335304 1049715289 /nfs/dbraw/zinc/71/52/89/1049715289.db2.gz GCSLKFLTZDEJSU-KRWDZBQOSA-N 1 0 317.379 4.186 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)cc1 ZINC001197070114 1049719182 /nfs/dbraw/zinc/71/91/82/1049719182.db2.gz RYMCCMHYOTUCDX-HXUWFJFHSA-N 1 0 316.489 4.066 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)CC2 ZINC001206517557 1049750603 /nfs/dbraw/zinc/75/06/03/1049750603.db2.gz WIUMFICCSIIGFZ-KRWDZBQOSA-N 1 0 301.817 4.440 20 10 DICDRO Cc1cc[nH+]c(NCc2cc(Cl)c(F)cc2O)c1C1CC1 ZINC001206590770 1049763742 /nfs/dbraw/zinc/76/37/42/1049763742.db2.gz MBRDSRSZQXLMRY-UHFFFAOYSA-N 1 0 306.768 4.378 20 10 DICDRO CC[C@H](C[C@@H](C)CC)[NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206646217 1049775003 /nfs/dbraw/zinc/77/50/03/1049775003.db2.gz PYIGGKISXGSYFT-GVDBMIGSSA-N 1 0 304.478 4.078 20 10 DICDRO COC1CCC([NH2+]Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001207103158 1049834507 /nfs/dbraw/zinc/83/45/07/1049834507.db2.gz WAPQWUSRFAFIGT-UHFFFAOYSA-N 1 0 312.457 4.141 20 10 DICDRO CCC[C@H](C[NH2+]Cc1cc(C)n(-c2cccc(C)c2)c1C)OC ZINC001207092805 1049836039 /nfs/dbraw/zinc/83/60/39/1049836039.db2.gz HZPIHUJYHLWGHO-HXUWFJFHSA-N 1 0 314.473 4.307 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cccc(C(F)F)c2)cc1 ZINC001207132621 1049843234 /nfs/dbraw/zinc/84/32/34/1049843234.db2.gz ZIKPVDHFYDOQOG-UHFFFAOYSA-N 1 0 304.384 4.322 20 10 DICDRO C[N@@H+](Cc1ccccc1O)C[C@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001207194617 1049860783 /nfs/dbraw/zinc/86/07/83/1049860783.db2.gz YCOSPJPMFVJXDE-WBVHZDCISA-N 1 0 301.817 4.281 20 10 DICDRO CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)c1cccnc1 ZINC000164140627 1049921556 /nfs/dbraw/zinc/92/15/56/1049921556.db2.gz QHZWCJAAJAERPX-OXQOHEQNSA-N 1 0 311.473 4.238 20 10 DICDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000760663669 1049922986 /nfs/dbraw/zinc/92/29/86/1049922986.db2.gz ZMIYQRRXRNATIC-CQSZACIVSA-N 1 0 302.384 4.353 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)Cc2cc3ccccc3o2)c1O ZINC000164444495 1049945857 /nfs/dbraw/zinc/94/58/57/1049945857.db2.gz YKAMAZJNNGWJSI-UHFFFAOYSA-N 1 0 311.381 4.087 20 10 DICDRO Cc1cc(C)c(O)c(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c1 ZINC000164497172 1049947133 /nfs/dbraw/zinc/94/71/33/1049947133.db2.gz VIGDKOIIMRCCRR-PBHICJAKSA-N 1 0 317.454 4.033 20 10 DICDRO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCc2cccc(O)c2C1 ZINC001208218879 1049987223 /nfs/dbraw/zinc/98/72/23/1049987223.db2.gz ONGVMXNLVPFHDS-INIZCTEOSA-N 1 0 319.489 4.372 20 10 DICDRO C[N@H+](CCCc1ccc(C(F)(F)F)cc1)Cc1ccccc1O ZINC001208692032 1050002285 /nfs/dbraw/zinc/00/22/85/1050002285.db2.gz JXSJGNSKNKNFAR-UHFFFAOYSA-N 1 0 323.358 4.476 20 10 DICDRO CCOc1cccc(C[NH2+]C2(Cc3ccccc3)CCC2)c1O ZINC000760718950 1050016097 /nfs/dbraw/zinc/01/60/97/1050016097.db2.gz UHYPJTXNWDPQJA-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO Cc1cnc(CC[N@@H+](C)Cc2cc(C(C)C)c(C)cc2O)s1 ZINC000165203628 1050025685 /nfs/dbraw/zinc/02/56/85/1050025685.db2.gz SZGZUWOPKMBFGE-UHFFFAOYSA-N 1 0 318.486 4.263 20 10 DICDRO CC[N@H+](CCc1ccc(C(F)(F)F)cc1)Cc1ccccc1O ZINC001209125373 1050038755 /nfs/dbraw/zinc/03/87/55/1050038755.db2.gz BIBUKHGPCAAEKW-UHFFFAOYSA-N 1 0 323.358 4.476 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc2cc[nH]c2c1 ZINC001209512142 1050064581 /nfs/dbraw/zinc/06/45/81/1050064581.db2.gz AFKBTHMXCRILHE-UHFFFAOYSA-N 1 0 319.452 4.400 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2cc[nH]c2c1 ZINC001209516290 1050064906 /nfs/dbraw/zinc/06/49/06/1050064906.db2.gz XMRAJCOQENVTLB-UHFFFAOYSA-N 1 0 307.441 4.256 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@]3(C2)CCCCO3)cc1 ZINC001209516662 1050065210 /nfs/dbraw/zinc/06/52/10/1050065210.db2.gz LFVOGHPHPDWVJU-OAQYLSRUSA-N 1 0 324.468 4.239 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@]3(C2)CCCOC3)cc1 ZINC001209520050 1050065764 /nfs/dbraw/zinc/06/57/64/1050065764.db2.gz MCHDQHRPPTYBAI-NRFANRHFSA-N 1 0 324.468 4.097 20 10 DICDRO CO[C@@H]1CC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)[C@H](C)C1 ZINC001209519701 1050066267 /nfs/dbraw/zinc/06/62/67/1050066267.db2.gz FRULZFSNGDXZMP-YLJYHZDGSA-N 1 0 312.457 4.093 20 10 DICDRO C[NH+]1CCC(c2ccc(Nc3ccc4c(c3)OCCN4)cc2)CC1 ZINC001209727447 1050078984 /nfs/dbraw/zinc/07/89/84/1050078984.db2.gz IEEWXNOHJOLKCB-UHFFFAOYSA-N 1 0 323.440 4.044 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000770510024 1050163338 /nfs/dbraw/zinc/16/33/38/1050163338.db2.gz VQBHGAHCWWIQHD-PXNSSMCTSA-N 1 0 324.468 4.050 20 10 DICDRO CC(C)[C@@H](CCO)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766194205 1050186184 /nfs/dbraw/zinc/18/61/84/1050186184.db2.gz UANWQMBBRSWQLP-YLJYHZDGSA-N 1 0 318.505 4.125 20 10 DICDRO CO[C@@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000770744662 1050191604 /nfs/dbraw/zinc/19/16/04/1050191604.db2.gz BDISGDHAEHBPCB-APPDUMDISA-N 1 0 323.795 4.051 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000770744669 1050192486 /nfs/dbraw/zinc/19/24/86/1050192486.db2.gz BDISGDHAEHBPCB-DIFFPNOSSA-N 1 0 323.795 4.051 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2CCCc3c(F)cccc32)c(O)c1 ZINC000824468178 1050216132 /nfs/dbraw/zinc/21/61/32/1050216132.db2.gz FIHNLVZIAUCJHN-SFHVURJKSA-N 1 0 315.388 4.097 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3c(F)cccc32)c1 ZINC000824468187 1050216169 /nfs/dbraw/zinc/21/61/69/1050216169.db2.gz FKMDWHSKLNUAIM-XIKOKIGWSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1Cl ZINC000824566285 1050223290 /nfs/dbraw/zinc/22/32/90/1050223290.db2.gz HUSXNWSMIBVCLT-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1O ZINC000824548497 1050225605 /nfs/dbraw/zinc/22/56/05/1050225605.db2.gz IHVOXVSZHRLZOB-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000166942754 1050225772 /nfs/dbraw/zinc/22/57/72/1050225772.db2.gz UAWYLXGHPKZDLY-CQSZACIVSA-N 1 0 315.461 4.106 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CCCC[C@H]2CC(F)(F)F)c1O ZINC000824654781 1050231272 /nfs/dbraw/zinc/23/12/72/1050231272.db2.gz QNEAXCGPRKOAMP-JSGCOSHPSA-N 1 0 301.352 4.301 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CC(C)(C)O)c1ccc(C(F)(F)F)cc1O ZINC000824702540 1050234413 /nfs/dbraw/zinc/23/44/13/1050234413.db2.gz NEIQYFXXQFRFEI-ZWNOBZJWSA-N 1 0 319.367 4.001 20 10 DICDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000760903246 1050237124 /nfs/dbraw/zinc/23/71/24/1050237124.db2.gz PPMMTROSVLEPRI-IQJOONFLSA-N 1 0 305.315 4.400 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(C)nc2C)cc1 ZINC000771385994 1050248436 /nfs/dbraw/zinc/24/84/36/1050248436.db2.gz VVETVYDPRLLFBI-INIZCTEOSA-N 1 0 311.473 4.395 20 10 DICDRO CCn1ccnc1[C@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000825006050 1050262884 /nfs/dbraw/zinc/26/28/84/1050262884.db2.gz XJJFKCYLLAXDMS-HNNXBMFYSA-N 1 0 321.424 4.126 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1 ZINC000825104052 1050270249 /nfs/dbraw/zinc/27/02/49/1050270249.db2.gz LLNGHIRABPYSCW-GOSISDBHSA-N 1 0 313.397 4.111 20 10 DICDRO CCOc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c(O)c1 ZINC000825104348 1050271082 /nfs/dbraw/zinc/27/10/82/1050271082.db2.gz USAGDRNPSYJYTC-SFHVURJKSA-N 1 0 313.397 4.111 20 10 DICDRO CCOCc1ccccc1C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825089698 1050276880 /nfs/dbraw/zinc/27/68/80/1050276880.db2.gz IFGWZLKINHTIMC-UHFFFAOYSA-N 1 0 319.832 4.180 20 10 DICDRO Oc1ccccc1C[NH+]1CC(c2cccc(C(F)(F)F)c2)C1 ZINC000825124700 1050279492 /nfs/dbraw/zinc/27/94/92/1050279492.db2.gz WOSPXWRVRRKUGY-UHFFFAOYSA-N 1 0 307.315 4.010 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000825214914 1050285485 /nfs/dbraw/zinc/28/54/85/1050285485.db2.gz ASHUHUQMCRWZKF-LJQANCHMSA-N 1 0 313.466 4.265 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1nc(C)cs1 ZINC000825253279 1050287618 /nfs/dbraw/zinc/28/76/18/1050287618.db2.gz GJYHVFOJMUDUOE-ZDUSSCGKSA-N 1 0 310.850 4.360 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(c3nccs3)CCCC2)cc1Cl ZINC000825283374 1050290518 /nfs/dbraw/zinc/29/05/18/1050290518.db2.gz KVRWDDMBEQVGBD-UHFFFAOYSA-N 1 0 322.861 4.370 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)nc1C ZINC000840784930 1050296635 /nfs/dbraw/zinc/29/66/35/1050296635.db2.gz WANRWBWKGIFZAY-CYBMUJFWSA-N 1 0 304.821 4.217 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825353922 1050298178 /nfs/dbraw/zinc/29/81/78/1050298178.db2.gz PURBCKABRGTTRT-INIZCTEOSA-N 1 0 317.816 4.140 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2cccc(F)c2F)cc1Cl ZINC000825375192 1050301689 /nfs/dbraw/zinc/30/16/89/1050301689.db2.gz JJKDAFUBOWYKRY-SNVBAGLBSA-N 1 0 311.759 4.483 20 10 DICDRO Cc1ccc(C(F)(F)F)c(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001143680596 1050335104 /nfs/dbraw/zinc/33/51/04/1050335104.db2.gz FGDWYTFQVNSKSM-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc3C2)cc1 ZINC001171103471 1050352428 /nfs/dbraw/zinc/35/24/28/1050352428.db2.gz CBWMUCVNWJDCLX-GOSISDBHSA-N 1 0 314.860 4.053 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1O ZINC000844256926 1050392680 /nfs/dbraw/zinc/39/26/80/1050392680.db2.gz OGSHNDUMXXXNCI-QGZVFWFLSA-N 1 0 315.388 4.185 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](C)CC1)c1ccc(N2CCOCC2)cc1 ZINC000785571342 1050394636 /nfs/dbraw/zinc/39/46/36/1050394636.db2.gz YFHYGNUMJRMDMF-ZIFCJYIRSA-N 1 0 316.489 4.143 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCC[C@H](C)CC3)CC2)cc1 ZINC000785570424 1050395028 /nfs/dbraw/zinc/39/50/28/1050395028.db2.gz QZZAIUSCPHYMMN-DLBZAZTESA-N 1 0 316.489 4.222 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)c1ccccc1F ZINC000844395302 1050410130 /nfs/dbraw/zinc/41/01/30/1050410130.db2.gz GRUNVMPIDGQICJ-KRWDZBQOSA-N 1 0 319.351 4.114 20 10 DICDRO Cc1cc(C)c(C[NH2+]CCCSc2nccs2)cc1C ZINC000735925814 1050438835 /nfs/dbraw/zinc/43/88/35/1050438835.db2.gz SVODESHRUFQVGG-UHFFFAOYSA-N 1 0 306.500 4.340 20 10 DICDRO C/C(=C/c1ccccc1)C[NH2+]CCCSc1nccs1 ZINC000735925592 1050439455 /nfs/dbraw/zinc/43/94/55/1050439455.db2.gz LEKNMSHQOXJMIF-OWBHPGMISA-N 1 0 304.484 4.318 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2c(C)cccc2F)cc1 ZINC000766216148 1050465214 /nfs/dbraw/zinc/46/52/14/1050465214.db2.gz LUAUSRJEAPTZGV-OAHLLOKOSA-N 1 0 300.421 4.441 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2cc(Cl)c(F)cc2F)cc1 ZINC001144135299 1050475347 /nfs/dbraw/zinc/47/53/47/1050475347.db2.gz VQHRIVUHDLDRSQ-UHFFFAOYSA-N 1 0 324.802 4.316 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1C ZINC000736590296 1050483283 /nfs/dbraw/zinc/48/32/83/1050483283.db2.gz SCZPYERUDPYXLT-KRWDZBQOSA-N 1 0 313.416 4.213 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)cc1C(C)C ZINC000844747623 1050489801 /nfs/dbraw/zinc/48/98/01/1050489801.db2.gz WRDWWKOHZKYXBO-KRWDZBQOSA-N 1 0 309.400 4.445 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)cc1C(C)C ZINC000844747625 1050491321 /nfs/dbraw/zinc/49/13/21/1050491321.db2.gz WRDWWKOHZKYXBO-QGZVFWFLSA-N 1 0 309.400 4.445 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 ZINC000766225944 1050504205 /nfs/dbraw/zinc/50/42/05/1050504205.db2.gz KDXRNADDKOOIDX-ZWOKBUDYSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCSC[C@@H]2c2ccccc2)cc1C ZINC000738064404 1050524329 /nfs/dbraw/zinc/52/43/29/1050524329.db2.gz BTNKXXWTIBQSLZ-GOSISDBHSA-N 1 0 313.466 4.299 20 10 DICDRO Cc1cscc1C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000786927774 1050532573 /nfs/dbraw/zinc/53/25/73/1050532573.db2.gz RCXITGXGVBRNRE-ZDUSSCGKSA-N 1 0 301.455 4.492 20 10 DICDRO C[C@@H](CC1CC1)[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766237016 1050540219 /nfs/dbraw/zinc/54/02/19/1050540219.db2.gz GMYJDLDYYTVFHQ-ZFWWWQNUSA-N 1 0 324.415 4.035 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2cnccc2c1 ZINC000787051012 1050545045 /nfs/dbraw/zinc/54/50/45/1050545045.db2.gz GSPHFYOKPHMXJC-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO CCOc1c(Cl)cccc1C[N@H+](C)Cc1ccccc1O ZINC000787112739 1050551759 /nfs/dbraw/zinc/55/17/59/1050551759.db2.gz RSZCIKMIJAUGIA-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]C12CCC(C(F)(F)F)(CC1)CC2 ZINC000787298012 1050583141 /nfs/dbraw/zinc/58/31/41/1050583141.db2.gz BTAYHAHYXMWSTE-UHFFFAOYSA-N 1 0 317.326 4.276 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](CC)Cc1c(O)ccc2ccncc21 ZINC000739888394 1050590027 /nfs/dbraw/zinc/59/00/27/1050590027.db2.gz TXWRLYDAEBNKHM-IBGZPJMESA-N 1 0 321.424 4.309 20 10 DICDRO CCC[N@H+](Cc1cc(C)c(C)cc1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000740859931 1050631672 /nfs/dbraw/zinc/63/16/72/1050631672.db2.gz WENPKIDWWUMCGT-BHIYHBOVSA-N 1 0 317.473 4.035 20 10 DICDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2c(O)ccc3ccccc32)C1(C)C ZINC000740863662 1050634488 /nfs/dbraw/zinc/63/44/88/1050634488.db2.gz WCNFQKDMUTWCCJ-RTBURBONSA-N 1 0 313.441 4.181 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCc2ccsc2)c1 ZINC000845970848 1050638755 /nfs/dbraw/zinc/63/87/55/1050638755.db2.gz DEUVRGQFCIMRJZ-QWHCGFSZSA-N 1 0 305.443 4.134 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)cc(Cl)c2)c1 ZINC000845970881 1050640308 /nfs/dbraw/zinc/64/03/08/1050640308.db2.gz FAYMFKYEJJFTIL-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO COc1cccc(C[N@H+](C)[C@H](C)CSc2ccccc2)c1O ZINC000846000720 1050645567 /nfs/dbraw/zinc/64/55/67/1050645567.db2.gz UDASLQBLNGBKOU-CQSZACIVSA-N 1 0 317.454 4.013 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(c3ccccc3C)CCC2)c1 ZINC000845995166 1050648357 /nfs/dbraw/zinc/64/83/57/1050648357.db2.gz QHWPYUBQIPVWGO-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO C[C@]1(CC[NH2+]Cc2ccc3ccccc3c2O)C[C@]1(F)Cl ZINC000846031580 1050650372 /nfs/dbraw/zinc/65/03/72/1050650372.db2.gz ASJFTTWVPNNFSG-DLBZAZTESA-N 1 0 307.796 4.340 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)c1 ZINC000846051543 1050659371 /nfs/dbraw/zinc/65/93/71/1050659371.db2.gz FLOOTZIJRZVEKL-INIZCTEOSA-N 1 0 315.388 4.232 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000846055845 1050660317 /nfs/dbraw/zinc/66/03/17/1050660317.db2.gz QDOCDTQZOPLCDT-SUMWQHHRSA-N 1 0 316.832 4.257 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccccc2OC(F)F)c1 ZINC000788259669 1050660808 /nfs/dbraw/zinc/66/08/08/1050660808.db2.gz OLJORCIJPFTMCR-CYBMUJFWSA-N 1 0 321.367 4.195 20 10 DICDRO CCC(O)(CC)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000788262814 1050662941 /nfs/dbraw/zinc/66/29/41/1050662941.db2.gz PSYCNRMHQYMZPC-AWEZNQCLSA-N 1 0 301.430 4.137 20 10 DICDRO CCC(O)(CC)CC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000788262491 1050663142 /nfs/dbraw/zinc/66/31/42/1050663142.db2.gz NLNGVWMDFIUSEM-KRWDZBQOSA-N 1 0 318.505 4.269 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c1O ZINC000846118781 1050666019 /nfs/dbraw/zinc/66/60/19/1050666019.db2.gz BZAHYSBTEFTFCK-UFYCRDLUSA-N 1 0 323.436 4.195 20 10 DICDRO CCS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cccc(OC)c2O)C1 ZINC000846149885 1050672557 /nfs/dbraw/zinc/67/25/57/1050672557.db2.gz NMPOUNZOAALWSH-MGPQQGTHSA-N 1 0 309.475 4.116 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(C)c2)c1O ZINC000846154808 1050673833 /nfs/dbraw/zinc/67/38/33/1050673833.db2.gz PVGXSVXGTZOPGN-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCc2cc3ccccc3o2)c1O ZINC000846154819 1050674770 /nfs/dbraw/zinc/67/47/70/1050674770.db2.gz NPCRAPIOTYXLEW-CYBMUJFWSA-N 1 0 311.381 4.040 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(c3ccccc3C)CCC2)c1O ZINC000846171840 1050680290 /nfs/dbraw/zinc/68/02/90/1050680290.db2.gz IDMJTJYLZYBGBQ-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2OC)c1O ZINC000846138126 1050682179 /nfs/dbraw/zinc/68/21/79/1050682179.db2.gz SWOWVRGBUJVDDI-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CCSc3ccccc32)c1O ZINC000846139846 1050682519 /nfs/dbraw/zinc/68/25/19/1050682519.db2.gz ALIWEACHNYTVIC-WFASDCNBSA-N 1 0 315.438 4.289 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3Cl)c1O ZINC000846141946 1050682699 /nfs/dbraw/zinc/68/26/99/1050682699.db2.gz OLRKHGVWERINIA-BDJLRTHQSA-N 1 0 317.816 4.392 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CSCc3ccccc32)c1O ZINC000846141502 1050683591 /nfs/dbraw/zinc/68/35/91/1050683591.db2.gz KKVBWCMPQAEEIT-WBMJQRKESA-N 1 0 315.438 4.040 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCc3c2cccc3Cl)c1O ZINC000846141948 1050683771 /nfs/dbraw/zinc/68/37/71/1050683771.db2.gz OLRKHGVWERINIA-MEDUHNTESA-N 1 0 317.816 4.392 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+][C@@H](C)c2cccc(OC)c2O)c1 ZINC000846141971 1050684154 /nfs/dbraw/zinc/68/41/54/1050684154.db2.gz PHFQCPFBVIGKIA-KGLIPLIRSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1O ZINC000846141260 1050684200 /nfs/dbraw/zinc/68/42/00/1050684200.db2.gz HBRGEQICBLQMMC-BDJLRTHQSA-N 1 0 317.816 4.392 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC(C)(C)c2cccc(F)c2)c1O ZINC000846144284 1050684435 /nfs/dbraw/zinc/68/44/35/1050684435.db2.gz KCRYPSBGMQAAPX-CYBMUJFWSA-N 1 0 317.404 4.168 20 10 DICDRO C[C@@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000846205438 1050685408 /nfs/dbraw/zinc/68/54/08/1050685408.db2.gz PMCBZBHKJFLURK-IRXDYDNUSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccc1F)[C@@H](C)O)c1ccc(C)cc1O ZINC000846182410 1050689059 /nfs/dbraw/zinc/68/90/59/1050689059.db2.gz JOWFPCSUOYCTSM-XVGQJIODSA-N 1 0 317.404 4.003 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](O)c2ccc(Cl)cc2)c(O)c1 ZINC000788503572 1050693995 /nfs/dbraw/zinc/69/39/95/1050693995.db2.gz DIHYDGHWSJCPKV-DYVFJYSZSA-N 1 0 319.832 4.047 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1O)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000788576365 1050709431 /nfs/dbraw/zinc/70/94/31/1050709431.db2.gz HRGPVZPFBFRSAL-KGYLQXTDSA-N 1 0 307.846 4.389 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2csc(C(C)C)n2)c(O)c1 ZINC000788589393 1050711945 /nfs/dbraw/zinc/71/19/45/1050711945.db2.gz QVCTZKCTNQGDTB-AWEZNQCLSA-N 1 0 318.486 4.482 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCCO[C@H]2C(C)C)c(O)c1 ZINC000788661613 1050727602 /nfs/dbraw/zinc/72/76/02/1050727602.db2.gz BLUAZGRUOKAANY-BXWFABGCSA-N 1 0 305.462 4.111 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(C)ccc2OC)cc1 ZINC000772950406 1050741247 /nfs/dbraw/zinc/74/12/47/1050741247.db2.gz HREXKTZDXADFKA-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cc(F)c(F)c(F)c2)c(O)c1 ZINC000788733338 1050741622 /nfs/dbraw/zinc/74/16/22/1050741622.db2.gz HXECZPUIAHANLT-LBPRGKRZSA-N 1 0 323.358 4.320 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cc(F)c(F)c(F)c2)c(O)c1 ZINC000788733335 1050742527 /nfs/dbraw/zinc/74/25/27/1050742527.db2.gz HXECZPUIAHANLT-GFCCVEGCSA-N 1 0 323.358 4.320 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1O ZINC000761183523 1050744133 /nfs/dbraw/zinc/74/41/33/1050744133.db2.gz NCGBOZHFGUIWSL-CYBMUJFWSA-N 1 0 323.845 4.453 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1ccc(N(C)C)cc1 ZINC000772951765 1050752709 /nfs/dbraw/zinc/75/27/09/1050752709.db2.gz YORFSRMPVRSMFB-OAHLLOKOSA-N 1 0 321.424 4.258 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)c(O)c1 ZINC000788821746 1050757377 /nfs/dbraw/zinc/75/73/77/1050757377.db2.gz GVWNYUAJXLUJSJ-CYBMUJFWSA-N 1 0 304.821 4.217 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cccc3[nH]ccc32)c(O)c1 ZINC000788821393 1050757729 /nfs/dbraw/zinc/75/77/29/1050757729.db2.gz FDWKGEHYFJFVQX-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO CCc1cccc(Cl)c1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000788960565 1050768107 /nfs/dbraw/zinc/76/81/07/1050768107.db2.gz RGZOPPJRRVXCOZ-UHFFFAOYSA-N 1 0 301.817 4.127 20 10 DICDRO CCOC1CC(CC[NH2+][C@@H](CC)c2cc(Cl)ccc2O)C1 ZINC000788983189 1050770598 /nfs/dbraw/zinc/77/05/98/1050770598.db2.gz CBSLOKYGPDZMNG-PXCJXSSVSA-N 1 0 311.853 4.292 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](Cc2cccs2)C2CC2)c1O ZINC000761191908 1050772578 /nfs/dbraw/zinc/77/25/78/1050772578.db2.gz ZTLMIZQCMOAXLN-UHFFFAOYSA-N 1 0 323.845 4.280 20 10 DICDRO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000788981496 1050777584 /nfs/dbraw/zinc/77/75/84/1050777584.db2.gz RFQVYJIQLJSVBV-AWEZNQCLSA-N 1 0 324.424 4.358 20 10 DICDRO c1cc(N2CCSCC2)ccc1C[NH2+][C@H]1CCC12CCCC2 ZINC000788978040 1050778981 /nfs/dbraw/zinc/77/89/81/1050778981.db2.gz MQCULRGDCXXRMY-SFHVURJKSA-N 1 0 316.514 4.052 20 10 DICDRO Cn1c(-c2ccccc2)cnc1SCC[C@@H]1CCCC[N@@H+]1C ZINC000302111079 1050795309 /nfs/dbraw/zinc/79/53/09/1050795309.db2.gz YZODGFQVMWSYQZ-INIZCTEOSA-N 1 0 315.486 4.054 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCOC3(CCCCC3)C2)cc1C(C)C ZINC000742165604 1050806130 /nfs/dbraw/zinc/80/61/30/1050806130.db2.gz IKVMXZGOVFQSCC-UHFFFAOYSA-N 1 0 317.473 4.359 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1)CCC2 ZINC000742173901 1050807072 /nfs/dbraw/zinc/80/70/72/1050807072.db2.gz MNLWINXMZWJJBA-SFHVURJKSA-N 1 0 313.828 4.481 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2c(C)cccc2F)cc1F ZINC000742381145 1050825845 /nfs/dbraw/zinc/82/58/45/1050825845.db2.gz YTVUXWOOJLQREU-UHFFFAOYSA-N 1 0 318.411 4.409 20 10 DICDRO Cc1ccccc1C1CC([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000742384999 1050826601 /nfs/dbraw/zinc/82/66/01/1050826601.db2.gz PGUQVDPSDKDVMH-UHFFFAOYSA-N 1 0 301.817 4.390 20 10 DICDRO CS[C@H]1CC[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000742382794 1050827729 /nfs/dbraw/zinc/82/77/29/1050827729.db2.gz GHILSCUQVGJEIA-ROUUACIJSA-N 1 0 313.466 4.433 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cc(F)ccc2C1)c1ccc(N(C)C)cc1 ZINC001168411091 1050832651 /nfs/dbraw/zinc/83/26/51/1050832651.db2.gz GCJUBZOYDUEYMS-LIRRHRJNSA-N 1 0 312.432 4.100 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H](OC)c2ccc(Cl)cc2)cc1C ZINC000742376899 1050837084 /nfs/dbraw/zinc/83/70/84/1050837084.db2.gz DAXRKGDZLZPNDE-GOSISDBHSA-N 1 0 319.832 4.134 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2cc(-c3ccccc3)ccc2O)nc1 ZINC000789595264 1050852080 /nfs/dbraw/zinc/85/20/80/1050852080.db2.gz SDBHIOSEJQYXPZ-UHFFFAOYSA-N 1 0 318.420 4.395 20 10 DICDRO CCCCO[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)CC)cc2)C1(C)C ZINC001170118106 1050884876 /nfs/dbraw/zinc/88/48/76/1050884876.db2.gz PBXWUQCNTXIEAQ-OALUTQOASA-N 1 0 318.505 4.216 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000772981327 1050886882 /nfs/dbraw/zinc/88/68/82/1050886882.db2.gz ZRFBGEKEMQZNGD-NHCUHLMSSA-N 1 0 324.468 4.107 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000772994893 1050977723 /nfs/dbraw/zinc/97/77/23/1050977723.db2.gz CANWTPRCXJBSSV-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO C[C@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1cc(Cl)ccc1O ZINC000790703700 1050986147 /nfs/dbraw/zinc/98/61/47/1050986147.db2.gz UEXDOVUORNEBAB-SJCJKPOMSA-N 1 0 311.853 4.028 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]Cc1ccc(-c2ccco2)cc1F ZINC000790926597 1051006755 /nfs/dbraw/zinc/00/67/55/1051006755.db2.gz MKBBEAZAPCKXBR-UHFFFAOYSA-N 1 0 315.319 4.220 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000743389374 1051020871 /nfs/dbraw/zinc/02/08/71/1051020871.db2.gz JMAIRABXKCGBRY-GOSISDBHSA-N 1 0 308.356 4.027 20 10 DICDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2c(O)ccc3ccncc32)C1 ZINC000743398720 1051022716 /nfs/dbraw/zinc/02/27/16/1051022716.db2.gz JZVBZYPGPFZUIJ-LSDHHAIUSA-N 1 0 316.470 4.046 20 10 DICDRO Oc1ccc2ccncc2c1C[NH+]1CCC(C2CCCC2)CC1 ZINC000743375881 1051023546 /nfs/dbraw/zinc/02/35/46/1051023546.db2.gz AZIGWWLYPOJNHO-UHFFFAOYSA-N 1 0 310.441 4.343 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)C)c1ccc(N(C)C)cc1 ZINC000773043524 1051034006 /nfs/dbraw/zinc/03/40/06/1051034006.db2.gz CNNGDXIFDUPZDY-IHPCNDPISA-N 1 0 318.505 4.245 20 10 DICDRO C[C@@H]([NH2+]CC1(C)CCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000773042871 1051035719 /nfs/dbraw/zinc/03/57/19/1051035719.db2.gz CDNGJGMAANYSPJ-CQSZACIVSA-N 1 0 322.880 4.017 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCCO[C@@H]2C(C)C)cc1 ZINC000773048595 1051039029 /nfs/dbraw/zinc/03/90/29/1051039029.db2.gz RLGBJQLOJMSWFQ-XKGZKEIXSA-N 1 0 318.505 4.245 20 10 DICDRO CCOCCC1(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)CCC1 ZINC000773061504 1051043719 /nfs/dbraw/zinc/04/37/19/1051043719.db2.gz YVFILXMQISEBIG-LJQANCHMSA-N 1 0 318.505 4.390 20 10 DICDRO C[C@@H]([NH2+][C@@H](CO)CC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000773075322 1051050371 /nfs/dbraw/zinc/05/03/71/1051050371.db2.gz IRQIBHGQFSESNJ-SJLPKXTDSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(F)n1)c1ccc(N2CCCCC2)cc1 ZINC000773089480 1051057856 /nfs/dbraw/zinc/05/78/56/1051057856.db2.gz QZVRPXJAZKNAMY-OAHLLOKOSA-N 1 0 313.420 4.062 20 10 DICDRO CS[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773095132 1051060280 /nfs/dbraw/zinc/06/02/80/1051060280.db2.gz RGZPHNZIKMGHFM-CVEARBPZSA-N 1 0 306.519 4.469 20 10 DICDRO COc1ccc(N2CCC[N@@H+]([C@H](C)c3cccc(C)c3)CC2)cc1 ZINC000743843585 1051068820 /nfs/dbraw/zinc/06/88/20/1051068820.db2.gz YVBAAKIFVSLLLQ-GOSISDBHSA-N 1 0 324.468 4.277 20 10 DICDRO CC[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000773119380 1051069811 /nfs/dbraw/zinc/06/98/11/1051069811.db2.gz OUGAOEBXKNSIDO-UXHICEINSA-N 1 0 309.457 4.340 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1 ZINC000773127766 1051073354 /nfs/dbraw/zinc/07/33/54/1051073354.db2.gz AQPKIEVBDYGGNR-KVSKMBFKSA-N 1 0 318.505 4.387 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389004 1051073741 /nfs/dbraw/zinc/07/37/41/1051073741.db2.gz RXULNRJTJHAQBR-MRXNPFEDSA-N 1 0 317.379 4.050 20 10 DICDRO Cc1cc2cc[nH]c2c(NCc2cc3ccccc3cc2O)[nH+]1 ZINC001171400279 1051087193 /nfs/dbraw/zinc/08/71/93/1051087193.db2.gz RJGZZPSDFZLYKU-UHFFFAOYSA-N 1 0 303.365 4.342 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(OC)ccc1O)c1ccc(Cl)cc1 ZINC000036978973 1051105755 /nfs/dbraw/zinc/10/57/55/1051105755.db2.gz VQCDXJJOKRHZPK-INIZCTEOSA-N 1 0 305.805 4.295 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccccc1OC ZINC000036995182 1051105996 /nfs/dbraw/zinc/10/59/96/1051105996.db2.gz RJHMTBYHDZUELJ-OAHLLOKOSA-N 1 0 305.805 4.295 20 10 DICDRO Cc1ccnc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c1 ZINC000792197848 1051125975 /nfs/dbraw/zinc/12/59/75/1051125975.db2.gz AAFHECZWDPWPFI-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CC(OCc3ccccc3)C2)c(O)c1 ZINC000716284285 1051129772 /nfs/dbraw/zinc/12/97/72/1051129772.db2.gz JLQILOVRUULZOS-ZLPCBKJTSA-N 1 0 311.425 4.099 20 10 DICDRO CCc1cccc(F)c1CNc1cc(C[NH+](C)C)ccc1OC ZINC000792864468 1051217627 /nfs/dbraw/zinc/21/76/27/1051217627.db2.gz GRCAHJIXNAXLOP-UHFFFAOYSA-N 1 0 316.420 4.070 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2cccs2)c(C(F)(F)F)c1 ZINC000792881804 1051223116 /nfs/dbraw/zinc/22/31/16/1051223116.db2.gz JUYSAFLGQRWPCY-UHFFFAOYSA-N 1 0 314.376 4.123 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000792985115 1051234603 /nfs/dbraw/zinc/23/46/03/1051234603.db2.gz VKUMWEVGOYTHTL-OLZOCXBDSA-N 1 0 319.832 4.336 20 10 DICDRO FC(F)c1ccc(C[NH2+]CCCSc2nccs2)cc1 ZINC000792991746 1051235455 /nfs/dbraw/zinc/23/54/55/1051235455.db2.gz IXESJEQAEQTUME-UHFFFAOYSA-N 1 0 314.426 4.353 20 10 DICDRO CSC(C)(C)C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792994505 1051236779 /nfs/dbraw/zinc/23/67/79/1051236779.db2.gz FWNLBJUXBCXZSJ-UHFFFAOYSA-N 1 0 320.424 4.003 20 10 DICDRO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000793231279 1051263836 /nfs/dbraw/zinc/26/38/36/1051263836.db2.gz LYZJECGHGIAIOL-NHYWBVRUSA-N 1 0 309.331 4.318 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccc(C)cc3C)C2)c1 ZINC000793233962 1051265616 /nfs/dbraw/zinc/26/56/16/1051265616.db2.gz XXIQUGOHRNFHMV-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC[C@@H](c2ccc(C)cc2C)C1 ZINC000793232495 1051265646 /nfs/dbraw/zinc/26/56/46/1051265646.db2.gz NAJIEFFUDQCEAE-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO COCCCC[C@H]([NH2+]Cc1cccc(C)c1O)c1ccccc1 ZINC000793233602 1051266263 /nfs/dbraw/zinc/26/62/63/1051266263.db2.gz WGOPHZXUSRLKOL-IBGZPJMESA-N 1 0 313.441 4.348 20 10 DICDRO CCC[C@H]([NH2+]Cc1cc(C)c(C)cc1O)[C@@H](O)c1ccccc1 ZINC000793236753 1051267412 /nfs/dbraw/zinc/26/74/12/1051267412.db2.gz DJYIYBXYQGSGPH-ICSRJNTNSA-N 1 0 313.441 4.001 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCCc3ccc(F)cc32)c1 ZINC000793306125 1051278177 /nfs/dbraw/zinc/27/81/77/1051278177.db2.gz WTLSFSYYBKMKGO-GOSISDBHSA-N 1 0 315.388 4.097 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH+]1CCC(F)(F)CC1 ZINC000793361417 1051287446 /nfs/dbraw/zinc/28/74/46/1051287446.db2.gz HFQSAJYBPCOTBS-UHFFFAOYSA-N 1 0 303.352 4.290 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000793351507 1051292329 /nfs/dbraw/zinc/29/23/29/1051292329.db2.gz JBAPJHQUUFJPSZ-CXAGYDPISA-N 1 0 303.352 4.096 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)c1O ZINC000793386025 1051294530 /nfs/dbraw/zinc/29/45/30/1051294530.db2.gz GTBSOHWUZARNKC-JCNLHEQBSA-N 1 0 301.817 4.390 20 10 DICDRO COc1cccc(C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)c1O ZINC000793386517 1051294572 /nfs/dbraw/zinc/29/45/72/1051294572.db2.gz VFVSDGCMUZRRPT-KOMQPUFPSA-N 1 0 317.816 4.090 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CC[C@@](C)(c3ccccc3)C2)c(O)c1 ZINC000793391427 1051296472 /nfs/dbraw/zinc/29/64/72/1051296472.db2.gz YKUMWFJQQSYTQD-FXAWDEMLSA-N 1 0 311.425 4.001 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c(O)c(C(C)(C)C)c1 ZINC000793547424 1051316266 /nfs/dbraw/zinc/31/62/66/1051316266.db2.gz TWXYEJVYUVSJNI-QAPCUYQASA-N 1 0 323.427 4.475 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000793607673 1051324390 /nfs/dbraw/zinc/32/43/90/1051324390.db2.gz BOEDXYIASGGSKY-TZIWHRDSSA-N 1 0 323.436 4.203 20 10 DICDRO C[C@@]12CC[N@H+](Cc3c(O)cccc3Cl)C[C@@H]1C2(Cl)Cl ZINC000793618624 1051328925 /nfs/dbraw/zinc/32/89/25/1051328925.db2.gz WAEGYQASPHISFW-QWHCGFSZSA-N 1 0 320.647 4.061 20 10 DICDRO CC[C@@H](C)OCC[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001172314254 1051337021 /nfs/dbraw/zinc/33/70/21/1051337021.db2.gz CENUNKFGCQOUDD-QZTJIDSGSA-N 1 0 318.505 4.360 20 10 DICDRO CC[C@@H](C)OCC[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001172314258 1051338344 /nfs/dbraw/zinc/33/83/44/1051338344.db2.gz CENUNKFGCQOUDD-ZWKOTPCHSA-N 1 0 318.505 4.360 20 10 DICDRO CCOCC[C@@H](C)[NH2+][C@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001172422579 1051384958 /nfs/dbraw/zinc/38/49/58/1051384958.db2.gz GDMOIADNYNKLAY-KDOFPFPSSA-N 1 0 305.462 4.037 20 10 DICDRO Cc1cccc2oc(CC[NH2+][C@@H](C)c3ccc(N(C)C)cc3)nc21 ZINC000766353608 1051403425 /nfs/dbraw/zinc/40/34/25/1051403425.db2.gz GNLCFQTWNCMOHQ-HNNXBMFYSA-N 1 0 323.440 4.096 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000766365429 1051407184 /nfs/dbraw/zinc/40/71/84/1051407184.db2.gz FHMQOCACGNKIIR-ZDUSSCGKSA-N 1 0 318.461 4.464 20 10 DICDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766360790 1051409580 /nfs/dbraw/zinc/40/95/80/1051409580.db2.gz NXFBWJJMDXCLOH-ZHALLVOQSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCSC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766447717 1051421580 /nfs/dbraw/zinc/42/15/80/1051421580.db2.gz ZZELDBVNYDULDJ-GOEBONIOSA-N 1 0 322.493 4.362 20 10 DICDRO CCCCCC[C@H](CCCC)[NH2+]C[C@H](O)c1ccc(O)c(O)c1 ZINC001172510483 1051426190 /nfs/dbraw/zinc/42/61/90/1051426190.db2.gz CYHGFPHDRQYJPV-LPHOPBHVSA-N 1 0 323.477 4.250 20 10 DICDRO C[C@H]([NH2+]C1CCC(C)(O)CC1)c1ccc(N2CCCCC2)cc1 ZINC000766476976 1051433591 /nfs/dbraw/zinc/43/35/91/1051433591.db2.gz FEQVRAKZOLCBBA-VQSBYGRUSA-N 1 0 316.489 4.021 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(CCO)CCCCC2)cc1 ZINC000766533147 1051462760 /nfs/dbraw/zinc/46/27/60/1051462760.db2.gz ADSGPBVQYOGWMB-KRWDZBQOSA-N 1 0 318.505 4.126 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766558761 1051480706 /nfs/dbraw/zinc/48/07/06/1051480706.db2.gz HJXKKGTZTAELBT-KXBFYZLASA-N 1 0 320.452 4.036 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC001172713915 1051496853 /nfs/dbraw/zinc/49/68/53/1051496853.db2.gz RSBPHRXNGLZLRJ-IBGZPJMESA-N 1 0 323.823 4.456 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCc3c2cccc3OC)cc1 ZINC000766583748 1051516079 /nfs/dbraw/zinc/51/60/79/1051516079.db2.gz KHDIVFXKOXLWIQ-MGPUTAFESA-N 1 0 324.468 4.489 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3OC)cc1 ZINC000766583746 1051516426 /nfs/dbraw/zinc/51/64/26/1051516426.db2.gz KHDIVFXKOXLWIQ-FOIQADDNSA-N 1 0 324.468 4.489 20 10 DICDRO C[C@@H](Cc1c(F)cccc1Cl)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001172839240 1051528043 /nfs/dbraw/zinc/52/80/43/1051528043.db2.gz CPFSHTNUHIBLDN-LBPRGKRZSA-N 1 0 319.807 4.135 20 10 DICDRO CCCOC1CCC([N@H+](CC)Cc2ccc(N(C)C)cc2)CC1 ZINC001173102361 1051607074 /nfs/dbraw/zinc/60/70/74/1051607074.db2.gz MNEGXVVRKSAUFV-UHFFFAOYSA-N 1 0 318.505 4.312 20 10 DICDRO CNc1cc(Nc2ccc(CCc3ccc(N)cc3)cc2)cc[nH+]1 ZINC001216334853 1051704606 /nfs/dbraw/zinc/70/46/06/1051704606.db2.gz AYOSPOHSAPQUNG-UHFFFAOYSA-N 1 0 318.424 4.234 20 10 DICDRO CNc1cc(Nc2ccccc2Cc2ccc(N)cc2)cc[nH+]1 ZINC001216337450 1051707114 /nfs/dbraw/zinc/70/71/14/1051707114.db2.gz BCYGJKYWLUFGED-UHFFFAOYSA-N 1 0 304.397 4.040 20 10 DICDRO CCCC[NH+]1CCC([NH2+][C@H](CC)c2cccc(Cl)c2[O-])CC1 ZINC000806134949 1051735143 /nfs/dbraw/zinc/73/51/43/1051735143.db2.gz DPGKUODWAJOHRU-QGZVFWFLSA-N 1 0 324.896 4.351 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)c1cc(Cl)cc(Cl)c1[O-] ZINC000806135034 1051735852 /nfs/dbraw/zinc/73/58/52/1051735852.db2.gz FFFHEGDSWHGFGD-QMTHXVAHSA-N 1 0 319.276 4.080 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1cccc(Cl)c1[O-] ZINC000806136664 1051736997 /nfs/dbraw/zinc/73/69/97/1051736997.db2.gz BBNFWTMNJTYZNQ-WMLDXEAASA-N 1 0 324.896 4.207 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCC1(C)C)c1ccc(N2CCOCC2)cc1Cl ZINC000806169363 1051746905 /nfs/dbraw/zinc/74/69/05/1051746905.db2.gz KQJOCWJTOBVOKD-DYVFJYSZSA-N 1 0 322.880 4.016 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCC(F)(F)C2)cc1F ZINC000767930884 1051866202 /nfs/dbraw/zinc/86/62/02/1051866202.db2.gz ZLLGYWQZOZCXJL-CQSZACIVSA-N 1 0 314.395 4.339 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cnc(Cl)c(C)c1 ZINC000768133753 1051886527 /nfs/dbraw/zinc/88/65/27/1051886527.db2.gz MBCIGCRWVHKDBR-UHFFFAOYSA-N 1 0 317.864 4.132 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cncc2ccccc21 ZINC000768133851 1051888116 /nfs/dbraw/zinc/88/81/16/1051888116.db2.gz MLCAMKHKUFEKGJ-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2[O-])CCc2ccccc21 ZINC000404801293 1051891944 /nfs/dbraw/zinc/89/19/44/1051891944.db2.gz UPKFIDSXRUXITK-CYBMUJFWSA-N 1 0 301.817 4.207 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2c(O)cccc2Cl)cc1 ZINC000768162352 1051892118 /nfs/dbraw/zinc/89/21/18/1051892118.db2.gz CHUAOBMCEOIPPP-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO C[NH+](C)Cc1ccccc1Nc1nc(-c2ccncc2)cs1 ZINC001173927685 1051900470 /nfs/dbraw/zinc/90/04/70/1051900470.db2.gz MZMIRAAWMPNFLU-UHFFFAOYSA-N 1 0 310.426 4.010 20 10 DICDRO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000768196328 1051900938 /nfs/dbraw/zinc/90/09/38/1051900938.db2.gz APKKBCMPNJGICM-OAQYLSRUSA-N 1 0 323.484 4.353 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)cc1F ZINC000768195072 1051901364 /nfs/dbraw/zinc/90/13/64/1051901364.db2.gz KOHRWZSLJRZLOF-MRXNPFEDSA-N 1 0 304.434 4.290 20 10 DICDRO Oc1ccc(Cl)cc1CN1CCc2[nH]c3ccccc3c2C1 ZINC000768231390 1051905847 /nfs/dbraw/zinc/90/58/47/1051905847.db2.gz UGTYVPMGHAZQHE-UHFFFAOYSA-N 1 0 312.800 4.085 20 10 DICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(Cl)ccc1O ZINC000768334708 1051917628 /nfs/dbraw/zinc/91/76/28/1051917628.db2.gz PBMJPDDEROIGKU-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2cccc(F)c2)C(C)C)c1O ZINC000768329868 1051918477 /nfs/dbraw/zinc/91/84/77/1051918477.db2.gz IIUBPKGLAOPNBE-UHFFFAOYSA-N 1 0 317.404 4.341 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccsc2)c(O)c1 ZINC000768329896 1051919305 /nfs/dbraw/zinc/91/93/05/1051919305.db2.gz KAKMJVOFCNXALN-INIZCTEOSA-N 1 0 303.427 4.190 20 10 DICDRO Cc1ccc(O)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000768336966 1051919853 /nfs/dbraw/zinc/91/98/53/1051919853.db2.gz DVHQRMISDJTFNF-UHFFFAOYSA-N 1 0 314.385 4.019 20 10 DICDRO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)Cc1cc(C)ccc1O ZINC000768338799 1051921300 /nfs/dbraw/zinc/92/13/00/1051921300.db2.gz PMUUMJDJNVGXIK-LJQANCHMSA-N 1 0 311.425 4.219 20 10 DICDRO COc1cccc(C[N@H+](Cc2cccc(Cl)c2)C(C)C)c1O ZINC000768338300 1051921373 /nfs/dbraw/zinc/92/13/73/1051921373.db2.gz NTEGSJBCONEOOJ-UHFFFAOYSA-N 1 0 319.832 4.465 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1)Cc1cccc(OC)c1O ZINC000768338400 1051922365 /nfs/dbraw/zinc/92/23/65/1051922365.db2.gz OJOCAPDPPOUBJJ-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO c1ccc([C@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)nc1 ZINC000768356672 1051924000 /nfs/dbraw/zinc/92/40/00/1051924000.db2.gz ZEFIEBOYHYRHLV-OAQYLSRUSA-N 1 0 321.468 4.409 20 10 DICDRO COc1cc(C[NH+]2CCC(c3ccccc3)CC2)c(O)cc1C ZINC000768442432 1051931158 /nfs/dbraw/zinc/93/11/58/1051931158.db2.gz WAHKCKAWUBCNDY-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCc3sccc3[C@H]2CC)c1O ZINC000768828562 1051970801 /nfs/dbraw/zinc/97/08/01/1051970801.db2.gz WFTRETHMYNZBPB-OAHLLOKOSA-N 1 0 317.454 4.362 20 10 DICDRO C[N@H+](Cc1cc(F)cc(C(F)(F)F)c1)Cc1ccccc1O ZINC000768872238 1051975546 /nfs/dbraw/zinc/97/55/46/1051975546.db2.gz GDTXWIBLCRGSRH-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccccc2O)c2ccccc12 ZINC000768872960 1051975722 /nfs/dbraw/zinc/97/57/22/1051975722.db2.gz NCRBMJKEDRVVBE-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1ccccc1N1CCCCC1 ZINC000768872950 1051976240 /nfs/dbraw/zinc/97/62/40/1051976240.db2.gz MNKNMALVVYXHBP-UHFFFAOYSA-N 1 0 310.441 4.015 20 10 DICDRO Cc1ncc(C[N@@H+](C)Cc2cc(-c3ccccc3)ccc2O)s1 ZINC000768913724 1051982077 /nfs/dbraw/zinc/98/20/77/1051982077.db2.gz QVTNDPJBLIJKOO-UHFFFAOYSA-N 1 0 324.449 4.456 20 10 DICDRO CC[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@@H]1CCCO1 ZINC000769029557 1051990964 /nfs/dbraw/zinc/99/09/64/1051990964.db2.gz KWMFZUANBKRCKX-IBGZPJMESA-N 1 0 311.425 4.060 20 10 DICDRO Oc1ccc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)cc1 ZINC000769107586 1051998382 /nfs/dbraw/zinc/99/83/82/1051998382.db2.gz YMTBODILYJDBOM-MRXNPFEDSA-N 1 0 303.789 4.088 20 10 DICDRO C[C@@H]1C[NH+](Cc2ccc(N3CCCCC3)cc2)C[C@@H](C)S1 ZINC000769142745 1052000511 /nfs/dbraw/zinc/00/05/11/1052000511.db2.gz ZEEHXKRRIRTASI-HZPDHXFCSA-N 1 0 304.503 4.003 20 10 DICDRO C[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H](C)S1 ZINC000769142748 1052001217 /nfs/dbraw/zinc/00/12/17/1052001217.db2.gz ZEEHXKRRIRTASI-IYBDPMFKSA-N 1 0 304.503 4.003 20 10 DICDRO CCC[N@H+](Cc1cnc2ccccc2c1)Cc1ccccc1O ZINC000769200640 1052006345 /nfs/dbraw/zinc/00/63/45/1052006345.db2.gz FHFUZAUNCSFWKP-UHFFFAOYSA-N 1 0 306.409 4.353 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000769426234 1052044057 /nfs/dbraw/zinc/04/40/57/1052044057.db2.gz OIRACQABEUHMHX-QGZVFWFLSA-N 1 0 319.857 4.336 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCCOC2CCCC2)c1O ZINC000808687272 1052060095 /nfs/dbraw/zinc/06/00/95/1052060095.db2.gz PUZBIJQIZYQKAB-ZDUSSCGKSA-N 1 0 311.853 4.354 20 10 DICDRO CCC[N@H+](Cc1c(O)cccc1Cl)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000769469720 1052063823 /nfs/dbraw/zinc/06/38/23/1052063823.db2.gz DDBJILIKSXJJPM-JLZZUVOBSA-N 1 0 323.864 4.071 20 10 DICDRO Cc1nc(CC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cs1 ZINC000808675055 1052064348 /nfs/dbraw/zinc/06/43/48/1052064348.db2.gz VIUGDDAQQSUHIJ-JTQLQIEISA-N 1 0 310.850 4.012 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cc1 ZINC000808671629 1052064658 /nfs/dbraw/zinc/06/46/58/1052064658.db2.gz LJAVSLBYAZISQS-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCCSc2nccs2)c2ccccc21 ZINC000808694164 1052065672 /nfs/dbraw/zinc/06/56/72/1052065672.db2.gz DNQDYULBYSHVKE-DOMZBBRYSA-N 1 0 304.484 4.463 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCCSc2nccs2)c2ccccc21 ZINC000808694166 1052065695 /nfs/dbraw/zinc/06/56/95/1052065695.db2.gz DNQDYULBYSHVKE-SWLSCSKDSA-N 1 0 304.484 4.463 20 10 DICDRO Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cc1 ZINC000808679450 1052066581 /nfs/dbraw/zinc/06/65/81/1052066581.db2.gz PPNHBMZLWXEMQP-SUMWQHHRSA-N 1 0 319.832 4.047 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O)c1ccccc1 ZINC000808679681 1052066798 /nfs/dbraw/zinc/06/67/98/1052066798.db2.gz WXMOSVQKVUFTTF-DYVFJYSZSA-N 1 0 319.832 4.392 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c1O ZINC000808704963 1052068543 /nfs/dbraw/zinc/06/85/43/1052068543.db2.gz OFSYBSXCDWNNKY-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808703807 1052068943 /nfs/dbraw/zinc/06/89/43/1052068943.db2.gz XIWMVWGHFFGVDB-QWHCGFSZSA-N 1 0 304.821 4.469 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](C)c2nccs2)c1O ZINC000808713631 1052074277 /nfs/dbraw/zinc/07/42/77/1052074277.db2.gz JFVYCPPCVRXMCP-QWRGUYRKSA-N 1 0 310.850 4.265 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CCCCN2C2CC2)c1O ZINC000808715292 1052075241 /nfs/dbraw/zinc/07/52/41/1052075241.db2.gz CKRSUHKIFCYXMM-BBRMVZONSA-N 1 0 322.880 4.022 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCCC23CCOCC3)c1O ZINC000808716935 1052075941 /nfs/dbraw/zinc/07/59/41/1052075941.db2.gz AADWMGOSFCSSGY-BBRMVZONSA-N 1 0 323.864 4.354 20 10 DICDRO CC[N@H+](Cc1occc1C)Cc1cc(Br)ccc1O ZINC000769538356 1052078651 /nfs/dbraw/zinc/07/86/51/1052078651.db2.gz DNLVDVMJMRVLOF-UHFFFAOYSA-N 1 0 324.218 4.078 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC[C@H](c3ccccc3)O2)c1 ZINC000808728374 1052083708 /nfs/dbraw/zinc/08/37/08/1052083708.db2.gz QMNFNNVVAFRFHT-WRWLIDTKSA-N 1 0 311.425 4.272 20 10 DICDRO CCc1nc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cs1 ZINC000808693887 1052083897 /nfs/dbraw/zinc/08/38/97/1052083897.db2.gz SZEQZZHPHVLJCG-SNVBAGLBSA-N 1 0 310.850 4.224 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2COc3ccccc32)c1O ZINC000808728642 1052084730 /nfs/dbraw/zinc/08/47/30/1052084730.db2.gz UAQXSWKLXAYARN-OLZOCXBDSA-N 1 0 317.816 4.181 20 10 DICDRO C/C=C/C[C@H](CO)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000769992817 1052138545 /nfs/dbraw/zinc/13/85/45/1052138545.db2.gz DHOZSEWZONVOFE-HECAZONMSA-N 1 0 316.489 4.045 20 10 DICDRO CN(C)c1ccc(/N=N/c2ccc(OC3CC[NH2+]CC3)cc2)cc1 ZINC001217963484 1052177706 /nfs/dbraw/zinc/17/77/06/1052177706.db2.gz CUGHHZLQWZEFKI-QURGRASLSA-N 1 0 324.428 4.299 20 10 DICDRO C[C@@H]1C[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)CC[NH2+]1 ZINC001218052622 1052189509 /nfs/dbraw/zinc/18/95/09/1052189509.db2.gz LROWHENNWWXHFL-FZKQIMNGSA-N 1 0 311.385 4.327 20 10 DICDRO C[C@@H]1C[C@H](Oc2ccccc2NN=C2C=CC=CC2=O)CC[NH2+]1 ZINC001218056838 1052191237 /nfs/dbraw/zinc/19/12/37/1052191237.db2.gz POUMOZZZJMVQGI-OKHLRRJLSA-N 1 0 311.385 4.327 20 10 DICDRO Cc1ccc(O[C@H]2CC[NH2+]C[C@H]2F)c(/N=N/c2ccccc2)c1 ZINC001218072581 1052192393 /nfs/dbraw/zinc/19/23/93/1052192393.db2.gz SEPXFTGFAHZIQB-KBYATVDDSA-N 1 0 313.376 4.489 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CC[C@]12CC[NH2+]C2 ZINC001218117431 1052198945 /nfs/dbraw/zinc/19/89/45/1052198945.db2.gz MYCPAJOPFIKPSG-QSDHIIRHSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1CC[C@]12CC[NH2+]C2 ZINC001218117433 1052199076 /nfs/dbraw/zinc/19/90/76/1052199076.db2.gz MYCPAJOPFIKPSG-QZDOXPCSSA-N 1 0 323.396 4.329 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@@H]3CCO[C@]34CC[NH2+]C4)cc2)cc1 ZINC001218139551 1052201259 /nfs/dbraw/zinc/20/12/59/1052201259.db2.gz WFOGVDFTQWTBQZ-NJOYMBDGSA-N 1 0 323.396 4.002 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2C[C@H]3CC[NH2+][C@H]3C2)=C1 ZINC001218249605 1052212691 /nfs/dbraw/zinc/21/26/91/1052212691.db2.gz KACSUIWQQPLIHV-IESYNNOOSA-N 1 0 323.396 4.327 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@H]1C[NH2+][C@H]1C ZINC001218392226 1052233744 /nfs/dbraw/zinc/23/37/44/1052233744.db2.gz OXMXPGWWVFWDHO-UGSOOPFHSA-N 1 0 310.401 4.189 20 10 DICDRO C[C@H]1CC[C@@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C[NH2+]1 ZINC001218400333 1052234352 /nfs/dbraw/zinc/23/43/52/1052234352.db2.gz DIDCMHZNHOPXPM-XJEBNATLSA-N 1 0 311.385 4.327 20 10 DICDRO C[C@H]1CC[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C[NH2+]1 ZINC001218404262 1052234619 /nfs/dbraw/zinc/23/46/19/1052234619.db2.gz ZRXRZOYYAKQPIL-UGSOOPFHSA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2C[NH2+]CCC23CC3)=C1 ZINC001218402091 1052234912 /nfs/dbraw/zinc/23/49/12/1052234912.db2.gz AOZYNEMAXCVFMN-KHOFPDMRSA-N 1 0 323.396 4.329 20 10 DICDRO C[C@@H]1C[NH2+]CC[C@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218412427 1052235739 /nfs/dbraw/zinc/23/57/39/1052235739.db2.gz FMSPCXGUYMZSMZ-SVKIDVEZSA-N 1 0 311.385 4.184 20 10 DICDRO C[C@H]1C[NH2+]CC[C@@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218417335 1052236784 /nfs/dbraw/zinc/23/67/84/1052236784.db2.gz VROMSNQEMRXWGD-JCNVQDTGSA-N 1 0 311.385 4.184 20 10 DICDRO C[C@@H]1C[NH2+]CC[C@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001218425699 1052237152 /nfs/dbraw/zinc/23/71/52/1052237152.db2.gz ULHRAOMIIYQETB-FZKQIMNGSA-N 1 0 311.385 4.184 20 10 DICDRO FC1(F)CC[NH2+]C[C@@H]1Oc1ccc(/N=N/c2ccccc2)cc1 ZINC001218446775 1052240553 /nfs/dbraw/zinc/24/05/53/1052240553.db2.gz GFMIZDRJFKEVSN-YWBAYFEHSA-N 1 0 317.339 4.478 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CC[C@H]4C[NH2+]C[C@H]43)cc2)C=C1 ZINC001218468537 1052242783 /nfs/dbraw/zinc/24/27/83/1052242783.db2.gz SEFSQMQBLZPWNZ-MJXNMMHHSA-N 1 0 323.396 4.184 20 10 DICDRO C[C@@H]1CC[NH2+]C[C@@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218482227 1052246108 /nfs/dbraw/zinc/24/61/08/1052246108.db2.gz FLQOHMNUFYSHHG-SYKDWPAJSA-N 1 0 311.385 4.184 20 10 DICDRO C[N@H+](CCCOc1ccccc1)Cc1c(O)ccc2ccccc21 ZINC000915209019 1052366613 /nfs/dbraw/zinc/36/66/13/1052366613.db2.gz VVBLVNWSFHCRJC-UHFFFAOYSA-N 1 0 321.420 4.446 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)[C@@H]2CCCC[C@@H]12 ZINC000915208804 1052366938 /nfs/dbraw/zinc/36/69/38/1052366938.db2.gz IDXAPMWWNPWXTC-SIXWZSSISA-N 1 0 310.441 4.341 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000316882860 1052375933 /nfs/dbraw/zinc/37/59/33/1052375933.db2.gz APPIWKOOQFPLBW-QWHCGFSZSA-N 1 0 303.377 4.342 20 10 DICDRO CC1(C)C(C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1(C)C ZINC000317579233 1052390620 /nfs/dbraw/zinc/39/06/20/1052390620.db2.gz BUWUJPHFMBCBMU-UHFFFAOYSA-N 1 0 300.490 4.449 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000153559114 1052394269 /nfs/dbraw/zinc/39/42/69/1052394269.db2.gz FROMENSHSQNRSQ-MRXNPFEDSA-N 1 0 303.427 4.190 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cc1C ZINC000762623555 1052407347 /nfs/dbraw/zinc/40/73/47/1052407347.db2.gz DCOWZYSTTFHDDS-UHFFFAOYSA-N 1 0 317.379 4.456 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC000763394334 1052624083 /nfs/dbraw/zinc/62/40/83/1052624083.db2.gz BYRDWKMLTDSYNU-LJQANCHMSA-N 1 0 314.860 4.492 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1)CCC2 ZINC000917488124 1052731766 /nfs/dbraw/zinc/73/17/66/1052731766.db2.gz YZLZEXPQSNDKOY-IBGZPJMESA-N 1 0 311.400 4.357 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](OC)c2ccccc2)cc1 ZINC000918749300 1052829517 /nfs/dbraw/zinc/82/95/17/1052829517.db2.gz RUGZZWOZVRHBCY-HXUWFJFHSA-N 1 0 312.457 4.010 20 10 DICDRO CC(C)[N@H+](Cc1cccs1)Cc1c(O)ccc2ccncc21 ZINC000919953858 1052906588 /nfs/dbraw/zinc/90/65/88/1052906588.db2.gz CFJKAMDQAQNRAQ-UHFFFAOYSA-N 1 0 312.438 4.413 20 10 DICDRO CC[C@H](C)[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000920183774 1052925833 /nfs/dbraw/zinc/92/58/33/1052925833.db2.gz WYNQFMCFTYVSJM-GJZGRUSLSA-N 1 0 319.449 4.109 20 10 DICDRO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)o1 ZINC000237574906 1053013312 /nfs/dbraw/zinc/01/33/12/1053013312.db2.gz OIUYJSHVWHPCEU-KSSFIOAISA-N 1 0 310.441 4.075 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Oc1ccc(N(C)C)cc1 ZINC001227939255 1053030324 /nfs/dbraw/zinc/03/03/24/1053030324.db2.gz QBJONMJUMNGKGR-DYESRHJHSA-N 1 0 324.468 4.042 20 10 DICDRO Oc1ccccc1C[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000238096251 1053051522 /nfs/dbraw/zinc/05/15/22/1053051522.db2.gz BDMHZBHYLWZSQH-UHFFFAOYSA-N 1 0 303.405 4.314 20 10 DICDRO C[N@@H+]1CCC[C@H](Oc2ccccc2NN=C2C=CC=CC2=O)C1 ZINC001228419847 1053097405 /nfs/dbraw/zinc/09/74/05/1053097405.db2.gz QQGAEIHCAZQCHI-YISVQYQQSA-N 1 0 311.385 4.281 20 10 DICDRO CCC[N@H+](Cc1ncc(-c2ccccc2)o1)Cc1ccccc1O ZINC000069009966 1053098360 /nfs/dbraw/zinc/09/83/60/1053098360.db2.gz JWEHQCDCGWFQCT-UHFFFAOYSA-N 1 0 322.408 4.459 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+][C@@H]1CCCc2cccnc21 ZINC001350987196 1053125544 /nfs/dbraw/zinc/12/55/44/1053125544.db2.gz JWSMHBLCYRXXJE-NUEKZKHPSA-N 1 0 308.425 4.311 20 10 DICDRO c1ccc(C2(C[NH2+]Cc3ccc(N4CCCC4)cc3)CCC2)cc1 ZINC001318368525 1053165075 /nfs/dbraw/zinc/16/50/75/1053165075.db2.gz WEWJNEGFPUPWMX-UHFFFAOYSA-N 1 0 320.480 4.498 20 10 DICDRO C[C@H]([NH2+]CCc1c(F)cccc1Cl)c1cc(F)ccc1O ZINC001320130618 1053308072 /nfs/dbraw/zinc/30/80/72/1053308072.db2.gz AQOULZMUSMPKGC-JTQLQIEISA-N 1 0 311.759 4.217 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCCOC1CCCC1 ZINC001320119256 1053308362 /nfs/dbraw/zinc/30/83/62/1053308362.db2.gz YVLIRBYZDYNQGO-GDBMZVCRSA-N 1 0 303.446 4.188 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@](C)(O)CCC(C)C ZINC001320119106 1053308559 /nfs/dbraw/zinc/30/85/59/1053308559.db2.gz WNRGKRIZIKZGDX-ZRGWGRIASA-N 1 0 305.462 4.026 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@@H](C)c3c1c(O)ccc3C)CO2 ZINC001320134711 1053310162 /nfs/dbraw/zinc/31/01/62/1053310162.db2.gz ZMEWGUFRPVFHNT-VNQPRFMTSA-N 1 0 309.409 4.281 20 10 DICDRO CCC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001200046185 1053330048 /nfs/dbraw/zinc/33/00/48/1053330048.db2.gz KRZWBGORGXZKNP-GOSISDBHSA-N 1 0 314.448 4.393 20 10 DICDRO CCC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001200046186 1053330368 /nfs/dbraw/zinc/33/03/68/1053330368.db2.gz KRZWBGORGXZKNP-SFHVURJKSA-N 1 0 314.448 4.393 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC001320411890 1053332356 /nfs/dbraw/zinc/33/23/56/1053332356.db2.gz XBGYMUWJHAVLJS-IJEWVQPXSA-N 1 0 313.445 4.377 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc2c(c1)COC2 ZINC001320424392 1053333264 /nfs/dbraw/zinc/33/32/64/1053333264.db2.gz JTZHKXXDUMOPGM-GUYCJALGSA-N 1 0 309.409 4.069 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCSCC(F)(F)F ZINC001320423828 1053333592 /nfs/dbraw/zinc/33/35/92/1053333592.db2.gz CGFIMCNXMDQOIS-QWRGUYRKSA-N 1 0 319.392 4.134 20 10 DICDRO CC[C@H]([NH2+]CCc1coc(-c2ccccc2)n1)c1ccccc1O ZINC001320527445 1053341101 /nfs/dbraw/zinc/34/11/01/1053341101.db2.gz XAEUXEBMAQQJKX-SFHVURJKSA-N 1 0 322.408 4.331 20 10 DICDRO CC(C)(CC(F)(F)F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001320517517 1053342066 /nfs/dbraw/zinc/34/20/66/1053342066.db2.gz CKBWZZGULXVFNI-UHFFFAOYSA-N 1 0 300.368 4.107 20 10 DICDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001320667347 1053353351 /nfs/dbraw/zinc/35/33/51/1053353351.db2.gz OOBPNVWDBUAQAI-MRXNPFEDSA-N 1 0 314.395 4.353 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC000775648394 1053353688 /nfs/dbraw/zinc/35/36/88/1053353688.db2.gz HFAPMZUFMARHBV-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO C[C@@H]([NH2+]CCCCCCO)c1ccc(N2CCCCC2)c(F)c1 ZINC000182146446 1053361314 /nfs/dbraw/zinc/36/13/14/1053361314.db2.gz SVJZPKPCOYBUMO-MRXNPFEDSA-N 1 0 322.468 4.019 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C2(c3ccccc3OC)CCC2)cc1 ZINC001320858865 1053367353 /nfs/dbraw/zinc/36/73/53/1053367353.db2.gz NAHMIMDZCOZKTD-UHFFFAOYSA-N 1 0 324.468 4.320 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCc1ccc2c(c1)CCO2 ZINC001321017863 1053383035 /nfs/dbraw/zinc/38/30/35/1053383035.db2.gz SSRLLCPGKZGNBZ-WMLDXEAASA-N 1 0 323.436 4.016 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCOc1ccccc1F ZINC001321024773 1053383463 /nfs/dbraw/zinc/38/34/63/1053383463.db2.gz VNKJLUDMNZMBLI-DZGCQCFKSA-N 1 0 315.388 4.057 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001321037584 1053385232 /nfs/dbraw/zinc/38/52/32/1053385232.db2.gz OQZXJKFLFWTVFO-BLLLJJGKSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc2c(n1)CCCC2 ZINC001321280802 1053405136 /nfs/dbraw/zinc/40/51/36/1053405136.db2.gz BWYKIFYTUXIXBX-KDOFPFPSSA-N 1 0 322.452 4.313 20 10 DICDRO Fc1cccc(CCC[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001200135741 1053407410 /nfs/dbraw/zinc/40/74/10/1053407410.db2.gz PKPBAGXRUHPGML-UHFFFAOYSA-N 1 0 312.432 4.148 20 10 DICDRO CC[N@@H+]1CC[C@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C1 ZINC001229815108 1053409209 /nfs/dbraw/zinc/40/92/09/1053409209.db2.gz WQSCJUGKBNXKDO-QBNCKDSPSA-N 1 0 311.385 4.281 20 10 DICDRO C[N@@H+]1CCC[C@@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C1 ZINC001229813420 1053409558 /nfs/dbraw/zinc/40/95/58/1053409558.db2.gz HXYGHJBIMPCBEQ-ZBBYCGENSA-N 1 0 311.385 4.281 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCc2cn(C(C)C)nc21)c1ccccc1O ZINC001321387770 1053410651 /nfs/dbraw/zinc/41/06/51/1053410651.db2.gz WIFIMQUJVKACJJ-SJORKVTESA-N 1 0 313.445 4.288 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(OC(C)C)c2)c1 ZINC000182433180 1053433420 /nfs/dbraw/zinc/43/34/20/1053433420.db2.gz KXKHVKXSAWNFAR-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001322714998 1053538949 /nfs/dbraw/zinc/53/89/49/1053538949.db2.gz BIZDRTKMPUVTGK-GJZGRUSLSA-N 1 0 305.462 4.291 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001322714997 1053539780 /nfs/dbraw/zinc/53/97/80/1053539780.db2.gz BIZDRTKMPUVTGK-CABCVRRESA-N 1 0 305.462 4.291 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001323828854 1053603228 /nfs/dbraw/zinc/60/32/28/1053603228.db2.gz DUNZFXLOFZWRCH-YOEHRIQHSA-N 1 0 311.425 4.356 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H](c1cccnc1)C1CC1 ZINC001323828840 1053603421 /nfs/dbraw/zinc/60/34/21/1053603421.db2.gz DOLLRSYQADKRIY-AUJRIZCKSA-N 1 0 308.425 4.385 20 10 DICDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001323831363 1053605488 /nfs/dbraw/zinc/60/54/88/1053605488.db2.gz LVTJLUWLJZDZKD-XHBSWPGZSA-N 1 0 314.429 4.075 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCc1ccc(Cl)nc1 ZINC001323832256 1053605780 /nfs/dbraw/zinc/60/57/80/1053605780.db2.gz UZELXZVCLBBJMW-GXTWGEPZSA-N 1 0 316.832 4.130 20 10 DICDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001323831362 1053605885 /nfs/dbraw/zinc/60/58/85/1053605885.db2.gz LVTJLUWLJZDZKD-WQGACYEGSA-N 1 0 314.429 4.075 20 10 DICDRO CC[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccc1O ZINC000183322494 1053636010 /nfs/dbraw/zinc/63/60/10/1053636010.db2.gz IIUTYYUZQBCCOD-AWEZNQCLSA-N 1 0 314.410 4.350 20 10 DICDRO CCN(CC)[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccsc1 ZINC000183415596 1053654719 /nfs/dbraw/zinc/65/47/19/1053654719.db2.gz HZYSFSIMANRCNJ-YOEHRIQHSA-N 1 0 318.486 4.187 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC001324602311 1053664413 /nfs/dbraw/zinc/66/44/13/1053664413.db2.gz UKEWPONWAPURBP-OAGGEKHMSA-N 1 0 315.457 4.188 20 10 DICDRO C[C@@H](NC(C)(C)C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000183512368 1053671903 /nfs/dbraw/zinc/67/19/03/1053671903.db2.gz AHMJLVAKHDFGOM-CVEARBPZSA-N 1 0 312.457 4.172 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H](Cc2ccccc2)C2CC2)cc1 ZINC001200473125 1053687884 /nfs/dbraw/zinc/68/78/84/1053687884.db2.gz ZYOPBTVZTQESMA-MECCDNJOSA-N 1 0 320.480 4.377 20 10 DICDRO Fc1ccc(CC2C[NH+](Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001324992293 1053692884 /nfs/dbraw/zinc/69/28/84/1053692884.db2.gz LLTKGFCCSJTEPJ-UHFFFAOYSA-N 1 0 324.443 4.100 20 10 DICDRO CN(C)c1ccc(/N=N/c2ccc(O[C@H]3CC[N@H+](C)C3)cc2)cc1 ZINC001231249378 1053710506 /nfs/dbraw/zinc/71/05/06/1053710506.db2.gz OYOVPUOSOCHFDH-GEXZYOHASA-N 1 0 324.428 4.251 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001325356427 1053716209 /nfs/dbraw/zinc/71/62/09/1053716209.db2.gz KDRCPGYRANZEEE-HOCLYGCPSA-N 1 0 311.425 4.356 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCC[C@@H]1CCCCO1 ZINC001325420757 1053719270 /nfs/dbraw/zinc/71/92/70/1053719270.db2.gz BRKWUQTZXJRNNJ-PMPSAXMXSA-N 1 0 303.446 4.188 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1OC1CN(C)C1 ZINC001231328952 1053728500 /nfs/dbraw/zinc/72/85/00/1053728500.db2.gz JUJUSIJDJBCWDC-UHFFFAOYSA-N 1 0 310.401 4.142 20 10 DICDRO CC1(C)CC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001231468634 1053756806 /nfs/dbraw/zinc/75/68/06/1053756806.db2.gz FKFJAZXTJDPQDH-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO C[N@H+](CCc1cccc(F)c1)Cc1c(O)ccc2ccccc21 ZINC001231589587 1053791299 /nfs/dbraw/zinc/79/12/99/1053791299.db2.gz LZUAXTGMQCDKHP-UHFFFAOYSA-N 1 0 309.384 4.359 20 10 DICDRO Cc1cccc(C[NH+]2CCC3(CC2)O[C@@H](C)c2ccccc23)c1O ZINC001231594602 1053791428 /nfs/dbraw/zinc/79/14/28/1053791428.db2.gz JHDTZEZJSRNSPY-INIZCTEOSA-N 1 0 323.436 4.283 20 10 DICDRO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cccc(C)c2O)on1 ZINC001231594235 1053791827 /nfs/dbraw/zinc/79/18/27/1053791827.db2.gz ZGYQPDHVTFBQMQ-UHFFFAOYSA-N 1 0 322.408 4.199 20 10 DICDRO Cc1cccc(OC2CC[NH+](Cc3cccc(C)c3O)CC2)c1 ZINC001231593472 1053792578 /nfs/dbraw/zinc/79/25/78/1053792578.db2.gz HRYCEDDYFUZGFO-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO COc1cccc([C@@H]2CCCC[N@@H+]2Cc2cccc(C)c2O)c1 ZINC001231593408 1053792881 /nfs/dbraw/zinc/79/28/81/1053792881.db2.gz WIMOMNUECPFVME-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1O ZINC001231594777 1053796111 /nfs/dbraw/zinc/79/61/11/1053796111.db2.gz KHVWDEPHGSFPBX-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cc(O)c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)cc1Br ZINC001237676551 1053828144 /nfs/dbraw/zinc/82/81/44/1053828144.db2.gz KUCDPPVFGJRSDJ-CHWSQXEVSA-N 1 0 324.262 4.085 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CC(F)(F)C3)CC2)cc1Cl ZINC001231867992 1053893606 /nfs/dbraw/zinc/89/36/06/1053893606.db2.gz PAWKFIYWAUAKBK-UHFFFAOYSA-N 1 0 315.791 4.365 20 10 DICDRO C[C@H]([NH2+]CCC[C@H]1CCCCO1)c1cc2c(cc1O)CCCC2 ZINC000183991171 1053894604 /nfs/dbraw/zinc/89/46/04/1053894604.db2.gz UYBRLVRLYHATMC-MAUKXSAKSA-N 1 0 317.473 4.271 20 10 DICDRO COc1cccc(CC[N@H+](C)Cc2cc(Cl)c(C)cc2O)c1 ZINC001231870470 1053897655 /nfs/dbraw/zinc/89/76/55/1053897655.db2.gz DCMFUQMCDHTBQU-UHFFFAOYSA-N 1 0 319.832 4.037 20 10 DICDRO CC[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000183989466 1053897700 /nfs/dbraw/zinc/89/77/00/1053897700.db2.gz KLEZIMRHMWZJCS-RTBURBONSA-N 1 0 304.478 4.143 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1Cl ZINC001231869969 1053899710 /nfs/dbraw/zinc/89/97/10/1053899710.db2.gz CPRMJZDEBDGJGA-UHFFFAOYSA-N 1 0 318.848 4.052 20 10 DICDRO Oc1c(CN2CCc3nc(Cl)ccc3C2)ccc2ccccc21 ZINC001231882266 1053904393 /nfs/dbraw/zinc/90/43/93/1053904393.db2.gz OXAXHFDEEZOOAD-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)C(C)(C)c1ccccc1 ZINC001200704525 1053909351 /nfs/dbraw/zinc/90/93/51/1053909351.db2.gz ULIFOAXWNBWDDZ-FQEVSTJZSA-N 1 0 309.453 4.468 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc3ccnc(Cl)c3c1)CC2 ZINC001231977628 1053925618 /nfs/dbraw/zinc/92/56/18/1053925618.db2.gz BXHYGFQUSXUPBZ-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO Cc1ccccc1O[C@H](C)C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001200772624 1053961265 /nfs/dbraw/zinc/96/12/65/1053961265.db2.gz CYZQNCYWIATACH-YPLUBFQTSA-N 1 0 324.468 4.131 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2cccs2)cc1Cl ZINC001232261953 1054006264 /nfs/dbraw/zinc/00/62/64/1054006264.db2.gz VRGYGKCZGPSHAE-GFCCVEGCSA-N 1 0 309.818 4.150 20 10 DICDRO C[N@H+](Cc1cccc(Cl)c1)Cc1cc(Cl)c(O)cc1O ZINC001232261038 1054007873 /nfs/dbraw/zinc/00/78/73/1054007873.db2.gz ACOYBCHDGYUQFX-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO C[N@H+](Cc1cc(Cl)c(O)cc1O)C12CC3CC(CC(C3)C1)C2 ZINC001232261726 1054007895 /nfs/dbraw/zinc/00/78/95/1054007895.db2.gz NEJFECMLNAFLCJ-UHFFFAOYSA-N 1 0 321.848 4.152 20 10 DICDRO CC[N@H+](Cc1ccc(C)cc1)Cc1cc(Cl)c(OC)cc1O ZINC001232269217 1054010524 /nfs/dbraw/zinc/01/05/24/1054010524.db2.gz TYAGKMQIXIBLPE-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO Fc1c(Cl)cccc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001200829920 1054017893 /nfs/dbraw/zinc/01/78/93/1054017893.db2.gz FQDXKKKWWCXHQP-UHFFFAOYSA-N 1 0 305.780 4.094 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c(O)c1 ZINC001330609076 1054043086 /nfs/dbraw/zinc/04/30/86/1054043086.db2.gz XCTIDGRCHVCKBI-LBPRGKRZSA-N 1 0 304.459 4.305 20 10 DICDRO CC[NH2+]Cc1cccc(NCc2ccc(N3CCCC3)cc2)c1 ZINC001331419839 1054073998 /nfs/dbraw/zinc/07/39/98/1054073998.db2.gz SSDYFLVBWFJLBU-UHFFFAOYSA-N 1 0 309.457 4.008 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccc(OC(F)F)c1 ZINC000296182905 1054085529 /nfs/dbraw/zinc/08/55/29/1054085529.db2.gz YEUIPMAOAOAXTJ-ABAIWWIYSA-N 1 0 319.351 4.332 20 10 DICDRO CC[N@H+](Cc1cccc(F)c1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237949419 1054096796 /nfs/dbraw/zinc/09/67/96/1054096796.db2.gz LLBOLOVZFPNGLM-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccnc(Cl)c1C ZINC001232756173 1054115605 /nfs/dbraw/zinc/11/56/05/1054115605.db2.gz ZHOVETGHJJFYKS-UHFFFAOYSA-N 1 0 317.864 4.132 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2C2CCCCC2)c(O)c1 ZINC001232840834 1054127568 /nfs/dbraw/zinc/12/75/68/1054127568.db2.gz LIQZDPGNSUJCRX-GOSISDBHSA-N 1 0 302.462 4.003 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1O)[C@@H](C)c1ccccc1 ZINC001232841710 1054131103 /nfs/dbraw/zinc/13/11/03/1054131103.db2.gz PCNAHZVMCQZDLC-INIZCTEOSA-N 1 0 312.457 4.430 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001332947077 1054133511 /nfs/dbraw/zinc/13/35/11/1054133511.db2.gz RQMGDGAOEXHUDL-GOEBONIOSA-N 1 0 311.425 4.356 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccccc1F ZINC000848556412 1054147530 /nfs/dbraw/zinc/14/75/30/1054147530.db2.gz XHTURFUCFORLTB-BLLLJJGKSA-N 1 0 303.377 4.342 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000848560288 1054148979 /nfs/dbraw/zinc/14/89/79/1054148979.db2.gz KONGBWVZNDUGHQ-DOMZBBRYSA-N 1 0 315.388 4.186 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)Cc1ccccn1)c1cc(Cl)ccc1O ZINC000848564050 1054150997 /nfs/dbraw/zinc/15/09/97/1054150997.db2.gz AMLAVLMWJZPGAB-MLGOLLRUSA-N 1 0 304.821 4.113 20 10 DICDRO CC[C@H]([NH2+][C@H](C)Cc1ccccn1)c1cc(Cl)ccc1O ZINC000848564051 1054151845 /nfs/dbraw/zinc/15/18/45/1054151845.db2.gz AMLAVLMWJZPGAB-WBMJQRKESA-N 1 0 304.821 4.113 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)C1CCC(F)(F)CC1 ZINC000848567714 1054154588 /nfs/dbraw/zinc/15/45/88/1054154588.db2.gz LVJBROIMZAAOBN-MNOVXSKESA-N 1 0 301.352 4.396 20 10 DICDRO CC[C@@H]([NH2+]Cc1noc2ccccc12)c1ccc(N(C)C)cc1 ZINC000848573129 1054156259 /nfs/dbraw/zinc/15/62/59/1054156259.db2.gz QSFBKAYRAQIRNK-QGZVFWFLSA-N 1 0 309.413 4.135 20 10 DICDRO COc1ccc(C[NH2+][C@H](c2ncc(C)s2)C2CC2)cc1C ZINC001334679416 1054195496 /nfs/dbraw/zinc/19/54/96/1054195496.db2.gz FFZIAXLELWVFKC-INIZCTEOSA-N 1 0 302.443 4.009 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC001335523229 1054220230 /nfs/dbraw/zinc/22/02/30/1054220230.db2.gz UGXPBVAVJAVFCS-GMXVVIOVSA-N 1 0 302.443 4.365 20 10 DICDRO CCC[N@H+](Cc1cc(C(C)(C)C)ccc1O)C1CCOCC1 ZINC001233286626 1054224388 /nfs/dbraw/zinc/22/43/88/1054224388.db2.gz BXBUURGKFBVOIU-UHFFFAOYSA-N 1 0 305.462 4.081 20 10 DICDRO CC(C)[N@H+](Cc1cc(C(C)(C)C)ccc1O)C1CCOCC1 ZINC001233287315 1054224509 /nfs/dbraw/zinc/22/45/09/1054224509.db2.gz IQMSDQZYWYRWGI-UHFFFAOYSA-N 1 0 305.462 4.079 20 10 DICDRO CC[N@H+](Cc1cccc(F)c1)Cc1cc(Cl)cc(OC)c1O ZINC001233290371 1054225359 /nfs/dbraw/zinc/22/53/59/1054225359.db2.gz ZGBWSGUDORKSRU-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c1 ZINC001233286348 1054226744 /nfs/dbraw/zinc/22/67/44/1054226744.db2.gz PPUXKTWYJRVZLC-ZDUSSCGKSA-N 1 0 301.352 4.074 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC(c3ccccn3)CC2)c1 ZINC001233286484 1054226996 /nfs/dbraw/zinc/22/69/96/1054226996.db2.gz WDATXBWZIJSBNB-UHFFFAOYSA-N 1 0 324.468 4.464 20 10 DICDRO [O-]c1ccc(F)c(F)c1C[N@@H+]1CCCC[C@@H]1c1ccccc1 ZINC001233331833 1054234131 /nfs/dbraw/zinc/23/41/31/1054234131.db2.gz MSZZOHTXPGOPJP-MRXNPFEDSA-N 1 0 303.352 4.398 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cc3ccccc3[nH]2)cc1F ZINC001337042643 1054256188 /nfs/dbraw/zinc/25/61/88/1054256188.db2.gz PJXZJZMQIWRREX-UHFFFAOYSA-N 1 0 311.404 4.005 20 10 DICDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001337042437 1054256495 /nfs/dbraw/zinc/25/64/95/1054256495.db2.gz MMEKOHARKIYNLA-RBUKOAKNSA-N 1 0 318.530 4.393 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](CN2CCCC2)c2ccccc2)c(O)c1 ZINC000184919769 1054266561 /nfs/dbraw/zinc/26/65/61/1054266561.db2.gz ICUXCPGAMMFKMM-YLJYHZDGSA-N 1 0 324.468 4.188 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC001337797716 1054285434 /nfs/dbraw/zinc/28/54/34/1054285434.db2.gz BWOXDENNNWYZNI-WCQYABFASA-N 1 0 314.454 4.373 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCO[C@@H](C(C)C)C1 ZINC001337785562 1054286102 /nfs/dbraw/zinc/28/61/02/1054286102.db2.gz OEWZYBGYZIODTN-PNBKFKSVSA-N 1 0 303.446 4.042 20 10 DICDRO CCC(CC)(CCO)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001337785385 1054286115 /nfs/dbraw/zinc/28/61/15/1054286115.db2.gz LNJUXAOTVPVOJT-CABCVRRESA-N 1 0 305.462 4.027 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1COc2ccccc2C1 ZINC001337785306 1054286434 /nfs/dbraw/zinc/28/64/34/1054286434.db2.gz KJUGHVBPBJIIGM-VYDXJSESSA-N 1 0 323.436 4.090 20 10 DICDRO Cc1csc(CCC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC001337784707 1054286451 /nfs/dbraw/zinc/28/64/51/1054286451.db2.gz DHDSEIPOFCIUGQ-OCCSQVGLSA-N 1 0 316.470 4.236 20 10 DICDRO COC1CCC(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001337785449 1054286653 /nfs/dbraw/zinc/28/66/53/1054286653.db2.gz NCOVCSOQVFTEDF-SLTXQBBLSA-N 1 0 303.446 4.044 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1O ZINC000848897390 1054288310 /nfs/dbraw/zinc/28/83/10/1054288310.db2.gz HXJDKKNIMXLERE-ZDUSSCGKSA-N 1 0 314.385 4.022 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc(Cl)cn1 ZINC001337801423 1054288441 /nfs/dbraw/zinc/28/84/41/1054288441.db2.gz STPWLCCEEMBMGA-SMDDNHRTSA-N 1 0 302.805 4.087 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc(Cl)cn1 ZINC001337801421 1054288654 /nfs/dbraw/zinc/28/86/54/1054288654.db2.gz STPWLCCEEMBMGA-FZMZJTMJSA-N 1 0 302.805 4.087 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccccc2OC2CCC2)c1O ZINC000848897953 1054289428 /nfs/dbraw/zinc/28/94/28/1054289428.db2.gz XHKOFSYOHDPQEQ-UHFFFAOYSA-N 1 0 311.425 4.176 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](COC)c2cccc(Cl)c2)c1O ZINC000848912852 1054294381 /nfs/dbraw/zinc/29/43/81/1054294381.db2.gz KYTKASSEUBQGOJ-KRWDZBQOSA-N 1 0 319.832 4.085 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@H](OC3CCC3)C2)ccc2ccccc21 ZINC000848925105 1054301334 /nfs/dbraw/zinc/30/13/34/1054301334.db2.gz NNHNVGBTGOKPDP-SFHVURJKSA-N 1 0 311.425 4.079 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)ccc2ccccc21 ZINC000848925104 1054301455 /nfs/dbraw/zinc/30/14/55/1054301455.db2.gz NNHNVGBTGOKPDP-GOSISDBHSA-N 1 0 311.425 4.079 20 10 DICDRO C[C@@]1(F)CCC[N@H+](Cc2cccc(OC(F)(F)F)c2O)CC1 ZINC001233726221 1054344634 /nfs/dbraw/zinc/34/46/34/1054344634.db2.gz AIMNUEMTPRAJEG-CQSZACIVSA-N 1 0 321.314 4.005 20 10 DICDRO C[C@H]1CCC[C@H](C)[NH+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233727166 1054345929 /nfs/dbraw/zinc/34/59/29/1054345929.db2.gz JNLNWSYSVBTVQI-QWRGUYRKSA-N 1 0 303.324 4.054 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@@H]3C[C@H](C)c4c3c(O)ccc4C)nc2c1 ZINC001342405750 1054420641 /nfs/dbraw/zinc/42/06/41/1054420641.db2.gz GEOOVLBTOBGXKS-XJKSGUPXSA-N 1 0 321.424 4.223 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C ZINC001342406511 1054421130 /nfs/dbraw/zinc/42/11/30/1054421130.db2.gz LUMRZCBMYLFXOP-AFGWGNBWSA-N 1 0 315.457 4.042 20 10 DICDRO c1cc(N2CCCC2)ccc1CNc1cc2c(c[nH+]1)CCCC2 ZINC001343620248 1054450233 /nfs/dbraw/zinc/45/02/33/1054450233.db2.gz XPUYGRHAUARLHG-UHFFFAOYSA-N 1 0 307.441 4.173 20 10 DICDRO Nc1ccc(C[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)cc1 ZINC001345159770 1054489820 /nfs/dbraw/zinc/48/98/20/1054489820.db2.gz KWKXTGHCCXUYKB-HNNXBMFYSA-N 1 0 312.310 4.191 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)c1 ZINC000185301909 1054511697 /nfs/dbraw/zinc/51/16/97/1054511697.db2.gz JNFUMMDMRDSNRT-CQSZACIVSA-N 1 0 308.381 4.206 20 10 DICDRO Cc1nccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185346587 1054528373 /nfs/dbraw/zinc/52/83/73/1054528373.db2.gz JUFGAHDENBKBQO-CABCVRRESA-N 1 0 323.440 4.037 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2nc(C(C)(C)C)cs2)c(O)c1 ZINC000185373925 1054531635 /nfs/dbraw/zinc/53/16/35/1054531635.db2.gz ORTLVJJENKFCSG-ZDUSSCGKSA-N 1 0 318.486 4.348 20 10 DICDRO COc1ccc2ccc(O)c(CN3CC[C@H](C)C(F)(F)C3)c2c1 ZINC001234526679 1054543395 /nfs/dbraw/zinc/54/33/95/1054543395.db2.gz XYOUPRBIHZXKHM-LBPRGKRZSA-N 1 0 321.367 4.031 20 10 DICDRO COc1ccc2ccc(O)c(C[N@H+](C)Cc3cccs3)c2c1 ZINC001234552651 1054546822 /nfs/dbraw/zinc/54/68/22/1054546822.db2.gz DPQASEAOZSMASU-UHFFFAOYSA-N 1 0 313.422 4.248 20 10 DICDRO C[C@@H]([NH2+]C[C@](C)(O)c1ccccc1)c1ccc2ccccc2c1O ZINC000185454119 1054548880 /nfs/dbraw/zinc/54/88/80/1054548880.db2.gz OFVWZVBMHARBBF-VFNWGFHPSA-N 1 0 321.420 4.104 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)CCCC(F)(F)F)c1 ZINC000755223978 1054571548 /nfs/dbraw/zinc/57/15/48/1054571548.db2.gz WMLFVGYMZAUPNM-NSHDSACASA-N 1 0 305.340 4.002 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2c[nH]c3c2cccc3C)c1 ZINC000185543863 1054573226 /nfs/dbraw/zinc/57/32/26/1054573226.db2.gz PXHOCOYLMYZGKM-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185566490 1054582714 /nfs/dbraw/zinc/58/27/14/1054582714.db2.gz PRZLERJAZMZMCO-STQMWFEESA-N 1 0 303.377 4.260 20 10 DICDRO Oc1c(C[N@@H+]2CCc3cnccc3C2)cccc1-c1ccccc1 ZINC001234991553 1054637084 /nfs/dbraw/zinc/63/70/84/1054637084.db2.gz MXZAXIMKNVNPDI-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO Oc1c(C[N@@H+]2CCc3ncccc3C2)cccc1-c1ccccc1 ZINC001234997471 1054639826 /nfs/dbraw/zinc/63/98/26/1054639826.db2.gz ZZGJJIKSCBITTO-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO CO[C@H]1CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001234997464 1054640111 /nfs/dbraw/zinc/64/01/11/1054640111.db2.gz ZSXOWNZDRGXAJS-SFHVURJKSA-N 1 0 311.425 4.060 20 10 DICDRO COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(-c2ccccc2)c1O ZINC001234998674 1054641164 /nfs/dbraw/zinc/64/11/64/1054641164.db2.gz MBQBZWVYEWCLLD-DFNIBXOVSA-N 1 0 323.436 4.201 20 10 DICDRO CC(C)O[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234999278 1054641955 /nfs/dbraw/zinc/64/19/55/1054641955.db2.gz RIKCFFHARKTRHO-GOSISDBHSA-N 1 0 311.425 4.059 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c(O)c1 ZINC001235676066 1054769606 /nfs/dbraw/zinc/76/96/06/1054769606.db2.gz PICRLYWDRBIZHZ-HNNXBMFYSA-N 1 0 315.379 4.259 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)c(O)c1 ZINC001235676073 1054771023 /nfs/dbraw/zinc/77/10/23/1054771023.db2.gz PNVFYXBSLLZJEV-SFHVURJKSA-N 1 0 310.441 4.422 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc(C(C)(C)C)cc2O)cc1 ZINC001235684699 1054774746 /nfs/dbraw/zinc/77/47/46/1054774746.db2.gz ZYZVSYXRWUZENT-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO COCC[C@H]1CCCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235685270 1054777899 /nfs/dbraw/zinc/77/78/99/1054777899.db2.gz OCHADYCNCJKSDY-QGZVFWFLSA-N 1 0 305.462 4.081 20 10 DICDRO CCCC[C@H]1CN(Cc2cccc(-c3ccccc3)c2O)CC[NH2+]1 ZINC001236141275 1054967832 /nfs/dbraw/zinc/96/78/32/1054967832.db2.gz JANHDUXSMQFMHK-IBGZPJMESA-N 1 0 324.468 4.023 20 10 DICDRO Nc1ccc(C2CC[NH+](Cc3cc(Cl)ccc3O)CC2)cc1 ZINC001236336448 1055064486 /nfs/dbraw/zinc/06/44/86/1055064486.db2.gz PKLXLEDVGUJNDD-UHFFFAOYSA-N 1 0 316.832 4.007 20 10 DICDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000764140790 1055114844 /nfs/dbraw/zinc/11/48/44/1055114844.db2.gz NFHFTBYWKZJXIO-NRFANRHFSA-N 1 0 324.468 4.106 20 10 DICDRO CC(C)N(Cc1cccc(-c2ccccc2)c1O)[C@@H]1CCC[NH2+]C1 ZINC001236470212 1055129100 /nfs/dbraw/zinc/12/91/00/1055129100.db2.gz BVYAUOIRFUHSAY-LJQANCHMSA-N 1 0 324.468 4.022 20 10 DICDRO C[C@H]([NH2+]C1CCCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000764550983 1055209385 /nfs/dbraw/zinc/20/93/85/1055209385.db2.gz PNVMFYDYCPYDIG-AWEZNQCLSA-N 1 0 322.880 4.160 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)CCc2ccco2)cc1 ZINC000764606286 1055217204 /nfs/dbraw/zinc/21/72/04/1055217204.db2.gz HFMPDBCYUAJJTC-JKSUJKDBSA-N 1 0 300.446 4.408 20 10 DICDRO CC(C)c1ccc(CN([C@H]2CC[NH2+]C2)C2CCCCC2)c(O)c1 ZINC001236663001 1055218712 /nfs/dbraw/zinc/21/87/12/1055218712.db2.gz MRYGSGWPCNGTDG-IBGZPJMESA-N 1 0 316.489 4.012 20 10 DICDRO [O-]c1cc(Cl)c(Cl)cc1C[N@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001236789082 1055259535 /nfs/dbraw/zinc/25/95/35/1055259535.db2.gz BLSWOCWXGPPNJJ-AOOOYVTPSA-N 1 0 322.182 4.176 20 10 DICDRO CC1CC[NH+](Cc2cc(OCc3ccccc3)ccc2O)CC1 ZINC001236791553 1055261304 /nfs/dbraw/zinc/26/13/04/1055261304.db2.gz FMVUQNCFVYXMFL-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001236792457 1055263807 /nfs/dbraw/zinc/26/38/07/1055263807.db2.gz MPGBZXOLMPDBAT-QZTJIDSGSA-N 1 0 323.436 4.203 20 10 DICDRO CCc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(OC)c2)c(O)c1 ZINC001236795529 1055264351 /nfs/dbraw/zinc/26/43/51/1055264351.db2.gz WBMYRTNBWRBLBJ-IBGZPJMESA-N 1 0 311.425 4.300 20 10 DICDRO COc1cc(O)c(C[N@@H+]2Cc3ccccc3C[C@H]2C)c(Cl)c1 ZINC001236809130 1055270623 /nfs/dbraw/zinc/27/06/23/1055270623.db2.gz SULIUYLKPOEJMY-GFCCVEGCSA-N 1 0 317.816 4.001 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)c(Cl)c1 ZINC001236808905 1055273101 /nfs/dbraw/zinc/27/31/01/1055273101.db2.gz RPLDIAVNHCSGPU-CHWSQXEVSA-N 1 0 309.837 4.066 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(O)c1 ZINC001236814569 1055273688 /nfs/dbraw/zinc/27/36/88/1055273688.db2.gz UXLTVRHYUZEIKV-SFHVURJKSA-N 1 0 315.388 4.185 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001236826415 1055281614 /nfs/dbraw/zinc/28/16/14/1055281614.db2.gz JCFWPZILJIUHRI-MRXNPFEDSA-N 1 0 309.331 4.115 20 10 DICDRO Cc1ccc2c(c1)CC[N@@H+](Cc1cc3ccccc3cc1O)C2 ZINC001236835199 1055284392 /nfs/dbraw/zinc/28/43/92/1055284392.db2.gz KXEKOQBZTQACSK-UHFFFAOYSA-N 1 0 303.405 4.412 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2cc3ccccc3cc2O)c1 ZINC001236841979 1055288683 /nfs/dbraw/zinc/28/86/83/1055288683.db2.gz RDSCZQDQSWVOQB-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO C[C@@H]([NH2+]CCCOc1ccccc1F)c1ccc(N(C)C)cc1 ZINC000764924531 1055297560 /nfs/dbraw/zinc/29/75/60/1055297560.db2.gz BJLMCJKWYQENMN-OAHLLOKOSA-N 1 0 316.420 4.011 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1nc3ccccc3cc1Cl)CC2 ZINC001236877227 1055303905 /nfs/dbraw/zinc/30/39/05/1055303905.db2.gz NJWFIELFLSDIGJ-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO CCC[N@@H+](Cc1ccc(N2CCOCC2)cc1Cl)CC(C)C ZINC001236928642 1055317435 /nfs/dbraw/zinc/31/74/35/1055317435.db2.gz AENCZAMDILISRK-UHFFFAOYSA-N 1 0 324.896 4.045 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC(=O)[C@H](C)C23CCCC3)c(O)c1 ZINC001237051285 1055349425 /nfs/dbraw/zinc/34/94/25/1055349425.db2.gz JOQYTNOSSGWUJD-HNNXBMFYSA-N 1 0 315.457 4.239 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2C)c(O)c1 ZINC001237050880 1055349489 /nfs/dbraw/zinc/34/94/89/1055349489.db2.gz XZTMVHNSCFKFMW-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC(OC3CCC3)CC2)c(O)c1 ZINC001237046741 1055350119 /nfs/dbraw/zinc/35/01/19/1055350119.db2.gz WRKOJDQWAQSLLS-UHFFFAOYSA-N 1 0 303.446 4.049 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCN(C)[C@@H](c3ccccc3)C2)c(O)c1 ZINC001237054293 1055352961 /nfs/dbraw/zinc/35/29/61/1055352961.db2.gz VCKSKJGLNBSOSK-HXUWFJFHSA-N 1 0 324.468 4.004 20 10 DICDRO C[C@H]1CCCCC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001237055502 1055355667 /nfs/dbraw/zinc/35/56/67/1055355667.db2.gz NNHDXULHKUGBCC-LBPRGKRZSA-N 1 0 317.351 4.098 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 ZINC000765301258 1055358023 /nfs/dbraw/zinc/35/80/23/1055358023.db2.gz TYXLQULYQXRTFX-FGTMMUONSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCC[C@H]1C)c1ccc(N2CCOCC2)cc1 ZINC000765342486 1055367135 /nfs/dbraw/zinc/36/71/35/1055367135.db2.gz FVVJMEBQRAWFAD-ZIFCJYIRSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@@]1(F)CCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001237137848 1055378033 /nfs/dbraw/zinc/37/80/33/1055378033.db2.gz OZLUJNFDTMYIEZ-CQSZACIVSA-N 1 0 305.315 4.125 20 10 DICDRO C[C@@]1(F)CCCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237137878 1055378594 /nfs/dbraw/zinc/37/85/94/1055378594.db2.gz QGGXGKLRJYYUAT-CQSZACIVSA-N 1 0 305.315 4.125 20 10 DICDRO CC1(C)C[N@H+](Cc2c(O)ccc(F)c2Cl)CCC1(F)F ZINC001237125435 1055380392 /nfs/dbraw/zinc/38/03/92/1055380392.db2.gz ZRQCNZZGQGYTSX-UHFFFAOYSA-N 1 0 307.743 4.052 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001237122707 1055380893 /nfs/dbraw/zinc/38/08/93/1055380893.db2.gz LAOSBBGSNYRFBD-AAEUAGOBSA-N 1 0 315.335 4.055 20 10 DICDRO C[C@H]([NH2+]CCc1ccc2ccccc2n1)c1ccc(N(C)C)cc1 ZINC000765455075 1055393740 /nfs/dbraw/zinc/39/37/40/1055393740.db2.gz AMMLPFZQDXJFQC-INIZCTEOSA-N 1 0 319.452 4.194 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)cc1F ZINC000765475191 1055401172 /nfs/dbraw/zinc/40/11/72/1055401172.db2.gz JZDKKWPDQXMPOL-MRXNPFEDSA-N 1 0 316.420 4.288 20 10 DICDRO C[C@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000765482875 1055403595 /nfs/dbraw/zinc/40/35/95/1055403595.db2.gz WHKUNZSMDJJVBX-YCRPNKLZSA-N 1 0 306.453 4.092 20 10 DICDRO CC[C@H]([NH2+]CCCOC1CCCC1)c1ccc(N(C)C)cc1 ZINC000765502503 1055410208 /nfs/dbraw/zinc/41/02/08/1055410208.db2.gz TWMMOYIYJBXNIG-IBGZPJMESA-N 1 0 304.478 4.143 20 10 DICDRO CC(C)(C)Oc1ccc([C@@H]2CC[N@H+](Cc3ccc(N)cc3)C2)cc1 ZINC001237266771 1055411020 /nfs/dbraw/zinc/41/10/20/1055411020.db2.gz ZSHBODPCLLYMRB-GOSISDBHSA-N 1 0 324.468 4.436 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC3(CCNc4ccccc43)CC2)c1 ZINC001237322994 1055426194 /nfs/dbraw/zinc/42/61/94/1055426194.db2.gz NERBPPFOZCHZOK-UHFFFAOYSA-N 1 0 322.452 4.050 20 10 DICDRO C[C@@H]([NH2+][C@H](CO)C1CCCCC1)c1ccc2ccccc2c1O ZINC000386213623 1055435390 /nfs/dbraw/zinc/43/53/90/1055435390.db2.gz UIGLGKWTAAOFOZ-AUUYWEPGSA-N 1 0 313.441 4.137 20 10 DICDRO C[C@H]([NH2+]C1(c2ccccc2F)CCC1)c1cc(F)ccc1O ZINC000842906406 1055435399 /nfs/dbraw/zinc/43/53/99/1055435399.db2.gz UGDXENZOVBXBTH-LBPRGKRZSA-N 1 0 303.352 4.400 20 10 DICDRO COc1cccc([C@@H]2CCCC[N@@H+]2Cc2c(C)cccc2O)c1 ZINC001237488991 1055458274 /nfs/dbraw/zinc/45/82/74/1055458274.db2.gz BFDQMIPSVURXNZ-IBGZPJMESA-N 1 0 311.425 4.436 20 10 DICDRO Cc1ccc(OC2CC[NH+](Cc3c(C)cccc3O)CC2)cc1 ZINC001237488895 1055458635 /nfs/dbraw/zinc/45/86/35/1055458635.db2.gz ADJRIMQKJOWWQC-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC001237483965 1055458709 /nfs/dbraw/zinc/45/87/09/1055458709.db2.gz WQRCHNAUJMLSDB-NRFANRHFSA-N 1 0 318.420 4.107 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001237490136 1055459267 /nfs/dbraw/zinc/45/92/67/1055459267.db2.gz QBDMDKSUZNITOO-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CCCc2ccccc2C1 ZINC001237621234 1055486132 /nfs/dbraw/zinc/48/61/32/1055486132.db2.gz XWRXHESKUTVNCJ-UHFFFAOYSA-N 1 0 305.780 4.133 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)cc1C ZINC001620859915 1055488225 /nfs/dbraw/zinc/48/82/25/1055488225.db2.gz GNFLYZRZCNBANW-SFHVURJKSA-N 1 0 317.473 4.365 20 10 DICDRO COC[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccc1 ZINC001620864640 1055491898 /nfs/dbraw/zinc/49/18/98/1055491898.db2.gz IXDNRFSMCARTCC-NRFANRHFSA-N 1 0 324.468 4.154 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1c(C)noc1C ZINC001620866157 1055494268 /nfs/dbraw/zinc/49/42/68/1055494268.db2.gz FGZKSCBGBBWRNM-MRXNPFEDSA-N 1 0 311.429 4.332 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCC[C@@H]1CF ZINC001237648765 1055495322 /nfs/dbraw/zinc/49/53/22/1055495322.db2.gz GVROYUVMMIWLMX-QGZVFWFLSA-N 1 0 303.352 4.132 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC3(CCOC3(C)C)CC2)c1O ZINC001237689716 1055503020 /nfs/dbraw/zinc/50/30/20/1055503020.db2.gz PBRVSFNRJDBFEP-UHFFFAOYSA-N 1 0 323.864 4.135 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c1O ZINC001237684279 1055504229 /nfs/dbraw/zinc/50/42/29/1055504229.db2.gz AJBDECXAGHHRBE-OAHLLOKOSA-N 1 0 311.828 4.458 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccsc2S1 ZINC000765607392 1055509840 /nfs/dbraw/zinc/50/98/40/1055509840.db2.gz DNQPEWFYRMBUHK-XHDPSFHLSA-N 1 0 317.479 4.398 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2ccccc2n1 ZINC000765607356 1055509873 /nfs/dbraw/zinc/50/98/73/1055509873.db2.gz BYZVXCINFLEVKV-AWEZNQCLSA-N 1 0 304.393 4.021 20 10 DICDRO Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCO3)CCCO2 ZINC000765609986 1055513117 /nfs/dbraw/zinc/51/31/17/1055513117.db2.gz SVYSHMGQXDBOFO-LJQANCHMSA-N 1 0 323.436 4.242 20 10 DICDRO Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)CCCO2 ZINC000765609976 1055513428 /nfs/dbraw/zinc/51/34/28/1055513428.db2.gz SHZPHQHSCANTMZ-IBGZPJMESA-N 1 0 323.436 4.242 20 10 DICDRO CCC1(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)CCCCC1 ZINC001620893029 1055516702 /nfs/dbraw/zinc/51/67/02/1055516702.db2.gz AEICVFTZRODARO-UHFFFAOYSA-N 1 0 310.432 4.481 20 10 DICDRO CC[C@@H](C)N(C)CC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765654621 1055532180 /nfs/dbraw/zinc/53/21/80/1055532180.db2.gz LAFIABKHYJWNOB-MSOLQXFVSA-N 1 0 317.521 4.058 20 10 DICDRO CC[C@H](C)N(C)CC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765654625 1055533136 /nfs/dbraw/zinc/53/31/36/1055533136.db2.gz LAFIABKHYJWNOB-ROUUACIJSA-N 1 0 317.521 4.058 20 10 DICDRO [O-]c1c(Cl)cc(F)cc1C[NH+]1CCC2(CC[C@H](F)C2)CC1 ZINC001237800769 1055533244 /nfs/dbraw/zinc/53/32/44/1055533244.db2.gz BCRIGBBPMCYRQD-LBPRGKRZSA-N 1 0 315.791 4.289 20 10 DICDRO [O-]c1c(Cl)cc(F)cc1C[NH+]1CCC2(CC(F)(F)C2)CC1 ZINC001237804693 1055535103 /nfs/dbraw/zinc/53/51/03/1055535103.db2.gz DYARYVGRRKJQOE-UHFFFAOYSA-N 1 0 319.754 4.196 20 10 DICDRO [O-]c1c(Cl)cc(Cl)cc1CNc1ccc2[nH]cnc2c1 ZINC001620932060 1055548122 /nfs/dbraw/zinc/54/81/22/1055548122.db2.gz WQQWEHGOGAEOAG-UHFFFAOYSA-N 1 0 308.168 4.187 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000186155489 1055559417 /nfs/dbraw/zinc/55/94/17/1055559417.db2.gz BHACMDCZUIVZPE-HNNXBMFYSA-N 1 0 317.473 4.128 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000186155503 1055559579 /nfs/dbraw/zinc/55/95/79/1055559579.db2.gz BHACMDCZUIVZPE-OAHLLOKOSA-N 1 0 317.473 4.128 20 10 DICDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(F)c(Cl)cc1[O-] ZINC001237950422 1055564131 /nfs/dbraw/zinc/56/41/31/1055564131.db2.gz SXOKDZUIWUEHTO-LLVKDONJSA-N 1 0 323.795 4.386 20 10 DICDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(F)cc(C)c2O)c1 ZINC001238071399 1055600973 /nfs/dbraw/zinc/60/09/73/1055600973.db2.gz WTKCTAPSFWJFGT-GOSISDBHSA-N 1 0 315.388 4.185 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001620964519 1055663311 /nfs/dbraw/zinc/66/33/11/1055663311.db2.gz VBIMVOGGXLAIOC-JTGQJZMRSA-N 1 0 324.468 4.434 20 10 DICDRO CC[N@H+](Cc1cc(C)cc(SC)c1)Cc1ccccc1O ZINC001238682754 1055721161 /nfs/dbraw/zinc/72/11/61/1055721161.db2.gz PBLKWRPXPMFKBD-UHFFFAOYSA-N 1 0 301.455 4.445 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2csc(C(C)(C)C)n2)c(O)c1 ZINC000186202121 1055936120 /nfs/dbraw/zinc/93/61/20/1055936120.db2.gz MCLWIVGNROGWGF-CYBMUJFWSA-N 1 0 318.486 4.348 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC001620985182 1055959001 /nfs/dbraw/zinc/95/90/01/1055959001.db2.gz XKODPQCNFHXCPG-IEBWSBKVSA-N 1 0 304.437 4.380 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C/C=C\c2ccc(F)cc2F)c1 ZINC001620989578 1055961955 /nfs/dbraw/zinc/96/19/55/1055961955.db2.gz HMUARQQAQSLZII-MVZIDQBPSA-N 1 0 319.351 4.043 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3C[C@H]3CC(C)(C)C)CC2)cc1 ZINC001620997124 1055964959 /nfs/dbraw/zinc/96/49/59/1055964959.db2.gz XPWJUAPSEVZXBC-HNAYVOBHSA-N 1 0 316.489 4.078 20 10 DICDRO C[C@H]1CC(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C[C@@H](C)C1 ZINC001620999418 1055968937 /nfs/dbraw/zinc/96/89/37/1055968937.db2.gz QAOZRDRQMUVVCX-UCCYTTEQSA-N 1 0 300.490 4.428 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2cccc(F)c2F)cc1 ZINC001620792284 1055970105 /nfs/dbraw/zinc/97/01/05/1055970105.db2.gz SYWAKBQRSZUUAW-UHFFFAOYSA-N 1 0 318.411 4.143 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001621023687 1055988862 /nfs/dbraw/zinc/98/88/62/1055988862.db2.gz VJPGLTIWRPYLCR-HNNXBMFYSA-N 1 0 308.208 4.476 20 10 DICDRO Cc1cc(CC[NH2+]Cc2ccccc2)c(C)n1-c1ccccc1 ZINC001621025094 1055990612 /nfs/dbraw/zinc/99/06/12/1055990612.db2.gz ZQQZBGZRVVKIGA-UHFFFAOYSA-N 1 0 304.437 4.426 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCOc2ccccc2C)cc1 ZINC001620738972 1055991665 /nfs/dbraw/zinc/99/16/65/1055991665.db2.gz UDXWNYCFBXGGSU-UHFFFAOYSA-N 1 0 312.457 4.010 20 10 DICDRO Cc1ccc(C[C@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)s1 ZINC001620803760 1055998420 /nfs/dbraw/zinc/99/84/20/1055998420.db2.gz DYBNIMHIEJLWBS-NSHDSACASA-N 1 0 324.440 4.122 20 10 DICDRO COc1cc2ccccc2cc1C[NH2+][C@@H](C)c1ccccc1O ZINC001621053041 1056009862 /nfs/dbraw/zinc/00/98/62/1056009862.db2.gz ZHODLCSIFUULRL-AWEZNQCLSA-N 1 0 307.393 4.405 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCCO[C@H]1C(C)C ZINC001620818767 1056100926 /nfs/dbraw/zinc/10/09/26/1056100926.db2.gz FJSSCGUYVUCOIX-JXFKEZNVSA-N 1 0 314.473 4.028 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCCO[C@@H]1C(C)C ZINC001620818769 1056101183 /nfs/dbraw/zinc/10/11/83/1056101183.db2.gz FJSSCGUYVUCOIX-OXQOHEQNSA-N 1 0 314.473 4.028 20 10 DICDRO C[C@H](CCc1ccsc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000765806772 1056134966 /nfs/dbraw/zinc/13/49/66/1056134966.db2.gz DAXUQFJNNNTNBL-MRXNPFEDSA-N 1 0 314.498 4.459 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC001203558686 1056139422 /nfs/dbraw/zinc/13/94/22/1056139422.db2.gz VJDBTJRYZZFWNN-QGZVFWFLSA-N 1 0 317.816 4.089 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000186423277 1056200569 /nfs/dbraw/zinc/20/05/69/1056200569.db2.gz TXSFGOGCSSJSIC-BPAFIMBUSA-N 1 0 312.457 4.124 20 10 DICDRO C[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)Cc1cccs1 ZINC001620821404 1056224635 /nfs/dbraw/zinc/22/46/35/1056224635.db2.gz VUYQIOYZSGBXQS-DQOPKJQZSA-N 1 0 314.498 4.296 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)CC(F)(F)F)cc1F ZINC000765881541 1056352895 /nfs/dbraw/zinc/35/28/95/1056352895.db2.gz SHXCAQVKRWFJMI-NSHDSACASA-N 1 0 306.347 4.102 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)CC(F)(F)F)cc1F ZINC000765881538 1056353079 /nfs/dbraw/zinc/35/30/79/1056353079.db2.gz SHXCAQVKRWFJMI-LLVKDONJSA-N 1 0 306.347 4.102 20 10 DICDRO C[N@H+](CCSc1ncc(Cl)s1)Cc1ccc(F)cc1 ZINC001614767354 1056451216 /nfs/dbraw/zinc/45/12/16/1056451216.db2.gz BFXYSVAYOIWGKJ-UHFFFAOYSA-N 1 0 316.854 4.160 20 10 DICDRO Cc1ccccc1[C@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001615363827 1056498631 /nfs/dbraw/zinc/49/86/31/1056498631.db2.gz XKTYJDULTWMBKU-IBGZPJMESA-N 1 0 308.469 4.359 20 10 DICDRO Cn1ccc2ccc(-c3cncc(C[NH+]4CCCCC4)c3)cc21 ZINC001240574875 1056584527 /nfs/dbraw/zinc/58/45/27/1056584527.db2.gz HZTFYMIHUMMJLQ-UHFFFAOYSA-N 1 0 305.425 4.226 20 10 DICDRO CC(C)[C@](C)(O)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765955491 1056621946 /nfs/dbraw/zinc/62/19/46/1056621946.db2.gz WNHSKIYBZVYVML-FXAWDEMLSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@@H]([NH2+]C[C@]1(C)CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000765957905 1056649387 /nfs/dbraw/zinc/64/93/87/1056649387.db2.gz KVLLGPXQQUSIIU-XLIONFOSSA-N 1 0 316.489 4.144 20 10 DICDRO c1ccc([C@H]2C[C@H]([NH2+]Cc3ccc4c(c3)CCCO4)CCO2)cc1 ZINC000922000525 1056723596 /nfs/dbraw/zinc/72/35/96/1056723596.db2.gz MDGNCZHSXUFLBB-TZIWHRDSSA-N 1 0 323.436 4.022 20 10 DICDRO CCC[C@@H](C)CCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC001616865647 1056730093 /nfs/dbraw/zinc/73/00/93/1056730093.db2.gz MSDDRTXHCCPDNH-MSOLQXFVSA-N 1 0 318.505 4.390 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCc3cc(F)cc(C)c3C2)cc1 ZINC001617491768 1056841547 /nfs/dbraw/zinc/84/15/47/1056841547.db2.gz HXGUGFSUIBGMOZ-UHFFFAOYSA-N 1 0 312.432 4.149 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1cc(F)ccc1F ZINC001617538851 1056846367 /nfs/dbraw/zinc/84/63/67/1056846367.db2.gz NKCDGUDZGXZSES-UHFFFAOYSA-N 1 0 305.368 4.473 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@@H]1Cc2cccc(Cl)c2C1 ZINC001168703668 1056883843 /nfs/dbraw/zinc/88/38/43/1056883843.db2.gz JBUUHBAAZJVVAD-QGZVFWFLSA-N 1 0 323.823 4.456 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)[C@@H](C)c1nc(C2CC2)no1 ZINC000282336687 1056933043 /nfs/dbraw/zinc/93/30/43/1056933043.db2.gz BKYYQOYJTAIMFH-ZDUSSCGKSA-N 1 0 315.417 4.016 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1cc2cnccc2o1 ZINC000922320582 1057005974 /nfs/dbraw/zinc/00/59/74/1057005974.db2.gz LXOOKLWYERWMFK-CYBMUJFWSA-N 1 0 308.381 4.004 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@H](C2CCOCC2)C1)c1ccccc1O ZINC000922330654 1057010310 /nfs/dbraw/zinc/01/03/10/1057010310.db2.gz YLBSKYABIULNGF-XIRDDKMYSA-N 1 0 303.446 4.028 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)c1ncc(C)s1)c1ccc(N(C)C)cc1 ZINC000186772631 1057121949 /nfs/dbraw/zinc/12/19/49/1057121949.db2.gz PWIRPYQLBUVAJH-CXAGYDPISA-N 1 0 317.502 4.362 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000766030625 1057131473 /nfs/dbraw/zinc/13/14/73/1057131473.db2.gz VEGYBLBRRZAWDI-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CCCCC1 ZINC000186883975 1057143685 /nfs/dbraw/zinc/14/36/85/1057143685.db2.gz ONYCFZRUCUVWDF-CQSZACIVSA-N 1 0 309.425 4.169 20 10 DICDRO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(C)cc(C)c1O)CCC2 ZINC000164321257 1057185572 /nfs/dbraw/zinc/18/55/72/1057185572.db2.gz NRLRJWLHNNWJHM-INIZCTEOSA-N 1 0 316.470 4.283 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000766062158 1057266661 /nfs/dbraw/zinc/26/66/61/1057266661.db2.gz VJCYFFWYXXYGQK-APWZRJJASA-N 1 0 318.505 4.125 20 10 DICDRO COc1cc(C)ccc1[C@@H](C)[NH2+]CCCSc1nccs1 ZINC000766073646 1057286155 /nfs/dbraw/zinc/28/61/55/1057286155.db2.gz SBSXOWFFRXNWSO-CYBMUJFWSA-N 1 0 322.499 4.293 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)CCC(C)(C)C)CC2)cc1 ZINC000766074925 1057287794 /nfs/dbraw/zinc/28/77/94/1057287794.db2.gz JLBOWOKRYUQISC-INIZCTEOSA-N 1 0 318.505 4.468 20 10 DICDRO C[C@H](CCC(C)(C)C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000766075315 1057287875 /nfs/dbraw/zinc/28/78/75/1057287875.db2.gz LTLVVJYJJCKEPZ-SJORKVTESA-N 1 0 318.505 4.389 20 10 DICDRO CCc1cc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)on1 ZINC000766137519 1057374357 /nfs/dbraw/zinc/37/43/57/1057374357.db2.gz ZRVPPCDJJMKDLM-OAHLLOKOSA-N 1 0 313.445 4.078 20 10 DICDRO CC[C@H]([NH2+]CCCCCC[NH3+])c1cc(Cl)cc(Cl)c1[O-] ZINC000843340666 1057378735 /nfs/dbraw/zinc/37/87/35/1057378735.db2.gz DHEDGFRHWYCJSU-AWEZNQCLSA-N 1 0 319.276 4.259 20 10 DICDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1c(O)cccc1Br ZINC000706809769 1057481805 /nfs/dbraw/zinc/48/18/05/1057481805.db2.gz MKFUAHIOBBQZKI-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO C[C@@H](C[N@H+](C)Cc1c(O)ccc2ccncc21)c1ccccc1 ZINC000727427283 1057654010 /nfs/dbraw/zinc/65/40/10/1057654010.db2.gz GGLHMUDREYFRSR-HNNXBMFYSA-N 1 0 306.409 4.176 20 10 DICDRO CCCCCC[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000727463938 1057655059 /nfs/dbraw/zinc/65/50/59/1057655059.db2.gz NHJDOGZQOIOSAH-INIZCTEOSA-N 1 0 322.468 4.111 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H](c3ccccc3F)C1)CCC2 ZINC000730453824 1057715110 /nfs/dbraw/zinc/71/51/10/1057715110.db2.gz CBBKXZHETGFVKK-MRXNPFEDSA-N 1 0 311.400 4.010 20 10 DICDRO Oc1ccccc1C[NH2+][C@H](COc1ccccc1)c1ccccc1 ZINC000730818195 1057726681 /nfs/dbraw/zinc/72/66/81/1057726681.db2.gz LCLGADSHHJHWTH-HXUWFJFHSA-N 1 0 319.404 4.302 20 10 DICDRO Cc1cc(CC[NH2+][C@@H](C)c2cccnc2)c(C)n1-c1ccccc1 ZINC000732916566 1057790040 /nfs/dbraw/zinc/79/00/40/1057790040.db2.gz PPRFGKKYYRIIFS-KRWDZBQOSA-N 1 0 319.452 4.382 20 10 DICDRO Oc1ccccc1C[N@H+](CCCC(F)(F)F)Cc1ccco1 ZINC001120007259 1057790379 /nfs/dbraw/zinc/79/03/79/1057790379.db2.gz MOWVXAPAVCOATO-UHFFFAOYSA-N 1 0 313.319 4.330 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1 ZINC000733325998 1057812868 /nfs/dbraw/zinc/81/28/68/1057812868.db2.gz CIYUQKMRPQQILW-QGZVFWFLSA-N 1 0 304.384 4.272 20 10 DICDRO COc1ccc(C(C)(C)C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000733328683 1057813510 /nfs/dbraw/zinc/81/35/10/1057813510.db2.gz ZXBJHTWQWNNRSG-UHFFFAOYSA-N 1 0 319.832 4.122 20 10 DICDRO Cc1ccccc1C1(C[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000733327852 1057813717 /nfs/dbraw/zinc/81/37/17/1057813717.db2.gz YHSIMUGSZROTRA-UHFFFAOYSA-N 1 0 301.817 4.175 20 10 DICDRO Nc1ccc(C[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)cc1 ZINC001246168384 1058712946 /nfs/dbraw/zinc/71/29/46/1058712946.db2.gz CWJUBCIWCPWFBA-HNNXBMFYSA-N 1 0 321.251 4.223 20 10 DICDRO Cc1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cs1 ZINC001559492053 1059268539 /nfs/dbraw/zinc/26/85/39/1059268539.db2.gz CAFFWIXWIDGDMN-UHFFFAOYSA-N 1 0 300.471 4.287 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)CC[C@@H]1c1ccccc1 ZINC001559565165 1059389957 /nfs/dbraw/zinc/38/99/57/1059389957.db2.gz GFNTWWQOYUUEJG-UTKZUKDTSA-N 1 0 308.469 4.378 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cc(O)ccc1Cl ZINC001559570172 1059402032 /nfs/dbraw/zinc/40/20/32/1059402032.db2.gz NSHAXXSCCSJFSG-UHFFFAOYSA-N 1 0 305.805 4.163 20 10 DICDRO Cc1cccc([C@H]2CC[N@@H+](Cc3ccc(N(C)C)c(C)c3)C2)c1 ZINC001559743903 1059578596 /nfs/dbraw/zinc/57/85/96/1059578596.db2.gz WXGXWJYLFFJURV-FQEVSTJZSA-N 1 0 308.469 4.359 20 10 DICDRO CCS[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001559761683 1059598621 /nfs/dbraw/zinc/59/86/21/1059598621.db2.gz DVRZKBGEWDQBEA-AEFFLSMTSA-N 1 0 306.519 4.215 20 10 DICDRO CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N(C)CC)cc1 ZINC001559762911 1059600327 /nfs/dbraw/zinc/60/03/27/1059600327.db2.gz XEEWSMWBOUCNHE-ZWKOTPCHSA-N 1 0 306.519 4.297 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H]2CCC(C)(C)C[C@@H]2C)c1O ZINC001559775340 1059612839 /nfs/dbraw/zinc/61/28/39/1059612839.db2.gz JSLKWZXBGQPQQI-ZBEGNZNMSA-N 1 0 307.409 4.038 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@@H](OC(C)(C)C)C2(C)C)cc1C ZINC001559902547 1059716374 /nfs/dbraw/zinc/71/63/74/1059716374.db2.gz ZDIFOMGDFKENTF-DLBZAZTESA-N 1 0 305.462 4.075 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCc3ccsc3[C@@H]2C)cc1 ZINC001560112983 1059918685 /nfs/dbraw/zinc/91/86/85/1059918685.db2.gz UNSPAWGTHXDNJR-AWEZNQCLSA-N 1 0 300.471 4.324 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2onc(C)c2c1 ZINC001248712227 1059947911 /nfs/dbraw/zinc/94/79/11/1059947911.db2.gz KMJAVSNYLBOCHL-UHFFFAOYSA-N 1 0 323.440 4.224 20 10 DICDRO CC(C)(C)c1cc(O)c(C[N@@H+]2CC[C@]3(CCCO3)C2)cc1Cl ZINC001248881508 1060029716 /nfs/dbraw/zinc/02/97/16/1060029716.db2.gz YFBVJXUJDBLXGD-GOSISDBHSA-N 1 0 323.864 4.098 20 10 DICDRO CC(C)(C)c1cc(O)c(C[N@H+]2[C@@H]3CC[C@H]2CC(=O)C3)cc1Cl ZINC001248881507 1060031262 /nfs/dbraw/zinc/03/12/62/1060031262.db2.gz YEIWXAQNNYVTLU-BETUJISGSA-N 1 0 321.848 4.039 20 10 DICDRO CC(C)(C)c1cc(O)c(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)cc1Cl ZINC001248885453 1060041230 /nfs/dbraw/zinc/04/12/30/1060041230.db2.gz XHWKPZFYXXEXHW-WBIUFABUSA-N 1 0 311.828 4.275 20 10 DICDRO Cc1cccc(C(C)(C)C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC001560299526 1060084187 /nfs/dbraw/zinc/08/41/87/1060084187.db2.gz DXKSWNLLYSZPQQ-UHFFFAOYSA-N 1 0 314.448 4.268 20 10 DICDRO COc1cccc2c(C[NH2+]Cc3ccc4c(c3)CCO4)cccc12 ZINC001560302838 1060090270 /nfs/dbraw/zinc/09/02/70/1060090270.db2.gz NJAICUMJDGQWAT-UHFFFAOYSA-N 1 0 319.404 4.073 20 10 DICDRO CC[C@@H](C[NH2+]Cc1ccc(OC)c(C)c1)Oc1cccc(F)c1 ZINC001560366141 1060153676 /nfs/dbraw/zinc/15/36/76/1060153676.db2.gz SVIZHKYXCAQUCA-KRWDZBQOSA-N 1 0 317.404 4.090 20 10 DICDRO COc1cc(C[NH2+]C[C@]2(C)CCCS2)c(O)c(C(C)(C)C)c1 ZINC001560394972 1060181774 /nfs/dbraw/zinc/18/17/74/1060181774.db2.gz XIMSZKWEVDUUKV-SFHVURJKSA-N 1 0 323.502 4.074 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2(C)Cc3ccccc3C2)cc1 ZINC001560397934 1060183692 /nfs/dbraw/zinc/18/36/92/1060183692.db2.gz SPVJRGWFGASYSL-UHFFFAOYSA-N 1 0 322.496 4.428 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CCC1(F)F ZINC001249224249 1060192418 /nfs/dbraw/zinc/19/24/18/1060192418.db2.gz WEUWBBROWDZWLI-GFCCVEGCSA-N 1 0 323.383 4.054 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@H+]3C[C@@H]4CCCC[C@@H]4C3)ccc2O1 ZINC001249223993 1060192495 /nfs/dbraw/zinc/19/24/95/1060192495.db2.gz QGVLGWAPMDRFRH-GASCZTMLSA-N 1 0 313.441 4.198 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCC[C@](C)(F)CC3)ccc2O1 ZINC001249223129 1060193877 /nfs/dbraw/zinc/19/38/77/1060193877.db2.gz AFJFUTFQFRPCIG-IBGZPJMESA-N 1 0 319.420 4.291 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCc4ccccc4C3)ccc2O1 ZINC001249223399 1060194301 /nfs/dbraw/zinc/19/43/01/1060194301.db2.gz FAMDRHRYFWICSK-UHFFFAOYSA-N 1 0 321.420 4.135 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)cc1C ZINC001560415960 1060200857 /nfs/dbraw/zinc/20/08/57/1060200857.db2.gz GZGZNMGWALPTSF-IEBWSBKVSA-N 1 0 305.462 4.077 20 10 DICDRO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001560416686 1060203480 /nfs/dbraw/zinc/20/34/80/1060203480.db2.gz VQEUGTDEDCDTCC-JLTOFOAXSA-N 1 0 312.432 4.305 20 10 DICDRO C[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)CC1CC(F)(F)C1 ZINC001249252470 1060204459 /nfs/dbraw/zinc/20/44/59/1060204459.db2.gz KYTZIYLNQJJKSH-UHFFFAOYSA-N 1 0 323.383 4.054 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC001560444700 1060233916 /nfs/dbraw/zinc/23/39/16/1060233916.db2.gz BUZBXAIOYSWIBA-MRXNPFEDSA-N 1 0 321.468 4.404 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C2(Cc3ccccc3)CC2)cc1 ZINC001560445269 1060237361 /nfs/dbraw/zinc/23/73/61/1060237361.db2.gz PWRMDVQFZSVVRX-TWGQIWQCSA-N 1 0 306.453 4.131 20 10 DICDRO C[C@H]1CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560466076 1060256426 /nfs/dbraw/zinc/25/64/26/1060256426.db2.gz SKYNBSJTWGBTAF-JXFKEZNVSA-N 1 0 306.453 4.137 20 10 DICDRO Fc1cccc([C@@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)c1 ZINC001560463236 1060256644 /nfs/dbraw/zinc/25/66/44/1060256644.db2.gz KOOAIDFZLHMSDZ-APWZRJJASA-N 1 0 311.400 4.187 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H]2CCO[C@@H](C(C)C)C2)cc1C ZINC001560479189 1060270624 /nfs/dbraw/zinc/27/06/24/1060270624.db2.gz ZQUFSWHXVKDBSL-UYAOXDASSA-N 1 0 319.489 4.325 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2coc3ccccc23)cc1 ZINC001560482534 1060271701 /nfs/dbraw/zinc/27/17/01/1060271701.db2.gz UMVMFFSVHSQUJZ-WAYWQWQTSA-N 1 0 306.409 4.302 20 10 DICDRO COc1ccc(N2CC[C@@H](C[NH2+][C@H]3CCCC(C)(C)C3)C2)cc1 ZINC001560512304 1060309722 /nfs/dbraw/zinc/30/97/22/1060309722.db2.gz QKKRPOYQCJZTNC-IRXDYDNUSA-N 1 0 316.489 4.080 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)CCc2ccccc2)c1 ZINC001560519455 1060318916 /nfs/dbraw/zinc/31/89/16/1060318916.db2.gz DBWLDSNNBKRANG-HOTGVXAUSA-N 1 0 313.441 4.320 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)CCc2ccccc2)c1 ZINC001560519457 1060320874 /nfs/dbraw/zinc/32/08/74/1060320874.db2.gz DBWLDSNNBKRANG-JKSUJKDBSA-N 1 0 313.441 4.320 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+]C[C@@H]3CCCC(C)(C)C3)C2)cc1 ZINC001560529172 1060330488 /nfs/dbraw/zinc/33/04/88/1060330488.db2.gz UKLUKIIMEJBABJ-IAGOWNOFSA-N 1 0 316.489 4.080 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)cc1F ZINC001560535361 1060340857 /nfs/dbraw/zinc/34/08/57/1060340857.db2.gz QVPHOGFSCOBILQ-YESZJQIVSA-N 1 0 304.453 4.198 20 10 DICDRO COc1cc(C[NH2+][C@@H]2CCCC[C@@H]2F)c(O)c(C(C)(C)C)c1 ZINC001560551488 1060362352 /nfs/dbraw/zinc/36/23/52/1060362352.db2.gz PUVHIMHBQIOACT-JKSUJKDBSA-N 1 0 309.425 4.069 20 10 DICDRO Cc1cc(C[NH2+]Cc2cccnc2C)c(C)n1-c1cccc(C)c1 ZINC001560555832 1060365454 /nfs/dbraw/zinc/36/54/54/1060365454.db2.gz GJFCVJHZHJJQOG-UHFFFAOYSA-N 1 0 319.452 4.396 20 10 DICDRO CC[C@H]1C[C@@H]([NH2+]Cc2cc(C)n(-c3ccccc3)c2C)CCO1 ZINC001560556417 1060366155 /nfs/dbraw/zinc/36/61/55/1060366155.db2.gz XBBBLBCFFVIASN-ICSRJNTNSA-N 1 0 312.457 4.141 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)cc1 ZINC001560568593 1060378472 /nfs/dbraw/zinc/37/84/72/1060378472.db2.gz UBUQZFBLGVZYKS-VGKRUOJXSA-N 1 0 324.443 4.381 20 10 DICDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)c1ccccc1O ZINC001560575547 1060388121 /nfs/dbraw/zinc/38/81/21/1060388121.db2.gz MSZYACUPBLLVKT-JWAFFJSPSA-N 1 0 312.369 4.055 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2CCCC3(CC3)C2)ccc1OC ZINC001560601834 1060414402 /nfs/dbraw/zinc/41/44/02/1060414402.db2.gz PNQMQYZIDCQHOY-KRWDZBQOSA-N 1 0 303.446 4.044 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CC(C)(C)OC2(C)C)c(Cl)c1 ZINC001560601188 1060415621 /nfs/dbraw/zinc/41/56/21/1060415621.db2.gz POFNIRCEVJEUMB-GFCCVEGCSA-N 1 0 311.853 4.037 20 10 DICDRO C[C@@H]1c2ccccc2CC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001560627883 1060437884 /nfs/dbraw/zinc/43/78/84/1060437884.db2.gz LUVIJPINIOVWFW-DKRLNXSXSA-N 1 0 306.453 4.385 20 10 DICDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2cc(C(C)C)ccc2O)C1(C)C ZINC001560635314 1060448516 /nfs/dbraw/zinc/44/85/16/1060448516.db2.gz AIDHIKXTEVNLTN-MSOLQXFVSA-N 1 0 305.462 4.151 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCCCC[C@H]2c2ccco2)c1O ZINC001560639986 1060456348 /nfs/dbraw/zinc/45/63/48/1060456348.db2.gz IMWIRWXHRVEJOF-INIZCTEOSA-N 1 0 315.413 4.420 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCCC[C@H]2c2cccn2C)cc1Cl ZINC001560676170 1060509008 /nfs/dbraw/zinc/50/90/08/1060509008.db2.gz UIQZALWMJOKISH-KRWDZBQOSA-N 1 0 318.848 4.420 20 10 DICDRO CC[N@H+](Cc1ccoc1C)Cc1cc(Br)ccc1O ZINC001560677162 1060515998 /nfs/dbraw/zinc/51/59/98/1060515998.db2.gz TVXRCVZRMQWZBL-UHFFFAOYSA-N 1 0 324.218 4.078 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCc2ccccc2F)cc1Cl ZINC001560683266 1060526007 /nfs/dbraw/zinc/52/60/07/1060526007.db2.gz RPDRFDDIQOXMFY-UHFFFAOYSA-N 1 0 307.796 4.168 20 10 DICDRO C[C@@H]1C[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@@H]2CCCC[C@H]21 ZINC001560705677 1060562594 /nfs/dbraw/zinc/56/25/94/1060562594.db2.gz ORUCOUQPMSMLPZ-HACGYAERSA-N 1 0 308.416 4.041 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCOc2ccccc2F)c(Cl)c1 ZINC001560721898 1060585141 /nfs/dbraw/zinc/58/51/41/1060585141.db2.gz XXSIZAJNMVGESG-UHFFFAOYSA-N 1 0 323.795 4.004 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2cccn2C(F)F)C2CC2)cc1 ZINC001560729954 1060596314 /nfs/dbraw/zinc/59/63/14/1060596314.db2.gz XZVHDMHCUFFAKG-UHFFFAOYSA-N 1 0 319.399 4.114 20 10 DICDRO Cc1cc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c(O)cc1Br ZINC001250120735 1060628307 /nfs/dbraw/zinc/62/83/07/1060628307.db2.gz OSMNOAHHCSUCFO-STQMWFEESA-N 1 0 324.262 4.085 20 10 DICDRO COc1ccc(C[NH+](CC(C)(C)C)CC(C)(C)C)c(O)c1OC ZINC001560813938 1060672048 /nfs/dbraw/zinc/67/20/48/1060672048.db2.gz MAQVEUSTDIAXSY-UHFFFAOYSA-N 1 0 323.477 4.304 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)c1 ZINC001560815080 1060675283 /nfs/dbraw/zinc/67/52/83/1060675283.db2.gz QDFKHCUWGWNAGW-YHUYYLMFSA-N 1 0 303.446 4.410 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCc2ccc(F)cc2)c1 ZINC001560814611 1060675300 /nfs/dbraw/zinc/67/53/00/1060675300.db2.gz COTMQODYJFTAAB-UONOGXRCSA-N 1 0 317.404 4.212 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2)c1O ZINC001560820403 1060679337 /nfs/dbraw/zinc/67/93/37/1060679337.db2.gz AUWFJMFSLFFVLZ-QAPCUYQASA-N 1 0 311.425 4.292 20 10 DICDRO CCc1cccc(C[N@@H+]2Cc3ccccc3C3(CCC3)C2)c1O ZINC001560823510 1060682002 /nfs/dbraw/zinc/68/20/02/1060682002.db2.gz IXZJNMLGPSDOEP-UHFFFAOYSA-N 1 0 307.437 4.392 20 10 DICDRO CSCC1CCC([NH2+]Cc2ccc(N(C)C)cc2C)CC1 ZINC001560850988 1060706775 /nfs/dbraw/zinc/70/67/75/1060706775.db2.gz NFEPMUSPWINEAC-UHFFFAOYSA-N 1 0 306.519 4.072 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H]1CC[C@@H]2CCC[C@@H]21 ZINC001560890784 1060754561 /nfs/dbraw/zinc/75/45/61/1060754561.db2.gz QMKRFBRCCRQCQG-LPWQTFTOSA-N 1 0 300.490 4.160 20 10 DICDRO COc1ccc(C[N@H+](C)[C@@H]2CCC[C@H]2C(C)(C)C)c(O)c1OC ZINC001560893124 1060756421 /nfs/dbraw/zinc/75/64/21/1060756421.db2.gz GZIBNMWBDVKNMS-HUUCEWRRSA-N 1 0 321.461 4.056 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@@]2(F)c2ccccc2)cc1Cl ZINC001560897939 1060758815 /nfs/dbraw/zinc/75/88/15/1060758815.db2.gz RSLONDWBHLFPSA-IAGOWNOFSA-N 1 0 305.780 4.081 20 10 DICDRO CC[C@]1(C)CCC[C@@H]1[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001560899124 1060760757 /nfs/dbraw/zinc/76/07/57/1060760757.db2.gz YIGBJBXXQWUFPO-FFZOFVMBSA-N 1 0 316.489 4.080 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2ccccc2C1(C)C ZINC001560899061 1060762559 /nfs/dbraw/zinc/76/25/59/1060762559.db2.gz IZOITONVVKVXMD-UHFFFAOYSA-N 1 0 308.469 4.354 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H](C)CCC3CCCC3)C2)cc1 ZINC001560928001 1060792260 /nfs/dbraw/zinc/79/22/60/1060792260.db2.gz HLILUPGUOAFOQH-AEFFLSMTSA-N 1 0 316.489 4.222 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@@H](C)CCC3CCCC3)C2)cc1 ZINC001560928004 1060792966 /nfs/dbraw/zinc/79/29/66/1060792966.db2.gz HLILUPGUOAFOQH-WMZOPIPTSA-N 1 0 316.489 4.222 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC2([C@H]3CCCCO3)CCC2)cc1Cl ZINC001560953403 1060818848 /nfs/dbraw/zinc/81/88/48/1060818848.db2.gz LFAAKXHOXISOQI-QGZVFWFLSA-N 1 0 323.864 4.183 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2CCSC3(CCC3)C2)c1 ZINC001561034269 1060887109 /nfs/dbraw/zinc/88/71/09/1060887109.db2.gz LLWISXBZGRRPIA-MRXNPFEDSA-N 1 0 305.487 4.424 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCOc3ccccc3[C@@H]2C)cc1 ZINC001473249371 1061026048 /nfs/dbraw/zinc/02/60/48/1061026048.db2.gz BJATVQXGNDYLBZ-INIZCTEOSA-N 1 0 310.441 4.098 20 10 DICDRO CCc1ccc([C@H]2CCC[N@H+](Cc3cc(F)ccc3O)C2)cc1 ZINC001462211240 1061028589 /nfs/dbraw/zinc/02/85/89/1061028589.db2.gz NOXMJWQMLYKPAK-KRWDZBQOSA-N 1 0 313.416 4.473 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC=C(c3ccco3)C2)cc1Cl ZINC001462220263 1061035903 /nfs/dbraw/zinc/03/59/03/1061035903.db2.gz OQKMKOBPRZFWIB-UHFFFAOYSA-N 1 0 303.789 4.236 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCCCC(F)(F)C1 ZINC001462275784 1061068399 /nfs/dbraw/zinc/06/83/99/1061068399.db2.gz MSXBOCRXFBPNIJ-OAHLLOKOSA-N 1 0 310.432 4.366 20 10 DICDRO COc1cc(C[NH+]2CC3(C2)CCCCC3)c(O)c(C(C)(C)C)c1 ZINC001462312123 1061098184 /nfs/dbraw/zinc/09/81/84/1061098184.db2.gz BRGCJXGIYKWCTE-UHFFFAOYSA-N 1 0 317.473 4.464 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH+]2CC(Cc3ccc(F)cc3)C2)cc1 ZINC001462319582 1061102630 /nfs/dbraw/zinc/10/26/30/1061102630.db2.gz FZQATMKFJZQHNX-ONEGZZNKSA-N 1 0 324.443 4.079 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@]2(C)CC=CCC2)c(C(F)(F)F)c1 ZINC001462343935 1061117586 /nfs/dbraw/zinc/11/75/86/1061117586.db2.gz RXNDVOQWJSKJAD-INIZCTEOSA-N 1 0 312.379 4.360 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](OC3CCC3)C2)c1 ZINC001462388672 1061143232 /nfs/dbraw/zinc/14/32/32/1061143232.db2.gz WEGJXANPOLDFGK-SFHVURJKSA-N 1 0 303.446 4.049 20 10 DICDRO COc1cc(C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC001462387978 1061143941 /nfs/dbraw/zinc/14/39/41/1061143941.db2.gz LNMHIOBDCHUSIX-KSSFIOAISA-N 1 0 317.473 4.463 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2C2CCC2)c1O ZINC001462408913 1061155980 /nfs/dbraw/zinc/15/59/80/1061155980.db2.gz GOEVUNCSQCYCPN-HNNXBMFYSA-N 1 0 309.837 4.209 20 10 DICDRO C[C@H](CSc1ccccc1)[N@H+](C)Cc1cc(F)ccc1O ZINC001462415165 1061158806 /nfs/dbraw/zinc/15/88/06/1061158806.db2.gz OOCWUPDHHAKLRD-CYBMUJFWSA-N 1 0 305.418 4.144 20 10 DICDRO CCO[C@H]1C[C@H]([NH2+]Cc2ccc(OC)c(C)c2)C12CCCCC2 ZINC001473446322 1061163600 /nfs/dbraw/zinc/16/36/00/1061163600.db2.gz CGPZHBUIHWINBH-OALUTQOASA-N 1 0 317.473 4.221 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+]CCCC3CCCCC3)C2)cc1 ZINC001462423103 1061164414 /nfs/dbraw/zinc/16/44/14/1061164414.db2.gz ZPVHFFYAXGOLOQ-SFHVURJKSA-N 1 0 316.489 4.224 20 10 DICDRO Cc1cccc(CC2C[NH+](C/C=C/c3ccc(N(C)C)cc3)C2)c1 ZINC001462456461 1061185409 /nfs/dbraw/zinc/18/54/09/1061185409.db2.gz VKOBOAQDJSBONP-VMPITWQZSA-N 1 0 320.480 4.249 20 10 DICDRO Cc1cccc(CC2C[NH+](C/C=C\c3ccc(N(C)C)cc3)C2)c1 ZINC001462456465 1061185723 /nfs/dbraw/zinc/18/57/23/1061185723.db2.gz VKOBOAQDJSBONP-YVMONPNESA-N 1 0 320.480 4.249 20 10 DICDRO CCN(C)c1ccc(CN2CCc3sc(Cl)cc3C2)cc1 ZINC001473584598 1061273352 /nfs/dbraw/zinc/27/33/52/1061273352.db2.gz XUNPZAGSIIQHSF-UHFFFAOYSA-N 1 0 320.889 4.416 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2C[C@H](c3ccc(F)cc3F)C2)c(O)c1 ZINC001462619777 1061301822 /nfs/dbraw/zinc/30/18/22/1061301822.db2.gz QTNCKWWVNBPENY-CTYIDZIISA-N 1 0 303.352 4.015 20 10 DICDRO CCCCC1([NH2+]Cc2cc(Br)cc(C)c2O)CC1 ZINC001462645763 1061314662 /nfs/dbraw/zinc/31/46/62/1061314662.db2.gz UZVDSRNUZUVGLP-UHFFFAOYSA-N 1 0 312.251 4.276 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Cl)c2cccnc12)c1ccccc1O ZINC001473722872 1061371900 /nfs/dbraw/zinc/37/19/00/1061371900.db2.gz QVZDDJWMAPWDTA-GFCCVEGCSA-N 1 0 312.800 4.445 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(F)ccc1OC ZINC001473813440 1061420995 /nfs/dbraw/zinc/42/09/95/1061420995.db2.gz KMOJCTJWDCBAGJ-GOSISDBHSA-N 1 0 316.420 4.141 20 10 DICDRO Cc1cc(C)c2c(c1)CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)C2 ZINC001473905336 1061455310 /nfs/dbraw/zinc/45/53/10/1061455310.db2.gz QSHLCNHDBHUYPK-UHFFFAOYSA-N 1 0 308.469 4.236 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)CCCC(C)C)CC2)cc1 ZINC001473913148 1061461031 /nfs/dbraw/zinc/46/10/31/1061461031.db2.gz JXRJNDIEFKZKNF-QGZVFWFLSA-N 1 0 318.505 4.468 20 10 DICDRO COc1cc2ccccc2cc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001473970342 1061516280 /nfs/dbraw/zinc/51/62/80/1061516280.db2.gz PGISAGAKZREGIU-UHFFFAOYSA-N 1 0 319.404 4.073 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2cc3c(s2)CCCC3)cc1F ZINC001473987141 1061529833 /nfs/dbraw/zinc/52/98/33/1061529833.db2.gz DUDZWIMLPZTGMQ-UHFFFAOYSA-N 1 0 318.461 4.122 20 10 DICDRO c1ccc2c(c1)SC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001251919392 1061534638 /nfs/dbraw/zinc/53/46/38/1061534638.db2.gz NKGMKNTUMWBZKY-SFHVURJKSA-N 1 0 310.466 4.223 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H](C)SC2)cc1F ZINC001473994798 1061538266 /nfs/dbraw/zinc/53/82/66/1061538266.db2.gz GCSPMPUGZRQGMC-UKRRQHHQSA-N 1 0 310.482 4.046 20 10 DICDRO CC1(C)C[C@@H]1C[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001473995928 1061539732 /nfs/dbraw/zinc/53/97/32/1061539732.db2.gz OCJXYWWERGDXGK-HXUWFJFHSA-N 1 0 320.480 4.385 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(F)cc1F ZINC001474024456 1061564816 /nfs/dbraw/zinc/56/48/16/1061564816.db2.gz KPZXNFMBYHFIRQ-CYBMUJFWSA-N 1 0 317.379 4.183 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCc2c(F)cccc2Cl)cc1F ZINC001474043093 1061588192 /nfs/dbraw/zinc/58/81/92/1061588192.db2.gz XRNRPYHXNYMRRC-UHFFFAOYSA-N 1 0 324.802 4.017 20 10 DICDRO C[C@@]1(C[NH2+]Cc2ccc3c(c2)CCO3)CCCc2ccccc21 ZINC001474098678 1061644948 /nfs/dbraw/zinc/64/49/48/1061644948.db2.gz LBCIBONGBOSCRL-NRFANRHFSA-N 1 0 307.437 4.005 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)cc1C ZINC001474099242 1061645626 /nfs/dbraw/zinc/64/56/26/1061645626.db2.gz IJXVBGUBTVYTMO-HKUYNNGSSA-N 1 0 319.489 4.467 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CSc2ccccc21 ZINC001474157005 1061698586 /nfs/dbraw/zinc/69/85/86/1061698586.db2.gz DKWPAGBGRBVIKJ-OAHLLOKOSA-N 1 0 322.477 4.466 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2COCc3ccccc32)cc1C ZINC001474184108 1061734674 /nfs/dbraw/zinc/73/46/74/1061734674.db2.gz PHJWEMOVWYALTD-IBGZPJMESA-N 1 0 311.425 4.145 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2CCC(F)CC2)cc1F ZINC001474199027 1061751914 /nfs/dbraw/zinc/75/19/14/1061751914.db2.gz YZDOARDFVCSDMU-UHFFFAOYSA-N 1 0 310.432 4.290 20 10 DICDRO CCCOc1ccc(C[NH2+]CC[C@H]2CCC(C)(C)CO2)cc1C ZINC001474283382 1061853580 /nfs/dbraw/zinc/85/35/80/1061853580.db2.gz PBMXSGVFMPZFFZ-GOSISDBHSA-N 1 0 319.489 4.469 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1C[C@@H]1Cc1ccccc1 ZINC001474299891 1061869601 /nfs/dbraw/zinc/86/96/01/1061869601.db2.gz OSEUXTLLKDHVFS-RBUKOAKNSA-N 1 0 318.464 4.455 20 10 DICDRO Cc1ccc(C[C@H]2CCC[N@H+](Cc3cc(F)ccc3O)C2)cc1 ZINC001474309950 1061876587 /nfs/dbraw/zinc/87/65/87/1061876587.db2.gz IHIFJYNWLYIAGJ-QGZVFWFLSA-N 1 0 313.416 4.294 20 10 DICDRO CCCCC[N@H+](Cc1ccc(N2CCC(O)CC2)cc1)C(C)C ZINC001474318288 1061893943 /nfs/dbraw/zinc/89/39/43/1061893943.db2.gz DCZHMLIORVBNAE-UHFFFAOYSA-N 1 0 318.505 4.048 20 10 DICDRO COc1ccc(C[N@H+](CCC(C)C)C2CCCC2)c(O)c1OC ZINC001474334507 1061928957 /nfs/dbraw/zinc/92/89/57/1061928957.db2.gz RESRTIQPPJXCPF-UHFFFAOYSA-N 1 0 321.461 4.200 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC001474344560 1061944482 /nfs/dbraw/zinc/94/44/82/1061944482.db2.gz NXVMQPFPFAKPHI-FQEVSTJZSA-N 1 0 323.484 4.138 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CCC(c3ccccn3)CC2)c1 ZINC001474345801 1061949358 /nfs/dbraw/zinc/94/93/58/1061949358.db2.gz VZCYUYCOLHPLII-UHFFFAOYSA-N 1 0 310.441 4.290 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC001474345173 1061949823 /nfs/dbraw/zinc/94/98/23/1061949823.db2.gz FIEQZUWNJSYPNE-OMUFJYGLSA-N 1 0 322.452 4.309 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2cc(Cl)c(C)cc2O)cc1F ZINC001474352781 1061962699 /nfs/dbraw/zinc/96/26/99/1061962699.db2.gz WNSQEHVOCDGESE-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO CC[C@H]1C[N@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)CCS1 ZINC001474369447 1062002911 /nfs/dbraw/zinc/00/29/11/1062002911.db2.gz LNDGBSSFALSONF-HNNXBMFYSA-N 1 0 323.502 4.026 20 10 DICDRO Cc1ccc(C[N@H+](Cc2cc(Cl)c(C)cc2O)C2CC2)o1 ZINC001474403137 1062060935 /nfs/dbraw/zinc/06/09/35/1062060935.db2.gz YRFVODDQVZJAMB-UHFFFAOYSA-N 1 0 305.805 4.420 20 10 DICDRO CSc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)o1 ZINC001474415104 1062082189 /nfs/dbraw/zinc/08/21/89/1062082189.db2.gz SERCXPGBFGMJNC-UHFFFAOYSA-N 1 0 316.470 4.232 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](Cc1cccc(F)c1)C1CC1 ZINC001474414523 1062084323 /nfs/dbraw/zinc/08/43/23/1062084323.db2.gz IIBDRJZODPILIO-UHFFFAOYSA-N 1 0 312.432 4.365 20 10 DICDRO COc1cc(Cl)cc(C[NH+]2CC(C)(C)CC(C)(C)C2)c1O ZINC001474417880 1062089430 /nfs/dbraw/zinc/08/94/30/1062089430.db2.gz NRSWIMIBUUTGSI-UHFFFAOYSA-N 1 0 311.853 4.312 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)cc1 ZINC001459346889 1062101734 /nfs/dbraw/zinc/10/17/34/1062101734.db2.gz GDRGPGMVMJFYDD-UTKZUKDTSA-N 1 0 324.468 4.105 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@H+](C)CC2(c3ccccc3)CC2)cc1 ZINC001474444896 1062125089 /nfs/dbraw/zinc/12/50/89/1062125089.db2.gz RHOYLUGGBREVKF-FPLPWBNLSA-N 1 0 320.480 4.429 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC001474476913 1062157894 /nfs/dbraw/zinc/15/78/94/1062157894.db2.gz KIRRYIUPQTXKJX-PXPVJAHISA-N 1 0 324.443 4.394 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)[C@H](OC)c1ccccc1 ZINC001474496240 1062177176 /nfs/dbraw/zinc/17/71/76/1062177176.db2.gz RUOFOAHIZFBBRP-UZLBHIALSA-N 1 0 312.457 4.138 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H](OC(C)(C)C)C2(C)C)c1 ZINC001474505050 1062189281 /nfs/dbraw/zinc/18/92/81/1062189281.db2.gz NAGQRFJGOOHKNH-JCURWCKSSA-N 1 0 321.461 4.034 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)C1CCSCC1 ZINC001474585382 1062294434 /nfs/dbraw/zinc/29/44/34/1062294434.db2.gz RRKSLHHGLHYXIU-HOTGVXAUSA-N 1 0 320.546 4.113 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(Br)cc1O)[C@H]1CC1(C)C ZINC001474587265 1062297814 /nfs/dbraw/zinc/29/78/14/1062297814.db2.gz PSJRGQQQKZDJHZ-CHWSQXEVSA-N 1 0 312.251 4.069 20 10 DICDRO CCCC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001474592952 1062303201 /nfs/dbraw/zinc/30/32/01/1062303201.db2.gz YFVMUZDZCHLMJN-OKZBNKHCSA-N 1 0 318.505 4.326 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+]C1CCSCC1 ZINC001255087493 1062310660 /nfs/dbraw/zinc/31/06/60/1062310660.db2.gz AQSSFBCLHUKMQK-KRWDZBQOSA-N 1 0 305.487 4.118 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)[C@@H]1C[C@H]1c1cccs1 ZINC001474609185 1062323138 /nfs/dbraw/zinc/32/31/38/1062323138.db2.gz OSCIQHREJZOSFC-DDTOSNHZSA-N 1 0 307.846 4.389 20 10 DICDRO CCc1cccc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)c1O ZINC001474616295 1062335848 /nfs/dbraw/zinc/33/58/48/1062335848.db2.gz NHPZPEQYIJXQRU-GOSISDBHSA-N 1 0 313.466 4.245 20 10 DICDRO COc1cc(C)cc(C[NH2+]C[C@]2(C)CC[C@H](C)C2(C)C)c1O ZINC001474621204 1062343977 /nfs/dbraw/zinc/34/39/77/1062343977.db2.gz DPSCEAFQELGIDK-LIRRHRJNSA-N 1 0 305.462 4.261 20 10 DICDRO C[C@H](C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1)C(C)(C)C ZINC001459743611 1062353998 /nfs/dbraw/zinc/35/39/98/1062353998.db2.gz XYINWHZICAEBTO-WBVHZDCISA-N 1 0 305.462 4.055 20 10 DICDRO C[C@@H](C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1)C(C)(C)C ZINC001459743601 1062355986 /nfs/dbraw/zinc/35/59/86/1062355986.db2.gz XYINWHZICAEBTO-DOTOQJQBSA-N 1 0 305.462 4.055 20 10 DICDRO CC[C@](C)([NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)C1CC1 ZINC001474632101 1062357153 /nfs/dbraw/zinc/35/71/53/1062357153.db2.gz JAEZMZRSFGPXFH-INIZCTEOSA-N 1 0 314.395 4.440 20 10 DICDRO CO[C@H](C[NH2+]Cc1ccc2ccccc2c1O)C1CCCCC1 ZINC001474646559 1062371882 /nfs/dbraw/zinc/37/18/82/1062371882.db2.gz SZPAFXNZETXIIZ-LJQANCHMSA-N 1 0 313.441 4.230 20 10 DICDRO Cc1cc(F)c(C[NH2+]Cc2cc(C(C)C)ccc2O)c(F)c1 ZINC001474720633 1062445413 /nfs/dbraw/zinc/44/54/13/1062445413.db2.gz AHGYDTHOQDXYJQ-UHFFFAOYSA-N 1 0 305.368 4.392 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)CC2CCC2)c(C(F)(F)F)c1 ZINC001474736129 1062455563 /nfs/dbraw/zinc/45/55/63/1062455563.db2.gz ZHQQWRVONQHLRI-UHFFFAOYSA-N 1 0 300.368 4.003 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCO[C@H](C(C)(C)C)CC2)c1 ZINC001474754892 1062466311 /nfs/dbraw/zinc/46/63/11/1062466311.db2.gz DPZJPXPGLABAAR-SFHVURJKSA-N 1 0 305.462 4.153 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC001255719024 1062540183 /nfs/dbraw/zinc/54/01/83/1062540183.db2.gz BDDSKPUQXPUYJQ-KBPBESRZSA-N 1 0 301.352 4.335 20 10 DICDRO C[C@@H](CSc1ccc(F)cc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC001255736224 1062560979 /nfs/dbraw/zinc/56/09/79/1062560979.db2.gz UOVGLJVJVZFZEA-AWEZNQCLSA-N 1 0 318.461 4.162 20 10 DICDRO Cc1ccc(SC[C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC001255755357 1062577246 /nfs/dbraw/zinc/57/72/46/1062577246.db2.gz KEOACPGKTNZTQK-MRXNPFEDSA-N 1 0 314.498 4.331 20 10 DICDRO Cc1cc(C[N@@H+](C)[C@@H](C)Cc2cccc(F)c2)ccc1N(C)C ZINC001460220316 1062704061 /nfs/dbraw/zinc/70/40/61/1062704061.db2.gz IMBQPXXOGWXGIT-INIZCTEOSA-N 1 0 314.448 4.263 20 10 DICDRO CCOC1CCC([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001256429603 1062819980 /nfs/dbraw/zinc/81/99/80/1062819980.db2.gz OYAWLOASPNGILW-UHFFFAOYSA-N 1 0 316.489 4.114 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H](C)Cc1ccncc1 ZINC001256732262 1062956490 /nfs/dbraw/zinc/95/64/90/1062956490.db2.gz CXISUKYXBHLBCJ-MGPUTAFESA-N 1 0 324.468 4.248 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@H]2CCO[C@H](c3ccccc3)C2)cc1 ZINC001256820932 1063004321 /nfs/dbraw/zinc/00/43/21/1063004321.db2.gz LSDSQDDOYNQBRN-SFTDATJTSA-N 1 0 324.468 4.105 20 10 DICDRO COc1cc(C[NH2+][C@@H]2CCC[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC001461042248 1063208963 /nfs/dbraw/zinc/20/89/63/1063208963.db2.gz WPGPAHGWIVYCOE-UKRRQHHQSA-N 1 0 305.462 4.367 20 10 DICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]C[C@H]2C[C@H]2C)cc1 ZINC001461051246 1063219368 /nfs/dbraw/zinc/21/93/68/1063219368.db2.gz ITACXFQJBPQERA-YLJYHZDGSA-N 1 0 308.469 4.459 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c2ccccc12 ZINC001461126513 1063277231 /nfs/dbraw/zinc/27/72/31/1063277231.db2.gz CQNQBSZUTYKBDE-UHFFFAOYSA-N 1 0 319.404 4.073 20 10 DICDRO Cc1cc(C)cc([C@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC001461160240 1063299283 /nfs/dbraw/zinc/29/92/83/1063299283.db2.gz JTKMFJNVCYYHKY-AWEZNQCLSA-N 1 0 318.411 4.498 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@@H](SC)C2)cc1F ZINC001461184511 1063318242 /nfs/dbraw/zinc/31/82/42/1063318242.db2.gz ZRCBSIDQNKWYHG-JKSUJKDBSA-N 1 0 324.509 4.436 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CC(C)(C)c2cccs2)cc1F ZINC001461209363 1063331612 /nfs/dbraw/zinc/33/16/12/1063331612.db2.gz ZGWCNEPRXJLQGG-UHFFFAOYSA-N 1 0 324.440 4.160 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@@H]2Cc2ccccc2)c(Cl)c1 ZINC001461219795 1063343469 /nfs/dbraw/zinc/34/34/69/1063343469.db2.gz CBKYUWOBAPUMAF-WMLDXEAASA-N 1 0 301.817 4.075 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(Cc3ccccc3)CCC2)cc1F ZINC001461283454 1063389429 /nfs/dbraw/zinc/38/94/29/1063389429.db2.gz XZGVBGABXOLOSD-UHFFFAOYSA-N 1 0 312.432 4.147 20 10 DICDRO CCCOc1ccc(C[NH2+]CCc2nc(C)c(C)s2)cc1C ZINC001461284731 1063389697 /nfs/dbraw/zinc/38/96/97/1063389697.db2.gz PMVXAUKDHXMKOC-UHFFFAOYSA-N 1 0 318.486 4.189 20 10 DICDRO CN(C)c1ccc(C[N@H+](CCSC(C)(C)C)C2CC2)cc1 ZINC001473115672 1063416536 /nfs/dbraw/zinc/41/65/36/1063416536.db2.gz LTMLMRHLTIANBJ-UHFFFAOYSA-N 1 0 306.519 4.249 20 10 DICDRO CSc1cc(C)ccc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001461341062 1063430018 /nfs/dbraw/zinc/43/00/18/1063430018.db2.gz WFTGXLHELVDHOI-UHFFFAOYSA-N 1 0 318.461 4.212 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CC(C)(C)OC2(C)C)cc1C ZINC001461388288 1063466513 /nfs/dbraw/zinc/46/65/13/1063466513.db2.gz MXZVWMJQOHKJHM-KRWDZBQOSA-N 1 0 305.462 4.220 20 10 DICDRO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@H](C)CO1 ZINC001473174191 1063480650 /nfs/dbraw/zinc/48/06/50/1063480650.db2.gz VHKLOAHHVLFPBZ-UTKZUKDTSA-N 1 0 324.468 4.023 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)cc1C ZINC001461427360 1063494060 /nfs/dbraw/zinc/49/40/60/1063494060.db2.gz VNALZHUVEUEOFZ-UXHICEINSA-N 1 0 317.473 4.079 20 10 DICDRO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC001461439251 1063505551 /nfs/dbraw/zinc/50/55/51/1063505551.db2.gz BHBRJZQINOYQGF-DKRLNXSXSA-N 1 0 323.484 4.183 20 10 DICDRO CC(C)=CCC[C@@H](C)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258086101 1063510026 /nfs/dbraw/zinc/51/00/26/1063510026.db2.gz QXFHORXJQJNTQM-QGZVFWFLSA-N 1 0 316.489 4.081 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)cc1C ZINC001461537884 1063565415 /nfs/dbraw/zinc/56/54/15/1063565415.db2.gz CQYZNJGLALKXKS-GOSISDBHSA-N 1 0 317.379 4.449 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1c2ccccc2O[C@H]1C ZINC001461553126 1063577377 /nfs/dbraw/zinc/57/73/77/1063577377.db2.gz MLSVAVFDWFSIPM-VBKZILBWSA-N 1 0 306.409 4.099 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1c2ccccc2O[C@H]1C ZINC001461553142 1063578354 /nfs/dbraw/zinc/57/83/54/1063578354.db2.gz MLSVAVFDWFSIPM-XOBRGWDASA-N 1 0 306.409 4.099 20 10 DICDRO CCCCC(CCCC)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001258382223 1063627236 /nfs/dbraw/zinc/62/72/36/1063627236.db2.gz LXWZXCXFVAHOKU-UHFFFAOYSA-N 1 0 318.505 4.362 20 10 DICDRO CN(C)c1ccc(/C=C\CNc2ccc3c([nH+]2)CCCC3)cc1 ZINC001461733687 1063686183 /nfs/dbraw/zinc/68/61/83/1063686183.db2.gz PSHNLBOOHMLECC-WAYWQWQTSA-N 1 0 307.441 4.152 20 10 DICDRO COCc1ccccc1/C=C(/C)C[NH2+][C@@H](C)c1ccccc1O ZINC001461732859 1063686230 /nfs/dbraw/zinc/68/62/30/1063686230.db2.gz YTWXYUXWBRDKPQ-IRVMHKCDSA-N 1 0 311.425 4.293 20 10 DICDRO CC(C)([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(F)cc1F ZINC001461756098 1063697749 /nfs/dbraw/zinc/69/77/49/1063697749.db2.gz PNYQPHLEIBRUAI-UHFFFAOYSA-N 1 0 317.379 4.315 20 10 DICDRO CC1(C)CC[C@H]([NH2+]Cc2cc(Cl)c3cccnc3c2[O-])C1 ZINC001258595760 1063698587 /nfs/dbraw/zinc/69/85/87/1063698587.db2.gz KEYCEYSDJVRFHB-LBPRGKRZSA-N 1 0 304.821 4.262 20 10 DICDRO COc1cc(C[NH2+]C(C)(C)/C=C/Cl)c(O)c(C(C)(C)C)c1 ZINC001461766856 1063705429 /nfs/dbraw/zinc/70/54/29/1063705429.db2.gz QZISWKYWSAIHGB-BQYQJAHWSA-N 1 0 311.853 4.319 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H](C)Cc1cccnc1 ZINC001258621213 1063712551 /nfs/dbraw/zinc/71/25/51/1063712551.db2.gz YVUDSASTPSXVJO-FOIQADDNSA-N 1 0 324.468 4.248 20 10 DICDRO Oc1cccc(Br)c1C[NH2+]C[C@@H]1C[C@H]1C1CCCC1 ZINC001461830794 1063741150 /nfs/dbraw/zinc/74/11/50/1063741150.db2.gz PEUDBZLWOWAVEA-STQMWFEESA-N 1 0 324.262 4.071 20 10 DICDRO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1cc(F)ccc1O ZINC001461897923 1063786662 /nfs/dbraw/zinc/78/66/62/1063786662.db2.gz GQRXPPGWBAGNCR-GXTWGEPZSA-N 1 0 303.352 4.048 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCCC23CCCCC3)cc1F ZINC001461914397 1063796505 /nfs/dbraw/zinc/79/65/05/1063796505.db2.gz NDHHZBZJJUJPMY-UHFFFAOYSA-N 1 0 308.416 4.330 20 10 DICDRO C[C@@H](Cc1cccc(Cl)c1)[N@@H+]1CCc2cccc(O)c2C1 ZINC001258751337 1063797142 /nfs/dbraw/zinc/79/71/42/1063797142.db2.gz LUOAWBBXGMSXSA-ZDUSSCGKSA-N 1 0 301.817 4.035 20 10 DICDRO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccc(C)cc1O)CCC2 ZINC001461918196 1063799329 /nfs/dbraw/zinc/79/93/29/1063799329.db2.gz FSJNJGQLDJSEKD-HNNXBMFYSA-N 1 0 316.470 4.229 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1F ZINC001461919145 1063799980 /nfs/dbraw/zinc/79/99/80/1063799980.db2.gz JKHPNPYQDQZKJZ-OAHLLOKOSA-N 1 0 316.395 4.020 20 10 DICDRO COc1cc(O)c(C[NH+]2CCC(CCC(C)C)CC2)cc1OC ZINC001461925067 1063807919 /nfs/dbraw/zinc/80/79/19/1063807919.db2.gz HYSRFIAFILWZKY-UHFFFAOYSA-N 1 0 321.461 4.058 20 10 DICDRO C[N@H+](Cc1ccc2c(c1)CCN2Cc1ccccc1)C1CCC1 ZINC001461928568 1063813817 /nfs/dbraw/zinc/81/38/17/1063813817.db2.gz VFLOPMCSEGUASK-UHFFFAOYSA-N 1 0 306.453 4.234 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H]2C2CCCC2)cc1F ZINC001461938367 1063822785 /nfs/dbraw/zinc/82/27/85/1063822785.db2.gz XVLPYHPTMMCWPR-QGZVFWFLSA-N 1 0 308.416 4.185 20 10 DICDRO CC[C@@H](C)C[C@H](CC)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258785677 1063823039 /nfs/dbraw/zinc/82/30/39/1063823039.db2.gz WIRDGFUUHXLPKF-AEFFLSMTSA-N 1 0 318.505 4.161 20 10 DICDRO C[C@@H]1C[NH+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C[C@H]1C ZINC001461965029 1063846864 /nfs/dbraw/zinc/84/68/64/1063846864.db2.gz YWJCSLBNUVAKID-QZTJIDSGSA-N 1 0 320.480 4.337 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+]Cc1cc(C(C)C)ccc1O)CCC2 ZINC001461989187 1063862371 /nfs/dbraw/zinc/86/23/71/1063862371.db2.gz PHAZJLNIXCRDLO-HNNXBMFYSA-N 1 0 316.470 4.448 20 10 DICDRO C[C@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001462008913 1063875616 /nfs/dbraw/zinc/87/56/16/1063875616.db2.gz RWYAWUANZKSQOD-LBPRGKRZSA-N 1 0 300.368 4.003 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)c(O)c1 ZINC001462047287 1063900485 /nfs/dbraw/zinc/90/04/85/1063900485.db2.gz YLGHOEHAHGFCPQ-UHFFFAOYSA-N 1 0 303.352 4.143 20 10 DICDRO CN(Cc1cccc2ccoc21)c1ccc(OCC[NH+](C)C)cc1 ZINC001462048627 1063902306 /nfs/dbraw/zinc/90/23/06/1063902306.db2.gz CKKPHWMQKJFZND-UHFFFAOYSA-N 1 0 324.424 4.010 20 10 DICDRO CN(Cc1cccc(C2CC2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC001462054477 1063905900 /nfs/dbraw/zinc/90/59/00/1063905900.db2.gz WRGMESLPPLWBDW-UHFFFAOYSA-N 1 0 324.468 4.141 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1COc2ccccc21 ZINC001261139646 1063910293 /nfs/dbraw/zinc/91/02/93/1063910293.db2.gz UJFQQMOTWWDOTI-FMKPAKJESA-N 1 0 309.409 4.015 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H](C1CC1)C1CCOCC1 ZINC001261515264 1063930131 /nfs/dbraw/zinc/93/01/31/1063930131.db2.gz BCJRZEWCDVSKEF-OWDMVUQNSA-N 1 0 315.457 4.044 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CCC3(CCOCC3)CC2)cc1Cl ZINC001261676436 1063942599 /nfs/dbraw/zinc/94/25/99/1063942599.db2.gz JQWAAJJYGDAADO-UHFFFAOYSA-N 1 0 323.864 4.183 20 10 DICDRO COCc1cccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC000390964349 1064176095 /nfs/dbraw/zinc/17/60/95/1064176095.db2.gz MBTBMQWHXFYCPA-PBHICJAKSA-N 1 0 311.425 4.185 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1OC(F)F ZINC000393540029 1064284623 /nfs/dbraw/zinc/28/46/23/1064284623.db2.gz XTVPOTCEEPFJHV-GFCCVEGCSA-N 1 0 319.351 4.074 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000393892076 1064309118 /nfs/dbraw/zinc/30/91/18/1064309118.db2.gz UBPNWOFJQMLIKT-MJGOQNOKSA-N 1 0 324.468 4.016 20 10 DICDRO CCCC[C@@H](CC)C[NH+]1CC2(CN(c3ccc(OC)cc3)C2)C1 ZINC001279729121 1064364199 /nfs/dbraw/zinc/36/41/99/1064364199.db2.gz KSFOUUYRWUABKX-QGZVFWFLSA-N 1 0 316.489 4.034 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000743870408 1064975075 /nfs/dbraw/zinc/97/50/75/1064975075.db2.gz QGYHPXZWUYACBM-AWEZNQCLSA-N 1 0 314.385 4.274 20 10 DICDRO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001307481077 1065428645 /nfs/dbraw/zinc/42/86/45/1065428645.db2.gz WFKZWTIKJXMCAA-QAPCUYQASA-N 1 0 312.432 4.270 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCc3c(Cl)cccc3C2)cc1 ZINC001307483822 1065429573 /nfs/dbraw/zinc/42/95/73/1065429573.db2.gz VXZHZMGRJZJLFB-UHFFFAOYSA-N 1 0 314.860 4.354 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)CC1([C@H]2CCCCO2)CCC1 ZINC001307502406 1065445956 /nfs/dbraw/zinc/44/59/56/1065445956.db2.gz WBAYCYSPEWXAAY-LJQANCHMSA-N 1 0 317.473 4.344 20 10 DICDRO C[N@H+](CCn1ccc2cc(Cl)ccc21)Cc1ccccc1O ZINC001307538211 1065472786 /nfs/dbraw/zinc/47/27/86/1065472786.db2.gz UYNHOZBECBBVEE-UHFFFAOYSA-N 1 0 314.816 4.132 20 10 DICDRO CCCC[N@H+](CCOCc1ccccc1)Cc1ccccc1O ZINC001307720700 1065583655 /nfs/dbraw/zinc/58/36/55/1065583655.db2.gz CHMCYBVKZNLOIE-UHFFFAOYSA-N 1 0 313.441 4.211 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2ccc(F)cc2C)c1O ZINC001308062389 1065748516 /nfs/dbraw/zinc/74/85/16/1065748516.db2.gz OXOZSIJDIKKIDF-LLVKDONJSA-N 1 0 319.351 4.032 20 10 DICDRO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC001308206732 1065815497 /nfs/dbraw/zinc/81/54/97/1065815497.db2.gz TUCZYXDXAGRMNG-CRAIPNDOSA-N 1 0 318.530 4.154 20 10 DICDRO Cc1[nH]c2ccccc2c1CC[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308239120 1065845168 /nfs/dbraw/zinc/84/51/68/1065845168.db2.gz ABHAWRDLBVCMKN-UHFFFAOYSA-N 1 0 320.436 4.134 20 10 DICDRO C[C@@H](C[NH2+]Cc1cc(F)c(N(C)C)cc1F)c1cccc(F)c1 ZINC001308252400 1065856977 /nfs/dbraw/zinc/85/69/77/1065856977.db2.gz XDRMSSNITOMWBY-LBPRGKRZSA-N 1 0 322.374 4.063 20 10 DICDRO Cc1cccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c1C ZINC001308259955 1065860565 /nfs/dbraw/zinc/86/05/65/1065860565.db2.gz CPRIBTBGAGQWGZ-OAHLLOKOSA-N 1 0 300.421 4.359 20 10 DICDRO CC1(C[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 ZINC001308297105 1065892295 /nfs/dbraw/zinc/89/22/95/1065892295.db2.gz FPSUWHPSERKHKH-UHFFFAOYSA-N 1 0 306.453 4.139 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCc2cc3ccccc3[nH]2)c(Cl)c1 ZINC001308338388 1065923118 /nfs/dbraw/zinc/92/31/18/1065923118.db2.gz VKCVNIVYXQACGW-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO C[C@@H](O)C[C@H](C)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001308345871 1065930164 /nfs/dbraw/zinc/93/01/64/1065930164.db2.gz XSAHQYYYBUTPPR-UONOGXRCSA-N 1 0 321.505 4.236 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@]2(CCC)CCOC2)cc1 ZINC001308401049 1065964037 /nfs/dbraw/zinc/96/40/37/1065964037.db2.gz GYTDYPWAHUDPGN-FQEVSTJZSA-N 1 0 318.505 4.362 20 10 DICDRO CCOCc1cc(C[NH2+]CC(C)(C)C2CCC2)ccc1OC ZINC001308408629 1065967737 /nfs/dbraw/zinc/96/77/37/1065967737.db2.gz TZOQLBHGHDFZJG-UHFFFAOYSA-N 1 0 305.462 4.148 20 10 DICDRO C[C@@H](F)CC[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001308421070 1065976267 /nfs/dbraw/zinc/97/62/67/1065976267.db2.gz QAIQJSKGCHRNPF-MRXNPFEDSA-N 1 0 312.432 4.087 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308431543 1065983814 /nfs/dbraw/zinc/98/38/14/1065983814.db2.gz QVUOCHMYJGEICP-HNNXBMFYSA-N 1 0 311.425 4.179 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](CC)[C@@H]2CCCCO2)cc1C ZINC001308451199 1065997342 /nfs/dbraw/zinc/99/73/42/1065997342.db2.gz VOSYFFBPJHRSCM-HKUYNNGSSA-N 1 0 305.462 4.221 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CC[C@@H]2CC2(F)F)cc1 ZINC001308471697 1066010594 /nfs/dbraw/zinc/01/05/94/1066010594.db2.gz LRCDEGMKFAWKNZ-MRXNPFEDSA-N 1 0 310.432 4.448 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCc3ccc(O)cc32)cc1C ZINC001308470720 1066010977 /nfs/dbraw/zinc/01/09/77/1066010977.db2.gz HRIMPYUWFYAWOD-LJQANCHMSA-N 1 0 311.425 4.267 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2O)c(OC(F)F)cc1C ZINC001308505591 1066034711 /nfs/dbraw/zinc/03/47/11/1066034711.db2.gz FEGFIKNFOOLFST-CYBMUJFWSA-N 1 0 321.367 4.461 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CCC=CCCC2)ccc1OC ZINC001308545564 1066060227 /nfs/dbraw/zinc/06/02/27/1066060227.db2.gz FZNBMSMUFBJITR-KRWDZBQOSA-N 1 0 317.473 4.458 20 10 DICDRO FC1(F)CC[C@@H](CC[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001308547327 1066060917 /nfs/dbraw/zinc/06/09/17/1066060917.db2.gz XOGWKPCNJCZJQC-HNNXBMFYSA-N 1 0 308.416 4.202 20 10 DICDRO c1ccc(C[C@H]2C[C@H]2C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001308551333 1066063928 /nfs/dbraw/zinc/06/39/28/1066063928.db2.gz GBZFEVMHEJVONW-SFTDATJTSA-N 1 0 320.480 4.255 20 10 DICDRO c1ccc(C[C@@H]2C[C@@H]2C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001308551331 1066063997 /nfs/dbraw/zinc/06/39/97/1066063997.db2.gz GBZFEVMHEJVONW-NHCUHLMSSA-N 1 0 320.480 4.255 20 10 DICDRO Cc1cccc2[nH]c(C[N@@H+](C)Cc3ccc(N(C)C)cc3)cc21 ZINC001308557848 1066066689 /nfs/dbraw/zinc/06/66/89/1066066689.db2.gz FMETYDQYJVZBNS-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO CCCCO[C@H]1C[C@H]([N@H+](C)Cc2ccc(C)cc2O)C1(C)C ZINC001308578080 1066092935 /nfs/dbraw/zinc/09/29/35/1066092935.db2.gz MKOFBKPLFNFRNG-ROUUACIJSA-N 1 0 305.462 4.116 20 10 DICDRO CCSCC[C@@H](C)[N@H+](C)Cc1c(O)cc(C)cc1Cl ZINC001308578247 1066093832 /nfs/dbraw/zinc/09/38/32/1066093832.db2.gz NYNNUKVRYCQASY-GFCCVEGCSA-N 1 0 301.883 4.318 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1Cl ZINC001308595276 1066107401 /nfs/dbraw/zinc/10/74/01/1066107401.db2.gz QUZXYEYCTOLGRV-QGZVFWFLSA-N 1 0 317.816 4.397 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001308597141 1066108457 /nfs/dbraw/zinc/10/84/57/1066108457.db2.gz ONULDVRHOWAXNU-MRXNPFEDSA-N 1 0 315.844 4.419 20 10 DICDRO C[C@@H]1C[NH+](Cc2ccc(N(C)Cc3cccs3)cc2)C[C@H]1C ZINC001308617560 1066120303 /nfs/dbraw/zinc/12/03/03/1066120303.db2.gz ATBDPKWFWAJDQZ-HZPDHXFCSA-N 1 0 314.498 4.472 20 10 DICDRO C[C@H]1C[NH+](Cc2ccc(N(C)Cc3cccs3)cc2)C[C@@H]1C ZINC001308617556 1066121102 /nfs/dbraw/zinc/12/11/02/1066121102.db2.gz ATBDPKWFWAJDQZ-HOTGVXAUSA-N 1 0 314.498 4.472 20 10 DICDRO CCc1cccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c1O ZINC001308621497 1066123543 /nfs/dbraw/zinc/12/35/43/1066123543.db2.gz NAICFXZGLHBZEI-UHFFFAOYSA-N 1 0 301.817 4.166 20 10 DICDRO C[C@H]1CCC[N@@H+]1Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001308629093 1066126252 /nfs/dbraw/zinc/12/62/52/1066126252.db2.gz INGIGIMUEPUCDK-KRWDZBQOSA-N 1 0 306.453 4.234 20 10 DICDRO C[C@H](CN(C)c1ccc(OCC[NH+](C)C)cc1)C1CCCCC1 ZINC001308670654 1066147915 /nfs/dbraw/zinc/14/79/15/1066147915.db2.gz SILQNJQVBAPILR-QGZVFWFLSA-N 1 0 318.505 4.280 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]Cc2ccc(C(C)(C)O)cc2)c1 ZINC001308695214 1066185125 /nfs/dbraw/zinc/18/51/25/1066185125.db2.gz DKWBTHIIVILBRP-UHFFFAOYSA-N 1 0 313.441 4.033 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1Cl ZINC001308715983 1066194955 /nfs/dbraw/zinc/19/49/55/1066194955.db2.gz RPFHHCYBKQBVCI-BTTYYORXSA-N 1 0 311.853 4.037 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1O ZINC001308726560 1066202280 /nfs/dbraw/zinc/20/22/80/1066202280.db2.gz IVYNSBVOXBZDGE-JCNLHEQBSA-N 1 0 311.425 4.053 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCc2cccc(C)c2)c1 ZINC001308748907 1066222024 /nfs/dbraw/zinc/22/20/24/1066222024.db2.gz XAPLGHRARJGVAG-CVEARBPZSA-N 1 0 313.441 4.381 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]C[C@@H]1CSc2ccccc21 ZINC001308781079 1066254612 /nfs/dbraw/zinc/25/46/12/1066254612.db2.gz YYDXATFHVUGMDU-GFCCVEGCSA-N 1 0 305.830 4.025 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@H](C(C)C)C2(CO)CCCC2)c1 ZINC001308807215 1066284201 /nfs/dbraw/zinc/28/42/01/1066284201.db2.gz QTMOGPMRCUTKLA-LJQANCHMSA-N 1 0 319.489 4.183 20 10 DICDRO CCCCCC[C@@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001308830132 1066306191 /nfs/dbraw/zinc/30/61/91/1066306191.db2.gz HYZBRFJFTLVXPS-QZTJIDSGSA-N 1 0 318.505 4.470 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@H]3O[C@@H](c4ccccc4)C[C@H]32)c(O)c1 ZINC001308843792 1066321228 /nfs/dbraw/zinc/32/12/28/1066321228.db2.gz UCCFSMASZFYBDO-HMXCVIKNSA-N 1 0 323.436 4.195 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@H](CCF)C2)c(O)c(C(C)(C)C)c1 ZINC001308863401 1066343319 /nfs/dbraw/zinc/34/33/19/1066343319.db2.gz IAZPFDDIWOQJMA-CQSZACIVSA-N 1 0 323.452 4.270 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cc3ccnc(Cl)c3s2)c1 ZINC001308869899 1066351521 /nfs/dbraw/zinc/35/15/21/1066351521.db2.gz SPXUPQOHZXGYQU-UHFFFAOYSA-N 1 0 318.829 4.254 20 10 DICDRO CSC1(C[NH2+]CCc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001308888895 1066370787 /nfs/dbraw/zinc/37/07/87/1066370787.db2.gz BLYGMRSBWAXPPJ-UHFFFAOYSA-N 1 0 314.498 4.122 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)c(Cl)c1 ZINC001308906840 1066386528 /nfs/dbraw/zinc/38/65/28/1066386528.db2.gz SICLRGQXNIZADA-OAHLLOKOSA-N 1 0 323.864 4.278 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC001308920709 1066399619 /nfs/dbraw/zinc/39/96/19/1066399619.db2.gz AKYWBPQUAHZPSX-UHFFFAOYSA-N 1 0 324.468 4.237 20 10 DICDRO CN(C)c1ccc([C@H](C[NH2+]C2CCCCCCC2)N(C)C)cc1 ZINC001308971273 1066426344 /nfs/dbraw/zinc/42/63/44/1066426344.db2.gz HAJILJXLZCKRRQ-FQEVSTJZSA-N 1 0 317.521 4.058 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000271580704 129937833 /nfs/dbraw/zinc/93/78/33/129937833.db2.gz QWJWFFDZEVGUAW-SQNIBIBYSA-N 1 0 316.489 4.143 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000273393948 130115773 /nfs/dbraw/zinc/11/57/73/130115773.db2.gz LMDNVFFNTQMFHS-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(C)o1 ZINC000273422430 130118713 /nfs/dbraw/zinc/11/87/13/130118713.db2.gz JPBDMIKHOLKXRM-HOCLYGCPSA-N 1 0 303.402 4.030 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOC3(CCCCC3)C2)c(O)c1 ZINC000273510306 130130830 /nfs/dbraw/zinc/13/08/30/130130830.db2.gz RPKIUDKOPNKLAU-CVEARBPZSA-N 1 0 303.446 4.233 20 10 DICDRO Cc1csc(C2([NH2+][C@H](C)c3cc(C)ccc3O)CCC2)n1 ZINC000273542898 130135738 /nfs/dbraw/zinc/13/57/38/130135738.db2.gz YQYKNKAUOVRCLM-CYBMUJFWSA-N 1 0 302.443 4.196 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CCO[C@H](C2CC2)C1 ZINC000274048363 130200075 /nfs/dbraw/zinc/20/00/75/130200075.db2.gz FTTMORHXDJEGLF-FPOVZHCZSA-N 1 0 323.436 4.106 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCO[C@@H](C2CC2)C1 ZINC000274048416 130200613 /nfs/dbraw/zinc/20/06/13/130200613.db2.gz FTTMORHXDJEGLF-TZIWHRDSSA-N 1 0 323.436 4.106 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2-n2cccn2)c(O)c1 ZINC000284856311 131116501 /nfs/dbraw/zinc/11/65/01/131116501.db2.gz AJUNNCOTDMQZHZ-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)s1 ZINC000285402816 131165439 /nfs/dbraw/zinc/16/54/39/131165439.db2.gz XIAKWGSIGDYKAP-TZMCWYRMSA-N 1 0 304.459 4.228 20 10 DICDRO CC[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccccc1O ZINC000286930938 131256776 /nfs/dbraw/zinc/25/67/76/131256776.db2.gz GGJCMFUPWMNWAR-DLBZAZTESA-N 1 0 319.832 4.210 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)c(C)c1OC ZINC000287190813 131268167 /nfs/dbraw/zinc/26/81/67/131268167.db2.gz VUUSNFDBSGKRBD-ZIAGYGMSSA-N 1 0 315.413 4.130 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCOC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000287315655 131275146 /nfs/dbraw/zinc/27/51/46/131275146.db2.gz FEXQIIJYRCLGFD-ZIFCJYIRSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCOC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000287315652 131275222 /nfs/dbraw/zinc/27/52/22/131275222.db2.gz FEXQIIJYRCLGFD-LNLFQRSKSA-N 1 0 316.489 4.000 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCCOC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000287654337 131293090 /nfs/dbraw/zinc/29/30/90/131293090.db2.gz LJRSEPMQFUSCMP-QMTHXVAHSA-N 1 0 318.244 4.166 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(F)cccc2SC)c1 ZINC000287711448 131296922 /nfs/dbraw/zinc/29/69/22/131296922.db2.gz XPHBLHOEHFCMPR-LLVKDONJSA-N 1 0 321.417 4.113 20 10 DICDRO Cc1ccc(OC(F)F)c(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000297941712 132041542 /nfs/dbraw/zinc/04/15/42/132041542.db2.gz YCNNRFKDEDPNGW-AWEZNQCLSA-N 1 0 319.351 4.079 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(F)c(F)c2)c1 ZINC000121505150 132155792 /nfs/dbraw/zinc/15/57/92/132155792.db2.gz ZLSKOCYZKAUVNH-MNOVXSKESA-N 1 0 307.340 4.091 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)cc1C ZINC000035257827 331491545 /nfs/dbraw/zinc/49/15/45/331491545.db2.gz UMXRQROOVHZURM-KGLIPLIRSA-N 1 0 301.352 4.214 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000176984801 332966847 /nfs/dbraw/zinc/96/68/47/332966847.db2.gz KOWIOKZIHQWSDE-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000184611566 333198901 /nfs/dbraw/zinc/19/89/01/333198901.db2.gz XDNWXGDQNZNIDY-ZIAGYGMSSA-N 1 0 315.461 4.372 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000119558270 333255031 /nfs/dbraw/zinc/25/50/31/333255031.db2.gz OPFLNQLITUALPH-MRXNPFEDSA-N 1 0 312.457 4.140 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c1 ZINC000019999492 333296195 /nfs/dbraw/zinc/29/61/95/333296195.db2.gz VSTSFPMGENVLBU-RYUDHWBXSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(O)c1 ZINC000297262493 335152460 /nfs/dbraw/zinc/15/24/60/335152460.db2.gz KDDQXSGDALCHPU-QWHCGFSZSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273464451 334047478 /nfs/dbraw/zinc/04/74/78/334047478.db2.gz IROPIQJTPQUEHB-AAEUAGOBSA-N 1 0 302.418 4.068 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C3CC3)ccc2F)c1 ZINC000295197754 334220480 /nfs/dbraw/zinc/22/04/80/334220480.db2.gz YELXDEXKSPZZDM-GFCCVEGCSA-N 1 0 315.388 4.268 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000192791309 336261993 /nfs/dbraw/zinc/26/19/93/336261993.db2.gz UGYPITVEXSZTAB-VLIAUNLRSA-N 1 0 323.392 4.434 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCC12CCOCC2)c1ccc(C)cc1O ZINC000370185447 336879236 /nfs/dbraw/zinc/87/92/36/336879236.db2.gz QPBPTFPJGROIIN-WMZOPIPTSA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCC12CCOCC2)c1ccc(C)cc1O ZINC000370185444 336879240 /nfs/dbraw/zinc/87/92/40/336879240.db2.gz QPBPTFPJGROIIN-FUHWJXTLSA-N 1 0 303.446 4.091 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(-c2cccnc2)cc1)c1cc(F)ccc1O ZINC000371840959 336914391 /nfs/dbraw/zinc/91/43/91/336914391.db2.gz NLRICPSLGDIBMN-CQSZACIVSA-N 1 0 322.383 4.444 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000373164908 336950265 /nfs/dbraw/zinc/95/02/65/336950265.db2.gz ORCCXKNIPAUHSD-LDQXTDLNSA-N 1 0 324.468 4.181 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(N(C)C)cc1 ZINC000193901886 337080000 /nfs/dbraw/zinc/08/00/00/337080000.db2.gz CRWSVMUIGDGVID-ZIAGYGMSSA-N 1 0 313.401 4.073 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1ccccc1O ZINC000183634207 337193866 /nfs/dbraw/zinc/19/38/66/337193866.db2.gz LQUGNEGHXWYURB-VLIAUNLRSA-N 1 0 322.383 4.367 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(-c2ccccn2)c1)c1ccccc1O ZINC000183625314 337193971 /nfs/dbraw/zinc/19/39/71/337193971.db2.gz JLRVVBQGAOWRBT-OAHLLOKOSA-N 1 0 304.393 4.305 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1cc(F)ccc1O ZINC000185153111 337202314 /nfs/dbraw/zinc/20/23/14/337202314.db2.gz NSFBLJUVAJXLFM-VBKZILBWSA-N 1 0 322.383 4.367 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2-n2cccn2)c(O)c1 ZINC000185742222 337250968 /nfs/dbraw/zinc/25/09/68/337250968.db2.gz GNVWEBGBMVDKGS-HZPDHXFCSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccc2c(c1)OCO2 ZINC000392704558 337276172 /nfs/dbraw/zinc/27/61/72/337276172.db2.gz WNDLRHRYOWXXDL-CQSZACIVSA-N 1 0 322.408 4.066 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccc2c(c1)OCO2 ZINC000392704556 337276196 /nfs/dbraw/zinc/27/61/96/337276196.db2.gz WNDLRHRYOWXXDL-AWEZNQCLSA-N 1 0 322.408 4.066 20 10 DICDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000189370595 337278907 /nfs/dbraw/zinc/27/89/07/337278907.db2.gz SHKJADVEYCHCHF-BLLLJJGKSA-N 1 0 301.361 4.014 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cc2c(cc1O)CCCC2 ZINC000528036224 337782615 /nfs/dbraw/zinc/78/26/15/337782615.db2.gz PLDMZNLWFXWVKO-STQMWFEESA-N 1 0 314.404 4.217 20 10 DICDRO CSc1ccc(C[NH2+]Cc2c(C)c3ccccc3n2C)cc1 ZINC000475189121 339440718 /nfs/dbraw/zinc/44/07/18/339440718.db2.gz DZRGTWYYJXDDLR-UHFFFAOYSA-N 1 0 310.466 4.498 20 10 DICDRO COCCC1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000530097564 340779129 /nfs/dbraw/zinc/77/91/29/340779129.db2.gz PEOSQXDKOVMZHJ-UHFFFAOYSA-N 1 0 305.462 4.073 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1 ZINC000237089122 341207102 /nfs/dbraw/zinc/20/71/02/341207102.db2.gz JRGBDQVKFXSSKA-QGZVFWFLSA-N 1 0 317.816 4.221 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](C)c2cccs2)c1O ZINC000182549410 518278740 /nfs/dbraw/zinc/27/87/40/518278740.db2.gz NRFZNUDPRKRUIW-VIFPVBQESA-N 1 0 309.818 4.161 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(COC)cc2)cc1 ZINC000124391892 520286660 /nfs/dbraw/zinc/28/66/60/520286660.db2.gz LRHCTFUHIATAQW-INIZCTEOSA-N 1 0 312.457 4.140 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cncc(F)c2)cc1F ZINC000158713885 520911284 /nfs/dbraw/zinc/91/12/84/520911284.db2.gz LIGXDSHOJVOMEE-ZDUSSCGKSA-N 1 0 319.399 4.057 20 10 DICDRO CCSc1cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)ccn1 ZINC000187789282 521734006 /nfs/dbraw/zinc/73/40/06/521734006.db2.gz LAPCQQQOJABZPL-AWEZNQCLSA-N 1 0 315.486 4.110 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)Cc1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000152131574 522691109 /nfs/dbraw/zinc/69/11/09/522691109.db2.gz QPGSTQBLWSJROL-DJJJIMSYSA-N 1 0 315.461 4.029 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)C[C@H](O)c1ccc(F)cc1)c1ccccc1O ZINC000156418328 522692058 /nfs/dbraw/zinc/69/20/58/522692058.db2.gz POURYCSJVBJQIQ-IXDGSTSKSA-N 1 0 317.404 4.084 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccccc1O ZINC000186147495 522709606 /nfs/dbraw/zinc/70/96/06/522709606.db2.gz YBBOHKMSAXHUAL-IHPCNDPISA-N 1 0 311.425 4.353 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1ccc(N(C)C)cc1 ZINC000182121447 522873679 /nfs/dbraw/zinc/87/36/79/522873679.db2.gz ZBDVNHKAPYGOMH-QGZVFWFLSA-N 1 0 303.837 4.042 20 10 DICDRO CC[C@@H]([NH2+][C@@H](COC)c1ccc(F)c(F)c1)c1ccccc1O ZINC000157028144 522923050 /nfs/dbraw/zinc/92/30/50/522923050.db2.gz YHINSEFUNHQRTA-SJORKVTESA-N 1 0 321.367 4.099 20 10 DICDRO CC[C@](C)([NH2+]Cc1ccc(N(C)C)c(F)c1)c1nc(C)cs1 ZINC000266142320 523488611 /nfs/dbraw/zinc/48/86/11/523488611.db2.gz HORWTZPLTFMIKG-KRWDZBQOSA-N 1 0 321.465 4.072 20 10 DICDRO C[C@H]([NH2+]C1CCSCC1)c1ccc(N2CCCCC2)cc1 ZINC000180509842 525299663 /nfs/dbraw/zinc/29/96/63/525299663.db2.gz RYIGCUUUUCZXGS-HNNXBMFYSA-N 1 0 304.503 4.223 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)c1 ZINC000157988252 525362212 /nfs/dbraw/zinc/36/22/12/525362212.db2.gz LIKPQUUYSPJYBF-SYNHAJSKSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1ccccn1 ZINC000159067547 525525307 /nfs/dbraw/zinc/52/53/07/525525307.db2.gz UEHFLYPQVQYJFM-QGZVFWFLSA-N 1 0 309.457 4.169 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOCC1)c1ccc(N2CCCCCC2)cc1 ZINC000183339126 525557680 /nfs/dbraw/zinc/55/76/80/525557680.db2.gz DHDDVMKXABJCLR-PKOBYXMFSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](C2CC2)C1)c1ccc2ccccc2c1O ZINC000157634909 525646376 /nfs/dbraw/zinc/64/63/76/525646376.db2.gz ZWVVJKVWGMBIFS-NRXGSXMXSA-N 1 0 311.425 4.154 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccc(C)o1 ZINC000273442529 536809528 /nfs/dbraw/zinc/80/95/28/536809528.db2.gz NBSUJYWBZDEFOD-IUODEOHRSA-N 1 0 323.820 4.375 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)c1 ZINC000037122972 1035942069 /nfs/dbraw/zinc/94/20/69/1035942069.db2.gz QJSOQUNJLMPZQO-RYUDHWBXSA-N 1 0 305.443 4.491 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)c1 ZINC000037122974 1035942870 /nfs/dbraw/zinc/94/28/70/1035942870.db2.gz QJSOQUNJLMPZQO-NWDGAFQWSA-N 1 0 305.443 4.491 20 10 DICDRO CCOC[C@H]1CC[N@H+](Cc2cc(CC)cc(C(C)(C)C)c2O)C1 ZINC000748093223 1036115394 /nfs/dbraw/zinc/11/53/94/1036115394.db2.gz AJFPHOSCJONUKQ-INIZCTEOSA-N 1 0 319.489 4.111 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](C)Cc2ccsc2)ccc1OC ZINC001648895481 1036674701 /nfs/dbraw/zinc/67/47/01/1036674701.db2.gz PWNSRTKBRCUWFG-AWEZNQCLSA-N 1 0 319.470 4.014 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2c(O)cccc2Cl)cc1F ZINC000083551567 1036895865 /nfs/dbraw/zinc/89/58/65/1036895865.db2.gz NZRTYNNSJXXSFD-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1c(O)cccc1Br ZINC000706833836 1037481002 /nfs/dbraw/zinc/48/10/02/1037481002.db2.gz JUXMGXHDJTXPCB-RYUDHWBXSA-N 1 0 312.251 4.071 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)c1cc(F)cc(F)c1[O-] ZINC000834840316 1037599694 /nfs/dbraw/zinc/59/96/94/1037599694.db2.gz JDQZMBBJVDQCHT-VHSXEESVSA-N 1 0 305.315 4.147 20 10 DICDRO Oc1cccc(Br)c1C[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000707165592 1037873446 /nfs/dbraw/zinc/87/34/46/1037873446.db2.gz IUAVZCMWJMYBEV-QWHCGFSZSA-N 1 0 324.262 4.167 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1O)Cc1cccc(F)c1F ZINC001140464428 1038121734 /nfs/dbraw/zinc/12/17/34/1038121734.db2.gz PMFDWYPXOPJWCU-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(N(C)CC)cc2)C1 ZINC001167496027 1038297339 /nfs/dbraw/zinc/29/73/39/1038297339.db2.gz IZEKVXDDYJYEBU-MSOLQXFVSA-N 1 0 306.519 4.249 20 10 DICDRO CCC[N@H+](Cc1cc(-c2ccco2)on1)Cc1ccccc1O ZINC000171668233 1038464529 /nfs/dbraw/zinc/46/45/29/1038464529.db2.gz IUCJJXZPSBZYED-UHFFFAOYSA-N 1 0 312.369 4.052 20 10 DICDRO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)[nH]1 ZINC000277247814 1038467286 /nfs/dbraw/zinc/46/72/86/1038467286.db2.gz NTJZHQPWPNHFAG-BPNCWPANSA-N 1 0 316.449 4.052 20 10 DICDRO C[C@H]([NH2+]CCSC(F)(F)F)c1ccc2ccccc2c1O ZINC000230659037 1038621513 /nfs/dbraw/zinc/62/15/13/1038621513.db2.gz MPRIIOUDZNZTFT-JTQLQIEISA-N 1 0 315.360 4.449 20 10 DICDRO CCC(CC)(C[NH2+]Cc1cc(Cl)cc(OC)c1O)SC ZINC000230935073 1038645964 /nfs/dbraw/zinc/64/59/64/1038645964.db2.gz WVOYTKLDDDAJOF-UHFFFAOYSA-N 1 0 317.882 4.066 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1Br)c1ccccc1O ZINC000048819640 1038670267 /nfs/dbraw/zinc/67/02/67/1038670267.db2.gz WNJIXKQLXUBJPL-OAHLLOKOSA-N 1 0 320.230 4.396 20 10 DICDRO CC[N@H+](Cc1cccs1)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000050151502 1038750222 /nfs/dbraw/zinc/75/02/22/1038750222.db2.gz VDQAEWFDTAMOKJ-UHFFFAOYSA-N 1 0 323.845 4.332 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3cccc(C)c3)CC2)cc1 ZINC000174040666 1038848813 /nfs/dbraw/zinc/84/88/13/1038848813.db2.gz WWCCTIPAHDMHSJ-KRWDZBQOSA-N 1 0 324.468 4.323 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(N2CCCCC2)cc1 ZINC000119301467 1038914583 /nfs/dbraw/zinc/91/45/83/1038914583.db2.gz YTPPUMKSVKZXIU-SJLPKXTDSA-N 1 0 316.489 4.285 20 10 DICDRO CCSCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000800492211 1038966537 /nfs/dbraw/zinc/96/65/37/1038966537.db2.gz FALXECOOHOADEJ-MRXNPFEDSA-N 1 0 306.519 4.471 20 10 DICDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc(N3CCCCC3)cc2)s1 ZINC000761434052 1039500878 /nfs/dbraw/zinc/50/08/78/1039500878.db2.gz AERVTTCCMGSXSS-AWEZNQCLSA-N 1 0 315.486 4.293 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1ccccc1O ZINC000130134841 1039585911 /nfs/dbraw/zinc/58/59/11/1039585911.db2.gz GMSYIBUTLUMISZ-MRXNPFEDSA-N 1 0 317.816 4.221 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc(OC)c(OC)c1O)c1ccccc1 ZINC000892418799 1040246341 /nfs/dbraw/zinc/24/63/41/1040246341.db2.gz UPEKSDDIHHSIOC-MRXNPFEDSA-N 1 0 315.413 4.040 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1F ZINC000176984540 1040311907 /nfs/dbraw/zinc/31/19/07/1040311907.db2.gz WZVLRSSMXBDUAH-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1Cc1ccccc1O ZINC000179566649 1040509516 /nfs/dbraw/zinc/50/95/16/1040509516.db2.gz LLBAZOMMZSPTNG-GOSISDBHSA-N 1 0 321.424 4.099 20 10 DICDRO Cc1nc(CC[NH2+]Cc2cc(-c3ccccc3)ccc2O)cs1 ZINC000725845354 1040683255 /nfs/dbraw/zinc/68/32/55/1040683255.db2.gz ZHPWQGYFKDQTKR-UHFFFAOYSA-N 1 0 324.449 4.156 20 10 DICDRO CCOCC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000725845510 1040686056 /nfs/dbraw/zinc/68/60/56/1040686056.db2.gz AQFYETXCSZHZLC-UHFFFAOYSA-N 1 0 307.478 4.113 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ncccc1Cl ZINC000924572870 1040889211 /nfs/dbraw/zinc/88/92/11/1040889211.db2.gz FYVWOPQNMUPOEG-QGZVFWFLSA-N 1 0 317.864 4.432 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](CCO)CC(C)C)c1O ZINC000808700283 1041008015 /nfs/dbraw/zinc/00/80/15/1041008015.db2.gz KAAROGOCTDCMMR-KBPBESRZSA-N 1 0 313.869 4.049 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c1O ZINC000808699901 1041009121 /nfs/dbraw/zinc/00/91/21/1041009121.db2.gz RYRRRTAIWMHKRW-XYZKALLWSA-N 1 0 323.864 4.208 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](C)c2ccncc2)c1O ZINC000808701513 1041011521 /nfs/dbraw/zinc/01/15/21/1041011521.db2.gz ZOIZIPSLXCKDEW-OLZOCXBDSA-N 1 0 304.821 4.203 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808701820 1041011542 /nfs/dbraw/zinc/01/15/42/1041011542.db2.gz JVYBAFCRBDGEPZ-NSHDSACASA-N 1 0 322.836 4.318 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)Cc2ccncc2)c1O ZINC000808701479 1041012320 /nfs/dbraw/zinc/01/23/20/1041012320.db2.gz ZBKPFFONPKJZPY-QWHCGFSZSA-N 1 0 304.821 4.031 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](CC)Cc2ccncc2)cc1F ZINC000809727098 1041224504 /nfs/dbraw/zinc/22/45/04/1041224504.db2.gz RVHOHJWMYOOCBV-UHFFFAOYSA-N 1 0 315.436 4.089 20 10 DICDRO COc1cccc(C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)c1O ZINC000809739882 1041241506 /nfs/dbraw/zinc/24/15/06/1041241506.db2.gz FUNCQGGOYIMSLB-UHFFFAOYSA-N 1 0 323.392 4.259 20 10 DICDRO COc1cccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1O ZINC000809783149 1041253956 /nfs/dbraw/zinc/25/39/56/1041253956.db2.gz SGWILEYXEPHGIR-MRXNPFEDSA-N 1 0 303.427 4.045 20 10 DICDRO Cc1nc(C)c(C[N@H+](Cc2ccccc2O)C2CCCCC2)o1 ZINC000809945886 1041277274 /nfs/dbraw/zinc/27/72/74/1041277274.db2.gz GEJHWVNELQQJMC-UHFFFAOYSA-N 1 0 314.429 4.332 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCc2c(C)noc2C)cc1 ZINC000166137944 1041315476 /nfs/dbraw/zinc/31/54/76/1041315476.db2.gz VYQTXDZFMFAEOQ-AWEZNQCLSA-N 1 0 315.461 4.031 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2ccc3sccc3c2)c1O ZINC000810159587 1041328724 /nfs/dbraw/zinc/32/87/24/1041328724.db2.gz AAHYLMFHRHKWIL-UHFFFAOYSA-N 1 0 313.422 4.295 20 10 DICDRO CC[C@@H]([NH2+]Cc1cncc(C)c1)c1ccc(C(F)(F)F)cc1O ZINC000810229225 1041343200 /nfs/dbraw/zinc/34/32/00/1041343200.db2.gz UWBVBUHJQRPMTF-OAHLLOKOSA-N 1 0 324.346 4.355 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810228550 1041344019 /nfs/dbraw/zinc/34/40/19/1041344019.db2.gz IFDCXOCDBANMPF-QKCSRTOESA-N 1 0 317.351 4.019 20 10 DICDRO CC[C@H](C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)OC ZINC000810261067 1041349831 /nfs/dbraw/zinc/34/98/31/1041349831.db2.gz SVQSFIFBRIIMFC-VQIMIIECSA-N 1 0 304.478 4.143 20 10 DICDRO CCOC(C)(C)C[NH2+][C@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000810238307 1041353072 /nfs/dbraw/zinc/35/30/72/1041353072.db2.gz JAYDENDOODZDFY-CYBMUJFWSA-N 1 0 319.367 4.267 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCSC1)c1ccc(C(F)(F)F)cc1O ZINC000810236885 1041353283 /nfs/dbraw/zinc/35/32/83/1041353283.db2.gz BFVKLCHDXVJCGO-GWCFXTLKSA-N 1 0 319.392 4.205 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@@H]1C(F)F)c1ccc(C(F)(F)F)cc1O ZINC000810239969 1041353842 /nfs/dbraw/zinc/35/38/42/1041353842.db2.gz LAUVQUHCHBMAKO-DCAQKATOSA-N 1 0 309.278 4.105 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCC=CO1)c1ccc(C(F)(F)F)cc1O ZINC000810239057 1041354199 /nfs/dbraw/zinc/35/41/99/1041354199.db2.gz RCRYCBXDVUMROT-OCCSQVGLSA-N 1 0 315.335 4.144 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CSC[C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000810241775 1041355604 /nfs/dbraw/zinc/35/56/04/1041355604.db2.gz YOJJHAVATBJBAV-JIMOISOXSA-N 1 0 319.392 4.203 20 10 DICDRO CCC[N@H+](Cc1ccn(C(CC)CC)n1)Cc1ccccc1O ZINC000747619554 1041414857 /nfs/dbraw/zinc/41/48/57/1041414857.db2.gz NMYMYBRQSNDWBW-UHFFFAOYSA-N 1 0 315.461 4.362 20 10 DICDRO Cc1ccc(C)n1-c1ccc(-c2ccc(C[NH+](C)C)cc2)cn1 ZINC001204632214 1041459148 /nfs/dbraw/zinc/45/91/48/1041459148.db2.gz WOTQIZBYLMEWRS-UHFFFAOYSA-N 1 0 305.425 4.218 20 10 DICDRO Oc1ccc2ccncc2c1C[NH2+]C1(c2ccccc2)CCC1 ZINC000728706827 1041460599 /nfs/dbraw/zinc/46/05/99/1041460599.db2.gz GHRFEOHFSQPBPZ-UHFFFAOYSA-N 1 0 304.393 4.109 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2C)c1 ZINC000926896600 1041472868 /nfs/dbraw/zinc/47/28/68/1041472868.db2.gz BAEWXIPZMVAVKC-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000179991933 1041522130 /nfs/dbraw/zinc/52/21/30/1041522130.db2.gz GTIYDIQOYVNAMH-INIZCTEOSA-N 1 0 311.473 4.296 20 10 DICDRO Cc1cccc(NC2CC[NH+](Cc3cccc(C)c3O)CC2)c1 ZINC000180398809 1041530699 /nfs/dbraw/zinc/53/06/99/1041530699.db2.gz HNWBLCYSDFPLHD-UHFFFAOYSA-N 1 0 310.441 4.086 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](CC)[C@@H]2CCOC(C)(C)C2)cc1 ZINC000811511638 1041534353 /nfs/dbraw/zinc/53/43/53/1041534353.db2.gz QCHSPMIUMJCLBH-LJQANCHMSA-N 1 0 318.505 4.312 20 10 DICDRO c1ccc2c(c1)C[C@@H]2C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000236674129 1041539722 /nfs/dbraw/zinc/53/97/22/1041539722.db2.gz REDMDOAZMKEEPR-LJQANCHMSA-N 1 0 306.453 4.106 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC(F)(F)[C@H](C)C3)c2c1 ZINC000811776969 1041565279 /nfs/dbraw/zinc/56/52/79/1041565279.db2.gz BUWUCKTTYIKBPA-GFCCVEGCSA-N 1 0 321.367 4.031 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC(F)(F)[C@@H](C)C3)c2c1 ZINC000811776970 1041565636 /nfs/dbraw/zinc/56/56/36/1041565636.db2.gz BUWUCKTTYIKBPA-LBPRGKRZSA-N 1 0 321.367 4.031 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2cc(C)cc(C)c2)c1O ZINC000182945072 1041575731 /nfs/dbraw/zinc/57/57/31/1041575731.db2.gz PKSFOPGLGWUIOF-ZDUSSCGKSA-N 1 0 315.388 4.202 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1OCC1CC1)c1cc(F)ccc1O ZINC000185516681 1041615137 /nfs/dbraw/zinc/61/51/37/1041615137.db2.gz RYIQXDLDMAIPPU-ZDUSSCGKSA-N 1 0 315.388 4.171 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000162360154 1041644151 /nfs/dbraw/zinc/64/41/51/1041644151.db2.gz SMSXEUOTKICTIG-CJNGLKHVSA-N 1 0 303.475 4.319 20 10 DICDRO CC[C@@H](C)C[C@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000812836203 1041655299 /nfs/dbraw/zinc/65/52/99/1041655299.db2.gz STAYZNGFFDNBJM-CVEARBPZSA-N 1 0 304.478 4.078 20 10 DICDRO CC[C@@H](C)C[C@@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000812836205 1041655717 /nfs/dbraw/zinc/65/57/17/1041655717.db2.gz STAYZNGFFDNBJM-HZPDHXFCSA-N 1 0 304.478 4.078 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CCOC3)C2)cc1C(C)C ZINC000747833023 1041669269 /nfs/dbraw/zinc/66/92/69/1041669269.db2.gz SPVMQMUTONTGQO-SJORKVTESA-N 1 0 317.473 4.073 20 10 DICDRO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000312496535 1041675064 /nfs/dbraw/zinc/67/50/64/1041675064.db2.gz JTCAAZAWFGWTIX-GFCCVEGCSA-N 1 0 307.743 4.208 20 10 DICDRO CCOC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000188690282 1041687528 /nfs/dbraw/zinc/68/75/28/1041687528.db2.gz JPGPGKRYMOMPSV-INIZCTEOSA-N 1 0 304.478 4.143 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3nc(C)ccc3c2)c1 ZINC000813331484 1041697594 /nfs/dbraw/zinc/69/75/94/1041697594.db2.gz PNPYNIGEMHVTDJ-CQSZACIVSA-N 1 0 322.408 4.108 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(SC)s2)c1 ZINC000813331426 1041698729 /nfs/dbraw/zinc/69/87/29/1041698729.db2.gz OPCXSCSOFXZNCQ-JTQLQIEISA-N 1 0 309.456 4.035 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CCC[C@@H](C)C2)ccc1OC ZINC000747853674 1041701632 /nfs/dbraw/zinc/70/16/32/1041701632.db2.gz AFAJVCLJIHBPEC-CVEARBPZSA-N 1 0 305.462 4.148 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CCC[C@H](C)C2)ccc1OC ZINC000747853675 1041702108 /nfs/dbraw/zinc/70/21/08/1041702108.db2.gz AFAJVCLJIHBPEC-HOTGVXAUSA-N 1 0 305.462 4.148 20 10 DICDRO Oc1ccc(Br)cc1C[NH+](C1CCC1)C1CCC1 ZINC000814177522 1041780394 /nfs/dbraw/zinc/78/03/94/1041780394.db2.gz FSMSNUMJCBDUGN-UHFFFAOYSA-N 1 0 310.235 4.062 20 10 DICDRO CSC[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000814178977 1041780535 /nfs/dbraw/zinc/78/05/35/1041780535.db2.gz LGQFXYXTGICYFY-SFHVURJKSA-N 1 0 318.530 4.252 20 10 DICDRO CC[C@@H]([NH2+][C@H](COC)c1ccc(Cl)cc1)c1ccccc1O ZINC000194254138 1041786059 /nfs/dbraw/zinc/78/60/59/1041786059.db2.gz VJTMCLRAQMVNMN-IAGOWNOFSA-N 1 0 319.832 4.474 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c1O ZINC000814225980 1041794560 /nfs/dbraw/zinc/79/45/60/1041794560.db2.gz NKEWOCXGCKGEOC-KRWDZBQOSA-N 1 0 311.425 4.089 20 10 DICDRO CSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000194836560 1041794673 /nfs/dbraw/zinc/79/46/73/1041794673.db2.gz YQPPRCSTNQTMOL-CQSZACIVSA-N 1 0 300.471 4.325 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2O)C12CCCC2 ZINC000756619932 1041802557 /nfs/dbraw/zinc/80/25/57/1041802557.db2.gz ZBZJZQJFVPAOAD-BMGDILEWSA-N 1 0 303.446 4.089 20 10 DICDRO CSc1cc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)ccn1 ZINC000756664723 1041852632 /nfs/dbraw/zinc/85/26/32/1041852632.db2.gz PGBOFXHYBMOSNI-SNVBAGLBSA-N 1 0 308.834 4.013 20 10 DICDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(N(C)C)c(C)c2)s1 ZINC000815043458 1041906277 /nfs/dbraw/zinc/90/62/77/1041906277.db2.gz SFNFWTQVYQCWAC-CQSZACIVSA-N 1 0 317.502 4.327 20 10 DICDRO CCc1ccc(C[N@H+](Cc2ccccc2O)C2CCCC2)nc1 ZINC000815048209 1041906404 /nfs/dbraw/zinc/90/64/04/1041906404.db2.gz MGHGZYQIYOEZMI-UHFFFAOYSA-N 1 0 310.441 4.294 20 10 DICDRO Cc1cc(C[N@H+](C)CCc2ccncc2)ccc1N1CCCCC1 ZINC000828597549 1041909066 /nfs/dbraw/zinc/90/90/66/1041909066.db2.gz HVFXNARWUZWAQL-UHFFFAOYSA-N 1 0 323.484 4.055 20 10 DICDRO Cc1csc([C@@H]([NH2+]Cc2ccc(N(C)C)c(C)c2)C2CC2)n1 ZINC000815083999 1041912637 /nfs/dbraw/zinc/91/26/37/1041912637.db2.gz MJRGTQQGFIJCGF-KRWDZBQOSA-N 1 0 315.486 4.067 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)cc1 ZINC000815092158 1041918138 /nfs/dbraw/zinc/91/81/38/1041918138.db2.gz AYNOEBDHPJSYOM-UZLBHIALSA-N 1 0 309.457 4.121 20 10 DICDRO CCOCc1cc(C[NH2+]CCC(C)(C)C2CC2)ccc1OC ZINC000815162588 1041922311 /nfs/dbraw/zinc/92/23/11/1041922311.db2.gz IFYCVEVZOYMDON-UHFFFAOYSA-N 1 0 305.462 4.148 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)c1 ZINC000815166614 1041929429 /nfs/dbraw/zinc/92/94/29/1041929429.db2.gz PVADLKXOVTWVBL-CTYIDZIISA-N 1 0 301.817 4.390 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)c1cccc(Cl)c1 ZINC000756734775 1041950663 /nfs/dbraw/zinc/95/06/63/1041950663.db2.gz ZOJSZGADQMZIKK-SCLBCKFNSA-N 1 0 319.832 4.392 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000815580545 1041965646 /nfs/dbraw/zinc/96/56/46/1041965646.db2.gz MGTSTIKGQISDNL-MSOLQXFVSA-N 1 0 324.468 4.329 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cc(F)ccc2F)c(O)c1 ZINC000815585613 1041968546 /nfs/dbraw/zinc/96/85/46/1041968546.db2.gz MWPZXNVXWSRZAO-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c(O)c1 ZINC000815597450 1041970487 /nfs/dbraw/zinc/97/04/87/1041970487.db2.gz WHFALHRLOPNICT-HEFCWWFNSA-N 1 0 307.437 4.246 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CC(C)(C)[C@H]2CCCCO2)c(O)c1 ZINC000815596220 1041970968 /nfs/dbraw/zinc/97/09/68/1041970968.db2.gz NUQZZKGZJLYRHD-DOTOQJQBSA-N 1 0 305.462 4.255 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCCCC(=O)OC(C)(C)C)c(O)c1 ZINC000815599808 1041971339 /nfs/dbraw/zinc/97/13/39/1041971339.db2.gz BOQRJCBFQQMWIY-HNNXBMFYSA-N 1 0 321.461 4.172 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1ccccc1Cl ZINC000756757757 1041982246 /nfs/dbraw/zinc/98/22/46/1041982246.db2.gz BRHDLWYISVAXGR-PIGZYNQJSA-N 1 0 323.795 4.223 20 10 DICDRO CC[C@@H]([NH2+]CCC1(COC)CCC1)c1cc(Cl)ccc1O ZINC000815643278 1041982595 /nfs/dbraw/zinc/98/25/95/1041982595.db2.gz YHPSIJGMWGSOCZ-OAHLLOKOSA-N 1 0 311.853 4.293 20 10 DICDRO CC(C)C1([NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2Cl)CC1 ZINC000815647805 1041984118 /nfs/dbraw/zinc/98/41/18/1041984118.db2.gz VSKSOZNBPFDDTN-AWEZNQCLSA-N 1 0 322.880 4.016 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3ccsc3)CC2)cc1 ZINC000178464083 1042027707 /nfs/dbraw/zinc/02/77/07/1042027707.db2.gz ZBXFTXVJWIYEKH-CQSZACIVSA-N 1 0 316.470 4.076 20 10 DICDRO COc1ccccc1C[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816480971 1042056436 /nfs/dbraw/zinc/05/64/36/1042056436.db2.gz CXHSORSYBZTJJI-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO C[N@H+](Cc1ccc2ccccc2c1O)C1Cc2ccccc2C1 ZINC000816495752 1042057340 /nfs/dbraw/zinc/05/73/40/1042057340.db2.gz ILJQHBXVNDSEDI-UHFFFAOYSA-N 1 0 303.405 4.145 20 10 DICDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc3ccccc3c2O)no1 ZINC000816488213 1042057927 /nfs/dbraw/zinc/05/79/27/1042057927.db2.gz LQHJTXCYLHWSFZ-SFHVURJKSA-N 1 0 308.381 4.179 20 10 DICDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc3ccccc3c2O)on1 ZINC000816492767 1042058392 /nfs/dbraw/zinc/05/83/92/1042058392.db2.gz BPXACLAMAPUUST-KRWDZBQOSA-N 1 0 308.381 4.179 20 10 DICDRO Oc1c(C[N@H+]2CC=C(C(F)(F)F)CC2)ccc2ccccc21 ZINC000816515083 1042061786 /nfs/dbraw/zinc/06/17/86/1042061786.db2.gz OXBFPRDRTPFNFF-UHFFFAOYSA-N 1 0 307.315 4.240 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816549288 1042064356 /nfs/dbraw/zinc/06/43/56/1042064356.db2.gz JKLOLJIFIANBLI-UHFFFAOYSA-N 1 0 320.436 4.210 20 10 DICDRO Oc1c(C[NH2+]Cc2ccn(C3CCCC3)n2)ccc2ccccc21 ZINC000816557672 1042067717 /nfs/dbraw/zinc/06/77/17/1042067717.db2.gz XRLNIZZUTBKOAE-UHFFFAOYSA-N 1 0 321.424 4.147 20 10 DICDRO C[C@@H](C[C@H](O)c1ccccc1)[NH2+]Cc1ccc2ccccc2c1O ZINC000816559174 1042068044 /nfs/dbraw/zinc/06/80/44/1042068044.db2.gz ALAWLMFLVDSMPU-YWZLYKJASA-N 1 0 321.420 4.147 20 10 DICDRO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816594975 1042070803 /nfs/dbraw/zinc/07/08/03/1042070803.db2.gz VBIBDROTVYFHEQ-IAQYHMDHSA-N 1 0 309.331 4.318 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC000816599461 1042071331 /nfs/dbraw/zinc/07/13/31/1042071331.db2.gz NSXFJVLUATUFPN-UHFFFAOYSA-N 1 0 312.800 4.192 20 10 DICDRO Oc1c(C[NH+]2CCC(c3cccnc3)CC2)ccc2ccccc21 ZINC000816610212 1042072824 /nfs/dbraw/zinc/07/28/24/1042072824.db2.gz BUXRLYSDOQZLCK-UHFFFAOYSA-N 1 0 318.420 4.320 20 10 DICDRO Oc1c(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)ccc2ccccc21 ZINC000816616162 1042072834 /nfs/dbraw/zinc/07/28/34/1042072834.db2.gz PPXSSQPJLSBYPT-ICSRJNTNSA-N 1 0 323.436 4.079 20 10 DICDRO C[C@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816608789 1042073769 /nfs/dbraw/zinc/07/37/69/1042073769.db2.gz JOOGWWKMFIIWLZ-YJBOKZPZSA-N 1 0 313.441 4.061 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000817366780 1042106367 /nfs/dbraw/zinc/10/63/67/1042106367.db2.gz ZFFSKTCJUCZECM-LBPRGKRZSA-N 1 0 324.346 4.105 20 10 DICDRO CC[C@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000817415481 1042108788 /nfs/dbraw/zinc/10/87/88/1042108788.db2.gz UCXMTTYMGAJHBP-OALUTQOASA-N 1 0 311.425 4.106 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccncc1Cl ZINC000817576897 1042115868 /nfs/dbraw/zinc/11/58/68/1042115868.db2.gz ZVFSOVRZMSWUEO-CQSZACIVSA-N 1 0 315.848 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC23CCSCC3)c(O)c1C ZINC000817589944 1042119461 /nfs/dbraw/zinc/11/94/61/1042119461.db2.gz RIYCLYRFULWSCV-LSDHHAIUSA-N 1 0 305.487 4.193 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cc(C)n1 ZINC000817590435 1042119593 /nfs/dbraw/zinc/11/95/93/1042119593.db2.gz WVGCDAIASZODEB-ZDUSSCGKSA-N 1 0 304.821 4.217 20 10 DICDRO CC[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000817948127 1042130712 /nfs/dbraw/zinc/13/07/12/1042130712.db2.gz WIXKDUVRZUANFG-QIMFLAQGSA-N 1 0 317.260 4.010 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000817956727 1042131093 /nfs/dbraw/zinc/13/10/93/1042131093.db2.gz BFYZMTFXGGUGGX-APWZRJJASA-N 1 0 314.860 4.391 20 10 DICDRO Nc1ccc(CC[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000817955633 1042131140 /nfs/dbraw/zinc/13/11/40/1042131140.db2.gz DEDZLVXNCMRPRX-SFHVURJKSA-N 1 0 300.833 4.206 20 10 DICDRO CC(C)c1ccc([C@@H](N)C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000817954215 1042131306 /nfs/dbraw/zinc/13/13/06/1042131306.db2.gz WBYVMHOFUKMMJE-UGSOOPFHSA-N 1 0 316.420 4.005 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1cc(Cl)c(N)c(Cl)c1 ZINC000817955638 1042131406 /nfs/dbraw/zinc/13/14/06/1042131406.db2.gz DHILTBDMBOLXQA-SNVBAGLBSA-N 1 0 324.255 4.051 20 10 DICDRO Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CCc2ccc(N)cc2)c1 ZINC000817956355 1042131626 /nfs/dbraw/zinc/13/16/26/1042131626.db2.gz XDCVNAMLZNYJIB-ZDUSSCGKSA-N 1 0 320.383 4.072 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cccc(OC(F)(F)F)c1 ZINC000817956053 1042131746 /nfs/dbraw/zinc/13/17/46/1042131746.db2.gz PALOXQPYPWVCMY-LBPRGKRZSA-N 1 0 324.346 4.061 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000817955632 1042131761 /nfs/dbraw/zinc/13/17/61/1042131761.db2.gz DEDZLVXNCMRPRX-GOSISDBHSA-N 1 0 300.833 4.206 20 10 DICDRO CC(C)[C@@H]([NH2+]CCc1ccc(N)cc1)c1cc(F)ccc1F ZINC000817958483 1042132884 /nfs/dbraw/zinc/13/28/84/1042132884.db2.gz WIOVFNQPIPOURE-GOSISDBHSA-N 1 0 304.384 4.076 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)c(O)c1C ZINC000817967433 1042134022 /nfs/dbraw/zinc/13/40/22/1042134022.db2.gz IJDARYDUKRJKBM-LIRRHRJNSA-N 1 0 310.441 4.319 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc3c2CCCN3)c(O)c1 ZINC000817976320 1042134713 /nfs/dbraw/zinc/13/47/13/1042134713.db2.gz XRNHZAZWZUXXKH-HNNXBMFYSA-N 1 0 310.441 4.218 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc3c2CCCN3)c(O)c1C ZINC000817976318 1042135123 /nfs/dbraw/zinc/13/51/23/1042135123.db2.gz XQYGKTRAJKJAMJ-HNNXBMFYSA-N 1 0 310.441 4.218 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)cc(Cl)c1[O-] ZINC000817970011 1042135145 /nfs/dbraw/zinc/13/51/45/1042135145.db2.gz JMHZLWSMBRYCJP-SUNKGSAMSA-N 1 0 317.260 4.010 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)cc(Cl)c1[O-] ZINC000817970012 1042135234 /nfs/dbraw/zinc/13/52/34/1042135234.db2.gz JMHZLWSMBRYCJP-WDMOLILDSA-N 1 0 317.260 4.010 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)c(O)c1C ZINC000756864417 1042136558 /nfs/dbraw/zinc/13/65/58/1042136558.db2.gz MIVMSGVZYJVOFJ-GVDBMIGSSA-N 1 0 305.462 4.253 20 10 DICDRO CC(C)(C)c1csc(C[NH2+]Cc2cc(Cl)ccc2O)n1 ZINC000105498301 1042175700 /nfs/dbraw/zinc/17/57/00/1042175700.db2.gz CYFVQOLVILAPGE-UHFFFAOYSA-N 1 0 310.850 4.089 20 10 DICDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1cccc(Cl)c1[O-] ZINC000317341123 1042224623 /nfs/dbraw/zinc/22/46/23/1042224623.db2.gz YXKRFCPXFWJPKC-ZDUSSCGKSA-N 1 0 319.832 4.117 20 10 DICDRO CCc1cccc2c(CC[NH2+]Cc3cc(C)ccc3O)c[nH]c21 ZINC000237006883 1042454236 /nfs/dbraw/zinc/45/42/36/1042454236.db2.gz SLHDVJRVHUEFBH-UHFFFAOYSA-N 1 0 308.425 4.077 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1O ZINC000894205397 1042504146 /nfs/dbraw/zinc/50/41/46/1042504146.db2.gz YOOLDLKQZWWDJD-INIZCTEOSA-N 1 0 317.816 4.140 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cccc(O)c1 ZINC000178867574 1042524034 /nfs/dbraw/zinc/52/40/34/1042524034.db2.gz UZMRLPGONOISHM-UHFFFAOYSA-N 1 0 310.441 4.015 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)cc1 ZINC000237122108 1042541979 /nfs/dbraw/zinc/54/19/79/1042541979.db2.gz FFSYWKAOTFVCEM-UHFFFAOYSA-N 1 0 312.432 4.451 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)c1cccnc1 ZINC000280075273 1042563900 /nfs/dbraw/zinc/56/39/00/1042563900.db2.gz XYQPKKUWVJYGOR-LBPRGKRZSA-N 1 0 323.362 4.017 20 10 DICDRO CC[C@H]([NH2+][C@H](C)C[C@H](O)c1cccs1)c1ccc(C)cc1O ZINC000280099151 1042564808 /nfs/dbraw/zinc/56/48/08/1042564808.db2.gz MYLKAULFSQTSQE-KMFMINBZSA-N 1 0 319.470 4.315 20 10 DICDRO CC[C@@H]([NH2+]Cc1cnn(-c2ccccc2)c1)c1ccc(C)cc1O ZINC000280113222 1042565531 /nfs/dbraw/zinc/56/55/31/1042565531.db2.gz NSVZJBKOQCFZKY-LJQANCHMSA-N 1 0 321.424 4.127 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccc(C)cc1O ZINC000280156275 1042566716 /nfs/dbraw/zinc/56/67/16/1042566716.db2.gz QLDYBWQHZROMOQ-IRXDYDNUSA-N 1 0 315.388 4.404 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2OC(C)C)c1 ZINC000271790327 1042668663 /nfs/dbraw/zinc/66/86/63/1042668663.db2.gz HSVMICCLURKQKN-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccccc1OCC1CC1 ZINC000237126892 1042678357 /nfs/dbraw/zinc/67/83/57/1042678357.db2.gz HSDGXVFRSJMKEA-UHFFFAOYSA-N 1 0 324.468 4.140 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccccc1OC ZINC000319682373 1042678448 /nfs/dbraw/zinc/67/84/48/1042678448.db2.gz VQMXEXDEBJEEEN-DYVFJYSZSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1O ZINC000894323223 1042845130 /nfs/dbraw/zinc/84/51/30/1042845130.db2.gz LELWCNRLSKDYNU-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2cc3ccccc3o2)c1O ZINC000894531643 1042966213 /nfs/dbraw/zinc/96/62/13/1042966213.db2.gz BNBMIMOEWIKIGB-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccc(C)cc1O ZINC000794805289 1043050756 /nfs/dbraw/zinc/05/07/56/1043050756.db2.gz GJCBYEHZYDZQBR-YJBOKZPZSA-N 1 0 311.425 4.308 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1ccc(C)cc1O ZINC000794811519 1043055444 /nfs/dbraw/zinc/05/54/44/1043055444.db2.gz FHDBTINHDFYWSR-RNIPGJKVSA-N 1 0 315.457 4.089 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2OC)c1ccc(C)cc1O ZINC000794810957 1043057327 /nfs/dbraw/zinc/05/73/27/1043057327.db2.gz PEDQSZPFCCYWNN-QZTJIDSGSA-N 1 0 311.425 4.437 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(OC)c(F)c1)c1ccc(C)cc1O ZINC000794807736 1043058078 /nfs/dbraw/zinc/05/80/78/1043058078.db2.gz LGQKUVAAMIBPOV-KRWDZBQOSA-N 1 0 317.404 4.132 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccc(C)cc1O ZINC000794815221 1043059103 /nfs/dbraw/zinc/05/91/03/1043059103.db2.gz NPBQUWWGVOFGDV-KRWDZBQOSA-N 1 0 305.368 4.262 20 10 DICDRO CC[C@H]([NH2+]CC[C@@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000794814577 1043059668 /nfs/dbraw/zinc/05/96/68/1043059668.db2.gz LVOWCAXMXMMPCD-AZUAARDMSA-N 1 0 313.441 4.039 20 10 DICDRO CC[C@H]([NH2+][C@H]1COc2c1ccc(C)c2C)c1ccc(C)cc1O ZINC000794812320 1043060559 /nfs/dbraw/zinc/06/05/59/1043060559.db2.gz VUIQMXIUEFXQFT-ROUUACIJSA-N 1 0 311.425 4.492 20 10 DICDRO CC[C@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1ccc(C)cc1O ZINC000794818463 1043062406 /nfs/dbraw/zinc/06/24/06/1043062406.db2.gz XDHNJWFWHRRRQE-PKOBYXMFSA-N 1 0 305.462 4.073 20 10 DICDRO CCCCn1cc(C[NH2+][C@H](CC)c2ccc(C)cc2O)c(C)n1 ZINC000794818584 1043062770 /nfs/dbraw/zinc/06/27/70/1043062770.db2.gz VNEFVUPYWYVJLL-GOSISDBHSA-N 1 0 315.461 4.247 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C)cc1O ZINC000794818498 1043062786 /nfs/dbraw/zinc/06/27/86/1043062786.db2.gz SYIYJQJSBBDJIX-CJNGLKHVSA-N 1 0 314.385 4.411 20 10 DICDRO CCC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)[C@@H](O)c1ccccc1 ZINC000794830522 1043067224 /nfs/dbraw/zinc/06/72/24/1043067224.db2.gz JSPYLSYDOYSFAY-QSFXBCCZSA-N 1 0 313.441 4.254 20 10 DICDRO CCC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)[C@H](O)c1ccccc1 ZINC000794831282 1043067298 /nfs/dbraw/zinc/06/72/98/1043067298.db2.gz PNFKCWSVOUIRCN-XVGQJIODSA-N 1 0 317.404 4.084 20 10 DICDRO CC[C@](C)([NH2+]Cc1cc(C)c(C)cc1O)c1nc(C)cs1 ZINC000174504350 1043068152 /nfs/dbraw/zinc/06/81/52/1043068152.db2.gz ZNOQPSXWHRSAHX-KRWDZBQOSA-N 1 0 304.459 4.189 20 10 DICDRO CCC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)[C@H](O)c1ccccc1 ZINC000794832482 1043069457 /nfs/dbraw/zinc/06/94/57/1043069457.db2.gz SRNGIHDMOZWPHW-MOXGXCLJSA-N 1 0 313.441 4.254 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)cc1 ZINC000777310036 1043098371 /nfs/dbraw/zinc/09/83/71/1043098371.db2.gz RONCKLKNGXELLT-ILZDJORESA-N 1 0 318.505 4.387 20 10 DICDRO C[C@H]([NH2+]CC1CCOCC1)c1ccc(N2CCCCCC2)cc1 ZINC000178280659 1043124937 /nfs/dbraw/zinc/12/49/37/1043124937.db2.gz IFZARFKNUJVBAY-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000865832638 1043138620 /nfs/dbraw/zinc/13/86/20/1043138620.db2.gz VDBDYDDKMOEBIT-VXGBXAGGSA-N 1 0 305.727 4.032 20 10 DICDRO Cc1nn(-c2ccccc2)c(C)c1C[NH2+][C@@H](C)c1ccccc1O ZINC000183386342 1043162598 /nfs/dbraw/zinc/16/25/98/1043162598.db2.gz WCEMYQIYJDDNKS-AWEZNQCLSA-N 1 0 321.424 4.046 20 10 DICDRO C[C@@H](CCc1cncc2ccccc21)[NH2+]Cc1ccccc1O ZINC000866253494 1043165203 /nfs/dbraw/zinc/16/52/03/1043165203.db2.gz JLIXKYRYFGOPLH-HNNXBMFYSA-N 1 0 306.409 4.051 20 10 DICDRO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000183608733 1043168295 /nfs/dbraw/zinc/16/82/95/1043168295.db2.gz KFHICRIYDBARNV-KGLIPLIRSA-N 1 0 309.413 4.174 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOc2cc(F)ccc21)c1ccccc1O ZINC000183671606 1043168433 /nfs/dbraw/zinc/16/84/33/1043168433.db2.gz SREDYOHMWHHSAW-LRDDRELGSA-N 1 0 301.361 4.096 20 10 DICDRO C[C@H]([NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1)c1ccccc1O ZINC000183628938 1043168781 /nfs/dbraw/zinc/16/87/81/1043168781.db2.gz WPJICCZRALJNBL-TXPKVOOTSA-N 1 0 311.425 4.211 20 10 DICDRO COCc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1 ZINC000184941732 1043192351 /nfs/dbraw/zinc/19/23/51/1043192351.db2.gz WOWAVYKYMFHJKJ-GFCCVEGCSA-N 1 0 305.805 4.043 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000185230048 1043196285 /nfs/dbraw/zinc/19/62/85/1043196285.db2.gz VZNIHOMCKJCHCX-CHWSQXEVSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H]2CCCO2)c(O)c1 ZINC000185225376 1043196964 /nfs/dbraw/zinc/19/69/64/1043196964.db2.gz FJJAIQTZTAGOGV-YSSFQJQWSA-N 1 0 311.425 4.272 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3cc(Cl)ccc32)c1 ZINC000185215781 1043197452 /nfs/dbraw/zinc/19/74/52/1043197452.db2.gz DPGMSVONEIEFPN-GTNSWQLSSA-N 1 0 317.816 4.392 20 10 DICDRO Cc1csc(CCCC[NH2+][C@H](C)c2ccc(C)cc2O)n1 ZINC000185318889 1043198033 /nfs/dbraw/zinc/19/80/33/1043198033.db2.gz BUUMRRAVFNTIQR-CQSZACIVSA-N 1 0 304.459 4.139 20 10 DICDRO Cc1csc(CCCC[NH2+][C@H](C)c2cc(C)ccc2O)n1 ZINC000185318749 1043198571 /nfs/dbraw/zinc/19/85/71/1043198571.db2.gz INRARRGXEPDBGF-CQSZACIVSA-N 1 0 304.459 4.139 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC000185334992 1043200481 /nfs/dbraw/zinc/20/04/81/1043200481.db2.gz WNZJMOYFURMWCK-KNBMTAEXSA-N 1 0 311.425 4.272 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC000185334957 1043201163 /nfs/dbraw/zinc/20/11/63/1043201163.db2.gz WNZJMOYFURMWCK-VPWXQRGCSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccc2ccccc2c1O ZINC000185534618 1043202420 /nfs/dbraw/zinc/20/24/20/1043202420.db2.gz OZOCHSPZXRTBGP-DMBMUNPASA-N 1 0 311.425 4.010 20 10 DICDRO C[C@@H]([NH2+]C1CCC(OC(C)(C)C)CC1)c1cc(F)ccc1O ZINC000866451519 1043202984 /nfs/dbraw/zinc/20/29/84/1043202984.db2.gz UVHOSGWWOSSOIW-LRVUVFPRSA-N 1 0 309.425 4.308 20 10 DICDRO C[C@H]([NH2+]C1CCC(OC(C)(C)C)CC1)c1cc(F)ccc1O ZINC000866451517 1043203269 /nfs/dbraw/zinc/20/32/69/1043203269.db2.gz UVHOSGWWOSSOIW-GRTSSRMGSA-N 1 0 309.425 4.308 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cccc(-n3cccn3)c2)c1 ZINC000185616405 1043204359 /nfs/dbraw/zinc/20/43/59/1043204359.db2.gz GMTOWYYEDQKLPO-HZPDHXFCSA-N 1 0 321.424 4.298 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cnc(C)s1)c1ccc(N(C)C)cc1 ZINC000866454369 1043204512 /nfs/dbraw/zinc/20/45/12/1043204512.db2.gz ACJKKDSIHRBUPS-LRDDRELGSA-N 1 0 303.475 4.319 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(-n3cccn3)cc2)c(O)c1 ZINC000185611946 1043204709 /nfs/dbraw/zinc/20/47/09/1043204709.db2.gz ZHKVUQLURSVGIV-HZPDHXFCSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccc(-n3cccn3)c2)c1 ZINC000185616423 1043205319 /nfs/dbraw/zinc/20/53/19/1043205319.db2.gz GMTOWYYEDQKLPO-CVEARBPZSA-N 1 0 321.424 4.298 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cnc(C)s1)c1ccc(N(C)C)cc1 ZINC000866454372 1043205718 /nfs/dbraw/zinc/20/57/18/1043205718.db2.gz ACJKKDSIHRBUPS-WBMJQRKESA-N 1 0 303.475 4.319 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccc(F)cc2)c1 ZINC000185838240 1043208405 /nfs/dbraw/zinc/20/84/05/1043208405.db2.gz AKKQPWOUIQOALT-NJSLBKSFSA-N 1 0 317.404 4.003 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2([C@H]3CCCCO3)CCC2)c1 ZINC000866480812 1043208739 /nfs/dbraw/zinc/20/87/39/1043208739.db2.gz ISOHUCJTKRTRTL-MAUKXSAKSA-N 1 0 303.446 4.091 20 10 DICDRO COc1cccc(C[NH2+]C(C)(C)c2cccc(Cl)c2F)c1O ZINC000185847751 1043209078 /nfs/dbraw/zinc/20/90/78/1043209078.db2.gz OSHKRYVKJXISMZ-UHFFFAOYSA-N 1 0 323.795 4.218 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC2([C@@H]3CCCCO3)CCC2)c1 ZINC000866480813 1043209488 /nfs/dbraw/zinc/20/94/88/1043209488.db2.gz ISOHUCJTKRTRTL-QAPCUYQASA-N 1 0 303.446 4.091 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc2[nH]c(=O)oc2c1)c1ccccc1O ZINC000866486004 1043210250 /nfs/dbraw/zinc/21/02/50/1043210250.db2.gz VKMBKJCAQIDBPX-SMDDNHRTSA-N 1 0 312.369 4.041 20 10 DICDRO CC[C@@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccccc1O ZINC000186147514 1043215014 /nfs/dbraw/zinc/21/50/14/1043215014.db2.gz YBBOHKMSAXHUAL-HOJAQTOUSA-N 1 0 311.425 4.353 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000186157455 1043217026 /nfs/dbraw/zinc/21/70/26/1043217026.db2.gz MCSSMXWAFLTKMO-NXEZZACHSA-N 1 0 308.809 4.105 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccccc1O ZINC000186268762 1043219259 /nfs/dbraw/zinc/21/92/59/1043219259.db2.gz JMLQXURCIVIYSM-HZPDHXFCSA-N 1 0 301.361 4.096 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1[N+](=O)[O-] ZINC000866540474 1043220573 /nfs/dbraw/zinc/22/05/73/1043220573.db2.gz OWEPFGXEWANKCN-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(O)c1C ZINC000866540514 1043221052 /nfs/dbraw/zinc/22/10/52/1043221052.db2.gz POSWQPOOIXYFTF-CQSZACIVSA-N 1 0 314.385 4.076 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCSCCC(F)(F)F)c(O)c1 ZINC000866543867 1043221543 /nfs/dbraw/zinc/22/15/43/1043221543.db2.gz ZEEKCDVORZKHHR-LLVKDONJSA-N 1 0 307.381 4.037 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCOc3cc(F)ccc32)c1 ZINC000186374094 1043222945 /nfs/dbraw/zinc/22/29/45/1043222945.db2.gz BVJHSCHAVYABJD-GUYCJALGSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCOc3c(F)cccc32)c1 ZINC000186506546 1043225058 /nfs/dbraw/zinc/22/50/58/1043225058.db2.gz LFHMYMQQAPBQJG-DYVFJYSZSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@H](C)c1ccc(F)cc1O ZINC000186477362 1043225580 /nfs/dbraw/zinc/22/55/80/1043225580.db2.gz SRDNTVXMQVRENW-CYBMUJFWSA-N 1 0 302.393 4.074 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1cc(F)ccc1O ZINC000186506989 1043228088 /nfs/dbraw/zinc/22/80/88/1043228088.db2.gz GRSLPIINCYNYGZ-ZBEGNZNMSA-N 1 0 319.351 4.235 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@@H](C)c2cc(Cl)ccc2O)n1 ZINC000186561682 1043228849 /nfs/dbraw/zinc/22/88/49/1043228849.db2.gz ZHUHQUQXBURPBK-KOLCDFICSA-N 1 0 310.850 4.265 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@H](C)c2cc(Cl)ccc2O)n1 ZINC000186561716 1043229663 /nfs/dbraw/zinc/22/96/63/1043229663.db2.gz ZHUHQUQXBURPBK-MWLCHTKSSA-N 1 0 310.850 4.265 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)c1cc(F)ccc1O ZINC000866608080 1043231942 /nfs/dbraw/zinc/23/19/42/1043231942.db2.gz DXGQWCYEQDEUJJ-ZWKOPEQDSA-N 1 0 303.299 4.079 20 10 DICDRO C[C@@H]([NH2+]CCCC(C)(C)CO)c1ccc(N2CCCCC2)cc1 ZINC000163160617 1043263237 /nfs/dbraw/zinc/26/32/37/1043263237.db2.gz SFOHSUBEBABTMY-QGZVFWFLSA-N 1 0 318.505 4.126 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CCCS1)c1ccc2ccccc2c1O ZINC000121991240 1043270399 /nfs/dbraw/zinc/27/03/99/1043270399.db2.gz IVVKIAVJRFWVMX-UGSOOPFHSA-N 1 0 301.455 4.482 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccnc1Cl ZINC000268811136 1043333898 /nfs/dbraw/zinc/33/38/98/1043333898.db2.gz KSFYQOGOAPTVGS-CQSZACIVSA-N 1 0 315.848 4.186 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(CCOC)CCC2)cc1 ZINC000122977536 1043338558 /nfs/dbraw/zinc/33/85/58/1043338558.db2.gz DMXZZAXASNLNSM-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000268984791 1043348201 /nfs/dbraw/zinc/34/82/01/1043348201.db2.gz SNQSAKIBJKNRGE-LJQANCHMSA-N 1 0 323.436 4.251 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cnc(Cl)s2)cc1C ZINC000895150720 1043349442 /nfs/dbraw/zinc/34/94/42/1043349442.db2.gz BQDPMOCPLUCTKI-UHFFFAOYSA-N 1 0 310.850 4.184 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2cccc3ncccc23)c2c1c(F)ccc2O ZINC000872124303 1043469382 /nfs/dbraw/zinc/46/93/82/1043469382.db2.gz JDFPVAPJTHZGOY-YVEFUNNKSA-N 1 0 322.383 4.418 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc3ncccc23)c(O)c1 ZINC000872124094 1043469746 /nfs/dbraw/zinc/46/97/46/1043469746.db2.gz COSMYJHPDRKYFN-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO c1[nH]c2ncccc2c1C1=CCN(c2cc[nH+]cc2C2CC2)CC1 ZINC000872401111 1043496909 /nfs/dbraw/zinc/49/69/09/1043496909.db2.gz GVVYUGZXIWHPGY-UHFFFAOYSA-N 1 0 316.408 4.129 20 10 DICDRO CCn1nc(C)c(C[N@H+](C)Cc2c(O)ccc3ccccc32)c1C ZINC000872632109 1043506453 /nfs/dbraw/zinc/50/64/53/1043506453.db2.gz DTXMUJKWHQDZRA-UHFFFAOYSA-N 1 0 323.440 4.011 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(F)c(F)c1 ZINC000124414334 1043520398 /nfs/dbraw/zinc/52/03/98/1043520398.db2.gz PMNMTPRUTWPYMC-QWHCGFSZSA-N 1 0 304.384 4.443 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000124471783 1043531033 /nfs/dbraw/zinc/53/10/33/1043531033.db2.gz VWAXXGBMLKQDGU-JKSUJKDBSA-N 1 0 312.457 4.481 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)C2CCC(F)(F)CC2)c1O ZINC000895190017 1043556339 /nfs/dbraw/zinc/55/63/39/1043556339.db2.gz HRNCMPLTQLQKED-GFCCVEGCSA-N 1 0 313.388 4.013 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1O ZINC000895190019 1043556643 /nfs/dbraw/zinc/55/66/43/1043556643.db2.gz HRNCMPLTQLQKED-LBPRGKRZSA-N 1 0 313.388 4.013 20 10 DICDRO CCc1cccc2c(CC[NH2+][C@H](C)c3ccccc3O)c[nH]c21 ZINC000783510977 1043557522 /nfs/dbraw/zinc/55/75/22/1043557522.db2.gz VINVQVOORJSFBT-CQSZACIVSA-N 1 0 308.425 4.329 20 10 DICDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc(Br)cc2)c1O ZINC000124653864 1043559950 /nfs/dbraw/zinc/55/99/50/1043559950.db2.gz FEWMEWGMQIVDDI-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)cc1C ZINC000874077010 1043568465 /nfs/dbraw/zinc/56/84/65/1043568465.db2.gz NANVFVMAPXLYAV-CYBMUJFWSA-N 1 0 305.368 4.480 20 10 DICDRO C[C@H]([NH2+]Cc1ccco1)c1ccc(N2CCCCC2)c(F)c1 ZINC000020550977 1043597351 /nfs/dbraw/zinc/59/73/51/1043597351.db2.gz NRAMWDUZZFTLKC-AWEZNQCLSA-N 1 0 302.393 4.260 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(O)cc1)c1ccc2ccccc2c1O ZINC000320191387 1043608715 /nfs/dbraw/zinc/60/87/15/1043608715.db2.gz GHJGRJUKWQSPDN-CQSZACIVSA-N 1 0 307.393 4.144 20 10 DICDRO c1ccc(C[C@H]2CCC[C@@H]2[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000738431720 1043631203 /nfs/dbraw/zinc/63/12/03/1043631203.db2.gz VUEIKNVSSYZJEE-QUCCMNQESA-N 1 0 307.437 4.123 20 10 DICDRO c1ccc(C[C@@H]2CCC[C@@H]2[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000738431718 1043632026 /nfs/dbraw/zinc/63/20/26/1043632026.db2.gz VUEIKNVSSYZJEE-ICSRJNTNSA-N 1 0 307.437 4.123 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2C)c1O ZINC000926896733 1043650220 /nfs/dbraw/zinc/65/02/20/1043650220.db2.gz COLRFLKBUGRAIZ-STQMWFEESA-N 1 0 303.377 4.260 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2C)c1O ZINC000926897047 1043650638 /nfs/dbraw/zinc/65/06/38/1043650638.db2.gz COLRFLKBUGRAIZ-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2[C@@H](c3ccccc3)C2(F)F)c(O)c1 ZINC000926974525 1043666164 /nfs/dbraw/zinc/66/61/64/1043666164.db2.gz TZJOOACCBGEYBA-MZMPZRCHSA-N 1 0 317.379 4.400 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1cc2c(cc1O)CCCC2 ZINC000927063283 1043677238 /nfs/dbraw/zinc/67/72/38/1043677238.db2.gz CDSGDSIFFAQPSC-KUHUBIRLSA-N 1 0 322.452 4.394 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1cc2c(cc1O)CCCC2 ZINC000927063284 1043677894 /nfs/dbraw/zinc/67/78/94/1043677894.db2.gz CDSGDSIFFAQPSC-LIRRHRJNSA-N 1 0 322.452 4.394 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](c2cnn(C)c2)C(C)C)c1O ZINC000927070550 1043682395 /nfs/dbraw/zinc/68/23/95/1043682395.db2.gz OZOMEAYDAPIYCH-BLLLJJGKSA-N 1 0 321.852 4.135 20 10 DICDRO Cc1ccccc1C(C)(C)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001202544925 1043689269 /nfs/dbraw/zinc/68/92/69/1043689269.db2.gz BYMSTNFINUMHIY-UHFFFAOYSA-N 1 0 318.411 4.364 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(C(F)F)nc1 ZINC000876522267 1043691327 /nfs/dbraw/zinc/69/13/27/1043691327.db2.gz MGPGBXONMCJKSS-UHFFFAOYSA-N 1 0 319.399 4.107 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1Cl ZINC000825903651 1043710498 /nfs/dbraw/zinc/71/04/98/1043710498.db2.gz NPZICPNOWWFUFC-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1ccc(C[NH2+]C2CCN([C@H](C)c3ccccc3)CC2)c(O)c1 ZINC000877038450 1043736192 /nfs/dbraw/zinc/73/61/92/1043736192.db2.gz PXBFGRKMRDZNDN-QGZVFWFLSA-N 1 0 324.468 4.016 20 10 DICDRO C[C@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccc(N(C)C)cc1 ZINC000777702783 1043766432 /nfs/dbraw/zinc/76/64/32/1043766432.db2.gz TWDUXEQXLZGZQX-AWEZNQCLSA-N 1 0 315.436 4.126 20 10 DICDRO C[C@@H]([NH2+]Cc1cnc(C2CCCC2)s1)c1ccccc1O ZINC000877756361 1043791870 /nfs/dbraw/zinc/79/18/70/1043791870.db2.gz IKTGGIBXNZAKGZ-GFCCVEGCSA-N 1 0 302.443 4.357 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@@H](C)C1)c1ccccc1O ZINC000877756520 1043791932 /nfs/dbraw/zinc/79/19/32/1043791932.db2.gz OZMYUQNMJHWPLF-SCTDSRPQSA-N 1 0 324.468 4.096 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(F)c(C(F)(F)F)c1)c1ccccc1O ZINC000877756269 1043792301 /nfs/dbraw/zinc/79/23/01/1043792301.db2.gz DLACKMHCDDGKRF-SNVBAGLBSA-N 1 0 313.294 4.401 20 10 DICDRO CCCOc1cc(C[NH2+][C@@H](C)c2ccccc2O)ccc1OC ZINC000877756482 1043793789 /nfs/dbraw/zinc/79/37/89/1043793789.db2.gz LSPUEQGAOYKUAN-AWEZNQCLSA-N 1 0 315.413 4.040 20 10 DICDRO COc1ccc(C[NH2+]CC[C@]2(C)CC2(Cl)Cl)cc1C ZINC001308408768 1043824842 /nfs/dbraw/zinc/82/48/42/1043824842.db2.gz XQCMKIYUZFGAHK-CQSZACIVSA-N 1 0 302.245 4.067 20 10 DICDRO Cc1c(Cl)cccc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001648965756 1043827733 /nfs/dbraw/zinc/82/77/33/1043827733.db2.gz UDSFXUOPIHMFBO-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000826023736 1043846027 /nfs/dbraw/zinc/84/60/27/1043846027.db2.gz DWCVINRJNCXNBS-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000127421662 1043931591 /nfs/dbraw/zinc/93/15/91/1043931591.db2.gz WAXGCWJPPYXPDA-SJLPKXTDSA-N 1 0 316.489 4.285 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(OC)c(F)c2)cc1C ZINC000237267986 1043956627 /nfs/dbraw/zinc/95/66/27/1043956627.db2.gz KJOMYQFKEVWIDX-ZDUSSCGKSA-N 1 0 303.377 4.002 20 10 DICDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000879650526 1043979793 /nfs/dbraw/zinc/97/97/93/1043979793.db2.gz GCVZDNUZTILOCU-STQMWFEESA-N 1 0 300.358 4.021 20 10 DICDRO C[C@]12CC[N@H+](Cc3c(O)ccc4ccccc43)C[C@H]1C2(F)F ZINC000291819466 1044105794 /nfs/dbraw/zinc/10/57/94/1044105794.db2.gz DRZBMUXIXBPCOW-SJORKVTESA-N 1 0 303.352 4.023 20 10 DICDRO CC(C)Oc1ccc(C[N@H+](C)Cc2ccccc2O)cc1Cl ZINC000778094839 1044135739 /nfs/dbraw/zinc/13/57/39/1044135739.db2.gz QSUDJTCGSXGBTM-UHFFFAOYSA-N 1 0 319.832 4.465 20 10 DICDRO COc1cccc(C[N@H+](C)[C@H](C)c2cccc(Cl)c2)c1O ZINC000130366655 1044200513 /nfs/dbraw/zinc/20/05/13/1044200513.db2.gz HAUMAHFEBLPMFO-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000780791744 1044218187 /nfs/dbraw/zinc/21/81/87/1044218187.db2.gz PFBXQRIMTAGRHB-QZEKMECESA-N 1 0 309.409 4.079 20 10 DICDRO CC1(C)CC[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)O1 ZINC000778208823 1044218737 /nfs/dbraw/zinc/21/87/37/1044218737.db2.gz UBCFVLKSASHJQL-GOSISDBHSA-N 1 0 311.425 4.106 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(Cl)cn2)cc1 ZINC000778213122 1044222610 /nfs/dbraw/zinc/22/26/10/1044222610.db2.gz PVAXWRZDHHAYNY-UHFFFAOYSA-N 1 0 317.864 4.213 20 10 DICDRO CCSc1ccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000883245655 1044242676 /nfs/dbraw/zinc/24/26/76/1044242676.db2.gz PFOJSWAFSZVBGM-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO C[C@H]([NH2+]CCc1ccns1)c1ccc(N2CCCCC2)cc1 ZINC000883249152 1044243624 /nfs/dbraw/zinc/24/36/24/1044243624.db2.gz VIEVALNBXSFYDL-HNNXBMFYSA-N 1 0 315.486 4.027 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000883265380 1044253136 /nfs/dbraw/zinc/25/31/36/1044253136.db2.gz ADJCUZHBVMNEPV-CQSZACIVSA-N 1 0 311.425 4.437 20 10 DICDRO COc1ccc(C2CC2)cc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000883267301 1044254886 /nfs/dbraw/zinc/25/48/86/1044254886.db2.gz ZIBJZSOOLDNUTN-QGZVFWFLSA-N 1 0 309.409 4.055 20 10 DICDRO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(Cl)ccc1O ZINC000780792709 1044256584 /nfs/dbraw/zinc/25/65/84/1044256584.db2.gz IOJMYMNCOWWDDZ-ONGXEEELSA-N 1 0 307.743 4.208 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C)nc2Cl)c(O)c1 ZINC000883302386 1044262073 /nfs/dbraw/zinc/26/20/73/1044262073.db2.gz XBMRPNKQSKPGRS-CYBMUJFWSA-N 1 0 304.821 4.217 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000293219335 1044262430 /nfs/dbraw/zinc/26/24/30/1044262430.db2.gz AGBQFNYREGQEOH-MRXNPFEDSA-N 1 0 313.441 4.396 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C3CC3)cc2F)c1 ZINC000293279292 1044267756 /nfs/dbraw/zinc/26/77/56/1044267756.db2.gz CQZRVZBISIFEER-LBPRGKRZSA-N 1 0 315.388 4.268 20 10 DICDRO CC[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccccc1O ZINC000293577541 1044303064 /nfs/dbraw/zinc/30/30/64/1044303064.db2.gz BUDDFWPPSRCADG-OAHLLOKOSA-N 1 0 324.346 4.089 20 10 DICDRO CC[C@H]([NH2+][C@H](Cn1ccnc1)c1ccccc1)c1ccccc1O ZINC000883387812 1044303594 /nfs/dbraw/zinc/30/35/94/1044303594.db2.gz FNWOEXIUXMRTBI-RBUKOAKNSA-N 1 0 321.424 4.071 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2c(C)c3ccccc3n2C)cc1 ZINC000475190561 1044303998 /nfs/dbraw/zinc/30/39/98/1044303998.db2.gz ABFYOBZUGBVFQD-UHFFFAOYSA-N 1 0 308.425 4.175 20 10 DICDRO CC[C@@H]([NH2+][C@@H](Cn1ccnc1)c1ccccc1)c1ccccc1O ZINC000883387810 1044304352 /nfs/dbraw/zinc/30/43/52/1044304352.db2.gz FNWOEXIUXMRTBI-MOPGFXCFSA-N 1 0 321.424 4.071 20 10 DICDRO COC1CCC([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000840794186 1044304528 /nfs/dbraw/zinc/30/45/28/1044304528.db2.gz XJJANLKMFQHPKX-PPDQVPDSSA-N 1 0 316.489 4.285 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)c1 ZINC000192724518 1044305502 /nfs/dbraw/zinc/30/55/02/1044305502.db2.gz RTBXUXPUDDZATP-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2nsc3ccccc23)c(O)c1C ZINC000883403056 1044306538 /nfs/dbraw/zinc/30/65/38/1044306538.db2.gz JCGUQALTEZWNHT-CYBMUJFWSA-N 1 0 312.438 4.470 20 10 DICDRO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000192789206 1044309221 /nfs/dbraw/zinc/30/92/21/1044309221.db2.gz AQBAFERIOOVAIE-KBPBESRZSA-N 1 0 315.413 4.130 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1cccnc1Cl ZINC000132204170 1044317383 /nfs/dbraw/zinc/31/73/83/1044317383.db2.gz KIYSDWZPCRQEDJ-JTQLQIEISA-N 1 0 313.879 4.025 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000192807625 1044317540 /nfs/dbraw/zinc/31/75/40/1044317540.db2.gz AILZLHREXAPYTF-STQMWFEESA-N 1 0 303.377 4.260 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccc(F)cc1F ZINC000132191313 1044317932 /nfs/dbraw/zinc/31/79/32/1044317932.db2.gz OFFRGWUWFIXCSJ-JTQLQIEISA-N 1 0 314.426 4.254 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccc(F)c(F)c1 ZINC000132307247 1044319310 /nfs/dbraw/zinc/31/93/10/1044319310.db2.gz XCBUOUXEDUVZGW-JTQLQIEISA-N 1 0 314.426 4.254 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccc(F)c(F)c1 ZINC000132307434 1044320164 /nfs/dbraw/zinc/32/01/64/1044320164.db2.gz XCBUOUXEDUVZGW-SNVBAGLBSA-N 1 0 314.426 4.254 20 10 DICDRO c1csc(SCCC[NH2+][C@H]2CCCOc3ccccc32)n1 ZINC000132251610 1044320679 /nfs/dbraw/zinc/32/06/79/1044320679.db2.gz BXALOSWNBVAOCE-AWEZNQCLSA-N 1 0 320.483 4.129 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(OC(C)C)nc2)c(O)c1 ZINC000293948949 1044355992 /nfs/dbraw/zinc/35/59/92/1044355992.db2.gz ZDPFAYLIZBCFDJ-OAHLLOKOSA-N 1 0 314.429 4.042 20 10 DICDRO COCC[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000840835804 1044359357 /nfs/dbraw/zinc/35/93/57/1044359357.db2.gz AQIXUQBSEPYBDX-QZTJIDSGSA-N 1 0 318.505 4.390 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c(O)c1 ZINC000293989661 1044363245 /nfs/dbraw/zinc/36/32/45/1044363245.db2.gz BWVUYJPFYHARHX-CZUORRHYSA-N 1 0 315.388 4.323 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c(O)c1 ZINC000293989655 1044363470 /nfs/dbraw/zinc/36/34/70/1044363470.db2.gz BWVUYJPFYHARHX-CJNGLKHVSA-N 1 0 315.388 4.323 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C2CC2)C2CCC2)cc1F ZINC001202676802 1044462906 /nfs/dbraw/zinc/46/29/06/1044462906.db2.gz QQIGGFDVIBGVJC-IBGZPJMESA-N 1 0 304.453 4.340 20 10 DICDRO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000294821903 1044464158 /nfs/dbraw/zinc/46/41/58/1044464158.db2.gz QMLXQFOOVVAMBZ-QWHCGFSZSA-N 1 0 320.458 4.024 20 10 DICDRO CCC[C@@H](C)CCC[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC001168068588 1044470563 /nfs/dbraw/zinc/47/05/63/1044470563.db2.gz OJLMYHYZOSTXIT-MRXNPFEDSA-N 1 0 322.468 4.173 20 10 DICDRO COC1CCN(c2ccc(C[NH2+][C@H](C)c3ccccc3)cc2)CC1 ZINC000294915254 1044471817 /nfs/dbraw/zinc/47/18/17/1044471817.db2.gz GAWORMSGKRYDDI-QGZVFWFLSA-N 1 0 324.468 4.153 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CCCC[C@H]2CC(F)(F)F)c1 ZINC000294933847 1044473788 /nfs/dbraw/zinc/47/37/88/1044473788.db2.gz BUCPOLUUWJCYIB-FZMZJTMJSA-N 1 0 317.351 4.002 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c(O)c1C ZINC000282904379 1044480067 /nfs/dbraw/zinc/48/00/67/1044480067.db2.gz WYOXEDDSFZJUSQ-NVXWUHKLSA-N 1 0 303.446 4.009 20 10 DICDRO CCOc1c(Cl)cccc1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000785412102 1044530426 /nfs/dbraw/zinc/53/04/26/1044530426.db2.gz BFXYQSIMUNMUHB-UHFFFAOYSA-N 1 0 318.848 4.095 20 10 DICDRO CC(C)[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1nc2ccccc2[nH]1 ZINC000295787928 1044559217 /nfs/dbraw/zinc/55/92/17/1044559217.db2.gz BJDMDBASNNTURR-LPHOPBHVSA-N 1 0 321.424 4.243 20 10 DICDRO CC[N@H+](Cc1ccc2cc(C)ccc2n1)Cc1ccccc1O ZINC001137217232 1044562175 /nfs/dbraw/zinc/56/21/75/1044562175.db2.gz OYQBXLKUAOKWRQ-UHFFFAOYSA-N 1 0 306.409 4.271 20 10 DICDRO Fc1ccc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCC2)c(F)c1 ZINC000136135599 1044586028 /nfs/dbraw/zinc/58/60/28/1044586028.db2.gz ANGMVNBYKWVXPU-UHFFFAOYSA-N 1 0 315.363 4.069 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)CC2 ZINC000296289569 1044604846 /nfs/dbraw/zinc/60/48/46/1044604846.db2.gz DATDPRDZXVQMTG-AWEZNQCLSA-N 1 0 309.743 4.101 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ncc(Cl)s1 ZINC000719442285 1044609857 /nfs/dbraw/zinc/60/98/57/1044609857.db2.gz SHECLDQYSDRBBR-NXEZZACHSA-N 1 0 308.834 4.149 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1cc(C)ccc1O)CC3 ZINC000778640222 1044621345 /nfs/dbraw/zinc/62/13/45/1044621345.db2.gz JJOVTAQPCMNGQX-MRXNPFEDSA-N 1 0 320.436 4.137 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H](C[C@H]1CCOC1)c1ccccc1)CC2 ZINC000296933131 1044653286 /nfs/dbraw/zinc/65/32/86/1044653286.db2.gz QBRJCKLIUUQUPW-ATZDWAIDSA-N 1 0 323.436 4.137 20 10 DICDRO CCOc1cccc(C[NH2+]C2(c3cccc(Cl)c3)CC2)c1O ZINC000077467889 1044699520 /nfs/dbraw/zinc/69/95/20/1044699520.db2.gz IVKSXRBWHFYDQR-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](c1ccco1)N(CC)CC)c1ccccc1O ZINC000155455636 1044699840 /nfs/dbraw/zinc/69/98/40/1044699840.db2.gz HERCDQLZKJDHFS-IAGOWNOFSA-N 1 0 316.445 4.109 20 10 DICDRO CC[C@@H]([NH2+]CCCCOCc1ccccc1)c1ccccc1O ZINC000155501143 1044701359 /nfs/dbraw/zinc/70/13/59/1044701359.db2.gz ZFIQSSWKRSJDPT-LJQANCHMSA-N 1 0 313.441 4.430 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccc1O ZINC000155557611 1044705028 /nfs/dbraw/zinc/70/50/28/1044705028.db2.gz QWTPJFXNTKXMSC-QGZVFWFLSA-N 1 0 308.381 4.288 20 10 DICDRO CC[C@@H]([NH2+]CCc1nc(C(C)(C)C)cs1)c1ccccc1O ZINC000155703859 1044718344 /nfs/dbraw/zinc/71/83/44/1044718344.db2.gz DEOOSOMQGWQUAP-CQSZACIVSA-N 1 0 318.486 4.430 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(-c2cccnc2)cc1)c1ccccc1O ZINC000367785396 1044752164 /nfs/dbraw/zinc/75/21/64/1044752164.db2.gz UEYGTZBBXKXZLC-HNNXBMFYSA-N 1 0 304.393 4.305 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)Oc1ccccc1F)c1ccccc1O ZINC000156068910 1044759633 /nfs/dbraw/zinc/75/96/33/1044759633.db2.gz BSGLUKVWSAXHCH-BBRMVZONSA-N 1 0 303.377 4.040 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)Oc1ccccc1F)c1ccccc1O ZINC000156068797 1044761383 /nfs/dbraw/zinc/76/13/83/1044761383.db2.gz BSGLUKVWSAXHCH-CZUORRHYSA-N 1 0 303.377 4.040 20 10 DICDRO Oc1cc2c(cc1C[NH+]1CCC(c3ccccc3)CC1)CCC2 ZINC000887559415 1044853788 /nfs/dbraw/zinc/85/37/88/1044853788.db2.gz UOCKEMQEYIVUIQ-UHFFFAOYSA-N 1 0 307.437 4.261 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C2CCC3(CCOCC3)CC2)c(O)c1 ZINC000371863576 1044894193 /nfs/dbraw/zinc/89/41/93/1044894193.db2.gz IBSXHODGFSMSJA-OAHLLOKOSA-N 1 0 303.446 4.091 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CCC3(CCOCC3)CC2)c(O)c1 ZINC000371863575 1044895968 /nfs/dbraw/zinc/89/59/68/1044895968.db2.gz IBSXHODGFSMSJA-HNNXBMFYSA-N 1 0 303.446 4.091 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000134910140 1044969698 /nfs/dbraw/zinc/96/96/98/1044969698.db2.gz OSSKPCNRABXOPA-KBPBESRZSA-N 1 0 315.461 4.372 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)c1ccccn1 ZINC000152401620 1045041556 /nfs/dbraw/zinc/04/15/56/1045041556.db2.gz OWOHQNNOIFVZAW-DLBZAZTESA-N 1 0 309.457 4.484 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@](C)(CC)c2nccs2)cc1 ZINC000152638738 1045044669 /nfs/dbraw/zinc/04/46/69/1045044669.db2.gz TUAKHXLVBQJQOG-SFHVURJKSA-N 1 0 317.502 4.404 20 10 DICDRO C[N@@H+](Cc1ccccc1C(F)(F)F)Cc1cc(F)ccc1O ZINC000778994116 1045109537 /nfs/dbraw/zinc/10/95/37/1045109537.db2.gz AFPRSIISJHATGB-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO Oc1ccc(F)cc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000778995215 1045111532 /nfs/dbraw/zinc/11/15/32/1045111532.db2.gz OKXXEMINXVBCQA-UHFFFAOYSA-N 1 0 311.356 4.327 20 10 DICDRO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)Cc1cc(F)ccc1O ZINC000778997022 1045112840 /nfs/dbraw/zinc/11/28/40/1045112840.db2.gz ZHDGRWLTFDEHPU-SFHVURJKSA-N 1 0 315.388 4.049 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000779026017 1045167165 /nfs/dbraw/zinc/16/71/65/1045167165.db2.gz SNSGLSPWDOOPPG-AWEZNQCLSA-N 1 0 317.429 4.146 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1ccc(N2CCCCC2)cc1 ZINC000779079026 1045254837 /nfs/dbraw/zinc/25/48/37/1045254837.db2.gz JVHQVOXCSOSPJA-VQIMIIECSA-N 1 0 316.489 4.285 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(Br)c1)c1ccccc1O ZINC000048817730 1045276279 /nfs/dbraw/zinc/27/62/79/1045276279.db2.gz ARDNPYNSJBLQFJ-HNNXBMFYSA-N 1 0 320.230 4.396 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cc2c(cc1O)CCCC2 ZINC000528036223 1045295582 /nfs/dbraw/zinc/29/55/82/1045295582.db2.gz PLDMZNLWFXWVKO-OLZOCXBDSA-N 1 0 314.404 4.217 20 10 DICDRO CO[C@@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000779149420 1045323315 /nfs/dbraw/zinc/32/33/15/1045323315.db2.gz LRFVNCRLXHDELI-APPDUMDISA-N 1 0 323.795 4.051 20 10 DICDRO Cc1cccc(C[NH2+]C[C@H](c2ccccc2)C(F)(F)F)c1O ZINC000188661949 1045338162 /nfs/dbraw/zinc/33/81/62/1045338162.db2.gz KATOOOJQRMBAPN-OAHLLOKOSA-N 1 0 309.331 4.136 20 10 DICDRO Cc1ccc2cc(C[NH2+]Cc3ccc(N(C)C)c(F)c3)ccc2n1 ZINC000189295710 1045345024 /nfs/dbraw/zinc/34/50/24/1045345024.db2.gz FGSNKWCTSGFTKW-UHFFFAOYSA-N 1 0 323.415 4.038 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)[C@@H](C)c2ccccc2)c1O ZINC000779197442 1045368707 /nfs/dbraw/zinc/36/87/07/1045368707.db2.gz APJNUCWIONQAKS-OLZOCXBDSA-N 1 0 315.388 4.016 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000800238833 1045590898 /nfs/dbraw/zinc/59/08/98/1045590898.db2.gz JXFYWXGAFPMOHO-YLJYHZDGSA-N 1 0 323.484 4.272 20 10 DICDRO C[C@H]1CCCN(c2ccc(C[NH2+]Cc3ccoc3)cc2Cl)C1 ZINC000800275351 1045601405 /nfs/dbraw/zinc/60/14/05/1045601405.db2.gz AFSJBQBFUCOEHD-AWEZNQCLSA-N 1 0 318.848 4.459 20 10 DICDRO CC[C@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1ccccc1O ZINC000800495436 1045632477 /nfs/dbraw/zinc/63/24/77/1045632477.db2.gz NRUYAERKLMFEES-WBVHZDCISA-N 1 0 301.817 4.254 20 10 DICDRO C[C@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1cc(F)ccc1O ZINC000800496168 1045633695 /nfs/dbraw/zinc/63/36/95/1045633695.db2.gz SSNWJDYUGUJFRH-BONVTDFDSA-N 1 0 305.780 4.003 20 10 DICDRO C[C@H]1CCCN(c2ccc(C[NH2+][C@H]3CCSC3)cc2Cl)C1 ZINC000800494651 1045634112 /nfs/dbraw/zinc/63/41/12/1045634112.db2.gz YEIKKPJPCFJFAW-ZFWWWQNUSA-N 1 0 324.921 4.171 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCCC23CCOCC3)cc1 ZINC000800498420 1045635323 /nfs/dbraw/zinc/63/53/23/1045635323.db2.gz JRGGQGGFDCIHKF-APWZRJJASA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCc2cccc3[nH]ccc32)c2c1c(F)ccc2O ZINC000800499978 1045635799 /nfs/dbraw/zinc/63/57/99/1045635799.db2.gz LVJOOSSHPZAKQG-SJKOYZFVSA-N 1 0 324.399 4.393 20 10 DICDRO Oc1cc2c(cc1C[NH+]1CCC(c3ccncc3)CC1)CCCC2 ZINC000191282165 1045674235 /nfs/dbraw/zinc/67/42/35/1045674235.db2.gz GKPILXBXHBYZLX-UHFFFAOYSA-N 1 0 322.452 4.046 20 10 DICDRO Cc1cc(C)cc([C@H](O)C[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000800992854 1045678637 /nfs/dbraw/zinc/67/86/37/1045678637.db2.gz UIYWYPDUZYJPRY-FZKQIMNGSA-N 1 0 319.832 4.047 20 10 DICDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000800993022 1045680358 /nfs/dbraw/zinc/68/03/58/1045680358.db2.gz LUUOMVTYQQFLEQ-MGPLVRAMSA-N 1 0 319.351 4.017 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2cccc(Cl)c2)c(O)c1 ZINC000752941860 1045717102 /nfs/dbraw/zinc/71/71/02/1045717102.db2.gz UZENVXPAIUHUDH-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)c1O ZINC000752986654 1045718216 /nfs/dbraw/zinc/71/82/16/1045718216.db2.gz LXNHBEXASHSDCM-AEFFLSMTSA-N 1 0 311.425 4.217 20 10 DICDRO CCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1O ZINC000801596791 1045753351 /nfs/dbraw/zinc/75/33/51/1045753351.db2.gz OZVUMKMHSJBPBH-UHFFFAOYSA-N 1 0 314.385 4.103 20 10 DICDRO CCCC[N@H+](Cc1csc(CC)n1)Cc1ccccc1O ZINC000801599487 1045753609 /nfs/dbraw/zinc/75/36/09/1045753609.db2.gz PRQKTSOCLBMJRC-UHFFFAOYSA-N 1 0 304.459 4.213 20 10 DICDRO CCOc1ccc(C[NH2+]CC2CC(c3ccccc3)C2)c(O)c1 ZINC000801730827 1045785490 /nfs/dbraw/zinc/78/54/90/1045785490.db2.gz OLWDORNIKGXVTG-UHFFFAOYSA-N 1 0 311.425 4.074 20 10 DICDRO C[C@@H](C[NH2+]CCCSc1nccs1)Cc1ccccc1 ZINC000753963326 1045824898 /nfs/dbraw/zinc/82/48/98/1045824898.db2.gz QBVGWNHCHIQLKN-CQSZACIVSA-N 1 0 306.500 4.094 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CCC[C@H](c3ccccc3)C2)c1 ZINC000754100359 1045845046 /nfs/dbraw/zinc/84/50/46/1045845046.db2.gz HDKQCDGVWPRBKV-WMZOPIPTSA-N 1 0 311.425 4.217 20 10 DICDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]CCCSc2nccs2)CS1 ZINC000754145054 1045855146 /nfs/dbraw/zinc/85/51/46/1045855146.db2.gz SOIVFVYGJQVCIB-RYUDHWBXSA-N 1 0 316.561 4.135 20 10 DICDRO C[C@H]1CSCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000754156323 1045857769 /nfs/dbraw/zinc/85/77/69/1045857769.db2.gz POMRMEYTRGJPDO-OAHLLOKOSA-N 1 0 313.466 4.244 20 10 DICDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000828614539 1045921598 /nfs/dbraw/zinc/92/15/98/1045921598.db2.gz QCDSHJHMYHYWJB-AEFFLSMTSA-N 1 0 316.489 4.065 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@H]2CSC)c(O)c(C(C)(C)C)c1 ZINC000754741815 1045922962 /nfs/dbraw/zinc/92/29/62/1045922962.db2.gz RXNYVRXPCTUMNH-AWEZNQCLSA-N 1 0 323.502 4.026 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H]2C)c1O ZINC000754740535 1045923994 /nfs/dbraw/zinc/92/39/94/1045923994.db2.gz UVJNTBNVCHOIMF-CRAIPNDOSA-N 1 0 311.425 4.087 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cccc(OC(F)F)c1)c1ccccc1O ZINC000192720853 1045926002 /nfs/dbraw/zinc/92/60/02/1045926002.db2.gz KCWHINAKCDVXMI-NWDGAFQWSA-N 1 0 307.340 4.405 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2F)c1 ZINC000192707318 1045926029 /nfs/dbraw/zinc/92/60/29/1045926029.db2.gz BSJDKHWXRJJSML-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccccn2)ccc1N1CCCCC1 ZINC000828770626 1045932078 /nfs/dbraw/zinc/93/20/78/1045932078.db2.gz BJAPABXGVGTPDP-QGZVFWFLSA-N 1 0 309.457 4.231 20 10 DICDRO C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000802308901 1045950994 /nfs/dbraw/zinc/95/09/94/1045950994.db2.gz KPOMXRWSKWYYQZ-CRWXNKLISA-N 1 0 311.853 4.290 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c(O)c1C ZINC000802310313 1045952606 /nfs/dbraw/zinc/95/26/06/1045952606.db2.gz ZKLJXBGZTRFSRE-YALNPMBYSA-N 1 0 305.462 4.253 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)c(C)n1-c1ccccc1 ZINC001137856137 1045987274 /nfs/dbraw/zinc/98/72/74/1045987274.db2.gz RLUXLOSEJBICLZ-NQIIRXRSSA-N 1 0 324.468 4.095 20 10 DICDRO CC[N@H+](Cc1cc(C)n(-c2ccccc2)c1C)C1CCOCC1 ZINC001137858019 1045987295 /nfs/dbraw/zinc/98/72/95/1045987295.db2.gz SVQAYDAXTJNCLP-UHFFFAOYSA-N 1 0 312.457 4.095 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@]3(CCOC3)C2)c(C)n1-c1ccccc1 ZINC001137856116 1045987760 /nfs/dbraw/zinc/98/77/60/1045987760.db2.gz QVXVIHGCBCNMOO-NRFANRHFSA-N 1 0 324.468 4.097 20 10 DICDRO Cc1cc(C[NH+]2CC(c3cccnc3)C2)c(C)n1-c1ccccc1 ZINC001137859264 1045987773 /nfs/dbraw/zinc/98/77/73/1045987773.db2.gz QMXWZESRJBGPSM-UHFFFAOYSA-N 1 0 317.436 4.089 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@]3(CCOC3)C2)c(C)n1-c1ccccc1 ZINC001137856117 1045988011 /nfs/dbraw/zinc/98/80/11/1045988011.db2.gz QVXVIHGCBCNMOO-OAQYLSRUSA-N 1 0 324.468 4.097 20 10 DICDRO CCC(CC)[N@H+](CC)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000829926907 1046024504 /nfs/dbraw/zinc/02/45/04/1046024504.db2.gz GLHFKDMJCAFQEN-UHFFFAOYSA-N 1 0 318.505 4.312 20 10 DICDRO CCCC[N@H+](Cc1nn(C)c2ccccc12)Cc1ccccc1O ZINC000802657429 1046026956 /nfs/dbraw/zinc/02/69/56/1046026956.db2.gz DCSHMNVLZCTDRI-UHFFFAOYSA-N 1 0 323.440 4.081 20 10 DICDRO C[C@@]1(c2ccccc2)CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000755932121 1046030206 /nfs/dbraw/zinc/03/02/06/1046030206.db2.gz RCDVFAKTQMCZHF-OAQYLSRUSA-N 1 0 318.420 4.104 20 10 DICDRO CCCC[N@H+](Cc1cnc2cccc(C)n12)Cc1ccccc1O ZINC000802658020 1046030412 /nfs/dbraw/zinc/03/04/12/1046030412.db2.gz ZHYBAGYBYCZRBR-UHFFFAOYSA-N 1 0 323.440 4.151 20 10 DICDRO CCCC[N@H+](Cc1[nH]nc2ccccc21)Cc1ccccc1O ZINC000802658011 1046030629 /nfs/dbraw/zinc/03/06/29/1046030629.db2.gz ZABZWBIVCUQVQK-UHFFFAOYSA-N 1 0 309.413 4.071 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cccc(Cl)c2F)cc1 ZINC001137963423 1046036032 /nfs/dbraw/zinc/03/60/32/1046036032.db2.gz IQBVAJUGOICGCF-UHFFFAOYSA-N 1 0 306.812 4.177 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccccc23)c2c1c(F)ccc2O ZINC000756343497 1046067134 /nfs/dbraw/zinc/06/71/34/1046067134.db2.gz MXTZRXJIYXWJTA-SJKOYZFVSA-N 1 0 324.399 4.393 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)c2c1c(F)ccc2O ZINC000756357186 1046068637 /nfs/dbraw/zinc/06/86/37/1046068637.db2.gz CJRGKZYYNCXKIO-XHDPSFHLSA-N 1 0 303.352 4.051 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCSc2ccccc2)c(O)c1C ZINC000756361902 1046068686 /nfs/dbraw/zinc/06/86/86/1046068686.db2.gz IJXZCAVGPXFJQU-HNNXBMFYSA-N 1 0 301.455 4.452 20 10 DICDRO C[C@@H](OCCC[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000756359145 1046069106 /nfs/dbraw/zinc/06/91/06/1046069106.db2.gz NYEAMPPYEZBFNC-LSDHHAIUSA-N 1 0 317.404 4.350 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCn2cnc3ccccc32)c(O)c1C ZINC000756362821 1046069920 /nfs/dbraw/zinc/06/99/20/1046069920.db2.gz NOAHHMZIZSOOSS-MRXNPFEDSA-N 1 0 323.440 4.100 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCSc2ccccc2)c(O)c1C ZINC000756361918 1046070159 /nfs/dbraw/zinc/07/01/59/1046070159.db2.gz IJXZCAVGPXFJQU-OAHLLOKOSA-N 1 0 301.455 4.452 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCCSc2ccccc2)c1 ZINC000756373986 1046072206 /nfs/dbraw/zinc/07/22/06/1046072206.db2.gz WMHCTOUGHPOWNJ-AWEZNQCLSA-N 1 0 317.454 4.234 20 10 DICDRO COCc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1 ZINC000756384884 1046074354 /nfs/dbraw/zinc/07/43/54/1046074354.db2.gz PTCSQLZNWWLGNM-MLGOLLRUSA-N 1 0 315.388 4.016 20 10 DICDRO COCc1cccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756420257 1046078507 /nfs/dbraw/zinc/07/85/07/1046078507.db2.gz HYYTUZIIINCBEL-LRDDRELGSA-N 1 0 315.388 4.016 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000756420049 1046079264 /nfs/dbraw/zinc/07/92/64/1046079264.db2.gz VPXYFFDMYNEURS-ZDUSSCGKSA-N 1 0 301.455 4.492 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(O)c2ccccc12 ZINC001138062421 1046079964 /nfs/dbraw/zinc/07/99/64/1046079964.db2.gz LRPDIAPLJAHZKP-UHFFFAOYSA-N 1 0 307.393 4.273 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000756434888 1046083213 /nfs/dbraw/zinc/08/32/13/1046083213.db2.gz VEPXYHWVCWUVTM-MLGOLLRUSA-N 1 0 315.388 4.268 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCC(C)(C)c2ccccc2)c1 ZINC000756455173 1046084427 /nfs/dbraw/zinc/08/44/27/1046084427.db2.gz PPVWTNOBHCKQAL-HNNXBMFYSA-N 1 0 313.441 4.419 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)c(F)c2)c2c1c(F)ccc2O ZINC000756457838 1046084728 /nfs/dbraw/zinc/08/47/28/1046084728.db2.gz RQWVJHWYEFAZTO-OTYXRUKQSA-N 1 0 307.315 4.148 20 10 DICDRO C[C@H]([NH2+]Cc1cn2ccsc2n1)c1ccc2ccccc2c1O ZINC000756457246 1046085121 /nfs/dbraw/zinc/08/51/21/1046085121.db2.gz QWDBNAHSGBIMFV-LBPRGKRZSA-N 1 0 323.421 4.105 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)cc1 ZINC000756455667 1046085336 /nfs/dbraw/zinc/08/53/36/1046085336.db2.gz KMHVEVWKEPIZII-BLLLJJGKSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)COc2ccc(F)cc2F)c(O)c1 ZINC000756453369 1046085579 /nfs/dbraw/zinc/08/55/79/1046085579.db2.gz GDCVOAVCPPWNHZ-QWHCGFSZSA-N 1 0 321.367 4.097 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2cccc3cccnc32)c2c1c(F)ccc2O ZINC000756493911 1046089758 /nfs/dbraw/zinc/08/97/58/1046089758.db2.gz AZEOCNTUVPKIKW-BLLLJJGKSA-N 1 0 322.383 4.418 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2cccc3cccnc32)c2c1c(F)ccc2O ZINC000756493920 1046089913 /nfs/dbraw/zinc/08/99/13/1046089913.db2.gz AZEOCNTUVPKIKW-WBMJQRKESA-N 1 0 322.383 4.418 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1cc2c(cc1O)CCCC2 ZINC000756496188 1046091697 /nfs/dbraw/zinc/09/16/97/1046091697.db2.gz OPJXWQZNDKSWOM-LBPRGKRZSA-N 1 0 317.379 4.400 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(F)cc2F)c2c1c(F)ccc2O ZINC000756496077 1046091918 /nfs/dbraw/zinc/09/19/18/1046091918.db2.gz MYOFCKRSHDMKDM-XPTSAGLGSA-N 1 0 307.315 4.148 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@H](C)c3ccc(C)cc3O)c[nH]c2c1 ZINC000756515786 1046093809 /nfs/dbraw/zinc/09/38/09/1046093809.db2.gz FSWQRBVLSVLCCN-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@H](C)c3cc(F)ccc3O)c[nH]c2c1 ZINC000756516185 1046094501 /nfs/dbraw/zinc/09/45/01/1046094501.db2.gz IFCXJJKWVCTMTF-CYBMUJFWSA-N 1 0 312.388 4.214 20 10 DICDRO CC[C@@H]([NH2+][C@@H](COC)c1ccc(Cl)cc1)c1ccccc1O ZINC000194254107 1046094853 /nfs/dbraw/zinc/09/48/53/1046094853.db2.gz VJTMCLRAQMVNMN-SJORKVTESA-N 1 0 319.832 4.474 20 10 DICDRO Clc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000756517195 1046094699 /nfs/dbraw/zinc/09/46/99/1046094699.db2.gz WPYGZLBZYXZXTH-GOSISDBHSA-N 1 0 313.828 4.442 20 10 DICDRO Cc1csc([C@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000756533272 1046095712 /nfs/dbraw/zinc/09/57/12/1046095712.db2.gz DDKCHCKCZDIDGV-UBHAPETDSA-N 1 0 306.406 4.195 20 10 DICDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756534356 1046095766 /nfs/dbraw/zinc/09/57/66/1046095766.db2.gz KHJCSEUNHQWUCA-OLZOCXBDSA-N 1 0 319.832 4.423 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccc2ccccc2c1O ZINC000756532693 1046095997 /nfs/dbraw/zinc/09/59/97/1046095997.db2.gz GNGQZTWWLBXCKG-OAHLLOKOSA-N 1 0 320.436 4.462 20 10 DICDRO C[C@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccc2ccccc2c1O ZINC000756534878 1046096021 /nfs/dbraw/zinc/09/60/21/1046096021.db2.gz LIEFZHHEBTZQCH-LIRRHRJNSA-N 1 0 313.441 4.137 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)CCc2ccc(O)cc2)c(O)c1C ZINC000756532183 1046097219 /nfs/dbraw/zinc/09/72/19/1046097219.db2.gz FBTOXWYINRPHJC-HOCLYGCPSA-N 1 0 313.441 4.387 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cc2c(cc1O)CCCC2 ZINC000756550878 1046097952 /nfs/dbraw/zinc/09/79/52/1046097952.db2.gz UBTUZHKMRLONNO-ORAYPTAESA-N 1 0 323.436 4.315 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)cs1 ZINC000756568388 1046100226 /nfs/dbraw/zinc/10/02/26/1046100226.db2.gz DQSOVGFZHJTYIK-SCVCMEIPSA-N 1 0 320.433 4.449 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2)c(O)c1C ZINC000756572402 1046102065 /nfs/dbraw/zinc/10/20/65/1046102065.db2.gz GEKARBHFJXBLFZ-GJZGRUSLSA-N 1 0 301.434 4.198 20 10 DICDRO COc1ccc2[nH]cc(CC[NH2+][C@H](C)c3ccc(C)cc3O)c2c1 ZINC000756575350 1046102273 /nfs/dbraw/zinc/10/22/73/1046102273.db2.gz PLUJVAJBYRSHGT-CQSZACIVSA-N 1 0 324.424 4.084 20 10 DICDRO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756571938 1046103263 /nfs/dbraw/zinc/10/32/63/1046103263.db2.gz HPVKADLEQWWHLG-NEPJUHHUSA-N 1 0 314.429 4.288 20 10 DICDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1O ZINC000756588790 1046104099 /nfs/dbraw/zinc/10/40/99/1046104099.db2.gz IWXUEQJUBQFMSD-LLVKDONJSA-N 1 0 316.351 4.045 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCc2cccc(F)c2)c1 ZINC000756583408 1046104160 /nfs/dbraw/zinc/10/41/60/1046104160.db2.gz NNSYEQIUVCTNCA-KBPBESRZSA-N 1 0 317.404 4.212 20 10 DICDRO CCCC[C@H](COC)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756584983 1046104540 /nfs/dbraw/zinc/10/45/40/1046104540.db2.gz IAKPTPFBOOYCFH-GOEBONIOSA-N 1 0 301.430 4.401 20 10 DICDRO CC(C)n1ccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)n1 ZINC000756596010 1046105781 /nfs/dbraw/zinc/10/57/81/1046105781.db2.gz XMKVVRJFWQLUGG-AWEZNQCLSA-N 1 0 309.413 4.174 20 10 DICDRO CCCC(O)(CCC)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756594927 1046106339 /nfs/dbraw/zinc/10/63/39/1046106339.db2.gz QLZIXMQFHBPBBQ-OCCSQVGLSA-N 1 0 309.425 4.001 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2c[nH]c3c2cccc3C)c(O)c1 ZINC000756596774 1046106470 /nfs/dbraw/zinc/10/64/70/1046106470.db2.gz GOQJNZCQYRKOOG-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO CC(C)CC[C@@](C)(O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756605082 1046107750 /nfs/dbraw/zinc/10/77/50/1046107750.db2.gz QHQGSUAJYWOZCI-MGPUTAFESA-N 1 0 315.457 4.383 20 10 DICDRO CC(C)CC[C@](C)(O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756605084 1046108389 /nfs/dbraw/zinc/10/83/89/1046108389.db2.gz QHQGSUAJYWOZCI-YWZLYKJASA-N 1 0 315.457 4.383 20 10 DICDRO CC(C)CC[C@](C)(O)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756605083 1046108815 /nfs/dbraw/zinc/10/88/15/1046108815.db2.gz QHQGSUAJYWOZCI-QRWLVFNGSA-N 1 0 315.457 4.383 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(C)cc2O)C12CCCC2 ZINC000756618006 1046109540 /nfs/dbraw/zinc/10/95/40/1046109540.db2.gz MXGYLKHLIYKCBU-BMGDILEWSA-N 1 0 303.446 4.089 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)Oc2ccccc2F)c(O)c1C ZINC000756609719 1046109705 /nfs/dbraw/zinc/10/97/05/1046109705.db2.gz NAJXSXIXFWTAQI-ZFWWWQNUSA-N 1 0 317.404 4.266 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(C)ccc2O)C12CCCC2 ZINC000756619937 1046109740 /nfs/dbraw/zinc/10/97/40/1046109740.db2.gz ZBZJZQJFVPAOAD-FHLIZLRMSA-N 1 0 303.446 4.089 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1c(C)nn(C)c1C ZINC000756615694 1046110877 /nfs/dbraw/zinc/11/08/77/1046110877.db2.gz FUJQULOSFWLQDZ-BONVTDFDSA-N 1 0 321.852 4.198 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)C(C)C ZINC000756628366 1046112571 /nfs/dbraw/zinc/11/25/71/1046112571.db2.gz LSNYPQANMMDIPV-XNRPHZJLSA-N 1 0 309.425 4.120 20 10 DICDRO Cc1cccc2oc(CC[NH2+][C@@H](C)c3ccc(C)c(C)c3O)nc21 ZINC000756624377 1046112595 /nfs/dbraw/zinc/11/25/95/1046112595.db2.gz FJYMUKFFJHIGPB-HNNXBMFYSA-N 1 0 324.424 4.352 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)C(C)(C)C ZINC000756627125 1046112893 /nfs/dbraw/zinc/11/28/93/1046112893.db2.gz QTDLBGISAOKOCW-SUMWQHHRSA-N 1 0 301.430 4.257 20 10 DICDRO CC[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)Oc1ccccc1F ZINC000756639405 1046114480 /nfs/dbraw/zinc/11/44/80/1046114480.db2.gz YIRIVKFGIVUULW-GJZGRUSLSA-N 1 0 317.404 4.348 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H](C)c1ccc(C)cc1O)C1CCCC1 ZINC000756635697 1046114518 /nfs/dbraw/zinc/11/45/18/1046114518.db2.gz HDMULXJSKDDBEX-HNAYVOBHSA-N 1 0 305.462 4.337 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)Cc1ccncc1)c1ccc2ccccc2c1O ZINC000756632989 1046114580 /nfs/dbraw/zinc/11/45/80/1046114580.db2.gz GJSQJJXJNLMZQC-LSDHHAIUSA-N 1 0 306.409 4.222 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2cccnc2)C(C)C)c(O)c1C ZINC000756649222 1046117955 /nfs/dbraw/zinc/11/79/55/1046117955.db2.gz MQPBGYPFXDLADZ-LPHOPBHVSA-N 1 0 312.457 4.494 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)c1 ZINC000756675373 1046119577 /nfs/dbraw/zinc/11/95/77/1046119577.db2.gz FNQZCNDIZLNETK-BHYGNILZSA-N 1 0 311.425 4.388 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)c1 ZINC000756675376 1046119877 /nfs/dbraw/zinc/11/98/77/1046119877.db2.gz FNQZCNDIZLNETK-UAGQMJEPSA-N 1 0 311.425 4.388 20 10 DICDRO FC1CC2(C1)CC[NH+](Cc1ccc(N3CCCCC3)cc1)CC2 ZINC001138215867 1046120084 /nfs/dbraw/zinc/12/00/84/1046120084.db2.gz ZBBWRBAZPDHHDZ-UHFFFAOYSA-N 1 0 316.464 4.391 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756672837 1046120357 /nfs/dbraw/zinc/12/03/57/1046120357.db2.gz UHHKUYGQLRMQCS-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO COCC[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001138219639 1046120288 /nfs/dbraw/zinc/12/02/88/1046120288.db2.gz KRYIHNOUICDXDU-IBGZPJMESA-N 1 0 316.489 4.068 20 10 DICDRO CCCOC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001138220020 1046120403 /nfs/dbraw/zinc/12/04/03/1046120403.db2.gz XDZKAMLPLHOBNW-UHFFFAOYSA-N 1 0 316.489 4.068 20 10 DICDRO c1ccc(C2C[NH+](Cc3ccc(N4CCCCC4)cc3)C2)cc1 ZINC001138220385 1046120434 /nfs/dbraw/zinc/12/04/34/1046120434.db2.gz AGJMBHPSNRGIJB-UHFFFAOYSA-N 1 0 306.453 4.276 20 10 DICDRO COc1ccccc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC001138218919 1046120459 /nfs/dbraw/zinc/12/04/59/1046120459.db2.gz YFPFZMSXGLGNED-UHFFFAOYSA-N 1 0 324.468 4.318 20 10 DICDRO C[C@]1(F)CCCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138215883 1046120599 /nfs/dbraw/zinc/12/05/99/1046120599.db2.gz ZWVXAQGNTLPLBQ-IBGZPJMESA-N 1 0 304.453 4.391 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000756684144 1046120829 /nfs/dbraw/zinc/12/08/29/1046120829.db2.gz LAFSQAGNDQJNIV-KBXCAEBGSA-N 1 0 311.425 4.437 20 10 DICDRO c1ccc2c(c1)C[N@H+](Cc1ccc(N3CCCCC3)cc1)CCO2 ZINC001138219932 1046120823 /nfs/dbraw/zinc/12/08/23/1046120823.db2.gz TWFJGWLMRLZNMP-UHFFFAOYSA-N 1 0 322.452 4.072 20 10 DICDRO COC[C@H]([NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)c1ccccc1 ZINC000756705236 1046122406 /nfs/dbraw/zinc/12/24/06/1046122406.db2.gz SGVQRWQZCRXHFH-RCBQFDQVSA-N 1 0 315.388 4.057 20 10 DICDRO CC(C)[C@H]1OCCC[C@H]1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756735822 1046123916 /nfs/dbraw/zinc/12/39/16/1046123916.db2.gz IXXUVVZNRVWTEH-QUHUKJRKSA-N 1 0 321.436 4.120 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1cccc(Cl)c1 ZINC000756734652 1046124126 /nfs/dbraw/zinc/12/41/26/1046124126.db2.gz XZRJEMBGSHOTFI-DIFFPNOSSA-N 1 0 323.795 4.223 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)Oc2ccccc2Cl)c(O)c1 ZINC000756732515 1046124390 /nfs/dbraw/zinc/12/43/90/1046124390.db2.gz MCOFHNFDPRNGHE-UONOGXRCSA-N 1 0 319.832 4.472 20 10 DICDRO CC(C)[C@@H]1OCCC[C@H]1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756737622 1046125661 /nfs/dbraw/zinc/12/56/61/1046125661.db2.gz WPYDPHRRXGMPMP-DCGLDWPTSA-N 1 0 311.853 4.147 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CC(C)(C)[C@H]2CCCCO2)c2c1c(F)ccc2O ZINC000756757218 1046125760 /nfs/dbraw/zinc/12/57/60/1046125760.db2.gz MHUGQYYRXFIDCU-IVMMDQJWSA-N 1 0 321.436 4.265 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2COc3c2cccc3Cl)c(O)c1C ZINC000756756191 1046125908 /nfs/dbraw/zinc/12/59/08/1046125908.db2.gz FYNVYTACZADZOT-LRDDRELGSA-N 1 0 317.816 4.447 20 10 DICDRO CC(C)[C@H]1OCCC[C@@H]1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756737624 1046126498 /nfs/dbraw/zinc/12/64/98/1046126498.db2.gz WPYDPHRRXGMPMP-OGHNNQOOSA-N 1 0 311.853 4.147 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c(F)c1 ZINC000756755833 1046126506 /nfs/dbraw/zinc/12/65/06/1046126506.db2.gz CUQUVMLOIGMGNC-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)c(O)c1 ZINC000756762546 1046127605 /nfs/dbraw/zinc/12/76/05/1046127605.db2.gz XQPMTKCPLFXMSS-ABAIWWIYSA-N 1 0 303.789 4.138 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)COC2)c1cc2c(cc1O)CCCC2 ZINC000756759518 1046127817 /nfs/dbraw/zinc/12/78/17/1046127817.db2.gz MAKDQRFXBQUYLT-AWEZNQCLSA-N 1 0 323.436 4.152 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](c3ccccc3)[C@H]2C)c1 ZINC000756758631 1046128113 /nfs/dbraw/zinc/12/81/13/1046128113.db2.gz HEHTUSQOCTYBCO-MCPREKNCSA-N 1 0 311.425 4.244 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccn(C3CCCC3)n2)c(O)c1C ZINC000756761601 1046128132 /nfs/dbraw/zinc/12/81/32/1046128132.db2.gz UHIBTJQHJRLUOH-HNNXBMFYSA-N 1 0 313.445 4.171 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2(Cc3ccccc3)CC2)c1 ZINC000756762012 1046128260 /nfs/dbraw/zinc/12/82/60/1046128260.db2.gz SEGFHLCLVFAVKT-OAHLLOKOSA-N 1 0 311.425 4.074 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCC[C@@H]2CCCC[C@H]2O)c2c1c(F)ccc2O ZINC000756761773 1046128351 /nfs/dbraw/zinc/12/83/51/1046128351.db2.gz VCTCJFBVYKHAMF-BFJAYTPKSA-N 1 0 321.436 4.001 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)c2ccccc2n1C ZINC001138256772 1046129027 /nfs/dbraw/zinc/12/90/27/1046129027.db2.gz KCJUQLXSGYBDRL-GOSISDBHSA-N 1 0 319.452 4.089 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756769246 1046129417 /nfs/dbraw/zinc/12/94/17/1046129417.db2.gz PGRREZSZIDFFBS-GPCCPHFNSA-N 1 0 318.392 4.078 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000756766165 1046129600 /nfs/dbraw/zinc/12/96/00/1046129600.db2.gz WAFVBJXARLRCGY-SWLSCSKDSA-N 1 0 309.400 4.500 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756767971 1046130384 /nfs/dbraw/zinc/13/03/84/1046130384.db2.gz HLJDBMIMBMCKMO-BLLLJJGKSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C2CCC(OC(C)C)CC2)c(O)c1C ZINC000756766632 1046130476 /nfs/dbraw/zinc/13/04/76/1046130476.db2.gz AQXDHRCWERZOFR-KLAILNCOSA-N 1 0 305.462 4.396 20 10 DICDRO Cc1c(C[N@H+](C)Cc2ccc(F)cc2F)c2ccccc2n1C ZINC001138257869 1046131559 /nfs/dbraw/zinc/13/15/59/1046131559.db2.gz AYHXPFPVDLQKDR-UHFFFAOYSA-N 1 0 314.379 4.397 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2(c3ccc(F)cc3F)CC2)c1 ZINC000756777016 1046131464 /nfs/dbraw/zinc/13/14/64/1046131464.db2.gz FSCVKDKGCJWDFZ-ZDUSSCGKSA-N 1 0 317.379 4.361 20 10 DICDRO C[C@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1cc(Cl)ccc1O ZINC000756778767 1046131596 /nfs/dbraw/zinc/13/15/96/1046131596.db2.gz PLHFLPFLQIPMLD-DETPVDSQSA-N 1 0 311.853 4.290 20 10 DICDRO CCCCCn1cc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c(C)n1 ZINC000756776501 1046132446 /nfs/dbraw/zinc/13/24/46/1046132446.db2.gz ZYKPXPDDDREZIN-INIZCTEOSA-N 1 0 315.461 4.247 20 10 DICDRO C[C@@H]([NH2+]C1CCC(F)(F)CC1)c1cc2c(cc1O)CCCC2 ZINC000756784009 1046133146 /nfs/dbraw/zinc/13/31/46/1046133146.db2.gz JUNNWCQMRSQVOI-GFCCVEGCSA-N 1 0 309.400 4.500 20 10 DICDRO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000756786114 1046133208 /nfs/dbraw/zinc/13/32/08/1046133208.db2.gz XNFCYOZZQBFCBM-QKKBWIMNSA-N 1 0 322.452 4.468 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H](c2cccnc2)C2CC2)c2c1c(F)ccc2O ZINC000756784004 1046133269 /nfs/dbraw/zinc/13/32/69/1046133269.db2.gz JUHTVLQEZBWLIC-KOXAJKMWSA-N 1 0 312.388 4.216 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCCc2cccs2)c2c1c(F)ccc2O ZINC000756780973 1046133457 /nfs/dbraw/zinc/13/34/57/1046133457.db2.gz ZLFGMMPZXHDGCG-SMDDNHRTSA-N 1 0 305.418 4.364 20 10 DICDRO Cc1ccsc1CC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756785566 1046133539 /nfs/dbraw/zinc/13/35/39/1046133539.db2.gz GEDJGMJRHVJWKD-YPMHNXCESA-N 1 0 305.418 4.282 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756786133 1046133606 /nfs/dbraw/zinc/13/36/06/1046133606.db2.gz JPPBUZRHKOVJIG-VXGBXAGGSA-N 1 0 304.821 4.415 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756785301 1046133830 /nfs/dbraw/zinc/13/38/30/1046133830.db2.gz CRDVMXUHJVFGIV-MKBNYLNASA-N 1 0 314.404 4.388 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756785302 1046133907 /nfs/dbraw/zinc/13/39/07/1046133907.db2.gz CRDVMXUHJVFGIV-MQIPJXDCSA-N 1 0 314.404 4.388 20 10 DICDRO Cc1ccsc1CC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756785563 1046134027 /nfs/dbraw/zinc/13/40/27/1046134027.db2.gz GEDJGMJRHVJWKD-AAEUAGOBSA-N 1 0 305.418 4.282 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1cc2c(cc1O)CCCC2 ZINC000756790098 1046134976 /nfs/dbraw/zinc/13/49/76/1046134976.db2.gz LQTHSBWZVBXNNU-LLVKDONJSA-N 1 0 305.805 4.368 20 10 DICDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756790916 1046135777 /nfs/dbraw/zinc/13/57/77/1046135777.db2.gz PROBXYMJAARSTB-SOZUMNATSA-N 1 0 321.367 4.097 20 10 DICDRO CSC1(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)CCC1 ZINC000193804020 1046136043 /nfs/dbraw/zinc/13/60/43/1046136043.db2.gz NSWOSUKYXSBIGS-ZDUSSCGKSA-N 1 0 301.455 4.482 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(c3ccc(F)cc3)CCC2)c1 ZINC000756818927 1046139966 /nfs/dbraw/zinc/13/99/66/1046139966.db2.gz QHWULWYWXCJJRP-CYBMUJFWSA-N 1 0 315.388 4.270 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CC(C)(c3ccccc3)C2)c1 ZINC000756819109 1046140756 /nfs/dbraw/zinc/14/07/56/1046140756.db2.gz TYHZSVYDEGAUPM-GPWPYBQESA-N 1 0 311.425 4.172 20 10 DICDRO C[C@H]1C[C@H]([NH2+]C2(c3cccc(F)c3)CC2)c2c1c(F)ccc2O ZINC000756831988 1046140817 /nfs/dbraw/zinc/14/08/17/1046140817.db2.gz CPOIJBBASBOIJJ-NHYWBVRUSA-N 1 0 315.363 4.498 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c(O)c1C ZINC000756858252 1046146015 /nfs/dbraw/zinc/14/60/15/1046146015.db2.gz SPMOFBKFRUKOOP-IAAVTCLWSA-N 1 0 315.457 4.007 20 10 DICDRO CN1CCCc2cc(C[NH+]3CCC4(CC(F)(F)C4)CC3)ccc21 ZINC001138354267 1046155587 /nfs/dbraw/zinc/15/55/87/1046155587.db2.gz CPMZPXNFTOLPBO-UHFFFAOYSA-N 1 0 320.427 4.080 20 10 DICDRO C[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1ccc2ccccc2c1O ZINC000903190569 1046187168 /nfs/dbraw/zinc/18/71/68/1046187168.db2.gz AUAVUBIMUVHGLF-GFCCVEGCSA-N 1 0 324.449 4.341 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccco1 ZINC000757640276 1046195733 /nfs/dbraw/zinc/19/57/33/1046195733.db2.gz XEOSNPDDMKSZOM-FZMZJTMJSA-N 1 0 309.793 4.067 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2c[nH]c(=O)c3ccccc23)c(O)c1 ZINC000903235069 1046202120 /nfs/dbraw/zinc/20/21/20/1046202120.db2.gz MVGZLMOBXQUGHM-CQSZACIVSA-N 1 0 322.408 4.114 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)[C@@H](C)c2cccnc2)cc1F ZINC000757890728 1046222969 /nfs/dbraw/zinc/22/29/69/1046222969.db2.gz JAQAOSFRXXUJMO-HNNXBMFYSA-N 1 0 315.436 4.260 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)[C@@H](C)c2ccncc2)cc1F ZINC000757883343 1046224083 /nfs/dbraw/zinc/22/40/83/1046224083.db2.gz ZXEGVTZWGFBVOU-HNNXBMFYSA-N 1 0 315.436 4.260 20 10 DICDRO CC[C@H]([NH2+]Cc1c(C)cc(CO)cc1C)c1ccc(C)cc1O ZINC000903302889 1046230022 /nfs/dbraw/zinc/23/00/22/1046230022.db2.gz HMQZEQFOWRFVJH-IBGZPJMESA-N 1 0 313.441 4.051 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C2CC3(C2)COC(C)(C)C3)c2c1c(F)ccc2O ZINC000903323271 1046237082 /nfs/dbraw/zinc/23/70/82/1046237082.db2.gz IHUOYHRBROSEPU-KLSWJBCKSA-N 1 0 319.420 4.017 20 10 DICDRO C[C@@H]1CCC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000088698666 1046238254 /nfs/dbraw/zinc/23/82/54/1046238254.db2.gz GCTXGUYFYQMVHL-CXAGYDPISA-N 1 0 324.415 4.035 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ncccn1)C1CC1)c1ccc2ccccc2c1O ZINC000903324250 1046239232 /nfs/dbraw/zinc/23/92/32/1046239232.db2.gz CXPHWCBHNFCEKD-ACJLOTCBSA-N 1 0 319.408 4.137 20 10 DICDRO C[C@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)c1nccs1 ZINC000758043968 1046241816 /nfs/dbraw/zinc/24/18/16/1046241816.db2.gz BAETUPSOHBXQTQ-CQSZACIVSA-N 1 0 324.449 4.409 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(OC)c(C)c2)c1 ZINC000897417733 1046253126 /nfs/dbraw/zinc/25/31/26/1046253126.db2.gz VOGLBQHYJYMMMZ-ZIAGYGMSSA-N 1 0 315.413 4.130 20 10 DICDRO Cc1ncccc1CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000903415122 1046271677 /nfs/dbraw/zinc/27/16/77/1046271677.db2.gz HNGBYDJFBDSDOQ-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](c2ccncc2)C2CC2)cc1 ZINC000903427691 1046277151 /nfs/dbraw/zinc/27/71/51/1046277151.db2.gz IQMFQOIIYBSIRH-QRWLVFNGSA-N 1 0 309.457 4.340 20 10 DICDRO c1cncc([C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C2CC2)c1 ZINC000758622916 1046280370 /nfs/dbraw/zinc/28/03/70/1046280370.db2.gz JFBQTBRQYATSHI-NRFANRHFSA-N 1 0 321.468 4.313 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)c1 ZINC000089726228 1046303154 /nfs/dbraw/zinc/30/31/54/1046303154.db2.gz SFLDAYYOPKNWGK-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO C[C@@H](C[NH2+]CCCSc1nccs1)c1ccc(F)cc1 ZINC000759189021 1046332605 /nfs/dbraw/zinc/33/26/05/1046332605.db2.gz ICBCWZYPAPAQTA-LBPRGKRZSA-N 1 0 310.463 4.158 20 10 DICDRO CSc1ccccc1C[N@H+](C)Cc1cc(F)c(F)cc1[O-] ZINC001462178148 1046344965 /nfs/dbraw/zinc/34/49/65/1046344965.db2.gz SYAZAXAQSBJIBW-UHFFFAOYSA-N 1 0 309.381 4.024 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)CC2 ZINC000689267424 1046347288 /nfs/dbraw/zinc/34/72/88/1046347288.db2.gz RZZRAZIUUASQCB-AWEZNQCLSA-N 1 0 308.208 4.476 20 10 DICDRO COC1CCN(c2ccc(C[N@@H+]3[C@@H](C)CCC3(C)C)cc2)CC1 ZINC000832564550 1046349048 /nfs/dbraw/zinc/34/90/48/1046349048.db2.gz HHBRBLSYBFYJNF-INIZCTEOSA-N 1 0 316.489 4.065 20 10 DICDRO CCOc1ccc(Cl)cc1C[N@H+](C)Cc1ccccc1O ZINC001139010843 1046354332 /nfs/dbraw/zinc/35/43/32/1046354332.db2.gz GNVVFOZEHSRKAP-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Cc1ccc(O)c(C[N@H+]2CC=C(c3c[nH]c4ccccc34)CC2)c1 ZINC000780768111 1046403450 /nfs/dbraw/zinc/40/34/50/1046403450.db2.gz NZVGRLSRGFGNTQ-UHFFFAOYSA-N 1 0 318.420 4.471 20 10 DICDRO CC[C@H]1C[C@@H](C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)CCO1 ZINC000780754400 1046403602 /nfs/dbraw/zinc/40/36/02/1046403602.db2.gz OKZWIUQHHFHWSS-ICSRJNTNSA-N 1 0 318.505 4.168 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)[C@H](C)c2ccccn2)cc1F ZINC000780894094 1046410617 /nfs/dbraw/zinc/41/06/17/1046410617.db2.gz WXFORTWLNFMXAL-OAHLLOKOSA-N 1 0 315.436 4.260 20 10 DICDRO CCC1CCC([NH2+]C[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 ZINC001202913465 1046418145 /nfs/dbraw/zinc/41/81/45/1046418145.db2.gz MXVJXAQAHSRYJN-LXPRWKDFSA-N 1 0 316.489 4.080 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+][C@H]3CCC[C@@H](C)CC3)C2)cc1 ZINC001202914364 1046421072 /nfs/dbraw/zinc/42/10/72/1046421072.db2.gz ZFHJENRLAFFKOG-KURKYZTESA-N 1 0 316.489 4.080 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc(-c3ccccc3)nc1)CC2 ZINC001139518699 1046460421 /nfs/dbraw/zinc/46/04/21/1046460421.db2.gz GQUCLQMYQZBIIX-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO C[N@H+](Cc1cnc(C2CCCC2)s1)Cc1ccccc1O ZINC000091956617 1046488056 /nfs/dbraw/zinc/48/80/56/1046488056.db2.gz LTFTTWGQYFRQQQ-UHFFFAOYSA-N 1 0 302.443 4.138 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)c(C)c2)cc1 ZINC001139672254 1046496443 /nfs/dbraw/zinc/49/64/43/1046496443.db2.gz UVWGOTSUGXLZQW-OAQYLSRUSA-N 1 0 324.468 4.407 20 10 DICDRO Cc1cc(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)ccc1N(C)C ZINC001139673441 1046497234 /nfs/dbraw/zinc/49/72/34/1046497234.db2.gz HFBWQRMEBLZCDM-HDICACEKSA-N 1 0 306.453 4.148 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)CC2 ZINC000693667633 1046522711 /nfs/dbraw/zinc/52/27/11/1046522711.db2.gz DDQKNPVXAPDAIR-ZDUSSCGKSA-N 1 0 308.208 4.476 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000782529677 1046534724 /nfs/dbraw/zinc/53/47/24/1046534724.db2.gz SIOGPRBYXLVDII-CABCVRRESA-N 1 0 314.395 4.272 20 10 DICDRO COc1ccc(C[NH2+]Cc2cccc(CSC)c2)cc1C ZINC000782536289 1046534751 /nfs/dbraw/zinc/53/47/51/1046534751.db2.gz YHHNOYHEVGLOQO-UHFFFAOYSA-N 1 0 301.455 4.156 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cccc(F)c1 ZINC000248097648 1046546159 /nfs/dbraw/zinc/54/61/59/1046546159.db2.gz ZRVGQNJNUXEXRE-UHFFFAOYSA-N 1 0 312.432 4.448 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC=CO1)c1ccc(N2CCCCC2)cc1 ZINC000783311119 1046580462 /nfs/dbraw/zinc/58/04/62/1046580462.db2.gz UHGZBBFVGGXUTQ-LPHOPBHVSA-N 1 0 300.446 4.020 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@H](C)c3ccccc3O)cn(C)c2c1 ZINC000783313052 1046581113 /nfs/dbraw/zinc/58/11/13/1046581113.db2.gz LSWYYGJLHCRBSN-OAHLLOKOSA-N 1 0 308.425 4.086 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](CC(F)(F)F)C(C)C)c1 ZINC000783329584 1046583081 /nfs/dbraw/zinc/58/30/81/1046583081.db2.gz HSRXRHVHPRSULX-ZWNOBZJWSA-N 1 0 305.340 4.028 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@H]1CC2CCC1CC2 ZINC001203005085 1046598235 /nfs/dbraw/zinc/59/82/35/1046598235.db2.gz ALATVUDEESOZFT-UWLZSVRSSA-N 1 0 322.443 4.335 20 10 DICDRO C[C@@H]([NH2+]CCc1ccccc1C(F)(F)F)c1ccccc1O ZINC000783505435 1046601579 /nfs/dbraw/zinc/60/15/79/1046601579.db2.gz WUEPEKXXCPQBEA-GFCCVEGCSA-N 1 0 309.331 4.304 20 10 DICDRO CC[C@@H](C[NH2+][C@H](C)c1ccccc1O)Oc1cccc(F)c1 ZINC000783519481 1046603941 /nfs/dbraw/zinc/60/39/41/1046603941.db2.gz LKGBJRYHAJEQIL-HIFRSBDPSA-N 1 0 303.377 4.040 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1O ZINC000783521463 1046603973 /nfs/dbraw/zinc/60/39/73/1046603973.db2.gz YNFYONBODUPUMS-YNEHKIRRSA-N 1 0 301.352 4.412 20 10 DICDRO CCOc1ccc(Cl)cc1CC[NH2+][C@@H](C)c1ccccc1O ZINC000783526074 1046605943 /nfs/dbraw/zinc/60/59/43/1046605943.db2.gz RMCILQUTTUMDQU-ZDUSSCGKSA-N 1 0 319.832 4.338 20 10 DICDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2c(C)ccc(C)c2O)C1 ZINC001140178764 1046609437 /nfs/dbraw/zinc/60/94/37/1046609437.db2.gz WWSZQDJSJVXYJE-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO Cc1ccc(C)c(C[N@@H+]2CCc3c(Cl)cccc3C2)c1O ZINC001140182346 1046609633 /nfs/dbraw/zinc/60/96/33/1046609633.db2.gz PRULHMXCUJOXPU-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(C)ccc(C)c2O)c1 ZINC001140181409 1046609881 /nfs/dbraw/zinc/60/98/81/1046609881.db2.gz APQOBUSUWLRAKI-LJQANCHMSA-N 1 0 311.425 4.355 20 10 DICDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1c(C)ccc(C)c1O ZINC001140184506 1046610104 /nfs/dbraw/zinc/61/01/04/1046610104.db2.gz XBDKFBLACMGQGZ-MRXNPFEDSA-N 1 0 313.441 4.081 20 10 DICDRO C[C@@H](OCCC[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834496615 1046623657 /nfs/dbraw/zinc/62/36/57/1046623657.db2.gz NYFSFLQNMKGRAG-QAPCUYQASA-N 1 0 311.425 4.137 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C)c1ccccc1O ZINC000248556725 1046623880 /nfs/dbraw/zinc/62/38/80/1046623880.db2.gz LBVOHKARDHSOIW-UWWQBHOKSA-N 1 0 305.462 4.274 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1OC1CCCC1)CC2 ZINC000834518255 1046625116 /nfs/dbraw/zinc/62/51/16/1046625116.db2.gz GSZDERPCXQXKOU-SFHVURJKSA-N 1 0 323.436 4.491 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc(F)cc1F ZINC000834594133 1046634956 /nfs/dbraw/zinc/63/49/56/1046634956.db2.gz PXADERPNAFUSNF-CVEARBPZSA-N 1 0 303.352 4.399 20 10 DICDRO Cc1cccc2c(CC[NH2+][C@H]3CCc4cccc(O)c43)c[nH]c21 ZINC000834598541 1046636076 /nfs/dbraw/zinc/63/60/76/1046636076.db2.gz QNVOIAWTONJZAK-KRWDZBQOSA-N 1 0 306.409 4.002 20 10 DICDRO CCOc1cccc(C[N@H+](C)Cc2cc3ccccc3o2)c1O ZINC000093689172 1046637604 /nfs/dbraw/zinc/63/76/04/1046637604.db2.gz YYWWZHOJUCPWPN-UHFFFAOYSA-N 1 0 311.381 4.169 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCC[C@H](C(F)(F)F)C1)CC2 ZINC000834615702 1046639699 /nfs/dbraw/zinc/63/96/99/1046639699.db2.gz IAPTYYUGJDFPOE-FPMFFAJLSA-N 1 0 313.363 4.338 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CC3(CCC3)Oc3ccccc31)CC2 ZINC000834619077 1046640078 /nfs/dbraw/zinc/64/00/78/1046640078.db2.gz AWFQHPQEBHPMMZ-IRXDYDNUSA-N 1 0 321.420 4.416 20 10 DICDRO CO[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1Cl ZINC000834681029 1046648711 /nfs/dbraw/zinc/64/87/11/1046648711.db2.gz SXQDJQLQNDGKJD-RDJZCZTQSA-N 1 0 317.816 4.010 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc(-c3ccccn3)cc1)CC2 ZINC001140382308 1046681080 /nfs/dbraw/zinc/68/10/80/1046681080.db2.gz QXWMGYSWAKTHFH-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO C[C@H]([NH2+]Cc1cc(C2CC2)ccc1F)c1cc(F)ccc1O ZINC000834841678 1046682565 /nfs/dbraw/zinc/68/25/65/1046682565.db2.gz YKAYOXZHYCRXTN-NSHDSACASA-N 1 0 303.352 4.399 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2ccccn2)c2c1c(F)ccc2O ZINC000834849300 1046686130 /nfs/dbraw/zinc/68/61/30/1046686130.db2.gz ACORYTQCGSNTPE-TZMCWYRMSA-N 1 0 314.404 4.042 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC(C)(C)c2ccccn2)cc1 ZINC000834856216 1046688237 /nfs/dbraw/zinc/68/82/37/1046688237.db2.gz MSPOPWBBNXZVOG-INIZCTEOSA-N 1 0 311.473 4.166 20 10 DICDRO CC[C@H]([NH2+][C@@H]1COCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000841762545 1046695771 /nfs/dbraw/zinc/69/57/71/1046695771.db2.gz XHUULARMYSQVHL-VQTJNVASSA-N 1 0 310.441 4.065 20 10 DICDRO CC[C@H]([NH2+][C@H]1COCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000841762543 1046696183 /nfs/dbraw/zinc/69/61/83/1046696183.db2.gz XHUULARMYSQVHL-PMACEKPBSA-N 1 0 310.441 4.065 20 10 DICDRO Cc1cccnc1CCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000834883312 1046697224 /nfs/dbraw/zinc/69/72/24/1046697224.db2.gz IRVIVTORBGQEHI-CZUORRHYSA-N 1 0 314.404 4.005 20 10 DICDRO Cc1cccnc1CC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000834885347 1046698401 /nfs/dbraw/zinc/69/84/01/1046698401.db2.gz IUCOFAVHNDGGAG-GOSISDBHSA-N 1 0 323.484 4.274 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)cc1 ZINC000834883977 1046698616 /nfs/dbraw/zinc/69/86/16/1046698616.db2.gz VMHVERWCJSMLJN-SJORKVTESA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000834883945 1046698708 /nfs/dbraw/zinc/69/87/08/1046698708.db2.gz VHDGSCYNESNFKI-CHWSQXEVSA-N 1 0 309.837 4.046 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000834883950 1046698791 /nfs/dbraw/zinc/69/87/91/1046698791.db2.gz VHDGSCYNESNFKI-QWHCGFSZSA-N 1 0 309.837 4.046 20 10 DICDRO CC[C@H]([NH2+]CCc1ncccc1C)c1cc(Cl)ccc1O ZINC000834886672 1046701243 /nfs/dbraw/zinc/70/12/43/1046701243.db2.gz VNAMVRAOAQAMDS-HNNXBMFYSA-N 1 0 304.821 4.032 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c1 ZINC000834895276 1046706705 /nfs/dbraw/zinc/70/67/05/1046706705.db2.gz XRPKNEIOTHMBIA-RISCZKNCSA-N 1 0 302.245 4.325 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1O ZINC000834896018 1046707582 /nfs/dbraw/zinc/70/75/82/1046707582.db2.gz GYIXWOJSCMNNCE-TVQRCGJNSA-N 1 0 307.315 4.148 20 10 DICDRO CCCC[N@H+](CC[C@@H](O)c1ccccc1)Cc1ccccc1O ZINC000796064672 1046708195 /nfs/dbraw/zinc/70/81/95/1046708195.db2.gz YVHDSKAJQVODGH-HXUWFJFHSA-N 1 0 313.441 4.118 20 10 DICDRO CCC1(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)COC1 ZINC000834900895 1046711393 /nfs/dbraw/zinc/71/13/93/1046711393.db2.gz SXBYRMZZTVRYPW-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cnn(CC)c1)c1cc(Cl)ccc1O ZINC000834902139 1046713645 /nfs/dbraw/zinc/71/36/45/1046713645.db2.gz DUEIYPKGWSEGHI-IAQYHMDHSA-N 1 0 307.825 4.064 20 10 DICDRO CO[C@@H]([C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C1CC1 ZINC000834903403 1046713900 /nfs/dbraw/zinc/71/39/00/1046713900.db2.gz JEUILRHUBGVZDO-GUXCAODWSA-N 1 0 316.489 4.141 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000834908821 1046715819 /nfs/dbraw/zinc/71/58/19/1046715819.db2.gz HMLCIVDTDTYWGY-SWLSCSKDSA-N 1 0 311.853 4.292 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCN(C)c2ccccc21)c1cc(F)ccc1O ZINC000834904069 1046716518 /nfs/dbraw/zinc/71/65/18/1046716518.db2.gz NGAULBSYDMCYNB-CXAGYDPISA-N 1 0 314.404 4.153 20 10 DICDRO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2O)cn1 ZINC000834905146 1046716889 /nfs/dbraw/zinc/71/68/89/1046716889.db2.gz RHDCEYLQXIWBRD-KGLIPLIRSA-N 1 0 309.413 4.174 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1cc(F)ccc1O ZINC000834904078 1046717007 /nfs/dbraw/zinc/71/70/07/1046717007.db2.gz NGAULBSYDMCYNB-GUYCJALGSA-N 1 0 314.404 4.153 20 10 DICDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)nc1 ZINC000834910041 1046717772 /nfs/dbraw/zinc/71/77/72/1046717772.db2.gz RALJQJKSLAGRPI-GOSISDBHSA-N 1 0 323.484 4.274 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1cc2c(cc1O)CCCC2 ZINC000834907987 1046718170 /nfs/dbraw/zinc/71/81/70/1046718170.db2.gz BLAONLUIRGQOLI-HUUCEWRRSA-N 1 0 317.473 4.127 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1cc2c(cc1O)CCCC2 ZINC000834907989 1046718227 /nfs/dbraw/zinc/71/82/27/1046718227.db2.gz BLAONLUIRGQOLI-LSDHHAIUSA-N 1 0 317.473 4.127 20 10 DICDRO CC[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cc1[O-] ZINC000796694371 1046718142 /nfs/dbraw/zinc/71/81/42/1046718142.db2.gz IOXRLQVLRGBGGD-YJBOKZPZSA-N 1 0 322.468 4.227 20 10 DICDRO CC[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(F)cc1[O-] ZINC000796692345 1046718869 /nfs/dbraw/zinc/71/88/69/1046718869.db2.gz BMDIDNUOYCXHJZ-GOSISDBHSA-N 1 0 322.468 4.084 20 10 DICDRO CC[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(F)cc1[O-] ZINC000796759258 1046728277 /nfs/dbraw/zinc/72/82/77/1046728277.db2.gz GPNPQGBVSJAGNI-GOSISDBHSA-N 1 0 322.468 4.228 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1ccccc1-c1nccs1 ZINC001140452159 1046731820 /nfs/dbraw/zinc/73/18/20/1046731820.db2.gz ASPPQABSZPYFCE-UHFFFAOYSA-N 1 0 310.422 4.148 20 10 DICDRO Oc1cc(Cl)ccc1C[NH+]1CCC(Oc2ccccc2)CC1 ZINC001140461378 1046736328 /nfs/dbraw/zinc/73/63/28/1046736328.db2.gz JXXXZYURVWNFDS-UHFFFAOYSA-N 1 0 317.816 4.089 20 10 DICDRO C[N@H+](Cc1ccc(Cl)cc1O)Cc1cccc2cccnc21 ZINC001140466639 1046737473 /nfs/dbraw/zinc/73/74/73/1046737473.db2.gz IZTYPPJVZSDGEO-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO Cc1ccccc1O[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140466358 1046739686 /nfs/dbraw/zinc/73/96/86/1046739686.db2.gz DUTWYRZKFYNNBR-MRXNPFEDSA-N 1 0 317.816 4.007 20 10 DICDRO CC[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1nc(C)cs1 ZINC000835039110 1046746370 /nfs/dbraw/zinc/74/63/70/1046746370.db2.gz WNDUZFOBRLAEMI-DKRLNXSXSA-N 1 0 315.486 4.272 20 10 DICDRO CC[C@@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccc(F)cc1O ZINC000796923029 1046759141 /nfs/dbraw/zinc/75/91/41/1046759141.db2.gz KFEJWFCGHLCLDY-QGZVFWFLSA-N 1 0 320.383 4.295 20 10 DICDRO Cc1cccc(CCC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC000797015041 1046769932 /nfs/dbraw/zinc/76/99/32/1046769932.db2.gz GHMAVCMYWNGKCR-BLLLJJGKSA-N 1 0 314.404 4.005 20 10 DICDRO C[C@H]([NH2+]CCn1ccc2cc(Cl)ccc21)c1ccccc1O ZINC000797010968 1046770058 /nfs/dbraw/zinc/77/00/58/1046770058.db2.gz HDVUSHKVEFBCII-ZDUSSCGKSA-N 1 0 314.816 4.351 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000797010651 1046770313 /nfs/dbraw/zinc/77/03/13/1046770313.db2.gz SZHRVKTXOLSNMD-LBPRGKRZSA-N 1 0 305.418 4.412 20 10 DICDRO C[C@H]([NH2+][C@@H]1CSC[C@@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000797066220 1046785316 /nfs/dbraw/zinc/78/53/16/1046785316.db2.gz QCNOHCNTAKDFIW-GRDNDAEWSA-N 1 0 322.493 4.218 20 10 DICDRO C[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1cc2c(cc1O)CCCC2 ZINC000797072066 1046786266 /nfs/dbraw/zinc/78/62/66/1046786266.db2.gz WHFJWMOAZUSHSR-NSHDSACASA-N 1 0 313.363 4.264 20 10 DICDRO CSCc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000797097923 1046789291 /nfs/dbraw/zinc/78/92/91/1046789291.db2.gz FJJIMNUPJBLPBA-CQSZACIVSA-N 1 0 301.455 4.414 20 10 DICDRO C[C@]1(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C[C@@]1(F)Cl ZINC001203048238 1046789613 /nfs/dbraw/zinc/78/96/13/1046789613.db2.gz JKCJIAVFTXTREX-ROUUACIJSA-N 1 0 324.871 4.471 20 10 DICDRO CCCN1CCC[C@H]1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000797115827 1046792876 /nfs/dbraw/zinc/79/28/76/1046792876.db2.gz QWFAVIJFKBGCJC-WBVHZDCISA-N 1 0 312.457 4.070 20 10 DICDRO C[C@@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1c(F)cncc1F ZINC000797125197 1046793313 /nfs/dbraw/zinc/79/33/13/1046793313.db2.gz IKDJNCGXHCXTAY-JRKPZEMJSA-N 1 0 322.330 4.104 20 10 DICDRO c1coc(C[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)c1 ZINC000796257293 1046804156 /nfs/dbraw/zinc/80/41/56/1046804156.db2.gz JMQDUOZRCDZOQJ-UHFFFAOYSA-N 1 0 318.420 4.132 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c1 ZINC001140620934 1046816010 /nfs/dbraw/zinc/81/60/10/1046816010.db2.gz INCUWGVJSVYWFO-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO COc1cccc([C@H]2CCC[N@H+](Cc3cc(C)ccc3O)C2)c1 ZINC001140623919 1046817323 /nfs/dbraw/zinc/81/73/23/1046817323.db2.gz XEUUWMYVAPQVAV-KRWDZBQOSA-N 1 0 311.425 4.089 20 10 DICDRO COc1ccccc1C1CC[NH+](Cc2cc(C)ccc2O)CC1 ZINC001140623612 1046817414 /nfs/dbraw/zinc/81/74/14/1046817414.db2.gz XZYMYPLERJRUAJ-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC3(CC2)O[C@H](C)c2ccccc23)c1 ZINC001140624505 1046819677 /nfs/dbraw/zinc/81/96/77/1046819677.db2.gz YTGSPETWXULMAN-MRXNPFEDSA-N 1 0 323.436 4.283 20 10 DICDRO Cc1cccc(OC2CC[NH+](Cc3cc(C)ccc3O)CC2)c1 ZINC001140623269 1046819883 /nfs/dbraw/zinc/81/98/83/1046819883.db2.gz MRPRFHDRUQKRBP-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccc4occc4c3)ccc21 ZINC000796284671 1046834477 /nfs/dbraw/zinc/83/44/77/1046834477.db2.gz YPFBHJUOJLWEBV-UHFFFAOYSA-N 1 0 306.409 4.105 20 10 DICDRO COc1ccc(O)c(C[NH2+]C(c2ccccc2)c2ccccc2)c1 ZINC000237360314 1046865499 /nfs/dbraw/zinc/86/54/99/1046865499.db2.gz SZCWZEDTABUHMJ-UHFFFAOYSA-N 1 0 319.404 4.280 20 10 DICDRO c1csc(SCCC[NH2+]CCSCc2ccccc2)n1 ZINC000797603173 1046869318 /nfs/dbraw/zinc/86/93/18/1046869318.db2.gz YXZBUOWBJGWWGJ-UHFFFAOYSA-N 1 0 324.540 4.148 20 10 DICDRO CC[N@H+](Cc1ccc(C(C)(C)C)[nH]1)Cc1ccc(N(C)C)cc1 ZINC001137378949 1046881723 /nfs/dbraw/zinc/88/17/23/1046881723.db2.gz IJJOGJYGXJNKNQ-UHFFFAOYSA-N 1 0 313.489 4.400 20 10 DICDRO Cc1c(O)ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)c1O ZINC001140747650 1046884575 /nfs/dbraw/zinc/88/45/75/1046884575.db2.gz HROIPIIHAIFQBP-LBPRGKRZSA-N 1 0 305.805 4.253 20 10 DICDRO COc1cccc(C[NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)c1O ZINC000797876788 1046900193 /nfs/dbraw/zinc/90/01/93/1046900193.db2.gz GNKOMBXBNWFFBF-KOMQPUFPSA-N 1 0 317.816 4.090 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(SC)cc1)c1ccccc1O ZINC000797999090 1046917395 /nfs/dbraw/zinc/91/73/95/1046917395.db2.gz PNGIFQAQRLSZDM-KRWDZBQOSA-N 1 0 301.455 4.398 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)c1 ZINC000797998728 1046917734 /nfs/dbraw/zinc/91/77/34/1046917734.db2.gz KXVKIRVGUJWXKB-NOLJZWGESA-N 1 0 315.388 4.137 20 10 DICDRO CSc1ccc(CC[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000797998750 1046918617 /nfs/dbraw/zinc/91/86/17/1046918617.db2.gz IHSTUSHKWUVPOF-GFCCVEGCSA-N 1 0 305.418 4.147 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC23CCCCC3)c(O)c1 ZINC001140850761 1046929232 /nfs/dbraw/zinc/92/92/32/1046929232.db2.gz SUXLLWGBIHRTQK-UHFFFAOYSA-N 1 0 302.462 4.147 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(O)c1 ZINC001140855600 1046930454 /nfs/dbraw/zinc/93/04/54/1046930454.db2.gz FELRJDKDWOFXCC-IBGZPJMESA-N 1 0 310.441 4.185 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(O)c1 ZINC001140855601 1046931060 /nfs/dbraw/zinc/93/10/60/1046931060.db2.gz FELRJDKDWOFXCC-LJQANCHMSA-N 1 0 310.441 4.185 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)[C@@H]2CCc3ccccc32)c(O)c1 ZINC001140856769 1046933609 /nfs/dbraw/zinc/93/36/09/1046933609.db2.gz MPYQFBXABXFGNE-HXUWFJFHSA-N 1 0 324.468 4.358 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)c(Cl)c1 ZINC001140923525 1046951138 /nfs/dbraw/zinc/95/11/38/1046951138.db2.gz CNJZAUMTCAGCJH-SFHVURJKSA-N 1 0 315.848 4.138 20 10 DICDRO CN(C)c1ccc(CN2CC[C@@H]2c2ccccc2)c(Cl)c1 ZINC001140924117 1046951561 /nfs/dbraw/zinc/95/15/61/1046951561.db2.gz DTZMCQARFQIPKH-GOSISDBHSA-N 1 0 300.833 4.353 20 10 DICDRO Cc1[nH+]ccc(N2CC=C(c3ccc(Cl)nc3)CC2)c1Cl ZINC000798396882 1046951757 /nfs/dbraw/zinc/95/17/57/1046951757.db2.gz LJLMDHROYVPBJU-UHFFFAOYSA-N 1 0 320.223 4.386 20 10 DICDRO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(C)cc2O)cc1 ZINC001140950863 1046960375 /nfs/dbraw/zinc/96/03/75/1046960375.db2.gz LWNXDHVPXZYAQV-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO c1ccc([C@@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)nc1 ZINC000798965234 1046993849 /nfs/dbraw/zinc/99/38/49/1046993849.db2.gz QEGJJYGDCYEBQU-LJQANCHMSA-N 1 0 321.468 4.061 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](c3ccccn3)C2)cc1C(C)C ZINC000799158309 1047005007 /nfs/dbraw/zinc/00/50/07/1047005007.db2.gz ITFLXOSEJDILKQ-INIZCTEOSA-N 1 0 310.441 4.209 20 10 DICDRO CCc1cc(C[NH+]2CCC3(CCO3)CC2)c(O)c(C(C)(C)C)c1 ZINC000799956034 1047077141 /nfs/dbraw/zinc/07/71/41/1047077141.db2.gz SXLXWBRDMWQHJX-UHFFFAOYSA-N 1 0 317.473 4.007 20 10 DICDRO Oc1cc2c(cc1C[NH+]1CCC3(CCO3)CC1)oc1ccccc12 ZINC000799954793 1047077559 /nfs/dbraw/zinc/07/75/59/1047077559.db2.gz BMZAUUQPZKZVPS-UHFFFAOYSA-N 1 0 323.392 4.047 20 10 DICDRO c1cc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)cc2c1CCC2 ZINC001116017729 1047100656 /nfs/dbraw/zinc/10/06/56/1047100656.db2.gz ZEDIGEMVSQRCMW-UHFFFAOYSA-N 1 0 320.480 4.455 20 10 DICDRO Cc1nc(C[N@H+](Cc2ccccc2O)C2CCCC2)c(C)s1 ZINC001116358689 1047132722 /nfs/dbraw/zinc/13/27/22/1047132722.db2.gz NJKOEJLYHJFDQF-UHFFFAOYSA-N 1 0 316.470 4.410 20 10 DICDRO COc1cc(C[N@H+](C)CCC(F)(F)F)c(O)c(C(C)(C)C)c1 ZINC001116377761 1047134621 /nfs/dbraw/zinc/13/46/21/1047134621.db2.gz NMSJTYLTDBJAKU-UHFFFAOYSA-N 1 0 319.367 4.083 20 10 DICDRO CCC[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccccc1O ZINC001116443185 1047142330 /nfs/dbraw/zinc/14/23/30/1047142330.db2.gz JMWSSZRDMUUWMK-UHFFFAOYSA-N 1 0 324.468 4.405 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc(Cl)nc1 ZINC001116565196 1047156980 /nfs/dbraw/zinc/15/69/80/1047156980.db2.gz KOUDCMXHWPRJSP-AAEUAGOBSA-N 1 0 302.805 4.087 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC001116569051 1047158224 /nfs/dbraw/zinc/15/82/24/1047158224.db2.gz ZLXWVEPQMHIDLR-BZUAXINKSA-N 1 0 315.457 4.330 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC001116569052 1047158320 /nfs/dbraw/zinc/15/83/20/1047158320.db2.gz ZLXWVEPQMHIDLR-OAGGEKHMSA-N 1 0 315.457 4.330 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)COc2ccccc2F)c(O)c1C ZINC001116584493 1047160419 /nfs/dbraw/zinc/16/04/19/1047160419.db2.gz GWWSMNVHZDGELG-HIFRSBDPSA-N 1 0 317.404 4.266 20 10 DICDRO c1cc2cccc(C[NH2+]Cc3ccc(N4CCCC4)cc3)c2[nH]1 ZINC001116719662 1047172044 /nfs/dbraw/zinc/17/20/44/1047172044.db2.gz NDADDBRMVNDWIU-UHFFFAOYSA-N 1 0 305.425 4.058 20 10 DICDRO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001116865418 1047184381 /nfs/dbraw/zinc/18/43/81/1047184381.db2.gz OERODSTWRNJYEV-BBRMVZONSA-N 1 0 312.379 4.060 20 10 DICDRO COC1CCN(c2ccc(C[N@@H+]3CCCCC[C@H]3C)cc2)CC1 ZINC000827821041 1047184684 /nfs/dbraw/zinc/18/46/84/1047184684.db2.gz IPRJZQIRRQBWFM-QGZVFWFLSA-N 1 0 316.489 4.066 20 10 DICDRO COC1CCN(c2ccc(C[N@@H+]3CCCCC[C@@H]3C)cc2)CC1 ZINC000827821040 1047184856 /nfs/dbraw/zinc/18/48/56/1047184856.db2.gz IPRJZQIRRQBWFM-KRWDZBQOSA-N 1 0 316.489 4.066 20 10 DICDRO CC[C@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccc(C)cc1O ZINC001116889897 1047187302 /nfs/dbraw/zinc/18/73/02/1047187302.db2.gz JXPBMBMDQAFOFQ-SFHVURJKSA-N 1 0 317.473 4.481 20 10 DICDRO CCOCc1cc(C[NH2+]C2(C3CCC3)CCC2)ccc1OC ZINC000839186473 1047202292 /nfs/dbraw/zinc/20/22/92/1047202292.db2.gz MGZDXPJKECQZHL-UHFFFAOYSA-N 1 0 303.446 4.044 20 10 DICDRO Cc1cc(NCc2cc(Cl)c(F)cc2O)ccc1C[NH+](C)C ZINC000839188251 1047202807 /nfs/dbraw/zinc/20/28/07/1047202807.db2.gz AYVOSFSOKKZIFH-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO COc1cccc(CC[NH2+][C@@H](C)c2ccc3ccccc3c2O)c1 ZINC000325685865 1047205506 /nfs/dbraw/zinc/20/55/06/1047205506.db2.gz BMAPIFFWPMVEID-HNNXBMFYSA-N 1 0 321.420 4.447 20 10 DICDRO Cc1cnccc1CC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000827919660 1047234228 /nfs/dbraw/zinc/23/42/28/1047234228.db2.gz NEIVUYAVJQTPSD-UHFFFAOYSA-N 1 0 310.441 4.083 20 10 DICDRO Oc1c(C[NH2+]CCCOCc2ccccc2)ccc2ccccc21 ZINC001117760026 1047243371 /nfs/dbraw/zinc/24/33/71/1047243371.db2.gz JYDGUKOVPBVGAX-UHFFFAOYSA-N 1 0 321.420 4.242 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC(C)(C)c1ccccn1 ZINC001117779564 1047245089 /nfs/dbraw/zinc/24/50/89/1047245089.db2.gz QJJCKUMDFRVXAW-CABCVRRESA-N 1 0 310.441 4.211 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2c2ccccc2)c1O ZINC000388391355 1047286927 /nfs/dbraw/zinc/28/69/27/1047286927.db2.gz JETBUODTJCDVKE-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c1O ZINC000388597010 1047287914 /nfs/dbraw/zinc/28/79/14/1047287914.db2.gz UTKSMQKPGXLBHI-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO CS[C@H]1CC[N@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000840117258 1047288146 /nfs/dbraw/zinc/28/81/46/1047288146.db2.gz UCSQMQWDZUZSMA-ZDUSSCGKSA-N 1 0 313.422 4.229 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)COCc1ccccc1 ZINC000389907198 1047293333 /nfs/dbraw/zinc/29/33/33/1047293333.db2.gz HOQSWCOVPRXJCZ-GJZGRUSLSA-N 1 0 317.404 4.035 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)CCOCc2ccccc2)c(O)c1 ZINC000389935974 1047293476 /nfs/dbraw/zinc/29/34/76/1047293476.db2.gz MNSONIBVABEXAF-SJORKVTESA-N 1 0 313.441 4.347 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cc(F)ccc1F ZINC000390637113 1047300553 /nfs/dbraw/zinc/30/05/53/1047300553.db2.gz KCRVCBJMJTUVHP-ZDUSSCGKSA-N 1 0 316.395 4.198 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(F)cc1F ZINC000390871204 1047302085 /nfs/dbraw/zinc/30/20/85/1047302085.db2.gz PENVPXPXBGBHLK-ZDUSSCGKSA-N 1 0 316.395 4.198 20 10 DICDRO CCOc1cccc(C[NH2+]C(C)(C)CCc2ccccc2)c1O ZINC000391272202 1047303776 /nfs/dbraw/zinc/30/37/76/1047303776.db2.gz YAOUREOLPQWYBR-UHFFFAOYSA-N 1 0 313.441 4.292 20 10 DICDRO COc1ccccc1CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000392310660 1047308449 /nfs/dbraw/zinc/30/84/49/1047308449.db2.gz NCCJDOIVVUCUBO-HNNXBMFYSA-N 1 0 321.420 4.447 20 10 DICDRO c1cnc2cc(C[NH2+]Cc3ccc(N4CCCC4)cc3)ccc2c1 ZINC001118924386 1047316501 /nfs/dbraw/zinc/31/65/01/1047316501.db2.gz PNYOCXISLPVRBF-UHFFFAOYSA-N 1 0 317.436 4.125 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1cccc2c1CCOC2 ZINC001118932726 1047317032 /nfs/dbraw/zinc/31/70/32/1047317032.db2.gz BZQVIKXJZPDRPY-KDOFPFPSSA-N 1 0 323.436 4.111 20 10 DICDRO COc1ccccc1C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725844184 1047318107 /nfs/dbraw/zinc/31/81/07/1047318107.db2.gz OINMCVXQFBEPIW-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]C[C@@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000725848183 1047320833 /nfs/dbraw/zinc/32/08/33/1047320833.db2.gz LAPUYSHLXXIMEB-AWEZNQCLSA-N 1 0 319.489 4.113 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)c1O ZINC000725847740 1047321069 /nfs/dbraw/zinc/32/10/69/1047321069.db2.gz CLTFSVSKMBTSDA-UHFFFAOYSA-N 1 0 324.424 4.179 20 10 DICDRO Clc1cc(Cl)cc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000725853747 1047321119 /nfs/dbraw/zinc/32/11/19/1047321119.db2.gz UVDYUZGNHBWTGT-UHFFFAOYSA-N 1 0 308.208 4.218 20 10 DICDRO COc1ccc(CC[C@@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000725849444 1047321334 /nfs/dbraw/zinc/32/13/34/1047321334.db2.gz NMKPVWQGHZYODD-CYBMUJFWSA-N 1 0 319.832 4.165 20 10 DICDRO Oc1ccc(CC[NH2+]Cc2cc(-c3ccccc3)ccc2O)cc1 ZINC000725847772 1047321925 /nfs/dbraw/zinc/32/19/25/1047321925.db2.gz IEJKBWWQLPGVEW-UHFFFAOYSA-N 1 0 319.404 4.097 20 10 DICDRO C[C@H](CN1CCCCC1)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725847959 1047321994 /nfs/dbraw/zinc/32/19/94/1047321994.db2.gz YDGKCNVYFLDZNA-QGZVFWFLSA-N 1 0 324.468 4.023 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)[C@@H]1CCCOC1 ZINC001119345604 1047330254 /nfs/dbraw/zinc/33/02/54/1047330254.db2.gz XLLCGDGXSGCOSH-LVQVYYBASA-N 1 0 303.446 4.044 20 10 DICDRO COCC1CCC([NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000840876980 1047351323 /nfs/dbraw/zinc/35/13/23/1047351323.db2.gz VOFMUJOBWUIIOT-OPFPJEHXSA-N 1 0 311.853 4.210 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)cc1 ZINC000840883515 1047353857 /nfs/dbraw/zinc/35/38/57/1047353857.db2.gz DPYQXIPFVNSJOT-UHFFFAOYSA-N 1 0 305.805 4.043 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)CCC(F)(F)F ZINC000840895481 1047356441 /nfs/dbraw/zinc/35/64/41/1047356441.db2.gz YNSZRRGDRQYWRI-ZIAGYGMSSA-N 1 0 316.411 4.313 20 10 DICDRO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)Cc1ccc(N(C)C)cc1C ZINC000840894719 1047356647 /nfs/dbraw/zinc/35/66/47/1047356647.db2.gz SDEKRFAWORJPAP-IAGOWNOFSA-N 1 0 311.473 4.046 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCOC3(CCCCC3)C2)c(Cl)c1 ZINC000840910376 1047358642 /nfs/dbraw/zinc/35/86/42/1047358642.db2.gz ZTHWLAKKFCWJFA-AWEZNQCLSA-N 1 0 323.864 4.326 20 10 DICDRO Cc1cnc([C@H]([NH2+]Cc2ccc(N(C)C)cc2C)C2CC2)s1 ZINC000840933652 1047360087 /nfs/dbraw/zinc/36/00/87/1047360087.db2.gz IYKWPCUUBPNADS-QGZVFWFLSA-N 1 0 315.486 4.067 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)c(Cl)c1 ZINC000840936614 1047360122 /nfs/dbraw/zinc/36/01/22/1047360122.db2.gz MRASLDCJJAURCJ-KGLIPLIRSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c(Cl)c1 ZINC000840946024 1047362340 /nfs/dbraw/zinc/36/23/40/1047362340.db2.gz GFIDMEXETUFFOO-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1C[C@@H](C)Oc2ccccc21 ZINC000840950654 1047362602 /nfs/dbraw/zinc/36/26/02/1047362602.db2.gz MYVNSLPSSNIOCL-DNVCBOLYSA-N 1 0 310.441 4.063 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c(Cl)c1 ZINC000840946084 1047363681 /nfs/dbraw/zinc/36/36/81/1047363681.db2.gz HUBRWHIFJDWBMX-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000840950478 1047363810 /nfs/dbraw/zinc/36/38/10/1047363810.db2.gz ODBRDCVIWKTIIP-LJQANCHMSA-N 1 0 309.457 4.039 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1(c2ccc(F)cc2)CCC1 ZINC000726606001 1047368987 /nfs/dbraw/zinc/36/89/87/1047368987.db2.gz PHQINLWKYSEVCP-UHFFFAOYSA-N 1 0 305.780 4.354 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C[C@H]1SCCc2ccccc21 ZINC000749300066 1047409311 /nfs/dbraw/zinc/40/93/11/1047409311.db2.gz WDNAMJZYECQJQY-QGZVFWFLSA-N 1 0 319.857 4.166 20 10 DICDRO COCc1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841743141 1047446908 /nfs/dbraw/zinc/44/69/08/1047446908.db2.gz CXNQONATDZPTBD-LBPRGKRZSA-N 1 0 305.805 4.043 20 10 DICDRO CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1[O-] ZINC000841744120 1047448639 /nfs/dbraw/zinc/44/86/39/1047448639.db2.gz MBIQDDRVXXTTRT-KBPBESRZSA-N 1 0 312.885 4.207 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccc(Cl)cc1O ZINC000841750287 1047450219 /nfs/dbraw/zinc/45/02/19/1047450219.db2.gz WEPOQWRZRHZPCZ-XIKOKIGWSA-N 1 0 317.816 4.010 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c(C)c1 ZINC000841753003 1047451998 /nfs/dbraw/zinc/45/19/98/1047451998.db2.gz XAFTYAMMZJIJLJ-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c(C)c1 ZINC000841753005 1047452158 /nfs/dbraw/zinc/45/21/58/1047452158.db2.gz XAFTYAMMZJIJLJ-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1c(F)cncc1F ZINC000841757790 1047453459 /nfs/dbraw/zinc/45/34/59/1047453459.db2.gz QEIFDUIUHRVSOK-DTWKUNHWSA-N 1 0 312.747 4.131 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)cc1 ZINC000841759399 1047453894 /nfs/dbraw/zinc/45/38/94/1047453894.db2.gz FPYCLEBBSBLGRR-FOIQADDNSA-N 1 0 310.441 4.065 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2COCc3ccccc32)c1O ZINC000841762074 1047454645 /nfs/dbraw/zinc/45/46/45/1047454645.db2.gz USQLQKMKIIPREZ-YVEFUNNKSA-N 1 0 317.816 4.276 20 10 DICDRO COCc1cc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)ccc1F ZINC000841765558 1047455604 /nfs/dbraw/zinc/45/56/04/1047455604.db2.gz ZQSSUKSLWKJKSO-LLVKDONJSA-N 1 0 323.795 4.182 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2[C@H]2CCCOC2)cc1C(C)C ZINC000842612845 1047493275 /nfs/dbraw/zinc/49/32/75/1047493275.db2.gz PFXDFUZGRPAVNC-QFBILLFUSA-N 1 0 317.473 4.215 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](CC(C)C)c1ccncc1 ZINC000842842364 1047506923 /nfs/dbraw/zinc/50/69/23/1047506923.db2.gz XHHWZGOEDYXIHH-HXUWFJFHSA-N 1 0 311.473 4.333 20 10 DICDRO C[C@H]([NH2+]C1(c2cccc(F)c2)CCC1)c1cc(F)ccc1O ZINC000842903407 1047512802 /nfs/dbraw/zinc/51/28/02/1047512802.db2.gz PJDIYRKBNUGVKX-LBPRGKRZSA-N 1 0 303.352 4.400 20 10 DICDRO COc1cccc(C[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)c1O ZINC000843435054 1047551078 /nfs/dbraw/zinc/55/10/78/1047551078.db2.gz GKTHSCGGSDMXGJ-FQEVSTJZSA-N 1 0 321.420 4.294 20 10 DICDRO c1cc(Nc2ccc3c(c2)CCCN3)ccc1C[NH+]1CCCC1 ZINC001159507146 1047856830 /nfs/dbraw/zinc/85/68/30/1047856830.db2.gz BWTHYISHYIGQSK-UHFFFAOYSA-N 1 0 307.441 4.384 20 10 DICDRO CSc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(O)c(O)c1 ZINC001203881131 1047863156 /nfs/dbraw/zinc/86/31/56/1047863156.db2.gz LYZHMBXWKAVCSJ-OAHLLOKOSA-N 1 0 315.438 4.157 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2CCC(c3ccc(O)cc3)CC2)c1 ZINC001182958499 1047868116 /nfs/dbraw/zinc/86/81/16/1047868116.db2.gz AZOZIIJNJUXWRM-UHFFFAOYSA-N 1 0 311.425 4.222 20 10 DICDRO [O-]c1cc(F)c(F)cc1C[NH2+][C@H]1C[C@H](Sc2ccccc2)C1 ZINC001183125473 1047890111 /nfs/dbraw/zinc/89/01/11/1047890111.db2.gz UVWWHXUPTVRCHU-MQMHXKEQSA-N 1 0 321.392 4.083 20 10 DICDRO Nc1ccc(N(c2ccccc2)c2cccc(OCC[NH3+])c2)cc1 ZINC001159703428 1047905106 /nfs/dbraw/zinc/90/51/06/1047905106.db2.gz IVWJLQQKALLVDO-UHFFFAOYSA-N 1 0 319.408 4.076 20 10 DICDRO Nc1ccc(Cc2ccc(Nc3ccc4c(c3)C[NH2+]C4)cc2)cc1 ZINC001159704362 1047905638 /nfs/dbraw/zinc/90/56/38/1047905638.db2.gz XUIXVQYNOGNTLE-UHFFFAOYSA-N 1 0 315.420 4.206 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccccc1)C1CCSCC1 ZINC001203561060 1047907724 /nfs/dbraw/zinc/90/77/24/1047907724.db2.gz KYVYLVWYVNZZBQ-UHFFFAOYSA-N 1 0 313.466 4.290 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)c(O)c1 ZINC000775822059 1047929489 /nfs/dbraw/zinc/92/94/89/1047929489.db2.gz LMFHGXGQWZWAQQ-LJQANCHMSA-N 1 0 317.404 4.417 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)cc1Cl ZINC001183492682 1047937199 /nfs/dbraw/zinc/93/71/99/1047937199.db2.gz XXRPENYKGLSSOG-FUHWJXTLSA-N 1 0 319.807 4.469 20 10 DICDRO CSc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000775833513 1047938222 /nfs/dbraw/zinc/93/82/22/1047938222.db2.gz KIYPARDLCROXAV-CQSZACIVSA-N 1 0 300.471 4.325 20 10 DICDRO CC(C)Nc1ccc(Nc2ccccc2N2CCC[C@H]([NH3+])C2)cc1 ZINC001159978852 1047963916 /nfs/dbraw/zinc/96/39/16/1047963916.db2.gz ZMKCLOIRXLPUGP-INIZCTEOSA-N 1 0 324.472 4.178 20 10 DICDRO c1cc(Nc2ccc3c(c2)CCCN3)ccc1CC1CC[NH2+]CC1 ZINC001160015455 1047970254 /nfs/dbraw/zinc/97/02/54/1047970254.db2.gz VOHYFYACXBCBRV-UHFFFAOYSA-N 1 0 321.468 4.330 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](C3CCOCC3)C2)c1 ZINC001183958178 1047986741 /nfs/dbraw/zinc/98/67/41/1047986741.db2.gz IHTKJTZBLDNIOM-SFHVURJKSA-N 1 0 317.473 4.154 20 10 DICDRO CCC(CC)(CC)C[NH2+]C[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC001184218548 1048009521 /nfs/dbraw/zinc/00/95/21/1048009521.db2.gz NDMBWLGGHIZUBB-IBGZPJMESA-N 1 0 319.537 4.161 20 10 DICDRO CC(C)[C@@H](C[NH2+]Cc1ccc2c(c1)CCCO2)Nc1ccccc1 ZINC001199117775 1048039953 /nfs/dbraw/zinc/03/99/53/1048039953.db2.gz FZSMERHHJVNGLM-HXUWFJFHSA-N 1 0 324.468 4.238 20 10 DICDRO CCc1onc(C)c1C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000927133338 1048052361 /nfs/dbraw/zinc/05/23/61/1048052361.db2.gz CABWXIWSZKOOTA-CQSZACIVSA-N 1 0 308.809 4.145 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC1(c2ccc(F)cc2)CC1 ZINC001199365527 1048060689 /nfs/dbraw/zinc/06/06/89/1048060689.db2.gz KOSHFDPFFFNMKA-UHFFFAOYSA-N 1 0 322.427 4.447 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(F)c(F)c2F)cc1 ZINC001199403428 1048065703 /nfs/dbraw/zinc/06/57/03/1048065703.db2.gz ULLARZIAAYKCGT-UHFFFAOYSA-N 1 0 322.374 4.240 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]Cc2cccc(C(C)C)c2)c1O ZINC000775995589 1048079519 /nfs/dbraw/zinc/07/95/19/1048079519.db2.gz NSMREKHAVDFJQK-UHFFFAOYSA-N 1 0 319.832 4.467 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)cc1C ZINC000776012192 1048086825 /nfs/dbraw/zinc/08/68/25/1048086825.db2.gz FHUNQRSBQUMMNJ-OCCSQVGLSA-N 1 0 301.352 4.172 20 10 DICDRO Cc1cc(Cl)ccc1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001199823052 1048108877 /nfs/dbraw/zinc/10/88/77/1048108877.db2.gz MGBRPBJUZIKCHG-UHFFFAOYSA-N 1 0 314.860 4.321 20 10 DICDRO Cc1cccc(C(C)(C)C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC001199875627 1048114168 /nfs/dbraw/zinc/11/41/68/1048114168.db2.gz VOTBPVWSRSKGTI-UHFFFAOYSA-N 1 0 303.833 4.421 20 10 DICDRO Cn1cnc2cc(NCc3cc(Cl)cc(Cl)c3)ccc21 ZINC001201114858 1048195025 /nfs/dbraw/zinc/19/50/25/1048195025.db2.gz NZZZMMGAURANDM-UHFFFAOYSA-N 1 0 306.196 4.492 20 10 DICDRO Cc1[nH+]c2cc(NCc3c(O)cc(C)cc3Cl)ccc2n1C ZINC001201133631 1048197481 /nfs/dbraw/zinc/19/74/81/1048197481.db2.gz QHMPTPRCPDAMHL-UHFFFAOYSA-N 1 0 315.804 4.161 20 10 DICDRO Cc1nc(-c2ccc(C[NH2+]Cc3cccc(C)c3O)cc2)cs1 ZINC000776151908 1048230781 /nfs/dbraw/zinc/23/07/81/1048230781.db2.gz YGHSTIZEQCVASP-UHFFFAOYSA-N 1 0 324.449 4.422 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2coc3ccccc23)c1O ZINC000776174509 1048267736 /nfs/dbraw/zinc/26/77/36/1048267736.db2.gz CJCWCLYBCGGLFI-UHFFFAOYSA-N 1 0 301.773 4.390 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2CCCS2)cc1 ZINC001201441966 1048274353 /nfs/dbraw/zinc/27/43/53/1048274353.db2.gz FPPRZBACLCKSHH-SFHVURJKSA-N 1 0 306.519 4.298 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2(C)Cc3ccccc3C2)cc1 ZINC001201511884 1048291192 /nfs/dbraw/zinc/29/11/92/1048291192.db2.gz AGZGEJYWIGSQPF-UHFFFAOYSA-N 1 0 308.469 4.180 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCO[C@@H](CC(C)C)C1 ZINC001201663410 1048344309 /nfs/dbraw/zinc/34/43/09/1048344309.db2.gz DEPZESUZBKNISZ-SJORKVTESA-N 1 0 314.473 4.170 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCO[C@@H](CC(C)C)C1 ZINC001201663409 1048344985 /nfs/dbraw/zinc/34/49/85/1048344985.db2.gz DEPZESUZBKNISZ-IRXDYDNUSA-N 1 0 314.473 4.170 20 10 DICDRO CCC[NH+]1CCN(c2ccc(-c3nc4ccccc4o3)cc2)CC1 ZINC001201652922 1048345898 /nfs/dbraw/zinc/34/58/98/1048345898.db2.gz YJRDTXJASSOESY-UHFFFAOYSA-N 1 0 321.424 4.027 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2CCC[C@@H]2OC)cc1 ZINC001201715060 1048353415 /nfs/dbraw/zinc/35/34/15/1048353415.db2.gz UUOVTUALZOKRDL-ICSRJNTNSA-N 1 0 318.505 4.218 20 10 DICDRO Nc1ccc(CNc2[nH+]c(N3CCCC3)cc3ccccc32)cc1 ZINC001162787769 1048359093 /nfs/dbraw/zinc/35/90/93/1048359093.db2.gz PSQFCIUPOPWVGV-UHFFFAOYSA-N 1 0 318.424 4.029 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H](Cc2cccnc2)C2CCCC2)cc1 ZINC001175600745 1048367790 /nfs/dbraw/zinc/36/77/90/1048367790.db2.gz BCDXFLMBKOVRJN-NRFANRHFSA-N 1 0 323.484 4.039 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCc3ccccc3C2)cc1 ZINC001201733816 1048373261 /nfs/dbraw/zinc/37/32/61/1048373261.db2.gz BZLSNNCJATUCAG-ZMBJWTFHSA-N 1 0 320.480 4.161 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC001201842554 1048388216 /nfs/dbraw/zinc/38/82/16/1048388216.db2.gz MPXVWTCCVMBZIA-IZZQQSIFSA-N 1 0 318.505 4.359 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001203658458 1048391201 /nfs/dbraw/zinc/39/12/01/1048391201.db2.gz WCGMUJDXPBDNKU-KRWDZBQOSA-N 1 0 317.816 4.089 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)c1O ZINC000776223893 1048392174 /nfs/dbraw/zinc/39/21/74/1048392174.db2.gz NEFKOYGJJJGGHC-ZDUSSCGKSA-N 1 0 324.207 4.231 20 10 DICDRO COc1ccc(C[NH2+][C@@H](Cc2cccnc2)C2CCCC2)cc1C ZINC001175610070 1048393652 /nfs/dbraw/zinc/39/36/52/1048393652.db2.gz DLDWTIVHZUUHCE-FQEVSTJZSA-N 1 0 324.468 4.290 20 10 DICDRO CCCN(Cc1cc(C)c2ncccc2c1)c1ccc(C[NH3+])cc1 ZINC000775140208 1048430485 /nfs/dbraw/zinc/43/04/85/1048430485.db2.gz KUGXMRHAJBNPBB-UHFFFAOYSA-N 1 0 319.452 4.419 20 10 DICDRO CCCN(Cc1ccc(OC(F)F)cc1)c1ccc(C[NH3+])cc1 ZINC000775140687 1048431227 /nfs/dbraw/zinc/43/12/27/1048431227.db2.gz QCZAHBLRTSKROO-UHFFFAOYSA-N 1 0 320.383 4.163 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2ccc(F)cc2F)c1O ZINC000776232696 1048432085 /nfs/dbraw/zinc/43/20/85/1048432085.db2.gz VLNHYUPUSGIUIF-JTQLQIEISA-N 1 0 311.759 4.483 20 10 DICDRO CCCN(Cc1ccccc1OC(F)F)c1ccc(C[NH3+])cc1 ZINC000775140009 1048432927 /nfs/dbraw/zinc/43/29/27/1048432927.db2.gz HNNOWYBWAAACNL-UHFFFAOYSA-N 1 0 320.383 4.163 20 10 DICDRO CSc1ccc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001202059281 1048433807 /nfs/dbraw/zinc/43/38/07/1048433807.db2.gz VIQXSWIZIUXLFY-SNAWJCMRSA-N 1 0 312.482 4.278 20 10 DICDRO CC(C)[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)Cc1ccccc1 ZINC001202058510 1048434183 /nfs/dbraw/zinc/43/41/83/1048434183.db2.gz PAOUKLSOHOPGTP-FQEVSTJZSA-N 1 0 309.453 4.226 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCc3cc(F)ccc3[C@@H]2C)cc1 ZINC001175882724 1048470569 /nfs/dbraw/zinc/47/05/69/1048470569.db2.gz KLMCQDYMEOVTPU-HNNXBMFYSA-N 1 0 312.432 4.401 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CC(c3ccccc3)C2)c(Cl)c1 ZINC001202150807 1048474685 /nfs/dbraw/zinc/47/46/85/1048474685.db2.gz MUJZBNBUIXIYTI-UHFFFAOYSA-N 1 0 301.817 4.390 20 10 DICDRO COC1(C)CC[NH+](Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001137853995 1048566097 /nfs/dbraw/zinc/56/60/97/1048566097.db2.gz DJBPJQFHFYZWLL-UHFFFAOYSA-N 1 0 312.457 4.095 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(Br)cc1)c1ccccc1O ZINC000042352328 1048578913 /nfs/dbraw/zinc/57/89/13/1048578913.db2.gz MJRHFKZPHHUBLP-OAHLLOKOSA-N 1 0 320.230 4.396 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)[C@H]1CCCOC1 ZINC000780747335 1048589815 /nfs/dbraw/zinc/58/98/15/1048589815.db2.gz XDVIBUVQIUBXGH-SCTDSRPQSA-N 1 0 316.489 4.143 20 10 DICDRO COc1ccccc1[C@@H]([NH2+]Cc1ccccc1O)c1ccccc1 ZINC000108421433 1048600589 /nfs/dbraw/zinc/60/05/89/1048600589.db2.gz BQXLYWUGLGVTHZ-NRFANRHFSA-N 1 0 319.404 4.280 20 10 DICDRO COc1cc(C[NH2+]Cc2ccccc2F)c(O)c(C(C)(C)C)c1 ZINC000850008073 1048609943 /nfs/dbraw/zinc/60/99/43/1048609943.db2.gz RKNQICMIGXGESN-UHFFFAOYSA-N 1 0 317.404 4.127 20 10 DICDRO COc1cc(C[NH2+]Cc2sccc2C)c(O)c(C(C)(C)C)c1 ZINC000850077068 1048616210 /nfs/dbraw/zinc/61/62/10/1048616210.db2.gz ISXUQRSYMIYMPY-UHFFFAOYSA-N 1 0 319.470 4.358 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)CC(F)(F)F)c(O)c(C(C)(C)C)c1 ZINC000850249424 1048626683 /nfs/dbraw/zinc/62/66/83/1048626683.db2.gz YKGUQHHSOZFGPK-JTQLQIEISA-N 1 0 319.367 4.129 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1Br)c1ccccc1O ZINC000042419179 1048627138 /nfs/dbraw/zinc/62/71/38/1048627138.db2.gz HYQOBGDMNWRNEW-NSHDSACASA-N 1 0 306.203 4.006 20 10 DICDRO CSCC1(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000850355646 1048635920 /nfs/dbraw/zinc/63/59/20/1048635920.db2.gz JBYOACQBPBTFRW-UHFFFAOYSA-N 1 0 318.530 4.300 20 10 DICDRO CCOCc1cc(C[NH2+]Cc2cc(C)cc(C)c2)ccc1OC ZINC000850366475 1048640677 /nfs/dbraw/zinc/64/06/77/1048640677.db2.gz CWWAJLBZXNKXNT-UHFFFAOYSA-N 1 0 313.441 4.138 20 10 DICDRO C[C@@]1(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1(F)F ZINC000850380279 1048644642 /nfs/dbraw/zinc/64/46/42/1048644642.db2.gz DCEKITDOQVOUFG-QGZVFWFLSA-N 1 0 308.416 4.202 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](C)C2CCC(F)CC2)ccc1OC ZINC000850395114 1048646491 /nfs/dbraw/zinc/64/64/91/1048646491.db2.gz AJHVMHSMLRNSBM-MXWWQKGMSA-N 1 0 323.452 4.238 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cc2cnccc2o1 ZINC000850430649 1048654634 /nfs/dbraw/zinc/65/46/34/1048654634.db2.gz NNWKNYSHZSNMSO-AWEZNQCLSA-N 1 0 321.424 4.061 20 10 DICDRO CC1CCN(c2ccc(C[NH2+]C3CC(CF)(CF)C3)cc2)CC1 ZINC000850432808 1048656490 /nfs/dbraw/zinc/65/64/90/1048656490.db2.gz FOQJRMCVUKCBBO-UHFFFAOYSA-N 1 0 322.443 4.100 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2c1cc(F)cc2F ZINC000121371547 1048658943 /nfs/dbraw/zinc/65/89/43/1048658943.db2.gz PCHJTOUTGVDSSA-IBGZPJMESA-N 1 0 316.395 4.116 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ccc2ccccc2c1O ZINC000850481068 1048668786 /nfs/dbraw/zinc/66/87/86/1048668786.db2.gz HEHBPUGJNUEYOD-GDBMZVCRSA-N 1 0 312.457 4.069 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1ccc2ccccc2c1O ZINC000850491886 1048671049 /nfs/dbraw/zinc/67/10/49/1048671049.db2.gz BBCZSSGOKFTYBF-GOEBONIOSA-N 1 0 312.457 4.069 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1cc2c(cc1O)CCCC2 ZINC000850482968 1048671595 /nfs/dbraw/zinc/67/15/95/1048671595.db2.gz SZBFWHZRKFKMJA-LSDHHAIUSA-N 1 0 310.441 4.120 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccnc3ccccc23)c(O)c1C ZINC000850507604 1048672319 /nfs/dbraw/zinc/67/23/19/1048672319.db2.gz OXCJBPYFQPYCHE-MRXNPFEDSA-N 1 0 320.436 4.451 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)COc2c(F)cccc2F)c1 ZINC000850522997 1048676280 /nfs/dbraw/zinc/67/62/80/1048676280.db2.gz VEPCNCWKIBGRJN-OLZOCXBDSA-N 1 0 321.367 4.097 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)c1 ZINC000850520663 1048676923 /nfs/dbraw/zinc/67/69/23/1048676923.db2.gz FLVXWTVNLMHOIV-CYBMUJFWSA-N 1 0 315.388 4.232 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)cc1 ZINC000850543630 1048687511 /nfs/dbraw/zinc/68/75/11/1048687511.db2.gz NJSDKLCSZQPXHB-XOBRGWDASA-N 1 0 310.441 4.186 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccc2)[C@H](O)C(C)C)c1 ZINC000850554791 1048688546 /nfs/dbraw/zinc/68/85/46/1048688546.db2.gz KZUYHNOFXGUAOL-CWFSZBLJSA-N 1 0 313.441 4.109 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc(N(C)C)cc1 ZINC000850544447 1048688664 /nfs/dbraw/zinc/68/86/64/1048688664.db2.gz XDPGEQAPIALTAB-WOJBJXKFSA-N 1 0 310.441 4.186 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H](O)C(C)C)c(O)c1 ZINC000850557177 1048691424 /nfs/dbraw/zinc/69/14/24/1048691424.db2.gz UUVWAOSYFPVAAI-YSSFQJQWSA-N 1 0 313.441 4.109 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2nsc3ccccc23)c1 ZINC000850559623 1048691439 /nfs/dbraw/zinc/69/14/39/1048691439.db2.gz FSAGKEHUMNTSLD-ZDUSSCGKSA-N 1 0 312.438 4.204 20 10 DICDRO COc1cccc(C2([NH2+][C@H](C)c3cc(C)ccc3O)CCC2)c1 ZINC000850565978 1048695011 /nfs/dbraw/zinc/69/50/11/1048695011.db2.gz IUXYDKTZDCMQGH-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO COc1cccc(C2([NH2+][C@H](C)c3ccc(C)cc3O)CCC2)c1 ZINC000850567251 1048696039 /nfs/dbraw/zinc/69/60/39/1048696039.db2.gz YVOLECRCUYLRGV-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCC2SCCS2)c1O ZINC000850568878 1048696186 /nfs/dbraw/zinc/69/61/86/1048696186.db2.gz MGPRTXDSNOWVIF-JTQLQIEISA-N 1 0 317.907 4.201 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCc3c(C)cccc32)c1O ZINC000850573782 1048699547 /nfs/dbraw/zinc/69/95/47/1048699547.db2.gz RATZUYIIMXFNBX-KDOFPFPSSA-N 1 0 311.425 4.437 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3c(C)cccc32)c1 ZINC000850573438 1048699615 /nfs/dbraw/zinc/69/96/15/1048699615.db2.gz LXPJWXNLXBRUFK-IFXJQAMLSA-N 1 0 311.425 4.437 20 10 DICDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1F)c1ccc(N(C)C)cc1 ZINC000775360155 1048702792 /nfs/dbraw/zinc/70/27/92/1048702792.db2.gz AFXLQMBWPZBCJO-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000776497757 1048718457 /nfs/dbraw/zinc/71/84/57/1048718457.db2.gz FBWAQQBOGUIWCB-LIRRHRJNSA-N 1 0 317.404 4.014 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)cc1 ZINC001190383994 1048724380 /nfs/dbraw/zinc/72/43/80/1048724380.db2.gz VNMPTDAHEUTTKJ-UHFFFAOYSA-N 1 0 316.395 4.195 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)[C@@H](OC)c2ccccc2F)cc1C ZINC000776498925 1048726958 /nfs/dbraw/zinc/72/69/58/1048726958.db2.gz QZTMBUMOASYTEE-AUUYWEPGSA-N 1 0 317.404 4.009 20 10 DICDRO Cc1cc(C)c(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c(C)n1 ZINC001190445298 1048732059 /nfs/dbraw/zinc/73/20/59/1048732059.db2.gz GEOYIOVPZJHVHH-UHFFFAOYSA-N 1 0 323.484 4.237 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccccc1O ZINC000775415460 1048792962 /nfs/dbraw/zinc/79/29/62/1048792962.db2.gz SBYQOSYOJBQVLD-MRXNPFEDSA-N 1 0 314.429 4.205 20 10 DICDRO CC[C@@H]([NH2+]CCCOc1ccc(F)cc1)c1ccccc1O ZINC000775416319 1048793936 /nfs/dbraw/zinc/79/39/36/1048793936.db2.gz UPLKDFBQZHMCJP-QGZVFWFLSA-N 1 0 303.377 4.041 20 10 DICDRO CC(C)[N@H+](Cc1cc(C2CC2)no1)Cc1ccc(N(C)C)cc1 ZINC000851732889 1048795232 /nfs/dbraw/zinc/79/52/32/1048795232.db2.gz ZMAMSXSKIJKPJH-UHFFFAOYSA-N 1 0 313.445 4.029 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)cc1 ZINC001191075404 1048840953 /nfs/dbraw/zinc/84/09/53/1048840953.db2.gz AIAICYXQPCQDRX-OAQYLSRUSA-N 1 0 323.484 4.156 20 10 DICDRO CO[C@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)C1CCCCC1 ZINC001203254606 1048852238 /nfs/dbraw/zinc/85/22/38/1048852238.db2.gz HXJGOXDAVKLRFH-QGZVFWFLSA-N 1 0 311.853 4.039 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cccc(COC)c2)cc1C ZINC001177289316 1048857872 /nfs/dbraw/zinc/85/78/72/1048857872.db2.gz CYXUCKKUGFVXCQ-UHFFFAOYSA-N 1 0 313.441 4.220 20 10 DICDRO Cc1ccoc1C[NH2+]CCc1cc(C)n(-c2ccccc2)c1C ZINC001203301174 1048864227 /nfs/dbraw/zinc/86/42/27/1048864227.db2.gz VDAKHYDYUPDFKN-UHFFFAOYSA-N 1 0 308.425 4.328 20 10 DICDRO CCC(C)(C)CC[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC001203352333 1048877389 /nfs/dbraw/zinc/87/73/89/1048877389.db2.gz UMCWSXQHFKSZMB-UHFFFAOYSA-N 1 0 304.478 4.080 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cnccc2C(F)(F)F)c(O)c1 ZINC000853240882 1048890761 /nfs/dbraw/zinc/89/07/61/1048890761.db2.gz NGQFVTJVJHLFFE-LBPRGKRZSA-N 1 0 324.346 4.274 20 10 DICDRO CCc1nc(C[N@H+](Cc2ccccc2O)C2CCCC2)cs1 ZINC000111245093 1048901080 /nfs/dbraw/zinc/90/10/80/1048901080.db2.gz KEOSWLDLPYCJLP-UHFFFAOYSA-N 1 0 316.470 4.356 20 10 DICDRO C[N@@H+](Cc1cc2oc3ccccc3c2cc1O)CC1=CCCOC1 ZINC000853561543 1048910870 /nfs/dbraw/zinc/91/08/70/1048910870.db2.gz HYVCJYVOSAHDNI-UHFFFAOYSA-N 1 0 323.392 4.070 20 10 DICDRO CC(C)c1cccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC001177548704 1048914426 /nfs/dbraw/zinc/91/44/26/1048914426.db2.gz ORKUENGCWCAJLH-UHFFFAOYSA-N 1 0 300.421 4.305 20 10 DICDRO CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177641942 1048922150 /nfs/dbraw/zinc/92/21/50/1048922150.db2.gz PLABDBHATFFCRW-CXAGYDPISA-N 1 0 310.432 4.479 20 10 DICDRO Cc1ccc2c(c1)C1(CC2)CC[NH+](Cc2ccccc2O)CC1 ZINC001203552345 1048926059 /nfs/dbraw/zinc/92/60/59/1048926059.db2.gz KRLPIJNSUJYZFC-UHFFFAOYSA-N 1 0 307.437 4.181 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2cccc(Cl)c2)CC1 ZINC001203550481 1048926677 /nfs/dbraw/zinc/92/66/77/1048926677.db2.gz VWOBESPTZUIZCE-UHFFFAOYSA-N 1 0 301.817 4.425 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1O ZINC001203599613 1048939376 /nfs/dbraw/zinc/93/93/76/1048939376.db2.gz JTWURTBPEFBYDL-OAHLLOKOSA-N 1 0 319.351 4.016 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2)c1O ZINC001203602218 1048939871 /nfs/dbraw/zinc/93/98/71/1048939871.db2.gz JLBFDHLYJVUQFD-GOSISDBHSA-N 1 0 311.425 4.436 20 10 DICDRO CCOc1cccc(C[N@H+](CC)Cc2cccc(F)c2F)c1O ZINC001203615346 1048942119 /nfs/dbraw/zinc/94/21/19/1048942119.db2.gz RZMTXBOVOHYYGG-UHFFFAOYSA-N 1 0 321.367 4.091 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)c(O)c1 ZINC001203628615 1048943850 /nfs/dbraw/zinc/94/38/50/1048943850.db2.gz DWMUYVLBUVCWQQ-KRWDZBQOSA-N 1 0 311.425 4.171 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2cccc3ccccc32)c(O)c1 ZINC001203629399 1048945150 /nfs/dbraw/zinc/94/51/50/1048945150.db2.gz ILQMWDCUUGVYSJ-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc3ccccc3c2)c(O)c1 ZINC001203634374 1048945324 /nfs/dbraw/zinc/94/53/24/1048945324.db2.gz BXNGALZSNFYDLF-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(SC)o2)cc1F ZINC001177795698 1048945624 /nfs/dbraw/zinc/94/56/24/1048945624.db2.gz VZKCSXVNWBOOPZ-UHFFFAOYSA-N 1 0 322.449 4.277 20 10 DICDRO CCCOc1ccc(C[NH2+]CCc2sc(C)nc2C)cc1C ZINC001177790513 1048945987 /nfs/dbraw/zinc/94/59/87/1048945987.db2.gz GBXYRGQQRYOORG-UHFFFAOYSA-N 1 0 318.486 4.189 20 10 DICDRO Cc1cc(Cl)ccc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC001177803709 1048947760 /nfs/dbraw/zinc/94/77/60/1048947760.db2.gz DQBXDLPFNRXGOE-UHFFFAOYSA-N 1 0 302.849 4.313 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000854225793 1048954632 /nfs/dbraw/zinc/95/46/32/1048954632.db2.gz KUUFOGNEQVUHEC-WOJBJXKFSA-N 1 0 309.457 4.063 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)c1 ZINC001203680364 1048958824 /nfs/dbraw/zinc/95/88/24/1048958824.db2.gz RBTGMZVQPQLHJY-QGZVFWFLSA-N 1 0 311.425 4.171 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)c1 ZINC001203679041 1048958976 /nfs/dbraw/zinc/95/89/76/1048958976.db2.gz YMZAPQHMFMPGKJ-ZDUSSCGKSA-N 1 0 323.845 4.453 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)c1 ZINC001203680363 1048959211 /nfs/dbraw/zinc/95/92/11/1048959211.db2.gz RBTGMZVQPQLHJY-KRWDZBQOSA-N 1 0 311.425 4.171 20 10 DICDRO C[C@@H](CCc1ccccc1)C[NH2+]CCCSc1nccs1 ZINC001177906059 1048960223 /nfs/dbraw/zinc/96/02/23/1048960223.db2.gz YUSUTULPJCAUBE-HNNXBMFYSA-N 1 0 320.527 4.484 20 10 DICDRO CCS[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177971927 1048966471 /nfs/dbraw/zinc/96/64/71/1048966471.db2.gz AODLUZQAFCDPRG-WMZOPIPTSA-N 1 0 305.487 4.166 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(C)cc2OC)cc1C ZINC001178010130 1048974445 /nfs/dbraw/zinc/97/44/45/1048974445.db2.gz QLXLAAPVOFNFNN-UHFFFAOYSA-N 1 0 313.441 4.391 20 10 DICDRO CSc1cc(C)ccc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001178165795 1048992371 /nfs/dbraw/zinc/99/23/71/1048992371.db2.gz JOBCXRMNSJQKNJ-UHFFFAOYSA-N 1 0 313.466 4.332 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(OC)c1)c1cc(Cl)ccc1O ZINC000775484607 1049002138 /nfs/dbraw/zinc/00/21/38/1049002138.db2.gz GKXWGAJMXJCLPE-MRXNPFEDSA-N 1 0 305.805 4.295 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(Cl)ccc1O ZINC000775484514 1049002689 /nfs/dbraw/zinc/00/26/89/1049002689.db2.gz DCLOBYCNKUVWSU-KRWDZBQOSA-N 1 0 318.848 4.353 20 10 DICDRO CC[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1)c1ccccc1O ZINC000775487110 1049003825 /nfs/dbraw/zinc/00/38/25/1049003825.db2.gz ICWFLPWZODDGFE-LNLFQRSKSA-N 1 0 318.505 4.191 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2C2CCOCC2)cc1C(C)C ZINC000776770221 1049004202 /nfs/dbraw/zinc/00/42/02/1049004202.db2.gz PPGFROKAJNYBDQ-LJQANCHMSA-N 1 0 317.473 4.215 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(COC)c1)c1cc(Cl)ccc1O ZINC000775486509 1049006255 /nfs/dbraw/zinc/00/62/55/1049006255.db2.gz CKCVQNVKLKWNPO-QGZVFWFLSA-N 1 0 319.832 4.433 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccccc1O ZINC000775489619 1049015781 /nfs/dbraw/zinc/01/57/81/1049015781.db2.gz VVVMOFPFFBIUET-GUYCJALGSA-N 1 0 324.424 4.079 20 10 DICDRO C[C@H](c1cccc2ccccc21)[N@H+](C)Cc1ccc(O)c(O)c1 ZINC001203878772 1049020415 /nfs/dbraw/zinc/02/04/15/1049020415.db2.gz BMYOYFIGYZKBMA-CQSZACIVSA-N 1 0 307.393 4.444 20 10 DICDRO CC[C@H]([NH2+]CCc1csc(C)n1)c1cc(Cl)ccc1O ZINC000775492807 1049020916 /nfs/dbraw/zinc/02/09/16/1049020916.db2.gz SLFXXCIDIZFBKH-AWEZNQCLSA-N 1 0 310.850 4.094 20 10 DICDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000775492643 1049021639 /nfs/dbraw/zinc/02/16/39/1049021639.db2.gz QFIQMZJVRGYRFM-AWEZNQCLSA-N 1 0 314.395 4.498 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CCc1ccc(OC)cc1)c1ccccc1O ZINC000775497071 1049030457 /nfs/dbraw/zinc/03/04/57/1049030457.db2.gz MEFRCBBQAKUXLW-KXBFYZLASA-N 1 0 313.441 4.463 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775497850 1049032199 /nfs/dbraw/zinc/03/21/99/1049032199.db2.gz WSMQIGJHHRNTNM-GWCFXTLKSA-N 1 0 319.276 4.080 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC[C@@H]1C[C@H]1Cc1ccccc1 ZINC001203936208 1049034315 /nfs/dbraw/zinc/03/43/15/1049034315.db2.gz WLSPERMLCBZLQB-HZPDHXFCSA-N 1 0 315.844 4.404 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)c1cc(Cl)ccc1O ZINC000775498769 1049038039 /nfs/dbraw/zinc/03/80/39/1049038039.db2.gz NSTDNOYXLAITST-YVEFUNNKSA-N 1 0 319.832 4.423 20 10 DICDRO FC(F)(F)[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC000776814170 1049038479 /nfs/dbraw/zinc/03/84/79/1049038479.db2.gz AFTWLEGXQSWDNA-MRXNPFEDSA-N 1 0 321.342 4.057 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cc(Cl)ccc1O ZINC000775501573 1049040799 /nfs/dbraw/zinc/04/07/99/1049040799.db2.gz IAOLOMQRLUADNZ-JKSUJKDBSA-N 1 0 317.816 4.479 20 10 DICDRO CCc1cnc(C[NH2+][C@H](CC)c2cc(Cl)ccc2O)s1 ZINC000775508001 1049046859 /nfs/dbraw/zinc/04/68/59/1049046859.db2.gz GRCVHWKZKHAJTH-CYBMUJFWSA-N 1 0 310.850 4.305 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2CCCC(C)(C)C2)ccc1OC ZINC001178505077 1049047550 /nfs/dbraw/zinc/04/75/50/1049047550.db2.gz MGRMHHQDTIZNLT-KRWDZBQOSA-N 1 0 305.462 4.290 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)CCCC(F)(F)F ZINC000775506527 1049048025 /nfs/dbraw/zinc/04/80/25/1049048025.db2.gz AJMPYEOSNIZDAL-CYBMUJFWSA-N 1 0 302.384 4.272 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21)c1cc(Cl)ccc1O ZINC000775513534 1049050344 /nfs/dbraw/zinc/05/03/44/1049050344.db2.gz LACQCIHVUZCOFU-DUFGSWQCSA-N 1 0 309.837 4.044 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c2c(n1)CCCC2 ZINC001178524941 1049050840 /nfs/dbraw/zinc/05/08/40/1049050840.db2.gz QXQDZLVHIKJQJE-INIZCTEOSA-N 1 0 323.484 4.186 20 10 DICDRO Fc1cccc(CC2([NH2+]Cc3ccc4c(c3)CCO4)CCC2)c1 ZINC001178532282 1049051187 /nfs/dbraw/zinc/05/11/87/1049051187.db2.gz OGBUVTPUKHAVMW-UHFFFAOYSA-N 1 0 311.400 4.016 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)c1ccncc1)c1cc(Cl)ccc1O ZINC000775511817 1049054470 /nfs/dbraw/zinc/05/44/70/1049054470.db2.gz JYYNVBUCLISZMF-BLLLJJGKSA-N 1 0 304.821 4.285 20 10 DICDRO CCN(C)c1ccc(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)cc1 ZINC000773755353 1049055025 /nfs/dbraw/zinc/05/50/25/1049055025.db2.gz HTTXMPGOMBUIMD-AWEZNQCLSA-N 1 0 317.502 4.409 20 10 DICDRO CC[C@H]([NH2+]CC(CC)(CC)CCO)c1cc(Cl)ccc1O ZINC000775511171 1049055723 /nfs/dbraw/zinc/05/57/23/1049055723.db2.gz CFOWTVVJSNSULJ-HNNXBMFYSA-N 1 0 313.869 4.275 20 10 DICDRO CCO[C@@H](CC[NH2+][C@H](CC)c1ccccc1O)C1CCCC1 ZINC000775513710 1049056205 /nfs/dbraw/zinc/05/62/05/1049056205.db2.gz SODVUOAKDDXUHS-MJGOQNOKSA-N 1 0 305.462 4.418 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](OC)c1ccccc1Cl)c1ccccc1O ZINC000775522545 1049080993 /nfs/dbraw/zinc/08/09/93/1049080993.db2.gz SZDHPZHKAAUJTG-FUHWJXTLSA-N 1 0 319.832 4.474 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@]2(C)CC2(Cl)Cl)c(Cl)c1 ZINC001178747295 1049081380 /nfs/dbraw/zinc/08/13/80/1049081380.db2.gz KYIIIBDVKHYMKT-GFCCVEGCSA-N 1 0 308.636 4.028 20 10 DICDRO CC[C@@H]([NH2+]CCCc1nccs1)c1cc(Cl)ccc1O ZINC000775522867 1049081372 /nfs/dbraw/zinc/08/13/72/1049081372.db2.gz COFJIVZKFZNMGM-CYBMUJFWSA-N 1 0 310.850 4.176 20 10 DICDRO CC[C@@H]([NH2+]C1CCC(O)(CC)CC1)c1cc(Cl)ccc1O ZINC000775520545 1049083314 /nfs/dbraw/zinc/08/33/14/1049083314.db2.gz SNESZCSCRATERZ-GNHJJJEISA-N 1 0 311.853 4.170 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](O)c1cccc(C)c1)c1cc(Cl)ccc1O ZINC000775522768 1049083408 /nfs/dbraw/zinc/08/34/08/1049083408.db2.gz ZWJSHNZVISMISO-AEFFLSMTSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)[C@H](O)C(C)C)c1cc(Cl)ccc1O ZINC000775524967 1049090209 /nfs/dbraw/zinc/09/02/09/1049090209.db2.gz XEPFMVKUQOPFFZ-GDBMZVCRSA-N 1 0 313.869 4.129 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)c1cc(Br)ccc1O ZINC000775527411 1049098720 /nfs/dbraw/zinc/09/87/20/1049098720.db2.gz XJWPZDMCFLOCRO-GXFFZTMASA-N 1 0 323.234 4.285 20 10 DICDRO Cc1ccc2cc(C[N@@H+](C)Cc3ccc(N(C)C)cc3)[nH]c2c1 ZINC001204146019 1049098892 /nfs/dbraw/zinc/09/88/92/1049098892.db2.gz QYMQQWOALLXPHH-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO Cc1cc(NC/C=C\c2ccc(N(C)C)cc2)ccc1C[NH+](C)C ZINC001178927437 1049106673 /nfs/dbraw/zinc/10/66/73/1049106673.db2.gz ZWNWBMTULPYHKH-SREVYHEPSA-N 1 0 323.484 4.248 20 10 DICDRO CC[C@H]([NH2+]C[C@H](OC)c1cccc(Cl)c1)c1ccccc1O ZINC000775528560 1049107465 /nfs/dbraw/zinc/10/74/65/1049107465.db2.gz ZIKDLQCJFCHZMK-WMZOPIPTSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H](OC)c1ccccc1F)c1ccccc1O ZINC000775531644 1049113186 /nfs/dbraw/zinc/11/31/86/1049113186.db2.gz KCYVOHXFNVJFMM-XVGQJIODSA-N 1 0 317.404 4.348 20 10 DICDRO Cc1cc(C)cc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)c1 ZINC001178972357 1049115609 /nfs/dbraw/zinc/11/56/09/1049115609.db2.gz RXVBMTHOGSHWDN-GOSISDBHSA-N 1 0 310.485 4.399 20 10 DICDRO CC[C@@H]([NH2+]C1(C2CC2)CC1)c1cc(Br)ccc1O ZINC000775534767 1049118681 /nfs/dbraw/zinc/11/86/81/1049118681.db2.gz IECKEQLLFSSSHS-CYBMUJFWSA-N 1 0 310.235 4.138 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](F)CC2)c2ccccc21 ZINC001204234366 1049116652 /nfs/dbraw/zinc/11/66/52/1049116652.db2.gz ZJQHYQKICZXGKR-MRXNPFEDSA-N 1 0 300.421 4.230 20 10 DICDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204232441 1049116690 /nfs/dbraw/zinc/11/66/90/1049116690.db2.gz DDMXGDAFNATTPP-HOCLYGCPSA-N 1 0 300.421 4.086 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C2CC(F)(F)C2)c2ccccc21 ZINC001204232777 1049116955 /nfs/dbraw/zinc/11/69/55/1049116955.db2.gz JLRDFUYTMZEMMV-UHFFFAOYSA-N 1 0 304.384 4.135 20 10 DICDRO Cc1ncccc1C[N@@H+](C)Cc1ccc(N(C)C)c2ccccc12 ZINC001204240191 1049118507 /nfs/dbraw/zinc/11/85/07/1049118507.db2.gz KXXUATXVCNAFTA-UHFFFAOYSA-N 1 0 319.452 4.241 20 10 DICDRO Oc1ccc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)c(O)c1 ZINC001204272915 1049126038 /nfs/dbraw/zinc/12/60/38/1049126038.db2.gz UZLODULBONXVJK-UHFFFAOYSA-N 1 0 315.800 4.041 20 10 DICDRO CC[C@@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1ccc(C)cc1O ZINC000857082878 1049127708 /nfs/dbraw/zinc/12/77/08/1049127708.db2.gz RHZZQXHQRNMHJP-WCQYABFASA-N 1 0 302.245 4.325 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)c(O)c1 ZINC000857082902 1049127733 /nfs/dbraw/zinc/12/77/33/1049127733.db2.gz RSLVTIJIJTXKMX-NEPJUHHUSA-N 1 0 302.245 4.244 20 10 DICDRO c1cncc([C@H]2CCC[N@H+]2Cc2ccc(N3CCCC3)cc2)c1 ZINC001204319965 1049139724 /nfs/dbraw/zinc/13/97/24/1049139724.db2.gz JJSLQZRRUTVRQR-HXUWFJFHSA-N 1 0 307.441 4.019 20 10 DICDRO c1ccc(C[C@H]2CC[N@H+](Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001204326943 1049141804 /nfs/dbraw/zinc/14/18/04/1049141804.db2.gz JKHHACVEMRVELR-OAQYLSRUSA-N 1 0 320.480 4.351 20 10 DICDRO c1ccc(C[C@@H]2CC[N@H+](Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001204326942 1049142112 /nfs/dbraw/zinc/14/21/12/1049142112.db2.gz JKHHACVEMRVELR-NRFANRHFSA-N 1 0 320.480 4.351 20 10 DICDRO Clc1cccc2c1CN(Cc1ccc(N3CCCC3)cc1)C2 ZINC001204328914 1049142740 /nfs/dbraw/zinc/14/27/40/1049142740.db2.gz TTWFHEBBOOEQRM-UHFFFAOYSA-N 1 0 312.844 4.456 20 10 DICDRO Fc1cccc([C@H]2CC[N@H+](Cc3ccc(N4CCCC4)cc3)C2)c1 ZINC001204322201 1049142957 /nfs/dbraw/zinc/14/29/57/1049142957.db2.gz PITBVYQYXYCXMS-IBGZPJMESA-N 1 0 324.443 4.415 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccccc1O ZINC001204328262 1049142991 /nfs/dbraw/zinc/14/29/91/1049142991.db2.gz FFSZSWKGROFPBR-UHFFFAOYSA-N 1 0 310.441 4.015 20 10 DICDRO CC[C@@H]([NH2+]CCCNc1cccc(F)c1)c1ccccc1O ZINC000775550993 1049143318 /nfs/dbraw/zinc/14/33/18/1049143318.db2.gz FCIUXIJGCAGTLS-QGZVFWFLSA-N 1 0 302.393 4.074 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(F)c(F)c1F)c1ccccc1O ZINC000775550777 1049143539 /nfs/dbraw/zinc/14/35/39/1049143539.db2.gz BGXCIRDBLXSWKG-AWEZNQCLSA-N 1 0 309.331 4.093 20 10 DICDRO Cc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001179238527 1049145390 /nfs/dbraw/zinc/14/53/90/1049145390.db2.gz QHNKVNKNHVXVSP-LJQANCHMSA-N 1 0 312.432 4.367 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)cc1 ZINC000773810721 1049153122 /nfs/dbraw/zinc/15/31/22/1049153122.db2.gz KSWHSAPFFPEIOV-UHFFFAOYSA-N 1 0 318.411 4.446 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000775555941 1049153829 /nfs/dbraw/zinc/15/38/29/1049153829.db2.gz SZENBVMYAZYDOH-KMFMINBZSA-N 1 0 309.837 4.044 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)cc1 ZINC001179348149 1049154775 /nfs/dbraw/zinc/15/47/75/1049154775.db2.gz POVHKSBEOPFTPO-CLWJZODNSA-N 1 0 318.505 4.215 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000775555948 1049155093 /nfs/dbraw/zinc/15/50/93/1049155093.db2.gz SZENBVMYAZYDOH-UKPHBRMFSA-N 1 0 309.837 4.044 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CN(Cc2ccccc2)C(C)(C)C1)c1ccccc1O ZINC001179489112 1049170775 /nfs/dbraw/zinc/17/07/75/1049170775.db2.gz FOMVPTVQGWYBLK-AEFFLSMTSA-N 1 0 324.468 4.096 20 10 DICDRO C[C@@H]([NH2+][C@H]1CN(Cc2ccccc2)C(C)(C)C1)c1ccccc1O ZINC001179489113 1049170792 /nfs/dbraw/zinc/17/07/92/1049170792.db2.gz FOMVPTVQGWYBLK-SJLPKXTDSA-N 1 0 324.468 4.096 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c1 ZINC001204543702 1049187553 /nfs/dbraw/zinc/18/75/53/1049187553.db2.gz UUBABVKMYDZHCJ-SJLPKXTDSA-N 1 0 305.487 4.376 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCO[C@H](CC(C)C)C2)cc1 ZINC000776953533 1049189860 /nfs/dbraw/zinc/18/98/60/1049189860.db2.gz NYNAUCXFQLUDQS-AZUAARDMSA-N 1 0 318.505 4.216 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(F)ccc1OC ZINC001179631238 1049191021 /nfs/dbraw/zinc/19/10/21/1049191021.db2.gz KXBFASWZTCFZEU-QGZVFWFLSA-N 1 0 315.388 4.010 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@H]2Cc2ccccc2)cc1 ZINC001204580106 1049192039 /nfs/dbraw/zinc/19/20/39/1049192039.db2.gz LBAVSBDWWXQKGT-AVKJRPAMSA-N 1 0 306.453 4.083 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCO[C@@H]2CC(C)C)c(O)c1C ZINC000775585826 1049191856 /nfs/dbraw/zinc/19/18/56/1049191856.db2.gz KGSHERRAFCFXGZ-RYQLBKOJSA-N 1 0 305.462 4.253 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1O)c1ccc(N2CCCCCC2)cc1 ZINC000775587168 1049197263 /nfs/dbraw/zinc/19/72/63/1049197263.db2.gz TYDKFVLYLRAFEP-NSISKUIASA-N 1 0 316.489 4.021 20 10 DICDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2ccc(C)cc2O)C12CCCCC2 ZINC001204616373 1049200966 /nfs/dbraw/zinc/20/09/66/1049200966.db2.gz VJTKKKCXZZPTJB-RBUKOAKNSA-N 1 0 317.473 4.260 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](c2ccc(OC)cc2)C2CC2)cc1 ZINC000773831275 1049211254 /nfs/dbraw/zinc/21/12/54/1049211254.db2.gz INEUBCPSAZOGEY-OAQYLSRUSA-N 1 0 324.468 4.392 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2ccccc2C)c(O)c1 ZINC001204658906 1049213464 /nfs/dbraw/zinc/21/34/64/1049213464.db2.gz ZCDCYFLGIZJAFW-LJQANCHMSA-N 1 0 311.425 4.355 20 10 DICDRO CC(C)[C@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001204658823 1049214851 /nfs/dbraw/zinc/21/48/51/1049214851.db2.gz YGZUHRXTLAMFDR-MRXNPFEDSA-N 1 0 314.395 4.392 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C/C=C/c2ccc(F)c(F)c2)cc1 ZINC001179845587 1049215806 /nfs/dbraw/zinc/21/58/06/1049215806.db2.gz VHZAUUVHMKTYDO-SNAWJCMRSA-N 1 0 316.395 4.176 20 10 DICDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001179850173 1049216021 /nfs/dbraw/zinc/21/60/21/1049216021.db2.gz SJBZFVPFYDAQBK-CXAGYDPISA-N 1 0 310.432 4.431 20 10 DICDRO C[C@H]1C[C@@H]1c1ccc(CNCc2cc(F)c(N(C)C)cc2F)o1 ZINC000858100620 1049217078 /nfs/dbraw/zinc/21/70/78/1049217078.db2.gz LJWVLNRMDPPPAQ-FZMZJTMJSA-N 1 0 320.383 4.037 20 10 DICDRO CCc1cccc(C[N@@H+]2CCc3c(Cl)cccc3C2)c1O ZINC001179864928 1049223689 /nfs/dbraw/zinc/22/36/89/1049223689.db2.gz YRYSRSUDSKMZOA-UHFFFAOYSA-N 1 0 301.817 4.166 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(CSC(F)F)o2)c1 ZINC000858237018 1049229846 /nfs/dbraw/zinc/22/98/46/1049229846.db2.gz CVJXVODUPHHHAP-UHFFFAOYSA-N 1 0 313.369 4.039 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H](c2ccccn2)C2CCC2)cc1 ZINC000858239655 1049229938 /nfs/dbraw/zinc/22/99/38/1049229938.db2.gz UVBRTESNPTYUKZ-NGXITPROSA-N 1 0 321.468 4.292 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)c1O ZINC000858320448 1049241270 /nfs/dbraw/zinc/24/12/70/1049241270.db2.gz CXAKWTJUMZEMPE-INIZCTEOSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1cc(Br)c([O-])c(C[N@@H+]([C@@H](C)C2CC2)C2CC2)c1 ZINC001204744756 1049248644 /nfs/dbraw/zinc/24/86/44/1049248644.db2.gz XJSMKSMZDSUDPH-NSHDSACASA-N 1 0 324.262 4.226 20 10 DICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(O)cc(C)cc1Cl ZINC001180042805 1049260351 /nfs/dbraw/zinc/26/03/51/1049260351.db2.gz JUEVATAGQLDNET-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO C[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000858445095 1049260463 /nfs/dbraw/zinc/26/04/63/1049260463.db2.gz AEROBPQBFPJCMP-MSOLQXFVSA-N 1 0 316.489 4.144 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)nc1 ZINC000858488137 1049263905 /nfs/dbraw/zinc/26/39/05/1049263905.db2.gz OHBSOPZOPXPGEB-INIZCTEOSA-N 1 0 312.457 4.341 20 10 DICDRO C[C@@H]([NH2+]CC1(C(F)(F)F)CCCC1)c1cc(F)ccc1O ZINC000858568678 1049275486 /nfs/dbraw/zinc/27/54/86/1049275486.db2.gz OXKCTNBSXRALPF-SNVBAGLBSA-N 1 0 305.315 4.305 20 10 DICDRO CO[C@H]1C[C@@H](C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000858590565 1049282271 /nfs/dbraw/zinc/28/22/71/1049282271.db2.gz ABGBGUGPLBHIOJ-ABSDTBQOSA-N 1 0 316.489 4.143 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1CC(F)(F)F)CC2 ZINC000858591331 1049283298 /nfs/dbraw/zinc/28/32/98/1049283298.db2.gz QVHAVXNFHAFREH-HNNXBMFYSA-N 1 0 321.342 4.274 20 10 DICDRO COc1ccc(C2([NH2+]Cc3cc(C)ccc3O)CCCC2)cc1 ZINC000116348065 1049293053 /nfs/dbraw/zinc/29/30/53/1049293053.db2.gz KLODSIBQVLUZLA-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO COc1cc(C[N@H+]([C@@H](C)C2CC2)C2CC2)c(O)c(C(C)(C)C)c1 ZINC001180178660 1049295750 /nfs/dbraw/zinc/29/57/50/1049295750.db2.gz YQKAQMPGOUMASP-ZDUSSCGKSA-N 1 0 317.473 4.461 20 10 DICDRO COc1ccccc1CC[N@H+](C)Cc1c(O)cc(C)cc1Cl ZINC001180188905 1049297825 /nfs/dbraw/zinc/29/78/25/1049297825.db2.gz LTRJQHGIOHUXPW-UHFFFAOYSA-N 1 0 319.832 4.037 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cccc2c1NCCC2 ZINC001180189775 1049312268 /nfs/dbraw/zinc/31/22/68/1049312268.db2.gz WUILIVRFLICIBD-UHFFFAOYSA-N 1 0 310.441 4.163 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC001180275221 1049314995 /nfs/dbraw/zinc/31/49/95/1049314995.db2.gz JYDSPOLWCIKWNM-CWFSZBLJSA-N 1 0 300.490 4.462 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](CC)Cc1cccs1 ZINC001205657057 1049347506 /nfs/dbraw/zinc/34/75/06/1049347506.db2.gz XMNFGTJHIDNWSH-MRXNPFEDSA-N 1 0 302.487 4.445 20 10 DICDRO C[C@H]1CCC[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC001180372302 1049355696 /nfs/dbraw/zinc/35/56/96/1049355696.db2.gz PBXUKXVFDXIWLP-SFHVURJKSA-N 1 0 320.480 4.481 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccns2)ccc1N1CCCCC1 ZINC000860061749 1049366616 /nfs/dbraw/zinc/36/66/16/1049366616.db2.gz NGWQVOOPWDOIHR-HNNXBMFYSA-N 1 0 315.486 4.293 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H]2c2cccc(OC)c2)c1O ZINC001180513681 1049369694 /nfs/dbraw/zinc/36/96/94/1049369694.db2.gz JYQIXKOYZDSLSJ-LJQANCHMSA-N 1 0 311.425 4.300 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001180540261 1049379163 /nfs/dbraw/zinc/37/91/63/1049379163.db2.gz KAGLAGJWOSCUHF-JTGQJZMRSA-N 1 0 324.468 4.467 20 10 DICDRO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc(C)cc(OC)c1O ZINC001180613108 1049383787 /nfs/dbraw/zinc/38/37/87/1049383787.db2.gz NLTXBYDSTJBDFT-GOSISDBHSA-N 1 0 311.425 4.046 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)ccc1F ZINC001205187241 1049405305 /nfs/dbraw/zinc/40/53/05/1049405305.db2.gz VDHSZHZAMWEOSI-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO CC[C@@H]([NH2+]C1(c2cccc(OC)c2)CC1)c1ccc(N(C)C)cc1 ZINC000777155980 1049423655 /nfs/dbraw/zinc/42/36/55/1049423655.db2.gz QSZSLEBLNOYOOA-HXUWFJFHSA-N 1 0 324.468 4.491 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cccc2[nH]ccc21 ZINC001205282085 1049426726 /nfs/dbraw/zinc/42/67/26/1049426726.db2.gz LERHBYJPPXAESN-UHFFFAOYSA-N 1 0 319.452 4.400 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cc2ccccc2[nH]1 ZINC000775622700 1049457118 /nfs/dbraw/zinc/45/71/18/1049457118.db2.gz ZLMZDGLLXPQZDW-CYBMUJFWSA-N 1 0 311.404 4.224 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cc1Cl ZINC001181350743 1049466806 /nfs/dbraw/zinc/46/68/06/1049466806.db2.gz UOCXMOMJNYXVPM-KOLCDFICSA-N 1 0 307.743 4.127 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)c(Cl)c1 ZINC001181350523 1049466946 /nfs/dbraw/zinc/46/69/46/1049466946.db2.gz SKXQOQGVZNWPSZ-MWLCHTKSSA-N 1 0 307.743 4.127 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC2(C)CCC(C)CC2)c1O ZINC001181418916 1049471452 /nfs/dbraw/zinc/47/14/52/1049471452.db2.gz REJXTGWQGMINQX-UHFFFAOYSA-N 1 0 311.853 4.360 20 10 DICDRO CC(C)c1ccc(O)c(CNc2ccccc2CC[NH+](C)C)c1 ZINC001205454056 1049474428 /nfs/dbraw/zinc/47/44/28/1049474428.db2.gz WNWHMKNCEVDKFN-UHFFFAOYSA-N 1 0 312.457 4.232 20 10 DICDRO CCCN(Cc1c(O)ccc(Cl)c1F)c1ccc(C[NH3+])cc1 ZINC001181445496 1049477837 /nfs/dbraw/zinc/47/78/37/1049477837.db2.gz PLLKPEMXZWLPCY-UHFFFAOYSA-N 1 0 322.811 4.060 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]2c2cccn2C)c1O ZINC000775644145 1049489361 /nfs/dbraw/zinc/48/93/61/1049489361.db2.gz DAWZKDLYICCPBY-INIZCTEOSA-N 1 0 304.821 4.030 20 10 DICDRO CCCC[N@H+](Cc1cc(COC)cs1)Cc1ccccc1O ZINC001205514333 1049489328 /nfs/dbraw/zinc/48/93/28/1049489328.db2.gz NLRDWELOOJYJEH-UHFFFAOYSA-N 1 0 319.470 4.402 20 10 DICDRO C[C@@H]([NH2+]Cc1ccsc1C(F)(F)F)c1ccccc1O ZINC000862401854 1049492357 /nfs/dbraw/zinc/49/23/57/1049492357.db2.gz VBVFVIMVEFTVNQ-SECBINFHSA-N 1 0 301.333 4.323 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](c2ccccn2)C2CCC2)cc1Cl ZINC000862477455 1049495910 /nfs/dbraw/zinc/49/59/10/1049495910.db2.gz KPGAOKDYFKBSQJ-GOSISDBHSA-N 1 0 316.832 4.380 20 10 DICDRO CCCN(CC[NH+]1CCCCC1)Cc1c(O)cc(C)cc1Cl ZINC001181689191 1049498450 /nfs/dbraw/zinc/49/84/50/1049498450.db2.gz WJJSAQNHRDEWOF-UHFFFAOYSA-N 1 0 324.896 4.052 20 10 DICDRO COc1ccc(O)c(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)c1 ZINC000775648356 1049508079 /nfs/dbraw/zinc/50/80/79/1049508079.db2.gz FFNWUSUXFKSJEV-UHFFFAOYSA-N 1 0 317.816 4.219 20 10 DICDRO Cc1cc(C[N@H+]2C[C@H](C)[C@@H](C)[C@@H]2C)ccc1N1CCCCC1 ZINC001195288727 1049510603 /nfs/dbraw/zinc/51/06/03/1049510603.db2.gz GSVHEMRGKCFJJB-KSZLIROESA-N 1 0 300.490 4.462 20 10 DICDRO Cc1cccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1O ZINC000775650907 1049518151 /nfs/dbraw/zinc/51/81/51/1049518151.db2.gz HJBPBEDAFUOQGN-UHFFFAOYSA-N 1 0 312.457 4.177 20 10 DICDRO CCCN(Cc1c(Cl)ccnc1Cl)c1ccc(C[NH3+])cc1 ZINC001205656849 1049523976 /nfs/dbraw/zinc/52/39/76/1049523976.db2.gz UZGJWDYQOSBRII-UHFFFAOYSA-N 1 0 324.255 4.264 20 10 DICDRO CCc1cccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001205708888 1049541807 /nfs/dbraw/zinc/54/18/07/1049541807.db2.gz LVRVQHPAPLKWIT-UHFFFAOYSA-N 1 0 308.469 4.481 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[N@@H+]2CC[C@H]2C2CC2)cc1 ZINC001181912451 1049547273 /nfs/dbraw/zinc/54/72/73/1049547273.db2.gz CRBTYHYENAEXJT-IBGZPJMESA-N 1 0 312.482 4.369 20 10 DICDRO CCCC[N@H+](Cc1oc(CCC)nc1C)Cc1ccccc1O ZINC000794542936 1049582241 /nfs/dbraw/zinc/58/22/41/1049582241.db2.gz CLPJLLXJVDLRQV-UHFFFAOYSA-N 1 0 316.445 4.443 20 10 DICDRO COc1ccc(O)c(C[NH+]2CCC(c3ccccc3C)CC2)c1 ZINC000775680732 1049602683 /nfs/dbraw/zinc/60/26/83/1049602683.db2.gz IAGIAJDPSDMCQP-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc3ccccc3[nH]2)cc1 ZINC000119731861 1049604347 /nfs/dbraw/zinc/60/43/47/1049604347.db2.gz QSPNOVLUDXZBBN-UHFFFAOYSA-N 1 0 307.441 4.304 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@H]2CSc3ccccc32)c1 ZINC001205950780 1049609611 /nfs/dbraw/zinc/60/96/11/1049609611.db2.gz FFHZBHDADSTCRV-INIZCTEOSA-N 1 0 313.466 4.495 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000775696411 1049629432 /nfs/dbraw/zinc/62/94/32/1049629432.db2.gz KMYGGBJBMNVJMD-QGZVFWFLSA-N 1 0 319.351 4.016 20 10 DICDRO Cc1cccc(C[N@H+]2CCC[C@H]2c2cccc(N(C)C)c2)c1O ZINC000775705741 1049636466 /nfs/dbraw/zinc/63/64/66/1049636466.db2.gz KTDPFKAVNVPEKQ-IBGZPJMESA-N 1 0 310.441 4.104 20 10 DICDRO Cc1cccc(C[N@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)c1O ZINC000775705742 1049636618 /nfs/dbraw/zinc/63/66/18/1049636618.db2.gz KTDPFKAVNVPEKQ-LJQANCHMSA-N 1 0 310.441 4.104 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCCN1C1CC1)c1ccc2ccccc2c1O ZINC000774380800 1049654121 /nfs/dbraw/zinc/65/41/21/1049654121.db2.gz UJISLVFGITVKBW-MAUKXSAKSA-N 1 0 324.468 4.213 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](c2cccnc2)C(C)C)cc1 ZINC000774391578 1049656526 /nfs/dbraw/zinc/65/65/26/1049656526.db2.gz IRTNYEQRZGOWTI-HXUWFJFHSA-N 1 0 311.473 4.415 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@H](C(C)(C)C)C[C@@H]2C)c(O)c1OC ZINC001206116404 1049657868 /nfs/dbraw/zinc/65/78/68/1049657868.db2.gz OEHLKAGZVHPEAK-ZFWWWQNUSA-N 1 0 321.461 4.056 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cc1 ZINC000774441677 1049662730 /nfs/dbraw/zinc/66/27/30/1049662730.db2.gz KCQUGEHDSFIVMA-MRXNPFEDSA-N 1 0 323.484 4.267 20 10 DICDRO Cc1cc(C[NH+]2CCC(C)(F)CC2)ccc1N1CCCCC1 ZINC001196583528 1049675730 /nfs/dbraw/zinc/67/57/30/1049675730.db2.gz QGFUSMIYIPKAJB-UHFFFAOYSA-N 1 0 304.453 4.309 20 10 DICDRO CCO[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000774496343 1049677407 /nfs/dbraw/zinc/67/74/07/1049677407.db2.gz KHBCXYPRERLPLM-OXQOHEQNSA-N 1 0 312.457 4.181 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)c1O ZINC000775734131 1049677937 /nfs/dbraw/zinc/67/79/37/1049677937.db2.gz LAFNGRWRARURDP-OAHLLOKOSA-N 1 0 317.816 4.007 20 10 DICDRO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1O ZINC001206276369 1049696369 /nfs/dbraw/zinc/69/63/69/1049696369.db2.gz GQAHKGADBPWYEC-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)Oc1ccccc1F)c1ccc(C)cc1O ZINC000794799955 1049697204 /nfs/dbraw/zinc/69/72/04/1049697204.db2.gz APWPCVUIXNDNKD-WMLDXEAASA-N 1 0 317.404 4.348 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)c1c(C)nn(C)c1C ZINC000794802089 1049698394 /nfs/dbraw/zinc/69/83/94/1049698394.db2.gz MQQIFHJOJZLVND-DLBZAZTESA-N 1 0 315.461 4.243 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](c1ccccc1)N(C)C)c1ccc(C)cc1O ZINC000794794301 1049698862 /nfs/dbraw/zinc/69/88/62/1049698862.db2.gz LILGMNLCBVKKFH-OALUTQOASA-N 1 0 312.457 4.044 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1ccc(C)cc1O ZINC000794794321 1049699056 /nfs/dbraw/zinc/69/90/56/1049699056.db2.gz LSVGKZDTTUOMLK-CVEARBPZSA-N 1 0 318.486 4.106 20 10 DICDRO CCc1cccc(C[NH2+][C@@](C)(Cc2ccccc2)C2CC2)c1O ZINC001206314894 1049710583 /nfs/dbraw/zinc/71/05/83/1049710583.db2.gz UOYZCQMJWLPTQL-NRFANRHFSA-N 1 0 309.453 4.456 20 10 DICDRO CC[C@H](C)C[C@H](CC)[NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206646220 1049774984 /nfs/dbraw/zinc/77/49/84/1049774984.db2.gz PYIGGKISXGSYFT-YESZJQIVSA-N 1 0 304.478 4.078 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CC(Cc3ccsc3)C2)c1 ZINC001206779956 1049797860 /nfs/dbraw/zinc/79/78/60/1049797860.db2.gz LKDZLPISHQALKZ-UHFFFAOYSA-N 1 0 301.455 4.252 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH+]1CC(CC2CC2)C1 ZINC001206781235 1049800068 /nfs/dbraw/zinc/80/00/68/1049800068.db2.gz YVHFIFMPSPCXKE-UHFFFAOYSA-N 1 0 323.436 4.203 20 10 DICDRO Cc1cc(CC[NH2+][C@H](C)[C@H]2CC2(F)F)c(C)n1-c1ccccc1 ZINC001207017071 1049821113 /nfs/dbraw/zinc/82/11/13/1049821113.db2.gz IBUZZFLUJPHGSG-RDTXWAMCSA-N 1 0 318.411 4.270 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC(C)(C)[C@@H]2CCCCO2)cc1Cl ZINC001207036349 1049822492 /nfs/dbraw/zinc/82/24/92/1049822492.db2.gz XXQUKJAJFXBIQM-INIZCTEOSA-N 1 0 311.853 4.039 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC(C)(C)[C@H]2CCCCO2)cc1Cl ZINC001207036350 1049822613 /nfs/dbraw/zinc/82/26/13/1049822613.db2.gz XXQUKJAJFXBIQM-MRXNPFEDSA-N 1 0 311.853 4.039 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]Cc1cn(C(F)F)c2ccccc12 ZINC001207076628 1049832902 /nfs/dbraw/zinc/83/29/02/1049832902.db2.gz UNVPDFYQMVSZLM-UHFFFAOYSA-N 1 0 320.314 4.171 20 10 DICDRO CCC[C@@H](C[NH2+]Cc1cc(C)n(-c2cccc(C)c2)c1C)OC ZINC001207092802 1049835336 /nfs/dbraw/zinc/83/53/36/1049835336.db2.gz HZPIHUJYHLWGHO-FQEVSTJZSA-N 1 0 314.473 4.307 20 10 DICDRO C[N@@H+](Cc1ccccc1O)C[C@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001207194614 1049859692 /nfs/dbraw/zinc/85/96/92/1049859692.db2.gz YCOSPJPMFVJXDE-NVXWUHKLSA-N 1 0 301.817 4.281 20 10 DICDRO C[C@H]1C[N@H+](Cc2cc(Cl)c(F)cc2[O-])Cc2ccccc21 ZINC001207447255 1049894351 /nfs/dbraw/zinc/89/43/51/1049894351.db2.gz CAQQTEDHIWDMJE-NSHDSACASA-N 1 0 305.780 4.304 20 10 DICDRO CC(C)[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)c1cccnc1 ZINC000164140739 1049921392 /nfs/dbraw/zinc/92/13/92/1049921392.db2.gz QHZWCJAAJAERPX-UZLBHIALSA-N 1 0 311.473 4.238 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](CC)CC(F)(F)F)ccc1OC ZINC000760663350 1049922024 /nfs/dbraw/zinc/92/20/24/1049922024.db2.gz YPYOYTPLCBBGMR-AWEZNQCLSA-N 1 0 319.367 4.052 20 10 DICDRO CCCC[C@H](C)[C@H](C)[NH2+]C[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC001207748666 1049934238 /nfs/dbraw/zinc/93/42/38/1049934238.db2.gz NOGRNQYZDXXTMI-ZWOKBUDYSA-N 1 0 319.537 4.160 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC=CCCC2)c1O ZINC001207763076 1049936135 /nfs/dbraw/zinc/93/61/35/1049936135.db2.gz JUBSYWRHWXUHOD-CYBMUJFWSA-N 1 0 309.837 4.280 20 10 DICDRO COc1ccccc1[C@H]1CC[N@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000164395993 1049937468 /nfs/dbraw/zinc/93/74/68/1049937468.db2.gz CZVAJVNWQKPKBF-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO Cc1ccc([C@H](C)CC[N@H+](C)Cc2ccc(N(C)C)cc2)o1 ZINC001208165720 1049980032 /nfs/dbraw/zinc/98/00/32/1049980032.db2.gz GYLGJKKBPRQYBS-OAHLLOKOSA-N 1 0 300.446 4.280 20 10 DICDRO COc1cc(Cl)ccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000156813203 1049991268 /nfs/dbraw/zinc/99/12/68/1049991268.db2.gz MCORFJXGLDKPAQ-ZDUSSCGKSA-N 1 0 318.848 4.265 20 10 DICDRO Oc1cccc2c1C[N@H+](CCc1ccccc1C(F)(F)F)CC2 ZINC001209281872 1050049327 /nfs/dbraw/zinc/04/93/27/1050049327.db2.gz KBMXLDBDZBWPLT-UHFFFAOYSA-N 1 0 321.342 4.012 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@]3(CCOC3)C2)cc1 ZINC001209516969 1050065288 /nfs/dbraw/zinc/06/52/88/1050065288.db2.gz VAEZIEFBMKKNSK-NRFANRHFSA-N 1 0 324.468 4.097 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[N@H+](C)CCc2ccccn2)cc1 ZINC001209517238 1050065810 /nfs/dbraw/zinc/06/58/10/1050065810.db2.gz BJQDKXWIXYHLAD-UHFFFAOYSA-N 1 0 319.452 4.164 20 10 DICDRO Cc1ccc(C)n1-c1ccc(CN(C)Cc2cscn2)cc1 ZINC001209520459 1050066534 /nfs/dbraw/zinc/06/65/34/1050066534.db2.gz XQKDHWWBJPGXDK-UHFFFAOYSA-N 1 0 311.454 4.183 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cnc(Cl)cc1C ZINC001209634807 1050072879 /nfs/dbraw/zinc/07/28/79/1050072879.db2.gz XFWQRUAOTAUEAT-UHFFFAOYSA-N 1 0 317.864 4.132 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)Oc1ccccc1 ZINC000733797901 1050156327 /nfs/dbraw/zinc/15/63/27/1050156327.db2.gz DELMOAQPKTXTGM-GOSISDBHSA-N 1 0 324.468 4.234 20 10 DICDRO CCOC[C@@H]1CCC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000733789580 1050156760 /nfs/dbraw/zinc/15/67/60/1050156760.db2.gz WTLXHJBUMMYOJI-MRXNPFEDSA-N 1 0 319.489 4.247 20 10 DICDRO CC[C@@H](CCO)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000166803488 1050180825 /nfs/dbraw/zinc/18/08/25/1050180825.db2.gz KNAHYTPXCFHNGV-MSOLQXFVSA-N 1 0 318.505 4.126 20 10 DICDRO CC(C)[C@H](CCO)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766194204 1050186122 /nfs/dbraw/zinc/18/61/22/1050186122.db2.gz UANWQMBBRSWQLP-XLIONFOSSA-N 1 0 318.505 4.125 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](CC)c2ccccc2OC)c1O ZINC000378891435 1050191987 /nfs/dbraw/zinc/19/19/87/1050191987.db2.gz LLUCYWMUHWTBFM-INIZCTEOSA-N 1 0 315.413 4.040 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)[C@H]2CCCCO2)c(C)n1-c1ccccc1 ZINC000379148802 1050196891 /nfs/dbraw/zinc/19/68/91/1050196891.db2.gz BENAOEYZKIMRRK-OXQOHEQNSA-N 1 0 312.457 4.141 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]CCCCF)cc1 ZINC000824423645 1050208915 /nfs/dbraw/zinc/20/89/15/1050208915.db2.gz SJBXVBJZEHQBCI-UHFFFAOYSA-N 1 0 306.450 4.224 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2cc(C3CC3)ccc2F)c1O ZINC000824548969 1050224166 /nfs/dbraw/zinc/22/41/66/1050224166.db2.gz UTSWXGHHCHLQHD-UHFFFAOYSA-N 1 0 315.388 4.097 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)c2ccccc2O1 ZINC000824650123 1050229779 /nfs/dbraw/zinc/22/97/79/1050229779.db2.gz JEIGIDFPSOSABE-IAQYHMDHSA-N 1 0 303.789 4.048 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3ccccn3)CC2)cc1Cl ZINC000824621540 1050232866 /nfs/dbraw/zinc/23/28/66/1050232866.db2.gz RHSOJEMXEKIYPK-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCC[C@H]2CCCCO2)c2c1c(F)ccc2O ZINC000760907901 1050240461 /nfs/dbraw/zinc/24/04/61/1050240461.db2.gz UUBGECOQZFYKST-NFAWXSAZSA-N 1 0 307.409 4.019 20 10 DICDRO CC[C@H]([NH2+]Cc1cnccc1C)c1ccc(C(F)(F)F)cc1O ZINC000824908625 1050251947 /nfs/dbraw/zinc/25/19/47/1050251947.db2.gz AKGFJITUMCOPDB-HNNXBMFYSA-N 1 0 324.346 4.355 20 10 DICDRO CCn1ccnc1[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000825006053 1050263407 /nfs/dbraw/zinc/26/34/07/1050263407.db2.gz XJJFKCYLLAXDMS-OAHLLOKOSA-N 1 0 321.424 4.126 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)cc1C ZINC000825084309 1050272799 /nfs/dbraw/zinc/27/27/99/1050272799.db2.gz DNVGHTDCDNRGSR-NVXWUHKLSA-N 1 0 317.454 4.075 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1 ZINC000825086773 1050274104 /nfs/dbraw/zinc/27/41/04/1050274104.db2.gz VSUOQTJQPRWFFY-IAQYHMDHSA-N 1 0 323.845 4.117 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3cc(C)c(C)cc3O)C2)c1 ZINC000825090783 1050276197 /nfs/dbraw/zinc/27/61/97/1050276197.db2.gz HSXMCKJGSTYPFD-SAABIXHNSA-N 1 0 311.425 4.053 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCCN(C)c3ccccc32)cc1C ZINC000825110454 1050276706 /nfs/dbraw/zinc/27/67/06/1050276706.db2.gz FZLRPSYWQTUDIF-SFHVURJKSA-N 1 0 310.441 4.065 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1ccccc1O ZINC000825087152 1050276913 /nfs/dbraw/zinc/27/69/13/1050276913.db2.gz XXTDWZJOQWYQFH-UKPHBRMFSA-N 1 0 317.454 4.415 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)c1 ZINC000825122152 1050277389 /nfs/dbraw/zinc/27/73/89/1050277389.db2.gz XIBZYQOQQPDHEI-UHFFFAOYSA-N 1 0 305.805 4.043 20 10 DICDRO Cc1cc(F)ccc1-c1ccc(C[NH2+]Cc2ccccc2O)o1 ZINC000734511117 1050281966 /nfs/dbraw/zinc/28/19/66/1050281966.db2.gz YHTIATRPBMVPMR-UHFFFAOYSA-N 1 0 311.356 4.390 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1O ZINC000825215829 1050284125 /nfs/dbraw/zinc/28/41/25/1050284125.db2.gz YHKHKRXISHTLBW-INIZCTEOSA-N 1 0 319.351 4.016 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(c3cccc(F)c3)CC2)cc1Cl ZINC000825290926 1050289845 /nfs/dbraw/zinc/28/98/45/1050289845.db2.gz AWZQTGTZMQTNIP-UHFFFAOYSA-N 1 0 305.780 4.272 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825353923 1050297983 /nfs/dbraw/zinc/29/79/83/1050297983.db2.gz PURBCKABRGTTRT-MRXNPFEDSA-N 1 0 317.816 4.140 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+]Cc2cc(Cl)c(C)cc2O)s1 ZINC000825510068 1050312170 /nfs/dbraw/zinc/31/21/70/1050312170.db2.gz WBIUAHPQIFXGSR-SNVBAGLBSA-N 1 0 310.850 4.012 20 10 DICDRO Fc1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)C2 ZINC001168402015 1050328946 /nfs/dbraw/zinc/32/89/46/1050328946.db2.gz XUURSZKXMWVFFW-FQEVSTJZSA-N 1 0 324.443 4.073 20 10 DICDRO Cc1cnc(C[N@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC000772178453 1050329813 /nfs/dbraw/zinc/32/98/13/1050329813.db2.gz MCCNTAJAWSPAJX-UHFFFAOYSA-N 1 0 302.443 4.102 20 10 DICDRO Fc1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)C2 ZINC001168402020 1050329932 /nfs/dbraw/zinc/32/99/32/1050329932.db2.gz XUURSZKXMWVFFW-HXUWFJFHSA-N 1 0 324.443 4.073 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cc(Cl)ccc2C1)c1ccccc1O ZINC001171099504 1050350630 /nfs/dbraw/zinc/35/06/30/1050350630.db2.gz JGNGOIBKRDJKGA-WBMJQRKESA-N 1 0 301.817 4.254 20 10 DICDRO Cc1cccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc3C2)c1O ZINC001171110778 1050372754 /nfs/dbraw/zinc/37/27/54/1050372754.db2.gz OKSVFUWLEOGWGU-QGZVFWFLSA-N 1 0 301.817 4.001 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1O ZINC000844256925 1050391954 /nfs/dbraw/zinc/39/19/54/1050391954.db2.gz OGSHNDUMXXXNCI-KRWDZBQOSA-N 1 0 315.388 4.185 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]1Cc1ccccc1)CCC2 ZINC000844257174 1050392318 /nfs/dbraw/zinc/39/23/18/1050392318.db2.gz SOPKLBLUTAGLHE-HXUWFJFHSA-N 1 0 307.437 4.088 20 10 DICDRO CCOc1ccc(F)c(CN(CC)Cc2ccccc2O)c1F ZINC001143941821 1050410033 /nfs/dbraw/zinc/41/00/33/1050410033.db2.gz CZOAYHLNPPXHPZ-UHFFFAOYSA-N 1 0 321.367 4.091 20 10 DICDRO Cc1c(C[N@H+](C)Cc2ccccc2O)cccc1C(F)(F)F ZINC001143931125 1050414458 /nfs/dbraw/zinc/41/44/58/1050414458.db2.gz ZGTFTUXQVBSXLK-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CC(C)(C[NH2+]Cc1c(O)cccc1Cl)c1cccc(F)c1 ZINC000735676789 1050420239 /nfs/dbraw/zinc/42/02/39/1050420239.db2.gz GGQKRRJUUSXFQH-UHFFFAOYSA-N 1 0 307.796 4.252 20 10 DICDRO Cc1cc(C)c(/C=C\C[NH2+]Cc2ccc3c(c2)CCO3)cc1C ZINC001649010236 1050452312 /nfs/dbraw/zinc/45/23/12/1050452312.db2.gz RZFIACBNXKTTSL-PLNGDYQASA-N 1 0 307.437 4.350 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCCC[C@H]1C)c1ccc(N2CCOCC2)cc1 ZINC000766225938 1050504416 /nfs/dbraw/zinc/50/44/16/1050504416.db2.gz KDXRNADDKOOIDX-FUHIMQAGSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(F)c(F)c2)c(O)c1C ZINC000786939545 1050534579 /nfs/dbraw/zinc/53/45/79/1050534579.db2.gz HNTSQQKHQGLTNU-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCC1 ZINC000766237145 1050554765 /nfs/dbraw/zinc/55/47/65/1050554765.db2.gz JETPTTPKOZOVMU-HIFRSBDPSA-N 1 0 324.415 4.035 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C/C=C\c2ccc(Cl)cc2)c1 ZINC000787278318 1050580471 /nfs/dbraw/zinc/58/04/71/1050580471.db2.gz DGLXDUDIAFHYCT-DHCBQETCSA-N 1 0 317.816 4.418 20 10 DICDRO Cc1cccc(C[NH2+]C23CCC(C(F)(F)F)(CC2)CC3)c1O ZINC000787299050 1050583965 /nfs/dbraw/zinc/58/39/65/1050583965.db2.gz WDJGEQBJMDQNHE-UHFFFAOYSA-N 1 0 313.363 4.446 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cc1C ZINC000787417459 1050597968 /nfs/dbraw/zinc/59/79/68/1050597968.db2.gz NGULGGLRIRZFMS-CQSZACIVSA-N 1 0 301.352 4.172 20 10 DICDRO Clc1cccc(C2(C[NH2+]Cc3ccc4c(c3)CCO4)CC2)c1 ZINC000740014887 1050598044 /nfs/dbraw/zinc/59/80/44/1050598044.db2.gz YEORMLFQSQDGFT-UHFFFAOYSA-N 1 0 313.828 4.096 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)ccc1OC ZINC000740017904 1050598671 /nfs/dbraw/zinc/59/86/71/1050598671.db2.gz FSNOJKSENFQPND-HWWDLCQESA-N 1 0 305.462 4.146 20 10 DICDRO Cc1cc(C[NH2+]Cc2cnccc2C)c(C)n1-c1ccccc1 ZINC000323853138 1050637942 /nfs/dbraw/zinc/63/79/42/1050637942.db2.gz PVYVYJSGFXCJSU-UHFFFAOYSA-N 1 0 305.425 4.087 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)C2CCC(F)(F)CC2)c1 ZINC000845972172 1050639441 /nfs/dbraw/zinc/63/94/41/1050639441.db2.gz PGUQMCRZNNFBNF-VXGBXAGGSA-N 1 0 313.388 4.265 20 10 DICDRO CC[C@H](CCO)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000740899209 1050639765 /nfs/dbraw/zinc/63/97/65/1050639765.db2.gz XNWTUMDXNDTBLB-MRXNPFEDSA-N 1 0 321.505 4.238 20 10 DICDRO C[C@@H]([NH2+]CC1CCSCC1)c1ccc2ccccc2c1O ZINC000168774315 1050642982 /nfs/dbraw/zinc/64/29/82/1050642982.db2.gz LVHQQDMZODLQMR-CYBMUJFWSA-N 1 0 301.455 4.339 20 10 DICDRO FC1(F)CC12CC[NH+](Cc1ccc(N3CCCCC3)cc1)CC2 ZINC000846055129 1050661672 /nfs/dbraw/zinc/66/16/72/1050661672.db2.gz SUQPUHUMWLZHAF-UHFFFAOYSA-N 1 0 320.427 4.298 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCc3ccc(C)cc32)c1O ZINC000846055211 1050662584 /nfs/dbraw/zinc/66/25/84/1050662584.db2.gz JZVSNUJTBFXNHC-MRXNPFEDSA-N 1 0 317.816 4.140 20 10 DICDRO CC[C@@H]([NH2+]CCC[C@H]1CC1(Cl)Cl)c1ccccc1O ZINC000846109400 1050665174 /nfs/dbraw/zinc/66/51/74/1050665174.db2.gz ILCLLTWAKUGORZ-WCQYABFASA-N 1 0 302.245 4.407 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@@H](SC)C2)cc1 ZINC000227378471 1050666475 /nfs/dbraw/zinc/66/64/75/1050666475.db2.gz USCVCQVTWDQJEU-SJLPKXTDSA-N 1 0 306.519 4.297 20 10 DICDRO CCO[C@@H](CC[NH2+][C@H](C)c1cccc(OC)c1O)C1CCCC1 ZINC000846148877 1050672037 /nfs/dbraw/zinc/67/20/37/1050672037.db2.gz UGMCBNMIFQOZBN-PBHICJAKSA-N 1 0 321.461 4.037 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2c3ccccc3CC[C@H]2C)c1O ZINC000846155651 1050675009 /nfs/dbraw/zinc/67/50/09/1050675009.db2.gz BMMBNXIQCNXYGW-BIENJYKASA-N 1 0 311.425 4.375 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(c3ccc(Cl)cc3)CC2)c1O ZINC000846161469 1050677075 /nfs/dbraw/zinc/67/70/75/1050677075.db2.gz CWELZDLKJSOROQ-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)c1O ZINC000846172052 1050680175 /nfs/dbraw/zinc/68/01/75/1050680175.db2.gz WGTVWFKMDFMTHK-LBPRGKRZSA-N 1 0 321.367 4.363 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCc3ccc(C)cc32)c1O ZINC000846169643 1050680473 /nfs/dbraw/zinc/68/04/73/1050680473.db2.gz JBNIUJCOJBQMIF-RDTXWAMCSA-N 1 0 311.425 4.437 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(c3ccccc3Cl)CC2)c1O ZINC000846171378 1050680538 /nfs/dbraw/zinc/68/05/38/1050680538.db2.gz GARHQVSCAJWEFX-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC[C@]2(C)CC2(Cl)Cl)c1O ZINC000846169718 1050680785 /nfs/dbraw/zinc/68/07/85/1050680785.db2.gz SENLMBPLIDRAMI-IINYFYTJSA-N 1 0 318.244 4.025 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(OC)c2O)cc1 ZINC000846136735 1050682017 /nfs/dbraw/zinc/68/20/17/1050682017.db2.gz OBCJRMANTAPGPW-UONOGXRCSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)c1O ZINC000846137834 1050682063 /nfs/dbraw/zinc/68/20/63/1050682063.db2.gz REZIPUVBRAZTFZ-MNOVXSKESA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCSc3ccccc32)c1O ZINC000846139842 1050682168 /nfs/dbraw/zinc/68/21/68/1050682168.db2.gz ALIWEACHNYTVIC-IUODEOHRSA-N 1 0 315.438 4.289 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)c1O ZINC000846135439 1050682229 /nfs/dbraw/zinc/68/22/29/1050682229.db2.gz DLTZUEYACPMKOJ-RYUDHWBXSA-N 1 0 305.443 4.491 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccc(OC)cc1 ZINC000846138579 1050682438 /nfs/dbraw/zinc/68/24/38/1050682438.db2.gz WLGHXOIJWITGDF-CXAGYDPISA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCCSc2ccccc2)c1O ZINC000846135979 1050682562 /nfs/dbraw/zinc/68/25/62/1050682562.db2.gz FVSNIBCFPPXXLR-AWEZNQCLSA-N 1 0 317.454 4.234 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCSc2ccc(C)cc2)c1O ZINC000846135198 1050682579 /nfs/dbraw/zinc/68/25/79/1050682579.db2.gz CAVCXGKHVUNEJB-CQSZACIVSA-N 1 0 317.454 4.152 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCCn2ccc3ccccc32)c1O ZINC000846138696 1050682744 /nfs/dbraw/zinc/68/27/44/1050682744.db2.gz XQLKQLPOLJGCSC-HNNXBMFYSA-N 1 0 324.424 4.096 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CSCc3ccccc32)c1O ZINC000846141500 1050683693 /nfs/dbraw/zinc/68/36/93/1050683693.db2.gz KKVBWCMPQAEEIT-LRDDRELGSA-N 1 0 315.438 4.040 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2cc(F)ccc2SC)c1O ZINC000846144015 1050684680 /nfs/dbraw/zinc/68/46/80/1050684680.db2.gz FNXPGSVLHNLJNI-LLVKDONJSA-N 1 0 321.417 4.113 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1O ZINC000846145740 1050684696 /nfs/dbraw/zinc/68/46/96/1050684696.db2.gz QBHCMLAOTQFMAM-GHMZBOCLSA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccccc2OC(C)C)c1O ZINC000846143464 1050684799 /nfs/dbraw/zinc/68/47/99/1050684799.db2.gz IUPFEGPBADNZSA-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1O ZINC000846147087 1050686244 /nfs/dbraw/zinc/68/62/44/1050686244.db2.gz SMWPBCWOESSSSD-LLVKDONJSA-N 1 0 320.458 4.006 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccc1F)[C@@H](C)O)c1ccc(C)cc1O ZINC000846182407 1050689403 /nfs/dbraw/zinc/68/94/03/1050689403.db2.gz JOWFPCSUOYCTSM-FMEYXAORSA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000846189745 1050690313 /nfs/dbraw/zinc/69/03/13/1050690313.db2.gz RYZOKGLNFNHNNK-ZAAXVRCTSA-N 1 0 313.441 4.038 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCCn2cnc3ccccc32)c(O)c1 ZINC000788505115 1050694144 /nfs/dbraw/zinc/69/41/44/1050694144.db2.gz SQHHQNXPRGJHAM-INIZCTEOSA-N 1 0 323.440 4.100 20 10 DICDRO C[C@@H](O)CCC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000788523669 1050698949 /nfs/dbraw/zinc/69/89/49/1050698949.db2.gz GMQVWPYWZVDNEC-CQSZACIVSA-N 1 0 321.505 4.238 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)cc1C ZINC000788532722 1050706510 /nfs/dbraw/zinc/70/65/10/1050706510.db2.gz SZGWUOQDAZJMIH-IBGZPJMESA-N 1 0 324.468 4.010 20 10 DICDRO Cc1csc(CCCC[NH2+][C@H](C)c2c(C)cc(C)cc2O)n1 ZINC000788591130 1050711341 /nfs/dbraw/zinc/71/13/41/1050711341.db2.gz YBVDRPDDHGVXGU-OAHLLOKOSA-N 1 0 318.486 4.447 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](C)Oc2ccccc2F)c(O)c1 ZINC000788616135 1050716347 /nfs/dbraw/zinc/71/63/47/1050716347.db2.gz XJBYWOMKANTMID-GJZGRUSLSA-N 1 0 317.404 4.266 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCN(c3ccccc3)C2)c1 ZINC000788620979 1050719237 /nfs/dbraw/zinc/71/92/37/1050719237.db2.gz SSQVCOMHAILGTE-QZTJIDSGSA-N 1 0 324.468 4.268 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](c2cccnc2)C(C)C)c(O)c1 ZINC000788629371 1050721097 /nfs/dbraw/zinc/72/10/97/1050721097.db2.gz UHFKHRGENUXOCI-AEFFLSMTSA-N 1 0 312.457 4.494 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2c2cccs2)c1O ZINC000761183526 1050742308 /nfs/dbraw/zinc/74/23/08/1050742308.db2.gz NCGBOZHFGUIWSL-ZDUSSCGKSA-N 1 0 323.845 4.453 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1O ZINC000761184989 1050746231 /nfs/dbraw/zinc/74/62/31/1050746231.db2.gz RQNRXRWOQPVICG-OAHLLOKOSA-N 1 0 303.789 4.001 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)[C@@H](C)c2ccccc2)c1O ZINC000761184114 1050746853 /nfs/dbraw/zinc/74/68/53/1050746853.db2.gz QEDNEEDYKHXPCH-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCOc3c(C)cccc32)c(O)c1 ZINC000788774986 1050752854 /nfs/dbraw/zinc/75/28/54/1050752854.db2.gz HBGKBKOSVJIHDN-DOTOQJQBSA-N 1 0 311.425 4.492 20 10 DICDRO CCO[C@@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)c1ccccc1 ZINC000788778891 1050753448 /nfs/dbraw/zinc/75/34/48/1050753448.db2.gz ZRRZGEJWWFMIFN-LPHOPBHVSA-N 1 0 313.441 4.437 20 10 DICDRO CSC1(C[N@H+](Cc2ccco2)Cc2ccccc2O)CCC1 ZINC000788841775 1050759969 /nfs/dbraw/zinc/75/99/69/1050759969.db2.gz YOANFEHTGHUROM-UHFFFAOYSA-N 1 0 317.454 4.273 20 10 DICDRO CCOC1CC(CC[NH2+][C@H](CC)c2cc(Cl)ccc2O)C1 ZINC000788983184 1050769290 /nfs/dbraw/zinc/76/92/90/1050769290.db2.gz CBSLOKYGPDZMNG-LDZOIKDWSA-N 1 0 311.853 4.292 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c(C)c1 ZINC000788985357 1050772069 /nfs/dbraw/zinc/77/20/69/1050772069.db2.gz QUCJTFHEJMVCGL-AWEZNQCLSA-N 1 0 317.404 4.479 20 10 DICDRO CCOC[C@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C(C)C ZINC000788985192 1050772821 /nfs/dbraw/zinc/77/28/21/1050772821.db2.gz ONTDWRUXBFGECY-XLIONFOSSA-N 1 0 318.505 4.389 20 10 DICDRO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000788979405 1050778881 /nfs/dbraw/zinc/77/88/81/1050778881.db2.gz FDXQXHJPKCAQLH-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]Cc1ccc(N(C)C)cc1 ZINC000788978587 1050779076 /nfs/dbraw/zinc/77/90/76/1050779076.db2.gz UVPAFXUSCIJDOC-HXUWFJFHSA-N 1 0 324.468 4.273 20 10 DICDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000772956204 1050780639 /nfs/dbraw/zinc/78/06/39/1050780639.db2.gz AIGYXLNDLFTESH-BEFAXECRSA-N 1 0 310.441 4.154 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(Cl)c1F)c1ccc(N(C)C)cc1 ZINC000766281035 1050782245 /nfs/dbraw/zinc/78/22/45/1050782245.db2.gz WJUOITKAGFPYDK-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000742152572 1050806318 /nfs/dbraw/zinc/80/63/18/1050806318.db2.gz IWZZLDCJVAHPSR-QGZVFWFLSA-N 1 0 318.420 4.005 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc(OC(C)(C)C)cc2)cc1C ZINC000742367873 1050822986 /nfs/dbraw/zinc/82/29/86/1050822986.db2.gz MGHJUGIUGLWICJ-UHFFFAOYSA-N 1 0 313.441 4.476 20 10 DICDRO Cc1cccc(F)c1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000742381054 1050823995 /nfs/dbraw/zinc/82/39/95/1050823995.db2.gz NRKFSGYRQMTIIO-UHFFFAOYSA-N 1 0 312.432 4.414 20 10 DICDRO C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 ZINC000742384549 1050828092 /nfs/dbraw/zinc/82/80/92/1050828092.db2.gz HZHCYELDTWBTTM-KFWWJZLASA-N 1 0 324.415 4.035 20 10 DICDRO COc1ccc([C@@H](C)CC[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000742373413 1050835622 /nfs/dbraw/zinc/83/56/22/1050835622.db2.gz BZNKOWYALIBYHJ-ZDUSSCGKSA-N 1 0 319.832 4.338 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(CC)CC)c(F)c1)c1ccncc1 ZINC000742372457 1050835678 /nfs/dbraw/zinc/83/56/78/1050835678.db2.gz MXSSDWAYGGMHEN-SFHVURJKSA-N 1 0 315.436 4.308 20 10 DICDRO COc1cccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000772977356 1050842390 /nfs/dbraw/zinc/84/23/90/1050842390.db2.gz MRKMBVRFXXPIPG-HOTGVXAUSA-N 1 0 312.457 4.043 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000789514353 1050844245 /nfs/dbraw/zinc/84/42/45/1050844245.db2.gz PRSWTFYRMPNLRH-ZWKOTPCHSA-N 1 0 317.473 4.142 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2OCCc3ccccc32)cc1 ZINC000772980471 1050880198 /nfs/dbraw/zinc/88/01/98/1050880198.db2.gz PFMXKHRQRINUAL-HRAATJIYSA-N 1 0 324.468 4.107 20 10 DICDRO Cc1ccc(C(C)(C)[NH2+]Cc2cc(Cl)cc(C)c2O)cn1 ZINC000761227094 1050880593 /nfs/dbraw/zinc/88/05/93/1050880593.db2.gz XSQAGPKKDCGRFN-UHFFFAOYSA-N 1 0 304.821 4.082 20 10 DICDRO c1sc2ccccc2c1CC[NH2+]Cc1ccc2c(c1)CCO2 ZINC000742710377 1050918038 /nfs/dbraw/zinc/91/80/38/1050918038.db2.gz MESQXMIAPACJAK-UHFFFAOYSA-N 1 0 309.434 4.169 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCSC1)c1ccc(N2CCCCCC2)cc1 ZINC000790494905 1050964206 /nfs/dbraw/zinc/96/42/06/1050964206.db2.gz GIEPWBFVLQNACN-DLBZAZTESA-N 1 0 318.530 4.471 20 10 DICDRO Cc1c(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cccc1[N+](=O)[O-] ZINC000790697272 1050986328 /nfs/dbraw/zinc/98/63/28/1050986328.db2.gz XYOMJFULHYPWLP-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO CC(C)[C@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C(C)(C)O ZINC000790703013 1050986940 /nfs/dbraw/zinc/98/69/40/1050986940.db2.gz VXDIFTUWAHYREV-APWZRJJASA-N 1 0 318.505 4.123 20 10 DICDRO C[C@H]1C[N@H+](Cc2c(O)ccc3ccncc32)[C@@H]1c1ccccc1 ZINC000743392847 1051023120 /nfs/dbraw/zinc/02/31/20/1051023120.db2.gz VLVYFOLLRAILCH-XOBRGWDASA-N 1 0 304.393 4.133 20 10 DICDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2c(O)ccc3ccncc32)C1 ZINC000743398718 1051023674 /nfs/dbraw/zinc/02/36/74/1051023674.db2.gz JZVBZYPGPFZUIJ-GJZGRUSLSA-N 1 0 316.470 4.046 20 10 DICDRO CC[C@@H]([NH2+][C@H]1COc2ccc(C)cc21)c1ccc(N(C)C)cc1 ZINC000773058674 1051042028 /nfs/dbraw/zinc/04/20/28/1051042028.db2.gz IRXJZYOOHXRCTE-MOPGFXCFSA-N 1 0 310.441 4.235 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(C)cc32)cc1 ZINC000773060734 1051045521 /nfs/dbraw/zinc/04/55/21/1051045521.db2.gz RYZVWOSPKOCHER-BEFAXECRSA-N 1 0 310.441 4.235 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)COC3)cc1 ZINC000773079301 1051052997 /nfs/dbraw/zinc/05/29/97/1051052997.db2.gz IEMAIKIRUKWIDC-HNNXBMFYSA-N 1 0 310.441 4.024 20 10 DICDRO CS[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000773090883 1051061501 /nfs/dbraw/zinc/06/15/01/1051061501.db2.gz HBXAKIKEZGBMCC-UONOGXRCSA-N 1 0 310.482 4.218 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)c1cn[nH]c1 ZINC000773105525 1051062205 /nfs/dbraw/zinc/06/22/05/1051062205.db2.gz HQPLFOXYMFORKC-JKSUJKDBSA-N 1 0 312.461 4.202 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H]1COc2ccccc21)c1ccc(N(C)C)cc1 ZINC000773105807 1051063387 /nfs/dbraw/zinc/06/33/87/1051063387.db2.gz RHCMHXZKGPSQIB-YSGRDPCXSA-N 1 0 324.468 4.358 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000773119385 1051068829 /nfs/dbraw/zinc/06/88/29/1051068829.db2.gz OUGAOEBXKNSIDO-VQTJNVASSA-N 1 0 309.457 4.340 20 10 DICDRO OCCCCCCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000743847743 1051070642 /nfs/dbraw/zinc/07/06/42/1051070642.db2.gz IIFISZHMZYTZRE-UHFFFAOYSA-N 1 0 305.462 4.080 20 10 DICDRO CC[C@@H]([NH2+]CCSCC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000773148494 1051080867 /nfs/dbraw/zinc/08/08/67/1051080867.db2.gz XREUKYDJCIPHSR-CQSZACIVSA-N 1 0 320.424 4.089 20 10 DICDRO [NH3+]C1(c2ccc(NCc3cc4ccccc4cc3O)cc2)CC1 ZINC001171405467 1051091627 /nfs/dbraw/zinc/09/16/27/1051091627.db2.gz WBTMUPWKKDPUCB-UHFFFAOYSA-N 1 0 304.393 4.105 20 10 DICDRO Cc1cc2[nH+]ccn2cc1NCc1cc2ccccc2cc1O ZINC001171405237 1051091640 /nfs/dbraw/zinc/09/16/40/1051091640.db2.gz SJDRUCYZJQKALK-UHFFFAOYSA-N 1 0 303.365 4.114 20 10 DICDRO [NH3+][C@H]1CCc2c1cccc2NCc1cc2ccccc2cc1O ZINC001171407826 1051094841 /nfs/dbraw/zinc/09/48/41/1051094841.db2.gz XKAVIYBPCBLPGZ-SFHVURJKSA-N 1 0 304.393 4.104 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(OC)ccc1O)c1cccc(Cl)c1 ZINC000036921196 1051101829 /nfs/dbraw/zinc/10/18/29/1051101829.db2.gz GSIVSKCSRXZHAF-INIZCTEOSA-N 1 0 305.805 4.295 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccc(OC)cc1 ZINC000037067424 1051108859 /nfs/dbraw/zinc/10/88/59/1051108859.db2.gz QWKFKKRJYHIBCX-INIZCTEOSA-N 1 0 305.805 4.295 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCSc2ccccc21 ZINC000037128117 1051113296 /nfs/dbraw/zinc/11/32/96/1051113296.db2.gz ZNKAHZQSROOZDA-AWEZNQCLSA-N 1 0 305.830 4.372 20 10 DICDRO CC[C@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccccc1O ZINC000716284873 1051130299 /nfs/dbraw/zinc/13/02/99/1051130299.db2.gz LSDFUFZCURHJTR-TVPLGVNVSA-N 1 0 311.425 4.181 20 10 DICDRO CCC(C)(C)CC[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000744402676 1051172057 /nfs/dbraw/zinc/17/20/57/1051172057.db2.gz PKXXQFVQDVJYGV-QGZVFWFLSA-N 1 0 305.462 4.200 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC000792985121 1051235081 /nfs/dbraw/zinc/23/50/81/1051235081.db2.gz VKUMWEVGOYTHTL-STQMWFEESA-N 1 0 319.832 4.336 20 10 DICDRO Cc1cccc(C[NH2+][C@@H](C)Cc2ccc(C(F)(F)F)cc2)c1O ZINC001171963357 1051249587 /nfs/dbraw/zinc/24/95/87/1051249587.db2.gz HZYYNDRLUQAOPZ-ZDUSSCGKSA-N 1 0 323.358 4.440 20 10 DICDRO C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1ccccc1O ZINC001171967842 1051249972 /nfs/dbraw/zinc/24/99/72/1051249972.db2.gz TUAPWURTTPSTBD-ZDUSSCGKSA-N 1 0 323.358 4.474 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)Cc2ccccc2SC)c1 ZINC000793233055 1051265414 /nfs/dbraw/zinc/26/54/14/1051265414.db2.gz OWVWQEKGISXMLK-UHFFFAOYSA-N 1 0 317.454 4.145 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](c3ccc(C)cc3C)C2)c1O ZINC000793232469 1051266658 /nfs/dbraw/zinc/26/66/58/1051266658.db2.gz MQKZBSYZBHGRER-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000793270673 1051275740 /nfs/dbraw/zinc/27/57/40/1051275740.db2.gz XZOSLXPWDGYONZ-DYVFJYSZSA-N 1 0 303.352 4.096 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000793309059 1051277876 /nfs/dbraw/zinc/27/78/76/1051277876.db2.gz JUHBXWSKZSTDIC-MRXNPFEDSA-N 1 0 305.780 4.352 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H]2CCCc3ccc(F)cc32)c1 ZINC000793309994 1051278239 /nfs/dbraw/zinc/27/82/39/1051278239.db2.gz WTLSFSYYBKMKGO-SFHVURJKSA-N 1 0 315.388 4.097 20 10 DICDRO CN(C)c1ccc(CNc2ccc(C[NH+](C)C)c(Cl)c2)cc1 ZINC000793337111 1051286627 /nfs/dbraw/zinc/28/66/27/1051286627.db2.gz CJEAZZXRGOTHNK-UHFFFAOYSA-N 1 0 317.864 4.080 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000793351512 1051291494 /nfs/dbraw/zinc/29/14/94/1051291494.db2.gz JBAPJHQUUFJPSZ-GUYCJALGSA-N 1 0 303.352 4.096 20 10 DICDRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000793521914 1051307696 /nfs/dbraw/zinc/30/76/96/1051307696.db2.gz YUEREGVXZYSVDB-IWMITWMQSA-N 1 0 324.468 4.043 20 10 DICDRO CC[C@H](C[NH2+][C@H](C)c1cc(OC)ccc1O)CC(F)(F)F ZINC000402560956 1051308717 /nfs/dbraw/zinc/30/87/17/1051308717.db2.gz JMLNTLFLTUWRCH-MNOVXSKESA-N 1 0 305.340 4.030 20 10 DICDRO c1ccc2c(c1)C[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CS2 ZINC001172190696 1051310512 /nfs/dbraw/zinc/31/05/12/1051310512.db2.gz LWIINLZOEHFZFS-SFHVURJKSA-N 1 0 324.493 4.093 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(OC)cc2)cc1 ZINC000793566029 1051320672 /nfs/dbraw/zinc/32/06/72/1051320672.db2.gz JPIHTCKJUXKNAH-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO C[C@H]([NH2+][C@@H]1CSc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC001172196750 1051323946 /nfs/dbraw/zinc/32/39/46/1051323946.db2.gz LJQXVIPAWJZYGR-YOEHRIQHSA-N 1 0 312.482 4.120 20 10 DICDRO CC[C@@H](C)OCC[C@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001172345336 1051364562 /nfs/dbraw/zinc/36/45/62/1051364562.db2.gz WOPMNRIPTJPSGN-LSDHHAIUSA-N 1 0 301.430 4.229 20 10 DICDRO CCCc1nc(C)c(C[N@@H+](CCC)Cc2ccccc2O)o1 ZINC000794381962 1051372753 /nfs/dbraw/zinc/37/27/53/1051372753.db2.gz FHEFUWWWDRMWET-UHFFFAOYSA-N 1 0 302.418 4.053 20 10 DICDRO CCc1nc(C)c(C[N@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000794375006 1051373747 /nfs/dbraw/zinc/37/37/47/1051373747.db2.gz HFRCTUPLATWHRH-UHFFFAOYSA-N 1 0 314.429 4.196 20 10 DICDRO CCOCC[C@H](C)[NH2+][C@@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001172422577 1051384951 /nfs/dbraw/zinc/38/49/51/1051384951.db2.gz GDMOIADNYNKLAY-KBXCAEBGSA-N 1 0 305.462 4.037 20 10 DICDRO Oc1cccc2c1C[N@@H+]([C@H]1CCC[C@@H](c3ccccc3)C1)CC2 ZINC001172549235 1051432429 /nfs/dbraw/zinc/43/24/29/1051432429.db2.gz NODMFLYAYNZYMR-MOPGFXCFSA-N 1 0 307.437 4.477 20 10 DICDRO C[C@@H]([NH2+]C1CCC(C)(O)CC1)c1ccc(N2CCCCC2)cc1 ZINC000766476973 1051434318 /nfs/dbraw/zinc/43/43/18/1051434318.db2.gz FEQVRAKZOLCBBA-PPDQVPDSSA-N 1 0 316.489 4.021 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(CCO)CCCCC2)cc1 ZINC000766533161 1051463152 /nfs/dbraw/zinc/46/31/52/1051463152.db2.gz ADSGPBVQYOGWMB-QGZVFWFLSA-N 1 0 318.505 4.126 20 10 DICDRO Cc1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)CC2 ZINC001172825911 1051516120 /nfs/dbraw/zinc/51/61/20/1051516120.db2.gz LQQKGWBAYOPEFK-NRFANRHFSA-N 1 0 320.480 4.242 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(F)cn1)c1ccc(N2CCCCC2)cc1 ZINC000766609386 1051542949 /nfs/dbraw/zinc/54/29/49/1051542949.db2.gz YTSSWTQAXLIRQY-HNNXBMFYSA-N 1 0 313.420 4.062 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](c3cccc(C)c3)C2)cc1 ZINC001169198288 1051543482 /nfs/dbraw/zinc/54/34/82/1051543482.db2.gz VPIFPCXVGLZCKJ-FQEVSTJZSA-N 1 0 308.469 4.441 20 10 DICDRO C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1ccc(N(C)C)cc1 ZINC001172860740 1051547898 /nfs/dbraw/zinc/54/78/98/1051547898.db2.gz NUURYCYJUZQFJJ-ZDUSSCGKSA-N 1 0 320.839 4.266 20 10 DICDRO C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001172860337 1051548094 /nfs/dbraw/zinc/54/80/94/1051548094.db2.gz CJLHFBPSXHPBBI-LBPRGKRZSA-N 1 0 319.807 4.135 20 10 DICDRO Cc1ccc(F)c(C[N@@H+](C)Cc2c(O)ccc3ccncc32)c1 ZINC000766629543 1051559769 /nfs/dbraw/zinc/55/97/69/1051559769.db2.gz DBBDPGCINPPKMY-UHFFFAOYSA-N 1 0 310.372 4.020 20 10 DICDRO C[C@H](CSc1ccc(Cl)cc1)[NH2+]Cc1cccc(O)c1O ZINC001172880517 1051563603 /nfs/dbraw/zinc/56/36/03/1051563603.db2.gz SLKUNUYRDWXXLS-LLVKDONJSA-N 1 0 323.845 4.022 20 10 DICDRO C[C@H](CSc1ccc(Cl)cc1)[NH2+]Cc1ccc(O)c(O)c1 ZINC001172884363 1051565734 /nfs/dbraw/zinc/56/57/34/1051565734.db2.gz XTJQHTQHMSUSRM-LLVKDONJSA-N 1 0 323.845 4.022 20 10 DICDRO CO[C@@H]1CCC[C@H]([NH2+][C@@H]2c3c(c(C)cc(C)c3O)CC2(C)C)C1 ZINC001172930489 1051576738 /nfs/dbraw/zinc/57/67/38/1051576738.db2.gz IZEMYOQCFIZJKD-QMTMVMCOSA-N 1 0 317.473 4.180 20 10 DICDRO CCCOC1CCC([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC001173092883 1051598665 /nfs/dbraw/zinc/59/86/65/1051598665.db2.gz HFQNQBAAQSSESI-DMKPSLHHSA-N 1 0 304.478 4.141 20 10 DICDRO Cc1cc(CC[NH2+]Cc2c(C)noc2C)c(C)n1-c1ccccc1 ZINC000761570583 1051600755 /nfs/dbraw/zinc/60/07/55/1051600755.db2.gz AEZYLEQJOAOTNW-UHFFFAOYSA-N 1 0 323.440 4.031 20 10 DICDRO CNc1cc(N(Cc2ccccc2)c2ccc(N)cc2)cc[nH+]1 ZINC001216337542 1051705953 /nfs/dbraw/zinc/70/59/53/1051705953.db2.gz FMJFVXSKESIJAE-UHFFFAOYSA-N 1 0 304.397 4.044 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1cccc(Cl)c1[O-] ZINC000806136661 1051737679 /nfs/dbraw/zinc/73/76/79/1051737679.db2.gz BBNFWTMNJTYZNQ-PBHICJAKSA-N 1 0 324.896 4.207 20 10 DICDRO CC[C@@H]1CC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000806137865 1051737869 /nfs/dbraw/zinc/73/78/69/1051737869.db2.gz SYYGUKPGJHFMDC-DYVFJYSZSA-N 1 0 324.415 4.035 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCC(C)(C)COC)cc1 ZINC000806175366 1051748274 /nfs/dbraw/zinc/74/82/74/1051748274.db2.gz AFXGOBSWDSRRNH-INIZCTEOSA-N 1 0 306.494 4.246 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCC(C)(C)COC)cc1 ZINC000806175367 1051748879 /nfs/dbraw/zinc/74/88/79/1051748879.db2.gz AFXGOBSWDSRRNH-MRXNPFEDSA-N 1 0 306.494 4.246 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCSC1)c1ccc(N2CCCCC2)cc1 ZINC000806178361 1051772045 /nfs/dbraw/zinc/77/20/45/1051772045.db2.gz FTDCOSNAXOSSOF-IAGOWNOFSA-N 1 0 318.530 4.471 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCSC1)c1cc2c(cc1O)CCCC2 ZINC000806179677 1051772754 /nfs/dbraw/zinc/77/27/54/1051772754.db2.gz UJBCUEMWDVPWNI-ZIAGYGMSSA-N 1 0 305.487 4.065 20 10 DICDRO Oc1ccc(C[NH2+]C2CCC3(CCc4ccccc43)CC2)c(O)c1 ZINC001173688503 1051781877 /nfs/dbraw/zinc/78/18/77/1051781877.db2.gz DOLLYQGJPLYDIU-UHFFFAOYSA-N 1 0 323.436 4.014 20 10 DICDRO C[C@@H]1CC([NH2+]Cc2cc(-c3ccccc3)ccc2O)C[C@@H](C)O1 ZINC000767427250 1051806481 /nfs/dbraw/zinc/80/64/81/1051806481.db2.gz XLOONKLUNQHPQP-HUUCEWRRSA-N 1 0 311.425 4.105 20 10 DICDRO CCCCCn1cc(C[NH2+]Cc2c(O)cccc2Cl)c(C)n1 ZINC000767427656 1051807021 /nfs/dbraw/zinc/80/70/21/1051807021.db2.gz VCPFOZPPXWYCSL-UHFFFAOYSA-N 1 0 321.852 4.031 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1Cl ZINC000767694707 1051831690 /nfs/dbraw/zinc/83/16/90/1051831690.db2.gz WHFQAMIRBSMOPH-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO FC1(F)CCC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000767929749 1051866694 /nfs/dbraw/zinc/86/66/94/1051866694.db2.gz PTGQNTJOLRTBCN-MRXNPFEDSA-N 1 0 308.416 4.344 20 10 DICDRO C[C@@H](Cc1cccc(F)c1)[NH2+]Cc1cc2ccccc2cc1O ZINC001168465302 1051883706 /nfs/dbraw/zinc/88/37/06/1051883706.db2.gz QRKKEOJZAGKZNE-AWEZNQCLSA-N 1 0 309.384 4.405 20 10 DICDRO COc1ccc2oc(C[N@H+](C)Cc3ccc(N(C)C)cc3)cc2c1 ZINC000768131225 1051887051 /nfs/dbraw/zinc/88/70/51/1051887051.db2.gz XQBTVXHTDYUVTO-UHFFFAOYSA-N 1 0 324.424 4.139 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2cc[nH]c21 ZINC000768131832 1051888079 /nfs/dbraw/zinc/88/80/79/1051888079.db2.gz ADSIGKHMADTRDQ-UHFFFAOYSA-N 1 0 307.441 4.256 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)Cc2cccc(Cl)c2)c1 ZINC000768173795 1051895637 /nfs/dbraw/zinc/89/56/37/1051895637.db2.gz GFSYIVFQWJEGLM-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@H+](C[C@@H]1CCOC1)C1CC1 ZINC000768258876 1051908512 /nfs/dbraw/zinc/90/85/12/1051908512.db2.gz YBRTVCJSISEBOT-INIZCTEOSA-N 1 0 323.436 4.060 20 10 DICDRO CC(C)[N@H+](Cc1ccco1)Cc1cc(Br)ccc1O ZINC000768250889 1051910459 /nfs/dbraw/zinc/91/04/59/1051910459.db2.gz YGCIWFSTOUEHLT-UHFFFAOYSA-N 1 0 324.218 4.158 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](Cc2cccc(F)c2)C2CC2)c1 ZINC000768256361 1051910608 /nfs/dbraw/zinc/91/06/08/1051910608.db2.gz DBXHBNOTGYMDCU-UHFFFAOYSA-N 1 0 315.388 4.095 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2ccccc2C)c1O ZINC000768320456 1051916250 /nfs/dbraw/zinc/91/62/50/1051916250.db2.gz VXWNGRCSROHXMR-SFHVURJKSA-N 1 0 311.425 4.436 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000768319447 1051921880 /nfs/dbraw/zinc/92/18/80/1051921880.db2.gz OIOOLJNWLHBFMQ-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO CCCN(CCC)c1ccc(C[NH+]2CCC(OCC)CC2)cc1 ZINC000768527819 1051937914 /nfs/dbraw/zinc/93/79/14/1051937914.db2.gz AHNITVMPIQFLCE-UHFFFAOYSA-N 1 0 318.505 4.314 20 10 DICDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)c1 ZINC000743473733 1051941425 /nfs/dbraw/zinc/94/14/25/1051941425.db2.gz QIVHTDJNVBYRBZ-ROUUACIJSA-N 1 0 324.468 4.243 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)Cc2ccccc2O)cc1[N+](=O)[O-] ZINC000768873969 1051974690 /nfs/dbraw/zinc/97/46/90/1051974690.db2.gz WUXYYIPRMMEGAQ-UHFFFAOYSA-N 1 0 314.385 4.056 20 10 DICDRO CC[N@H+](Cc1cc(Cl)ccc1O)[C@H](C)c1cccc(O)c1 ZINC000768873592 1051975973 /nfs/dbraw/zinc/97/59/73/1051975973.db2.gz QNPDOWWPSHSVCN-GFCCVEGCSA-N 1 0 305.805 4.334 20 10 DICDRO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)cc1 ZINC000769104622 1052001998 /nfs/dbraw/zinc/00/19/98/1052001998.db2.gz JNLJPARQCYGBES-INIZCTEOSA-N 1 0 303.789 4.088 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cc(F)c(F)cc1F ZINC000769201802 1052008390 /nfs/dbraw/zinc/00/83/90/1052008390.db2.gz ZOYLNCNMYWSABH-UHFFFAOYSA-N 1 0 309.331 4.222 20 10 DICDRO CC[N@H+](CCC(F)(F)F)Cc1ccc(N2CCCCC2)cc1 ZINC000769226056 1052010348 /nfs/dbraw/zinc/01/03/48/1052010348.db2.gz RUCACHJKNJEUPV-UHFFFAOYSA-N 1 0 314.395 4.451 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@H](c3ccccc3C)C2)c1O ZINC000769233851 1052011321 /nfs/dbraw/zinc/01/13/21/1052011321.db2.gz QNTQAHSLDKBFIR-INIZCTEOSA-N 1 0 311.425 4.089 20 10 DICDRO CC(C)SCC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000808420111 1052020438 /nfs/dbraw/zinc/02/04/38/1052020438.db2.gz VROZANQURUBYOJ-UHFFFAOYSA-N 1 0 320.424 4.003 20 10 DICDRO Cc1ncsc1C[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000769319924 1052023408 /nfs/dbraw/zinc/02/34/08/1052023408.db2.gz FNOPPAUHRWBFIW-UHFFFAOYSA-N 1 0 324.449 4.456 20 10 DICDRO COC[C@H]([NH2+]Cc1cc(C)c(C)cc1O)c1cccc(Cl)c1 ZINC000808455049 1052025691 /nfs/dbraw/zinc/02/56/91/1052025691.db2.gz UGNMNHUBHIBPEO-KRWDZBQOSA-N 1 0 319.832 4.140 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)CCOCc2ccccc2)cc1C ZINC000808434234 1052032495 /nfs/dbraw/zinc/03/24/95/1052032495.db2.gz YXPZCHKYIHQKMC-QGZVFWFLSA-N 1 0 313.441 4.094 20 10 DICDRO COc1ccccc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000769388232 1052035950 /nfs/dbraw/zinc/03/59/50/1052035950.db2.gz KIELTRGYPXNISZ-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000769428703 1052047581 /nfs/dbraw/zinc/04/75/81/1052047581.db2.gz REMYOSHEKOATQU-MRXNPFEDSA-N 1 0 319.351 4.016 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2C)c1O ZINC000769482070 1052051366 /nfs/dbraw/zinc/05/13/66/1052051366.db2.gz YGQPIDZIPDPWNG-GOSISDBHSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)c1O ZINC000769457029 1052057892 /nfs/dbraw/zinc/05/78/92/1052057892.db2.gz NGZZMBFOBHISRE-CXAGYDPISA-N 1 0 315.388 4.123 20 10 DICDRO c1ccc2c(c1)[nH]c1c2CCC[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000808688620 1052060462 /nfs/dbraw/zinc/06/04/62/1052060462.db2.gz SVSQSAXMZBCEMQ-LJQANCHMSA-N 1 0 318.420 4.270 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)c2ccccc21 ZINC000808687377 1052060548 /nfs/dbraw/zinc/06/05/48/1052060548.db2.gz QKYCEMIQLIIIPV-FOIQADDNSA-N 1 0 306.453 4.407 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCc3c2cccc3O)c1O ZINC000808691996 1052060936 /nfs/dbraw/zinc/06/09/36/1052060936.db2.gz MMWWFXKIOCQNCU-MEDUHNTESA-N 1 0 317.816 4.398 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C2CCN(C3CCC3)CC2)c1O ZINC000808685976 1052061322 /nfs/dbraw/zinc/06/13/22/1052061322.db2.gz UJFJHGYIGBSVHB-ZDUSSCGKSA-N 1 0 322.880 4.022 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c1O ZINC000808681204 1052061374 /nfs/dbraw/zinc/06/13/74/1052061374.db2.gz WTYWSBIORZFCOO-QWHCGFSZSA-N 1 0 319.832 4.258 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)c1O ZINC000808691739 1052062597 /nfs/dbraw/zinc/06/25/97/1052062597.db2.gz NMADTSRSKUNWFG-CHWSQXEVSA-N 1 0 319.832 4.341 20 10 DICDRO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(N(C)C)cc2)s1 ZINC000769470697 1052062870 /nfs/dbraw/zinc/06/28/70/1052062870.db2.gz NSYGSUFWEFOFIG-AWEZNQCLSA-N 1 0 317.502 4.273 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCOC2(CCCC2)C1 ZINC000769468437 1052063595 /nfs/dbraw/zinc/06/35/95/1052063595.db2.gz HZUXHFKQFOXSQS-UHFFFAOYSA-N 1 0 323.436 4.204 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cc1 ZINC000808671630 1052064409 /nfs/dbraw/zinc/06/44/09/1052064409.db2.gz LJAVSLBYAZISQS-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO COCc1ccc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cc1 ZINC000808673409 1052065535 /nfs/dbraw/zinc/06/55/35/1052065535.db2.gz CNZKJIHYRKEISM-ZDUSSCGKSA-N 1 0 319.832 4.351 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)c1O ZINC000769492985 1052065891 /nfs/dbraw/zinc/06/58/91/1052065891.db2.gz PPABMLDNFXRVKN-QAPCUYQASA-N 1 0 311.425 4.026 20 10 DICDRO COCc1cccc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808676754 1052066767 /nfs/dbraw/zinc/06/67/67/1052066767.db2.gz KWFKFTQJQKGOBV-CYBMUJFWSA-N 1 0 319.832 4.351 20 10 DICDRO Cc1csc(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)n1 ZINC000808675695 1052066992 /nfs/dbraw/zinc/06/69/92/1052066992.db2.gz PQGDDLBALNCQOI-LLVKDONJSA-N 1 0 310.850 4.012 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)c1ccccc1 ZINC000808679683 1052067497 /nfs/dbraw/zinc/06/74/97/1052067497.db2.gz WXMOSVQKVUFTTF-SUMWQHHRSA-N 1 0 319.832 4.392 20 10 DICDRO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1ccc(N(C)C)cc1 ZINC000747523636 1052067541 /nfs/dbraw/zinc/06/75/41/1052067541.db2.gz NHHNWTZCMUHZLK-UHFFFAOYSA-N 1 0 307.441 4.256 20 10 DICDRO Cc1ccc([C@@H](O)C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cc1 ZINC000808679448 1052067782 /nfs/dbraw/zinc/06/77/82/1052067782.db2.gz PPNHBMZLWXEMQP-DYVFJYSZSA-N 1 0 319.832 4.047 20 10 DICDRO CCOc1ccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c(O)c1 ZINC000769499848 1052068125 /nfs/dbraw/zinc/06/81/25/1052068125.db2.gz RJUVKEJFIJWARC-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)cc1C ZINC000769503841 1052068822 /nfs/dbraw/zinc/06/88/22/1052068822.db2.gz OPYBNIXTNNWUFP-IBGZPJMESA-N 1 0 310.441 4.086 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1O ZINC000769500417 1052069260 /nfs/dbraw/zinc/06/92/60/1052069260.db2.gz ZLBJVOUQTARION-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808703808 1052069509 /nfs/dbraw/zinc/06/95/09/1052069509.db2.gz XIWMVWGHFFGVDB-STQMWFEESA-N 1 0 304.821 4.469 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808709355 1052071578 /nfs/dbraw/zinc/07/15/78/1052071578.db2.gz DWEGNAYSEYHCMO-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000808708153 1052071656 /nfs/dbraw/zinc/07/16/56/1052071656.db2.gz INROUBBYODDZBT-ZDUSSCGKSA-N 1 0 311.853 4.211 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c1O ZINC000808715958 1052075270 /nfs/dbraw/zinc/07/52/70/1052075270.db2.gz ZNBBQIUWAMTFQA-IGNZVWTISA-N 1 0 323.864 4.210 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCCC23CCOCC3)c1O ZINC000808716936 1052075361 /nfs/dbraw/zinc/07/53/61/1052075361.db2.gz AADWMGOSFCSSGY-CJNGLKHVSA-N 1 0 323.864 4.354 20 10 DICDRO CCOCC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000808725467 1052081476 /nfs/dbraw/zinc/08/14/76/1052081476.db2.gz SNJIOFSSDWPIDV-KRWDZBQOSA-N 1 0 318.505 4.390 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1cc(F)ccc1O ZINC000808728412 1052083686 /nfs/dbraw/zinc/08/36/86/1052083686.db2.gz QZYFMDCWIHSGJV-VVFCZOMOSA-N 1 0 315.388 4.102 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1COc2ccccc21)c1cc(Cl)ccc1O ZINC000808727264 1052083780 /nfs/dbraw/zinc/08/37/80/1052083780.db2.gz FTXFXPGJBOSBLF-WBMJQRKESA-N 1 0 317.816 4.263 20 10 DICDRO CCc1nc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)cs1 ZINC000808693886 1052083961 /nfs/dbraw/zinc/08/39/61/1052083961.db2.gz SZEQZZHPHVLJCG-JTQLQIEISA-N 1 0 310.850 4.224 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1COc2ccccc21)c1cc(Cl)ccc1O ZINC000808727262 1052083990 /nfs/dbraw/zinc/08/39/90/1052083990.db2.gz FTXFXPGJBOSBLF-MLGOLLRUSA-N 1 0 317.816 4.263 20 10 DICDRO C/C=C/C[C@H](CO)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000769992819 1052138385 /nfs/dbraw/zinc/13/83/85/1052138385.db2.gz DHOZSEWZONVOFE-JFZXIXNHSA-N 1 0 316.489 4.045 20 10 DICDRO C/C=C\C[C@H](CO)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000769992820 1052139147 /nfs/dbraw/zinc/13/91/47/1052139147.db2.gz DHOZSEWZONVOFE-VKCQWTKXSA-N 1 0 316.489 4.045 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2CCC[NH2+]CC2)=C1 ZINC001217997130 1052182977 /nfs/dbraw/zinc/18/29/77/1052182977.db2.gz PVGOTVICWYQTBR-BZROSYFNSA-N 1 0 311.385 4.329 20 10 DICDRO C[C@@H]1C[C@H](OC2=CC(=O)C=CC2=NNc2ccccc2)CC[NH2+]1 ZINC001218052300 1052189318 /nfs/dbraw/zinc/18/93/18/1052189318.db2.gz APTMYXYVSAJGFL-APQGHPQYSA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2CC[C@@]23CC[NH2+]C3)=C1 ZINC001218120049 1052199118 /nfs/dbraw/zinc/19/91/18/1052199118.db2.gz SDVDPFICNHGEDY-YTCPRFGJSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)C=C1 ZINC001218188705 1052204758 /nfs/dbraw/zinc/20/47/58/1052204758.db2.gz OOLOOPUBACSTPE-HGKCTWBKSA-N 1 0 323.396 4.469 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@H](C)C1C[NH2+]C1 ZINC001218198857 1052207528 /nfs/dbraw/zinc/20/75/28/1052207528.db2.gz TVEFRPDLWJQLQK-CQSZACIVSA-N 1 0 324.428 4.436 20 10 DICDRO Cc1ccc(O[C@@H]2C[C@H]3C[NH2+]C[C@H]32)c(/N=N/c2ccccc2)c1 ZINC001218329829 1052225633 /nfs/dbraw/zinc/22/56/33/1052225633.db2.gz GUVSPKFBELMPNM-MGBIWVOLSA-N 1 0 307.397 4.397 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2C[NH2+]CCC23CC3)=C1 ZINC001218402093 1052234184 /nfs/dbraw/zinc/23/41/84/1052234184.db2.gz AOZYNEMAXCVFMN-VEGAHXMMSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1C[NH2+]CCC12CC2 ZINC001218405163 1052234770 /nfs/dbraw/zinc/23/47/70/1052234770.db2.gz NUJJULKRUAXXKA-KHOFPDMRSA-N 1 0 323.396 4.329 20 10 DICDRO C[C@H]1CC[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C[NH2+]1 ZINC001218404260 1052235013 /nfs/dbraw/zinc/23/50/13/1052235013.db2.gz ZRXRZOYYAKQPIL-SCLBCKFNSA-N 1 0 311.385 4.327 20 10 DICDRO C[C@H]1C[NH2+]CC[C@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218412425 1052236127 /nfs/dbraw/zinc/23/61/27/1052236127.db2.gz FMSPCXGUYMZSMZ-LUWDRPHRSA-N 1 0 311.385 4.184 20 10 DICDRO C[C@H]1C[NH2+]CC[C@@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001218425703 1052237795 /nfs/dbraw/zinc/23/77/95/1052237795.db2.gz ULHRAOMIIYQETB-UGSOOPFHSA-N 1 0 311.385 4.184 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CC[C@H]3C[NH2+]C[C@H]32)=C1 ZINC001218460599 1052241928 /nfs/dbraw/zinc/24/19/28/1052241928.db2.gz NFUXWNLHWRYUKT-IDXPZVDFSA-N 1 0 323.396 4.184 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CC[C@@H]3C[NH2+]C[C@H]23)=C1 ZINC001218460601 1052242420 /nfs/dbraw/zinc/24/24/20/1052242420.db2.gz NFUXWNLHWRYUKT-NBERMSCLSA-N 1 0 323.396 4.184 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CC[C@H]2C[NH2+]C[C@@H]21 ZINC001218462332 1052242756 /nfs/dbraw/zinc/24/27/56/1052242756.db2.gz WQFKLVPILNSOGN-YCNSVCLQSA-N 1 0 323.396 4.184 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CC[C@@H]2C[NH2+]C[C@H]12 ZINC001218462328 1052242792 /nfs/dbraw/zinc/24/27/92/1052242792.db2.gz WQFKLVPILNSOGN-BKESJFCASA-N 1 0 323.396 4.184 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3C[C@@H]4CC[C@H]3[NH2+]4)cc2)C=C1 ZINC001218477200 1052244651 /nfs/dbraw/zinc/24/46/51/1052244651.db2.gz FDQQBIOGQWRGTK-BMGDILEWSA-N 1 0 309.369 4.079 20 10 DICDRO Cc1ccccc1/N=N/c1ccc(NC(=O)[C@H]2CC[C@@H]2[NH3+])c(C)c1 ZINC001219205585 1052277333 /nfs/dbraw/zinc/27/73/33/1052277333.db2.gz IVNPBWNLJIKPGN-XBIFPAPLSA-N 1 0 322.412 4.395 20 10 DICDRO Cc1nc(C)c(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC000315005467 1052328576 /nfs/dbraw/zinc/32/85/76/1052328576.db2.gz WZZGHHMTVWMWCZ-ZWNOBZJWSA-N 1 0 302.443 4.112 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@H]3CCCc4sccc43)ccc21 ZINC000315716895 1052348323 /nfs/dbraw/zinc/34/83/23/1052348323.db2.gz MRRVXTNPZITNBP-KRWDZBQOSA-N 1 0 312.482 4.298 20 10 DICDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000153507443 1052362214 /nfs/dbraw/zinc/36/22/14/1052362214.db2.gz GNXUCRZCJVITDL-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO Cc1cc(C[NH2+]Cc2cnc(C)s2)c(C)n1-c1ccccc1 ZINC000316662319 1052372335 /nfs/dbraw/zinc/37/23/35/1052372335.db2.gz RRNWZVFIVASVGD-UHFFFAOYSA-N 1 0 311.454 4.149 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000316882855 1052376292 /nfs/dbraw/zinc/37/62/92/1052376292.db2.gz APPIWKOOQFPLBW-OLZOCXBDSA-N 1 0 303.377 4.342 20 10 DICDRO CCC(CC)[N@@H+](Cc1cc(F)cc(C(C)=O)c1[O-])CC(C)C ZINC000317530476 1052388656 /nfs/dbraw/zinc/38/86/56/1052388656.db2.gz WWAWOGRJTSSQLA-UHFFFAOYSA-N 1 0 309.425 4.381 20 10 DICDRO CC[C@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1ccccc1O ZINC000762643291 1052409600 /nfs/dbraw/zinc/40/96/00/1052409600.db2.gz OSHPSZJYGKOVHN-DQPZFDDXSA-N 1 0 305.462 4.417 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCC2CC(OC(C)(C)C)C2)c1 ZINC000762640482 1052410153 /nfs/dbraw/zinc/41/01/53/1052410153.db2.gz FIPGZYYZKSAOJS-VQCLRJIVSA-N 1 0 321.461 4.035 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C)cc(C)c2O)cc1 ZINC000915836419 1052501518 /nfs/dbraw/zinc/50/15/18/1052501518.db2.gz LOZKTLVRYSOABU-LJQANCHMSA-N 1 0 311.425 4.355 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2ccc(Cl)cc2)c1 ZINC000915876450 1052525259 /nfs/dbraw/zinc/52/52/59/1052525259.db2.gz WEPWOHPLUSCZDJ-QWHCGFSZSA-N 1 0 319.832 4.336 20 10 DICDRO COc1cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)ccc1F ZINC000153819410 1052587090 /nfs/dbraw/zinc/58/70/90/1052587090.db2.gz HVNTXYHJTCTLPJ-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000917020570 1052681507 /nfs/dbraw/zinc/68/15/07/1052681507.db2.gz RTNZWQQIUHJCFO-UHFFFAOYSA-N 1 0 324.468 4.318 20 10 DICDRO Cc1cc(C[N@@H+]2CCO[C@@H]3CCCC[C@H]32)c(O)c(C(C)(C)C)c1 ZINC000917473597 1052729340 /nfs/dbraw/zinc/72/93/40/1052729340.db2.gz QYVYJKPHTNGGMH-QZTJIDSGSA-N 1 0 317.473 4.142 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@@H]1C1CCCCC1 ZINC000917480074 1052729436 /nfs/dbraw/zinc/72/94/36/1052729436.db2.gz IJGCGTYZLFXBSE-LJQANCHMSA-N 1 0 310.441 4.485 20 10 DICDRO C[N@H+](CCCCc1ccccc1)Cc1c(O)ccc2ccncc21 ZINC000917476550 1052730086 /nfs/dbraw/zinc/73/00/86/1052730086.db2.gz OKGFVCKWRNLPKV-UHFFFAOYSA-N 1 0 320.436 4.395 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1)CCC2 ZINC000917488125 1052731994 /nfs/dbraw/zinc/73/19/94/1052731994.db2.gz YZLZEXPQSNDKOY-LJQANCHMSA-N 1 0 311.400 4.357 20 10 DICDRO C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 ZINC000237539185 1052883648 /nfs/dbraw/zinc/88/36/48/1052883648.db2.gz HZHCYELDTWBTTM-RBSFLKMASA-N 1 0 324.415 4.035 20 10 DICDRO C[N@H+](Cc1c(O)ccc2ccccc21)C1Cc2ccccc2C1 ZINC000919949915 1052905244 /nfs/dbraw/zinc/90/52/44/1052905244.db2.gz QCWUEPUEJUNYTA-UHFFFAOYSA-N 1 0 303.405 4.145 20 10 DICDRO COc1ccc(C[NH2+]CCc2ccccc2C(F)(F)F)cc1C ZINC000920180095 1052925389 /nfs/dbraw/zinc/92/53/89/1052925389.db2.gz PKKSBDPZHJMYLZ-UHFFFAOYSA-N 1 0 323.358 4.355 20 10 DICDRO C[C@@H](CCCO)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000237549835 1053011932 /nfs/dbraw/zinc/01/19/32/1053011932.db2.gz XEVPNUGLUHMIGL-AWEZNQCLSA-N 1 0 321.505 4.238 20 10 DICDRO C[C@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(N2CCCCC2)cc1 ZINC000180258404 1053052281 /nfs/dbraw/zinc/05/22/81/1053052281.db2.gz RIDYYBFNYYIWDU-FXAWDEMLSA-N 1 0 316.489 4.287 20 10 DICDRO Oc1ccccc1C[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000238100112 1053053215 /nfs/dbraw/zinc/05/32/15/1053053215.db2.gz VUXJVTXNLRVLCC-UHFFFAOYSA-N 1 0 319.404 4.228 20 10 DICDRO C[N@@H+]1CCC[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)C1 ZINC001228419845 1053097478 /nfs/dbraw/zinc/09/74/78/1053097478.db2.gz QQGAEIHCAZQCHI-ATQAJOFPSA-N 1 0 311.385 4.281 20 10 DICDRO C[C@@H](C[N+](C)(C)C)Oc1ccccc1NN=C1C=CC=CC1=O ZINC001228420866 1053099646 /nfs/dbraw/zinc/09/96/46/1053099646.db2.gz ZQRPESRGMDSWJY-AWEZNQCLSA-O 1 0 314.409 4.281 20 10 DICDRO Cc1cc(C)cc(OCC[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001318346207 1053163597 /nfs/dbraw/zinc/16/35/97/1053163597.db2.gz CYJHSKCGNRXKPJ-UHFFFAOYSA-N 1 0 324.468 4.072 20 10 DICDRO Cc1ccc([C@H](C)C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001318691359 1053183517 /nfs/dbraw/zinc/18/35/17/1053183517.db2.gz DEVBKYQUBKFEBF-GOSISDBHSA-N 1 0 308.469 4.489 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c1O ZINC000181373383 1053198413 /nfs/dbraw/zinc/19/84/13/1053198413.db2.gz DPNYUUGMRXFPKJ-LLVKDONJSA-N 1 0 319.351 4.032 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2cccc(Cl)c2)c1O ZINC000181421766 1053206377 /nfs/dbraw/zinc/20/63/77/1053206377.db2.gz YQPJPCWJJDSRHJ-SNVBAGLBSA-N 1 0 321.779 4.238 20 10 DICDRO CC(C)(C)OC1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001319706063 1053265126 /nfs/dbraw/zinc/26/51/26/1053265126.db2.gz TUKBKJAMYUDGJO-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC001319828923 1053277397 /nfs/dbraw/zinc/27/73/97/1053277397.db2.gz ORNGVCUQYPZICV-RTBURBONSA-N 1 0 316.514 4.147 20 10 DICDRO C[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccc(N(C)C)cc1 ZINC001319893561 1053284709 /nfs/dbraw/zinc/28/47/09/1053284709.db2.gz LGANRUHSNZXDTP-MRXNPFEDSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1nc(C)c(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC001320119071 1053307656 /nfs/dbraw/zinc/30/76/56/1053307656.db2.gz WJOVYVZFXYUVLX-BXUZGUMPSA-N 1 0 316.470 4.155 20 10 DICDRO CSc1cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)ccn1 ZINC001320119061 1053308131 /nfs/dbraw/zinc/30/81/31/1053308131.db2.gz VWTUZBWRUKURHT-JSGCOSHPSA-N 1 0 314.454 4.156 20 10 DICDRO Cc1nc(C)c(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC001320119073 1053308185 /nfs/dbraw/zinc/30/81/85/1053308185.db2.gz WJOVYVZFXYUVLX-RISCZKNCSA-N 1 0 316.470 4.155 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001320118648 1053308433 /nfs/dbraw/zinc/30/84/33/1053308433.db2.gz OKNCNEQCNWQCQQ-DOTOQJQBSA-N 1 0 324.468 4.495 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CCOc2ccccc21 ZINC001320118665 1053308825 /nfs/dbraw/zinc/30/88/25/1053308825.db2.gz OQYTUQFMHVAGLS-VYDXJSESSA-N 1 0 323.436 4.405 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC001320260384 1053320018 /nfs/dbraw/zinc/32/00/18/1053320018.db2.gz UTLSQSVBKYDNLF-OUCADQQQSA-N 1 0 316.470 4.407 20 10 DICDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001320293396 1053323866 /nfs/dbraw/zinc/32/38/66/1053323866.db2.gz XJDCVWSFIDXZSO-AWEZNQCLSA-N 1 0 300.368 4.107 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)C12CCC2 ZINC001320410471 1053330597 /nfs/dbraw/zinc/33/05/97/1053330597.db2.gz BSJWTMMZHSXVKV-TXCZRRACSA-N 1 0 315.457 4.186 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC001320411886 1053332805 /nfs/dbraw/zinc/33/28/05/1053332805.db2.gz XBGYMUWJHAVLJS-FMKPAKJESA-N 1 0 313.445 4.377 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC001320425062 1053333032 /nfs/dbraw/zinc/33/30/32/1053333032.db2.gz SLSKXWGGSSOUON-OUCADQQQSA-N 1 0 316.470 4.407 20 10 DICDRO COc1ccccc1C1([NH2+][C@@H](C)c2cc(C)ccc2O)CCC1 ZINC001320424652 1053333772 /nfs/dbraw/zinc/33/37/72/1053333772.db2.gz NONHCQRKFJAVGW-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001320763262 1053359682 /nfs/dbraw/zinc/35/96/82/1053359682.db2.gz GVFJAFOUSZSHLU-IUODEOHRSA-N 1 0 315.388 4.186 20 10 DICDRO C[C@@H]([NH2+]Cc1cnc(-c2ccccc2)s1)c1ccccc1O ZINC001320868085 1053369699 /nfs/dbraw/zinc/36/96/99/1053369699.db2.gz QQOWPGFMORJUMH-CYBMUJFWSA-N 1 0 310.422 4.367 20 10 DICDRO CC[N@@H+]1CC[C@@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C1 ZINC001229815110 1053408359 /nfs/dbraw/zinc/40/83/59/1053408359.db2.gz WQSCJUGKBNXKDO-ZBBYCGENSA-N 1 0 311.385 4.281 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCc2cn(C(C)C)nc21)c1ccccc1O ZINC001321387767 1053410545 /nfs/dbraw/zinc/41/05/45/1053410545.db2.gz WIFIMQUJVKACJJ-IRXDYDNUSA-N 1 0 313.445 4.288 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC001321457409 1053414787 /nfs/dbraw/zinc/41/47/87/1053414787.db2.gz OQLVEEUUBPWTSO-NQNKBUKLSA-N 1 0 317.473 4.432 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2ccc(F)cn2)cc1 ZINC000763518378 1053417479 /nfs/dbraw/zinc/41/74/79/1053417479.db2.gz JXHDYUSVTXBPTE-UHFFFAOYSA-N 1 0 315.436 4.137 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCc2ccc3ccccc3c2)cc1F ZINC001200171511 1053437627 /nfs/dbraw/zinc/43/76/27/1053437627.db2.gz BCPDSNURZGTKQN-UHFFFAOYSA-N 1 0 322.427 4.377 20 10 DICDRO Cc1cc2cc(C[NH2+]Cc3ccc(N4CCCC4)cc3)ccc2[nH]1 ZINC001321903667 1053442043 /nfs/dbraw/zinc/44/20/43/1053442043.db2.gz KZJSVZHYDXXWAN-UHFFFAOYSA-N 1 0 319.452 4.366 20 10 DICDRO CS[C@@H]1CC[C@@H]([N@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC001323271109 1053570471 /nfs/dbraw/zinc/57/04/71/1053570471.db2.gz YLBCAILTEBGVMY-HUUCEWRRSA-N 1 0 323.502 4.111 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)c2ncc(C)s2)cc1 ZINC000183193685 1053602647 /nfs/dbraw/zinc/60/26/47/1053602647.db2.gz SWXMCYXAWBGWBZ-HIFRSBDPSA-N 1 0 317.502 4.362 20 10 DICDRO Cc1csc(CCC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC001323828426 1053603994 /nfs/dbraw/zinc/60/39/94/1053603994.db2.gz AQHOTCCUGUZNCH-GWCFXTLKSA-N 1 0 320.433 4.067 20 10 DICDRO CC[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1O ZINC000183337543 1053634996 /nfs/dbraw/zinc/63/49/96/1053634996.db2.gz CHBOUWMWOAPWAB-KRWDZBQOSA-N 1 0 308.381 4.288 20 10 DICDRO CC[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccc1O ZINC000183322514 1053635450 /nfs/dbraw/zinc/63/54/50/1053635450.db2.gz IIUTYYUZQBCCOD-CQSZACIVSA-N 1 0 314.410 4.350 20 10 DICDRO CC[C@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccccc1O ZINC000183347400 1053640690 /nfs/dbraw/zinc/64/06/90/1053640690.db2.gz DBIZIGCNMJPJHX-AWEZNQCLSA-N 1 0 314.410 4.350 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)o1 ZINC001324348097 1053646841 /nfs/dbraw/zinc/64/68/41/1053646841.db2.gz FWCLWHBVBWJZJS-GXTWGEPZSA-N 1 0 314.429 4.288 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC001324602316 1053664560 /nfs/dbraw/zinc/66/45/60/1053664560.db2.gz UKEWPONWAPURBP-PMPSAXMXSA-N 1 0 315.457 4.188 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2ccc(Br)cc2)c1 ZINC000071408442 1053674266 /nfs/dbraw/zinc/67/42/66/1053674266.db2.gz QKGCTCYDCWGFKB-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO CN(C)c1ccc(/N=N/c2ccc(O[C@@H]3CC[N@H+](C)C3)cc2)cc1 ZINC001231249384 1053710114 /nfs/dbraw/zinc/71/01/14/1053710114.db2.gz OYOVPUOSOCHFDH-UOFXHNCJSA-N 1 0 324.428 4.251 20 10 DICDRO CC[NH2+]Cc1ccccc1NCc1ccc(N2CCCC2)cc1 ZINC001325321045 1053712847 /nfs/dbraw/zinc/71/28/47/1053712847.db2.gz TYAUEZOCXWJWDA-UHFFFAOYSA-N 1 0 309.457 4.008 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCC[C@H]1CCCCO1 ZINC001325420754 1053719553 /nfs/dbraw/zinc/71/95/53/1053719553.db2.gz BRKWUQTZXJRNNJ-BZUAXINKSA-N 1 0 303.446 4.188 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC(C)(C)c1cccnc1 ZINC001325582627 1053722286 /nfs/dbraw/zinc/72/22/86/1053722286.db2.gz RNHIMZXYSNKGAD-ZBFHGGJFSA-N 1 0 310.441 4.211 20 10 DICDRO CN(C)c1ccc2cc(C[N@H+](C)Cc3ccccc3O)ccc2c1 ZINC001231442388 1053753544 /nfs/dbraw/zinc/75/35/44/1053753544.db2.gz MIQQBHFJBROLMY-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO C[N@@H+](Cc1ccc(OCc2ccccc2)cc1O)CC1CCC1 ZINC001231468139 1053757659 /nfs/dbraw/zinc/75/76/59/1053757659.db2.gz CNIPLOLGUFOMEM-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCCCC12CC2 ZINC001231469670 1053758255 /nfs/dbraw/zinc/75/82/55/1053758255.db2.gz KPVPVDWUPJQTHH-UHFFFAOYSA-N 1 0 323.436 4.490 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCC2(CCC2)C1 ZINC001231469549 1053758348 /nfs/dbraw/zinc/75/83/48/1053758348.db2.gz GUIWLTUPSBTNHX-UHFFFAOYSA-N 1 0 323.436 4.347 20 10 DICDRO COc1ccc(CC[N@H+](C)Cc2c(O)ccc3ccccc32)cc1 ZINC001231590308 1053791593 /nfs/dbraw/zinc/79/15/93/1053791593.db2.gz SAXRUJXHJIDROJ-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1O ZINC001231594158 1053792425 /nfs/dbraw/zinc/79/24/25/1053792425.db2.gz UFYYUCONRWFDIM-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccccc2)Cc2ccccn2)c1O ZINC001231590811 1053792934 /nfs/dbraw/zinc/79/29/34/1053792934.db2.gz IFRCIQNBQBACIG-UHFFFAOYSA-N 1 0 318.420 4.298 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CCC1(F)F ZINC001231588257 1053793785 /nfs/dbraw/zinc/79/37/85/1053793785.db2.gz NZTUABMBZMAWTF-CYBMUJFWSA-N 1 0 305.368 4.413 20 10 DICDRO CSCC1(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001327269683 1053847892 /nfs/dbraw/zinc/84/78/92/1053847892.db2.gz ZTUAHHBPJQUHHI-UONOGXRCSA-N 1 0 305.487 4.372 20 10 DICDRO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2O)s1 ZINC000274281549 1053861185 /nfs/dbraw/zinc/86/11/85/1053861185.db2.gz YMJOOWBKLHDVPX-WDEREUQCSA-N 1 0 313.426 4.117 20 10 DICDRO Cc1cc(C)c(C[NH+]2CCC3(CC2)OCc2ccccc23)c(O)c1 ZINC001231843780 1053885392 /nfs/dbraw/zinc/88/53/92/1053885392.db2.gz AIMGMGDEWHGBJT-UHFFFAOYSA-N 1 0 323.436 4.031 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001231853505 1053890710 /nfs/dbraw/zinc/89/07/10/1053890710.db2.gz LGRCSYNUJGVDJG-UHFFFAOYSA-N 1 0 318.848 4.047 20 10 DICDRO COc1ccc([C@H]2CC[N@H+](Cc3c(C)cc(C)cc3O)C2)cc1 ZINC001231848757 1053891430 /nfs/dbraw/zinc/89/14/30/1053891430.db2.gz LJRHBPUGXZTEBI-KRWDZBQOSA-N 1 0 311.425 4.007 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1Cl ZINC001231869246 1053897943 /nfs/dbraw/zinc/89/79/43/1053897943.db2.gz NKAGYXRTZGMSPH-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc(F)cc2F)cc1Cl ZINC001231869982 1053900372 /nfs/dbraw/zinc/90/03/72/1053900372.db2.gz DDDDGPJLFVRNLW-UHFFFAOYSA-N 1 0 311.759 4.264 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC[C@@H]2CCCCO2)cc1 ZINC000183996902 1053901150 /nfs/dbraw/zinc/90/11/50/1053901150.db2.gz QGZPPLMWBSDOTK-APWZRJJASA-N 1 0 304.478 4.143 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)ccc2ccccc21 ZINC001231878739 1053902629 /nfs/dbraw/zinc/90/26/29/1053902629.db2.gz RMVBBIGMDPFEBP-HNNXBMFYSA-N 1 0 309.331 4.115 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@H]2c2nccs2)ccc2ccccc21 ZINC001231880306 1053902878 /nfs/dbraw/zinc/90/28/78/1053902878.db2.gz BLIMLGGLKOQHEX-MRXNPFEDSA-N 1 0 310.422 4.339 20 10 DICDRO Oc1c(C[N@@H+]2CCCc3ccccc3C2)ccc2ccccc21 ZINC001231880336 1053902964 /nfs/dbraw/zinc/90/29/64/1053902964.db2.gz CBPYQGKSVFYHAR-UHFFFAOYSA-N 1 0 303.405 4.494 20 10 DICDRO C[C@@H]([NH2+]Cc1cnc(-c2ccccc2)o1)c1ccc(N(C)C)cc1 ZINC001354627837 1053926853 /nfs/dbraw/zinc/92/68/53/1053926853.db2.gz ZXGPKPOMKNVRAC-OAHLLOKOSA-N 1 0 321.424 4.258 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CCC12CCOCC2 ZINC001329374677 1053987429 /nfs/dbraw/zinc/98/74/29/1053987429.db2.gz DIUWLSBBFPIGCX-PMPSAXMXSA-N 1 0 315.457 4.045 20 10 DICDRO CC[N@H+](Cc1cccn1Cc1ccccc1)Cc1ccccc1O ZINC001232237906 1053998388 /nfs/dbraw/zinc/99/83/88/1053998388.db2.gz FJSKRXKHDFAXSI-UHFFFAOYSA-N 1 0 320.436 4.264 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccc2)cc1Cl ZINC001232261467 1054004860 /nfs/dbraw/zinc/00/48/60/1054004860.db2.gz IGTNVOZPKJXQQK-OAHLLOKOSA-N 1 0 303.789 4.088 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@H](c3ccccc3)C2)cc1Cl ZINC001232261398 1054006604 /nfs/dbraw/zinc/00/66/04/1054006604.db2.gz GWCQGHCNSLDEHL-AWEZNQCLSA-N 1 0 317.816 4.131 20 10 DICDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1cc(Cl)c(O)cc1O ZINC001232262393 1054006990 /nfs/dbraw/zinc/00/69/90/1054006990.db2.gz FUKYJUHJWPFMDO-OAHLLOKOSA-N 1 0 305.805 4.334 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1Cl ZINC001232263816 1054007284 /nfs/dbraw/zinc/00/72/84/1054007284.db2.gz WLZLBARDBPGKFV-OAHLLOKOSA-N 1 0 321.779 4.227 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1Cl ZINC001232259857 1054007343 /nfs/dbraw/zinc/00/73/43/1054007343.db2.gz LQLKQAVKTRSTGK-OAHLLOKOSA-N 1 0 321.779 4.227 20 10 DICDRO COc1cc(O)c(C[N@H+](C)C/C=C/c2ccccc2)cc1Cl ZINC001232267988 1054010688 /nfs/dbraw/zinc/01/06/88/1054010688.db2.gz KZPBHIGEZZAGKX-RMKNXTFCSA-N 1 0 317.816 4.199 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)[C@@H](C)c1ccccc1 ZINC001200854734 1054043139 /nfs/dbraw/zinc/04/31/39/1054043139.db2.gz SNTYWKFUFBFZNN-CABCVRRESA-N 1 0 300.421 4.174 20 10 DICDRO c1cc2c(cccc2C[NH2+]Cc2ccc(N3CCCC3)cc2)[nH]1 ZINC001330623105 1054044699 /nfs/dbraw/zinc/04/46/99/1054044699.db2.gz WFDUUJIFMUKXAT-UHFFFAOYSA-N 1 0 305.425 4.058 20 10 DICDRO COc1ccccc1C1([NH2+][C@H]2CCc3cccc(O)c32)CCC1 ZINC001330716156 1054049408 /nfs/dbraw/zinc/04/94/08/1054049408.db2.gz WMMMLVIWEQGUCD-INIZCTEOSA-N 1 0 309.409 4.057 20 10 DICDRO Oc1ccc2ccccc2c1C[NH+]1CCC2(CCCCO2)CC1 ZINC001331057344 1054060186 /nfs/dbraw/zinc/06/01/86/1054060186.db2.gz CKKVOYLUCYKMFA-UHFFFAOYSA-N 1 0 311.425 4.081 20 10 DICDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1ccc(N(C)C)cc1O ZINC001232840984 1054127548 /nfs/dbraw/zinc/12/75/48/1054127548.db2.gz PBGITABKTWJIAV-UHFFFAOYSA-N 1 0 318.848 4.134 20 10 DICDRO Cc1cccc(C[N@@H+](Cc2ccc(N(C)C)cc2O)C2CC2)c1C ZINC001232841494 1054128281 /nfs/dbraw/zinc/12/82/81/1054128281.db2.gz INRNZABJACNROA-UHFFFAOYSA-N 1 0 324.468 4.240 20 10 DICDRO C[C@H]([NH2+][C@H](C1CC1)[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000848558830 1054149654 /nfs/dbraw/zinc/14/96/54/1054149654.db2.gz OBXUNZVUYRIHJF-YMRXKLBXSA-N 1 0 309.837 4.044 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C2CC2)[C@@H]2CCCCO2)c(O)c1C ZINC000848560119 1054149791 /nfs/dbraw/zinc/14/97/91/1054149791.db2.gz YUZINMPOPJDXQI-JCGIZDLHSA-N 1 0 303.446 4.007 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)Cc1ccccn1)c1ccc2ccccc2c1O ZINC000848565349 1054151601 /nfs/dbraw/zinc/15/16/01/1054151601.db2.gz NOXFPGLZDNBCHX-LSDHHAIUSA-N 1 0 306.409 4.222 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2noc3ccccc23)cc1 ZINC000848573608 1054156521 /nfs/dbraw/zinc/15/65/21/1054156521.db2.gz WLSZMOUZIQDXKW-CQSZACIVSA-N 1 0 309.413 4.135 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1O ZINC000848574801 1054158049 /nfs/dbraw/zinc/15/80/49/1054158049.db2.gz IPPBLVDSTLBUQF-LBPRGKRZSA-N 1 0 313.388 4.095 20 10 DICDRO Cc1cc(Br)cc(C[NH+](C(C)C)C(C)C)c1O ZINC001233106563 1054185469 /nfs/dbraw/zinc/18/54/69/1054185469.db2.gz JLOXVVBAYCYVDT-UHFFFAOYSA-N 1 0 300.240 4.082 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)cc1 ZINC000184836462 1054202687 /nfs/dbraw/zinc/20/26/87/1054202687.db2.gz NBCJPCZDKZQSIU-CQSZACIVSA-N 1 0 311.425 4.130 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc2c(c1)CCO2 ZINC001335035703 1054205749 /nfs/dbraw/zinc/20/57/49/1054205749.db2.gz PMSAPCQHAMIWII-MRXNPFEDSA-N 1 0 322.452 4.073 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N)cc1)c1cccc(OC(F)(F)F)c1 ZINC001335289561 1054211467 /nfs/dbraw/zinc/21/14/67/1054211467.db2.gz OTDZUYWPYLROJO-NSHDSACASA-N 1 0 310.319 4.018 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC001335523234 1054219221 /nfs/dbraw/zinc/21/92/21/1054219221.db2.gz UGXPBVAVJAVFCS-GVXVVHGQSA-N 1 0 302.443 4.365 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2nccs2)c1 ZINC001233286249 1054221259 /nfs/dbraw/zinc/22/12/59/1054221259.db2.gz MAJQQQPFGNDVNV-OAHLLOKOSA-N 1 0 316.470 4.483 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c1 ZINC001233284511 1054222137 /nfs/dbraw/zinc/22/21/37/1054222137.db2.gz XYBIVZOLXRFPGI-OKILXGFUSA-N 1 0 309.400 4.167 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c1 ZINC001233284434 1054222596 /nfs/dbraw/zinc/22/25/96/1054222596.db2.gz USMNCLMLNJYQNS-HNNXBMFYSA-N 1 0 315.379 4.259 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@H](c3ccncc3)C2)c1 ZINC001233286092 1054223071 /nfs/dbraw/zinc/22/30/71/1054223071.db2.gz FCDWJUFRSLXWBV-INIZCTEOSA-N 1 0 310.441 4.074 20 10 DICDRO CCC[N@H+](Cc1ccccc1)Cc1cc(Cl)cc(OC)c1O ZINC001233289647 1054225442 /nfs/dbraw/zinc/22/54/42/1054225442.db2.gz FUNRBPNWJFDRCI-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCOC3(CCCCC3)C2)c1 ZINC001233286834 1054226507 /nfs/dbraw/zinc/22/65/07/1054226507.db2.gz KQRGKPSSRKYEPP-UHFFFAOYSA-N 1 0 317.473 4.225 20 10 DICDRO CC(C)([NH2+]Cc1ccc(N)cc1)c1ccc(C(F)(F)F)cc1 ZINC001336286581 1054235633 /nfs/dbraw/zinc/23/56/33/1054235633.db2.gz SVBFHXCZNGCMHL-UHFFFAOYSA-N 1 0 308.347 4.313 20 10 DICDRO Cc1nc2ccccc2n1CCC[NH2+][C@H](C)c1ccc(C)cc1O ZINC000184869983 1054236634 /nfs/dbraw/zinc/23/66/34/1054236634.db2.gz UPMWMGZHXRZUPW-OAHLLOKOSA-N 1 0 323.440 4.100 20 10 DICDRO Cc1cccc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2O)c1 ZINC001233451636 1054277280 /nfs/dbraw/zinc/27/72/80/1054277280.db2.gz SOFKJJRHTVBVNW-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CO[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)c1ccccc1 ZINC001337784337 1054285605 /nfs/dbraw/zinc/28/56/05/1054285605.db2.gz AUVULQIKEONQKI-QGPMSJSTSA-N 1 0 311.425 4.226 20 10 DICDRO Cc1csc(CCC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC001337784706 1054286051 /nfs/dbraw/zinc/28/60/51/1054286051.db2.gz DHDSEIPOFCIUGQ-JSGCOSHPSA-N 1 0 316.470 4.236 20 10 DICDRO CC(C)([NH3+])c1ccc(NCc2ccc(N3CCCC3)cc2)cc1 ZINC001337838999 1054289850 /nfs/dbraw/zinc/28/98/50/1054289850.db2.gz YZDORLFOHLDZCS-UHFFFAOYSA-N 1 0 309.457 4.093 20 10 DICDRO CCc1cccc(C[NH2+]CCC2CC(OC(C)(C)C)C2)c1O ZINC000848908174 1054292748 /nfs/dbraw/zinc/29/27/48/1054292748.db2.gz YJYMDAADWRIWCZ-UHFFFAOYSA-N 1 0 305.462 4.028 20 10 DICDRO CCc1cccc(C[NH+]2CCC(c3ncc(C)s3)CC2)c1O ZINC000848908259 1054293368 /nfs/dbraw/zinc/29/33/68/1054293368.db2.gz ZYJFUOAZCWIRNT-UHFFFAOYSA-N 1 0 316.470 4.099 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000185068104 1054344356 /nfs/dbraw/zinc/34/43/56/1054344356.db2.gz ZDNBQUARAGOIOF-INIZCTEOSA-N 1 0 312.457 4.398 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccc(N3CCCC3)cc2)C2CC2)o1 ZINC001341523319 1054393471 /nfs/dbraw/zinc/39/34/71/1054393471.db2.gz PFODXLKCFCBJBV-UHFFFAOYSA-N 1 0 310.441 4.353 20 10 DICDRO CS[C@@H](C[NH2+]Cc1ccc(N2CCCC2)cc1)C(C)(C)C ZINC001342229120 1054419423 /nfs/dbraw/zinc/41/94/23/1054419423.db2.gz OMSAVQFREAHPBS-KRWDZBQOSA-N 1 0 306.519 4.154 20 10 DICDRO CCOc1ccccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001342390455 1054420489 /nfs/dbraw/zinc/42/04/89/1054420489.db2.gz PWXBGNHOJKGZRS-ZBFHGGJFSA-N 1 0 311.425 4.437 20 10 DICDRO CCO[C@@H](C[NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccc1 ZINC001343922488 1054456965 /nfs/dbraw/zinc/45/69/65/1054456965.db2.gz HVJBSHFOKGSBDR-NRFANRHFSA-N 1 0 324.468 4.154 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1OC)c1ccccc1O ZINC000185213188 1054466994 /nfs/dbraw/zinc/46/69/94/1054466994.db2.gz NDWLTOOREGZBOV-IUODEOHRSA-N 1 0 303.377 4.342 20 10 DICDRO CCN(CC)[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)c1ccco1 ZINC000185228079 1054482057 /nfs/dbraw/zinc/48/20/57/1054482057.db2.gz UHZIUWIODGJERG-NVXWUHKLSA-N 1 0 316.445 4.027 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1cccc2c1CCCN2 ZINC001345482999 1054496601 /nfs/dbraw/zinc/49/66/01/1054496601.db2.gz PXHNYSHOESONFL-KBXCAEBGSA-N 1 0 322.452 4.397 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1cccc2c1CCCN2 ZINC001345483025 1054496826 /nfs/dbraw/zinc/49/68/26/1054496826.db2.gz PXHNYSHOESONFL-KSSFIOAISA-N 1 0 322.452 4.397 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)cc1O ZINC000185300831 1054511754 /nfs/dbraw/zinc/51/17/54/1054511754.db2.gz SMHKHLJOMUWRHB-CYBMUJFWSA-N 1 0 323.392 4.110 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2c[nH]c3cccc(C)c23)c1 ZINC000185337173 1054523099 /nfs/dbraw/zinc/52/30/99/1054523099.db2.gz GKZVEEZIRZFRCY-CQSZACIVSA-N 1 0 324.424 4.084 20 10 DICDRO Cc1csc([C@H](C)[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000185323891 1054523602 /nfs/dbraw/zinc/52/36/02/1054523602.db2.gz ZKZPBADMWKDZJA-OLZOCXBDSA-N 1 0 316.470 4.448 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCCc2c[nH]c3ccccc23)c1 ZINC000185396651 1054539480 /nfs/dbraw/zinc/53/94/80/1054539480.db2.gz LFRSNKYKLXAMMK-AWEZNQCLSA-N 1 0 324.424 4.166 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc3ccccc3c2)c(O)c1 ZINC000185406873 1054539512 /nfs/dbraw/zinc/53/95/12/1054539512.db2.gz ZVDBCBUOUCIOKL-YCRPNKLZSA-N 1 0 321.420 4.238 20 10 DICDRO Cc1ccccc1[C@@H](O)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185435394 1054547111 /nfs/dbraw/zinc/54/71/11/1054547111.db2.gz HDGISICOWFCAHZ-QRWLVFNGSA-N 1 0 321.420 4.238 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C1CC2(CC2(F)F)C1 ZINC001347355717 1054566419 /nfs/dbraw/zinc/56/64/19/1054566419.db2.gz FCQUPWWWVTWGDY-UHFFFAOYSA-N 1 0 315.363 4.337 20 10 DICDRO CC[NH+]1CCN(c2ccc(O[C@H](C)c3cccs3)cc2)CC1 ZINC001234657096 1054569948 /nfs/dbraw/zinc/56/99/48/1054569948.db2.gz AWVBAIWRFLLGOK-OAHLLOKOSA-N 1 0 316.470 4.030 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185566948 1054582179 /nfs/dbraw/zinc/58/21/79/1054582179.db2.gz IONOFHRGRCSGPR-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)c(O)c1 ZINC000185571528 1054582601 /nfs/dbraw/zinc/58/26/01/1054582601.db2.gz JDQPWVFPRCHVSF-AWEZNQCLSA-N 1 0 308.381 4.206 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)c2ccc(F)cc2F)c1 ZINC000185601430 1054595584 /nfs/dbraw/zinc/59/55/84/1054595584.db2.gz VOJVCNLSKWMYBV-RYUDHWBXSA-N 1 0 321.367 4.133 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)c2ccc(F)cc2F)c1 ZINC000185601475 1054595866 /nfs/dbraw/zinc/59/58/66/1054595866.db2.gz VOJVCNLSKWMYBV-VXGBXAGGSA-N 1 0 321.367 4.133 20 10 DICDRO CCS[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000185658343 1054607923 /nfs/dbraw/zinc/60/79/23/1054607923.db2.gz LURPTSDJDHSTAZ-XGWLTEMNSA-N 1 0 309.475 4.116 20 10 DICDRO CC[N@H+](Cc1ccncc1)Cc1cccc(-c2ccccc2)c1O ZINC001234993189 1054637914 /nfs/dbraw/zinc/63/79/14/1054637914.db2.gz VXPSYELFLHZWFH-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO Oc1c(C[N@@H+]2CCc3ncsc3C2)cccc1-c1ccccc1 ZINC001234996382 1054638358 /nfs/dbraw/zinc/63/83/58/1054638358.db2.gz GUMMRZGNVBGPAH-UHFFFAOYSA-N 1 0 322.433 4.074 20 10 DICDRO C[N@H+](Cc1cccnc1)Cc1cccc(-c2ccccc2)c1O ZINC001234992651 1054638908 /nfs/dbraw/zinc/63/89/08/1054638908.db2.gz QFENWXQTSROHNA-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2cccc(-c3ccccc3)c2O)cn1 ZINC001234998672 1054639867 /nfs/dbraw/zinc/63/98/67/1054639867.db2.gz LVCXQWFYZADHQS-UHFFFAOYSA-N 1 0 318.420 4.395 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)cccc1-c1ccccc1 ZINC001235000481 1054641389 /nfs/dbraw/zinc/64/13/89/1054641389.db2.gz IPSFNJHJEKJXGB-XLIONFOSSA-N 1 0 323.436 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@]3(CCOC3)C2)cccc1-c1ccccc1 ZINC001235003857 1054641413 /nfs/dbraw/zinc/64/14/13/1054641413.db2.gz YCYCQDNDISNHGM-NRFANRHFSA-N 1 0 323.436 4.062 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc2c(c1)CCCN2 ZINC001348855577 1054689290 /nfs/dbraw/zinc/68/92/90/1054689290.db2.gz GVCXZCTVFNMJDC-KSSFIOAISA-N 1 0 322.452 4.397 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccccc1-c1ccncc1)CC2 ZINC001235620475 1054758198 /nfs/dbraw/zinc/75/81/98/1054758198.db2.gz JVTQFWTVXCFHPZ-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)c(O)c1 ZINC001235685616 1054777352 /nfs/dbraw/zinc/77/73/52/1054777352.db2.gz STPGXEKMVJHYQA-LJQANCHMSA-N 1 0 324.468 4.292 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H]2Cc2ccccn2)c(O)c1 ZINC001235685615 1054779721 /nfs/dbraw/zinc/77/97/21/1054779721.db2.gz STPGXEKMVJHYQA-IBGZPJMESA-N 1 0 324.468 4.292 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1c[nH]c2ccccc21 ZINC001236192909 1054991434 /nfs/dbraw/zinc/99/14/34/1054991434.db2.gz QVNFMZMOTWXSDF-GOSISDBHSA-N 1 0 310.372 4.350 20 10 DICDRO C[NH+]1CCN(c2ccc(C3=CC[C@H](C(F)(F)F)CC3)cc2)CC1 ZINC001236254720 1055037837 /nfs/dbraw/zinc/03/78/37/1055037837.db2.gz RFHHQHXZEHMUJO-INIZCTEOSA-N 1 0 324.390 4.184 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCC[C@@H](C)[C@H]3C)CC2)cc1 ZINC000764434104 1055185809 /nfs/dbraw/zinc/18/58/09/1055185809.db2.gz SRDSWNDHOSYRRC-JXXFODFXSA-N 1 0 316.489 4.078 20 10 DICDRO [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(Cl)cc2[O-])C2CCCC2)CC1 ZINC001236571882 1055193388 /nfs/dbraw/zinc/19/33/88/1055193388.db2.gz LQUSFFLLQOSQMR-JCNLHEQBSA-N 1 0 322.880 4.060 20 10 DICDRO CC(C)CC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000764502559 1055198710 /nfs/dbraw/zinc/19/87/10/1055198710.db2.gz GQUGLASWPFIEPU-JKSUJKDBSA-N 1 0 322.468 4.138 20 10 DICDRO C[C@H]([NH2+]CCc1ccco1)c1ccc(N2CCCCC2)c(F)c1 ZINC000764588116 1055216052 /nfs/dbraw/zinc/21/60/52/1055216052.db2.gz DJGHSFRQALWSHU-HNNXBMFYSA-N 1 0 316.420 4.302 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)CCc2ccco2)cc1 ZINC000764606269 1055218381 /nfs/dbraw/zinc/21/83/81/1055218381.db2.gz HFMPDBCYUAJJTC-HOTGVXAUSA-N 1 0 300.446 4.408 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 ZINC000764636600 1055226816 /nfs/dbraw/zinc/22/68/16/1055226816.db2.gz WHLPHRYEKNKRTE-FQEVSTJZSA-N 1 0 312.457 4.392 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(F)c(C)c1)c1ccc(N(C)C)cc1 ZINC000764744308 1055242333 /nfs/dbraw/zinc/24/23/33/1055242333.db2.gz SCUYSHOSCPVGCG-LJQANCHMSA-N 1 0 300.421 4.441 20 10 DICDRO C[C@H]([NH2+]CCCC1CCCC1)c1ccc(N2CCOCC2)cc1 ZINC000764743718 1055243592 /nfs/dbraw/zinc/24/35/92/1055243592.db2.gz GFWVJQMANCMAEJ-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@@H]1C[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C2(CC2)C1 ZINC001236781798 1055256200 /nfs/dbraw/zinc/25/62/00/1055256200.db2.gz HVYJFAXQIFFTCW-INIZCTEOSA-N 1 0 323.436 4.346 20 10 DICDRO C[N@H+](Cc1cc(OCc2ccccc2)ccc1O)C1CCCC1 ZINC001236787469 1055257167 /nfs/dbraw/zinc/25/71/67/1055257167.db2.gz YJWSVXYUBBXMIW-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[N@@H+]1CCC2(CCC2)C1 ZINC001236790459 1055262418 /nfs/dbraw/zinc/26/24/18/1055262418.db2.gz WEYXCJZMCNIMTM-UHFFFAOYSA-N 1 0 323.436 4.347 20 10 DICDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2OC)c(O)c1 ZINC001236795769 1055264496 /nfs/dbraw/zinc/26/44/96/1055264496.db2.gz ZUODCGJAPHWDDS-GOSISDBHSA-N 1 0 311.425 4.300 20 10 DICDRO CC[N@H+](Cc1cccc(F)c1)Cc1c(O)cc(OC)cc1Cl ZINC001236807805 1055265178 /nfs/dbraw/zinc/26/51/78/1055265178.db2.gz JTOFIVTULWMEDY-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO COc1cc(O)c(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(Cl)c1 ZINC001236799639 1055266503 /nfs/dbraw/zinc/26/65/03/1055266503.db2.gz UESXUCHPASJTBH-LBPRGKRZSA-N 1 0 317.816 4.174 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCCC3(CCCC3)C2)c(Cl)c1 ZINC001236797743 1055266912 /nfs/dbraw/zinc/26/69/12/1055266912.db2.gz IQFNBEIKBVFTRR-UHFFFAOYSA-N 1 0 309.837 4.210 20 10 DICDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1c(C)cc(OC)cc1O ZINC001236821841 1055276044 /nfs/dbraw/zinc/27/60/44/1055276044.db2.gz USKGAFAFHLRIRA-LJQANCHMSA-N 1 0 311.425 4.219 20 10 DICDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1c(C)cc(OC)cc1O ZINC001236821839 1055276954 /nfs/dbraw/zinc/27/69/54/1055276954.db2.gz USKGAFAFHLRIRA-IBGZPJMESA-N 1 0 311.425 4.219 20 10 DICDRO COc1cccc2c1C[N@H+](Cc1cc3ccccc3cc1O)CC2 ZINC001236827958 1055280565 /nfs/dbraw/zinc/28/05/65/1055280565.db2.gz XKYVZCBXXPOVDJ-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO C[C@@H](CSC(C)(C)C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000764903517 1055290298 /nfs/dbraw/zinc/29/02/98/1055290298.db2.gz VAQYZSWQMXDYAL-HNNXBMFYSA-N 1 0 306.519 4.297 20 10 DICDRO CCOc1ccc(C[N@H+]2CC=C(c3ccccc3)CC2)c(O)c1 ZINC001237044759 1055349076 /nfs/dbraw/zinc/34/90/76/1055349076.db2.gz UDIRCBFMZFASCC-UHFFFAOYSA-N 1 0 309.409 4.080 20 10 DICDRO CCOc1ccc(C[N@H+](CC)Cc2cccc(F)c2F)c(O)c1 ZINC001237047229 1055349226 /nfs/dbraw/zinc/34/92/26/1055349226.db2.gz VOZYETJQPKBJEQ-UHFFFAOYSA-N 1 0 321.367 4.091 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCOC[C@H]2C2CCCCC2)c(O)c1 ZINC001237056731 1055353353 /nfs/dbraw/zinc/35/33/53/1055353353.db2.gz ZHGIQTYFVBGJTA-IBGZPJMESA-N 1 0 317.473 4.297 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)CCC(=O)c2cccs2)c(O)c1 ZINC001237056546 1055355315 /nfs/dbraw/zinc/35/53/15/1055355315.db2.gz YXWDPZDTCROPTJ-UHFFFAOYSA-N 1 0 317.454 4.282 20 10 DICDRO CC[C@H]1CCCC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001237060533 1055360750 /nfs/dbraw/zinc/36/07/50/1055360750.db2.gz VCJBZFYJROHNKE-ZDUSSCGKSA-N 1 0 317.351 4.098 20 10 DICDRO CCC(CC)[N@H+](CC)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237060004 1055360931 /nfs/dbraw/zinc/36/09/31/1055360931.db2.gz SHTBTSOJMWEOKE-UHFFFAOYSA-N 1 0 319.367 4.344 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2COc3ccccc3C2)cc1 ZINC000765334664 1055364487 /nfs/dbraw/zinc/36/44/87/1055364487.db2.gz QQTAAZLQYGSNDQ-DLBZAZTESA-N 1 0 324.468 4.045 20 10 DICDRO C[C@H]1CCC[C@H](C)[NH+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237118802 1055375314 /nfs/dbraw/zinc/37/53/14/1055375314.db2.gz BEDXLXUHISPPAV-QWRGUYRKSA-N 1 0 303.324 4.054 20 10 DICDRO C[C@@H]1CCCCC[N@@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237111132 1055375501 /nfs/dbraw/zinc/37/55/01/1055375501.db2.gz OIBDUQAWNHCKFB-LLVKDONJSA-N 1 0 303.324 4.055 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC001237137250 1055378506 /nfs/dbraw/zinc/37/85/06/1055378506.db2.gz NPFUFKCXVPVLHL-OAHLLOKOSA-N 1 0 322.330 4.143 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(C)c(OC)c1)c1ccc(N(C)C)cc1 ZINC000765401621 1055378600 /nfs/dbraw/zinc/37/86/00/1055378600.db2.gz HHPOFDLLDILMIG-LJQANCHMSA-N 1 0 312.457 4.311 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC001237138770 1055378915 /nfs/dbraw/zinc/37/89/15/1055378915.db2.gz GHJDGOKRQNABSS-OAHLLOKOSA-N 1 0 322.330 4.143 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001237126676 1055379227 /nfs/dbraw/zinc/37/92/27/1055379227.db2.gz OLTUOUHQQAWGQA-LLVKDONJSA-N 1 0 323.770 4.313 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(C)c(OC)c2)cc1 ZINC000765402635 1055380314 /nfs/dbraw/zinc/38/03/14/1055380314.db2.gz KSZPGPCQOURTJC-MRXNPFEDSA-N 1 0 312.457 4.311 20 10 DICDRO C[N@H+](Cc1c(O)ccc(F)c1Cl)[C@@H]1CCc2ccccc21 ZINC001237128539 1055381248 /nfs/dbraw/zinc/38/12/48/1055381248.db2.gz RIJPOVCOIHTTEP-OAHLLOKOSA-N 1 0 305.780 4.304 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2cc(C(F)(F)F)ccc2O)CCC1(F)F ZINC001237135658 1055381574 /nfs/dbraw/zinc/38/15/74/1055381574.db2.gz KIQPEZGRGSEOAX-SNVBAGLBSA-N 1 0 323.305 4.278 20 10 DICDRO C[C@H]([NH2+][C@H]1CSCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000765423921 1055383708 /nfs/dbraw/zinc/38/37/08/1055383708.db2.gz JPZYMLIWCDRXPW-LIRRHRJNSA-N 1 0 312.482 4.391 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC001237140003 1055384847 /nfs/dbraw/zinc/38/48/47/1055384847.db2.gz SXPPPWIMZBMPOZ-OAHLLOKOSA-N 1 0 322.330 4.143 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2F)cc1 ZINC000765461727 1055396243 /nfs/dbraw/zinc/39/62/43/1055396243.db2.gz BKVJDNMFCORBOI-ZDUSSCGKSA-N 1 0 304.384 4.272 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2F)cc1 ZINC000765461723 1055396838 /nfs/dbraw/zinc/39/68/38/1055396838.db2.gz BKVJDNMFCORBOI-CYBMUJFWSA-N 1 0 304.384 4.272 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCCN3C)CC2 ZINC000765481711 1055404025 /nfs/dbraw/zinc/40/40/25/1055404025.db2.gz QCHUJEFVBPXBRA-HXUWFJFHSA-N 1 0 306.453 4.155 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc3nccc(Cl)c3c1)CC2 ZINC001237274146 1055412282 /nfs/dbraw/zinc/41/22/82/1055412282.db2.gz ZTJIJPWWCYDJDC-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001237350928 1055437632 /nfs/dbraw/zinc/43/76/32/1055437632.db2.gz UKZHLNFNRUIWOK-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO C[C@@H]([NH2+]CC1(O)CCCCC1)c1ccc(N2CCCCC2)cc1 ZINC000765549687 1055451346 /nfs/dbraw/zinc/45/13/46/1055451346.db2.gz WISLHNLGOWHCKN-QGZVFWFLSA-N 1 0 316.489 4.023 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC(Cc2ccccc2F)CC1 ZINC001237488090 1055458213 /nfs/dbraw/zinc/45/82/13/1055458213.db2.gz QRAAFBMFOPDFOS-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO Cc1ccccc1OC1CC[NH+](Cc2c(C)cccc2O)CC1 ZINC001237482697 1055458578 /nfs/dbraw/zinc/45/85/78/1055458578.db2.gz NIXFWKDFIBBMGH-UHFFFAOYSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC(n2ccc3ccccc32)CC1 ZINC001237493389 1055461731 /nfs/dbraw/zinc/46/17/31/1055461731.db2.gz XZNPXPLIPPBVSD-UHFFFAOYSA-N 1 0 320.436 4.492 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC001237493406 1055462475 /nfs/dbraw/zinc/46/24/75/1055462475.db2.gz YEGFIVALCUIJBT-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cccc3c(F)cccc13)CC2 ZINC001237518771 1055466153 /nfs/dbraw/zinc/46/61/53/1055466153.db2.gz QEWJTZZKHKWZDZ-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO C[N@H+](Cc1cccnc1)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237640843 1055491240 /nfs/dbraw/zinc/49/12/40/1055491240.db2.gz GMDUWJIAKCFKFH-UHFFFAOYSA-N 1 0 322.383 4.225 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1cccc(F)c1F ZINC001620867622 1055493940 /nfs/dbraw/zinc/49/39/40/1055493940.db2.gz UCGONEWXUVNPOH-LBPRGKRZSA-N 1 0 303.352 4.141 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCC[C@H](CF)C1 ZINC001237647284 1055494080 /nfs/dbraw/zinc/49/40/80/1055494080.db2.gz SWZZAKRPUSYXGW-CQSZACIVSA-N 1 0 317.379 4.380 20 10 DICDRO CCC(CC)[C@H](CC[NH2+]Cc1c(O)cc(C)cc1Cl)OC ZINC001620868423 1055495475 /nfs/dbraw/zinc/49/54/75/1055495475.db2.gz CKKANAJIVPPGKB-KRWDZBQOSA-N 1 0 313.869 4.285 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC3(CC(F)(F)C3)CC2)c1O ZINC001237682072 1055503057 /nfs/dbraw/zinc/50/30/57/1055503057.db2.gz WPSFVRQLSNKZFR-UHFFFAOYSA-N 1 0 315.791 4.365 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(Cl)cc(C)c1O ZINC001237687181 1055503502 /nfs/dbraw/zinc/50/35/02/1055503502.db2.gz UEFCESBZAMNIDX-UHFFFAOYSA-N 1 0 305.805 4.082 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c1O ZINC001237684254 1055503842 /nfs/dbraw/zinc/50/38/42/1055503842.db2.gz AJBDECXAGHHRBE-HNNXBMFYSA-N 1 0 311.828 4.458 20 10 DICDRO Cc1cc(O)c(C[NH+]2CC3(C2)CCCCC3)cc1Br ZINC001237680498 1055505176 /nfs/dbraw/zinc/50/51/76/1055505176.db2.gz CPNPBFDNIHMLGV-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765610646 1055513602 /nfs/dbraw/zinc/51/36/02/1055513602.db2.gz WSAQYDYZRQKIFK-GFCCVEGCSA-N 1 0 317.816 4.134 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3cccc(O)c3C2)ccc1OC(C)C ZINC001237727660 1055515392 /nfs/dbraw/zinc/51/53/92/1055515392.db2.gz NOEMWBVLQODPQV-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@H](OC(C)C)C2(C)C)c(Cl)c1 ZINC001620893084 1055517419 /nfs/dbraw/zinc/51/74/19/1055517419.db2.gz BKUDWVCAXDXUCC-CVEARBPZSA-N 1 0 311.853 4.036 20 10 DICDRO CCc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCCO3)CCO2 ZINC001620895513 1055521949 /nfs/dbraw/zinc/52/19/49/1055521949.db2.gz DUDVETMVOPJXDF-LJQANCHMSA-N 1 0 323.436 4.187 20 10 DICDRO Oc1ccccc1C[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000765627024 1055524403 /nfs/dbraw/zinc/52/44/03/1055524403.db2.gz UMUAQGDGCIZUNG-HNNXBMFYSA-N 1 0 303.789 4.049 20 10 DICDRO CO[C@@H](C)CC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765632212 1055529319 /nfs/dbraw/zinc/52/93/19/1055529319.db2.gz YCEHEETYGPGJCR-IRXDYDNUSA-N 1 0 304.478 4.143 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC(C)(C)C(F)(F)F)cc1F ZINC001620911558 1055535553 /nfs/dbraw/zinc/53/55/53/1055535553.db2.gz OJZUZROAMIWWDZ-UHFFFAOYSA-N 1 0 320.374 4.350 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCc1ccc2[nH]ccc2c1 ZINC001620911922 1055535961 /nfs/dbraw/zinc/53/59/61/1055535961.db2.gz BBEOQELMPJLNPW-UHFFFAOYSA-N 1 0 317.436 4.300 20 10 DICDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(F)c(Cl)cc1[O-] ZINC001237950424 1055563463 /nfs/dbraw/zinc/56/34/63/1055563463.db2.gz SXOKDZUIWUEHTO-NSHDSACASA-N 1 0 323.795 4.386 20 10 DICDRO CC[N@H+](Cc1ccc(F)c(OC(C)C)c1)Cc1ccccc1O ZINC001238456823 1055663337 /nfs/dbraw/zinc/66/33/37/1055663337.db2.gz AFKMKQJOCMJMHR-UHFFFAOYSA-N 1 0 317.404 4.341 20 10 DICDRO CSc1ccc(Cl)cc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001238681771 1055719570 /nfs/dbraw/zinc/71/95/70/1055719570.db2.gz TXIPHQBAYXLVIC-UHFFFAOYSA-N 1 0 319.857 4.326 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c2ccccc12 ZINC001620971900 1055772289 /nfs/dbraw/zinc/77/22/89/1055772289.db2.gz DDKSHSVPPWCTPF-UHFFFAOYSA-N 1 0 303.405 4.373 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(SC)cc2)c1 ZINC000282191127 1055784306 /nfs/dbraw/zinc/78/43/06/1055784306.db2.gz KULZIKGXCNAEFO-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO Cc1sccc1C[NH2+][C@H](C)Cc1ccc(N(C)C)cc1C ZINC001620974227 1055811333 /nfs/dbraw/zinc/81/13/33/1055811333.db2.gz GJXQWSQULHIWEB-CQSZACIVSA-N 1 0 302.487 4.152 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)c(Cl)c1 ZINC001620751897 1055926164 /nfs/dbraw/zinc/92/61/64/1055926164.db2.gz KBCJEZWVBXNWAM-UHFFFAOYSA-N 1 0 314.860 4.321 20 10 DICDRO C[C@@H](CCc1ccccc1)C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001620751723 1055926355 /nfs/dbraw/zinc/92/63/55/1055926355.db2.gz BBCZZJBJOVAGLI-SFHVURJKSA-N 1 0 322.496 4.428 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC(C)(C)c2ccc(F)cc2)cc1F ZINC001620771525 1055939955 /nfs/dbraw/zinc/93/99/55/1055939955.db2.gz HTACJTZIJRZJCZ-UHFFFAOYSA-N 1 0 318.411 4.098 20 10 DICDRO CCN(C)c1ccccc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC001620773672 1055940813 /nfs/dbraw/zinc/94/08/13/1055940813.db2.gz RDCDHJKRXWCISK-UHFFFAOYSA-N 1 0 321.468 4.233 20 10 DICDRO COc1ccc(C[NH2+][C@H](c2ccccc2)c2cccnc2)cc1C ZINC001649085705 1055946202 /nfs/dbraw/zinc/94/62/02/1055946202.db2.gz XVCQXSPNBFZBCX-OAQYLSRUSA-N 1 0 318.420 4.278 20 10 DICDRO Cc1cc(C[N@H+](Cc2ccccn2)CC(C)C)ccc1N(C)C ZINC001620601801 1055972988 /nfs/dbraw/zinc/97/29/88/1055972988.db2.gz MCVRPLZWFMQZTO-UHFFFAOYSA-N 1 0 311.473 4.114 20 10 DICDRO CC(C)[C@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1 ZINC001620709703 1055985060 /nfs/dbraw/zinc/98/50/60/1055985060.db2.gz UHUGERBLLYOQOM-SFHVURJKSA-N 1 0 314.448 4.421 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCO[C@@H]1CCCC[C@H]1C ZINC001620721072 1055986269 /nfs/dbraw/zinc/98/62/69/1055986269.db2.gz FUWPNEGDCWXLKK-FOIQADDNSA-N 1 0 314.473 4.172 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)COc1cccc(C)c1 ZINC001620739419 1055990805 /nfs/dbraw/zinc/99/08/05/1055990805.db2.gz RBIRJRCRPCQTOD-INIZCTEOSA-N 1 0 322.452 4.352 20 10 DICDRO C1=C[C@H](C[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 ZINC001621047561 1056005741 /nfs/dbraw/zinc/00/57/41/1056005741.db2.gz WSOSRXSHDGZFKF-SFHVURJKSA-N 1 0 318.464 4.305 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2(CC3CC3)CC2)cc1F ZINC001621049131 1056007906 /nfs/dbraw/zinc/00/79/06/1056007906.db2.gz OSCGPDVZTHYDAQ-UHFFFAOYSA-N 1 0 304.453 4.342 20 10 DICDRO COc1ccc(-c2[nH+]ccc3c2ccn3Cc2ccccc2)cn1 ZINC001239724134 1056042980 /nfs/dbraw/zinc/04/29/80/1056042980.db2.gz SXQAMJAMQHMZBG-UHFFFAOYSA-N 1 0 315.376 4.155 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCCO[C@H]1C(C)C ZINC001620818770 1056101022 /nfs/dbraw/zinc/10/10/22/1056101022.db2.gz FJSSCGUYVUCOIX-UZLBHIALSA-N 1 0 314.473 4.028 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](c2ccccc2)N(C)C)c(O)c1 ZINC000186320593 1056104565 /nfs/dbraw/zinc/10/45/65/1056104565.db2.gz NOTBVMYCEZVCFG-YRNRMSPPSA-N 1 0 312.457 4.043 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)c1 ZINC000765818590 1056183579 /nfs/dbraw/zinc/18/35/79/1056183579.db2.gz FUYYNRONXGCYQR-PBHICJAKSA-N 1 0 313.445 4.206 20 10 DICDRO CCN(C)c1ccc(C[N@H+](CC)Cc2ccc(OC)cc2)cc1 ZINC001615185030 1056471535 /nfs/dbraw/zinc/47/15/35/1056471535.db2.gz VQXXKBYDHGOVRF-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO Cc1ccc(F)cc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001615219864 1056478193 /nfs/dbraw/zinc/47/81/93/1056478193.db2.gz SBRUDWONERNREB-UHFFFAOYSA-N 1 0 312.432 4.365 20 10 DICDRO CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765921859 1056485155 /nfs/dbraw/zinc/48/51/55/1056485155.db2.gz MKNVFRLHHDPWRA-UZLBHIALSA-N 1 0 318.505 4.125 20 10 DICDRO Cc1ccccc1[C@H]1C[C@H](C)[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001615622030 1056547014 /nfs/dbraw/zinc/54/70/14/1056547014.db2.gz OFEUFOKRHTZXIY-HKUYNNGSSA-N 1 0 308.469 4.439 20 10 DICDRO CCOc1ccc(N(CC)C[C@@H]2CCCC[N@@H+]2C(C)C)cc1 ZINC001616180967 1056616801 /nfs/dbraw/zinc/61/68/01/1056616801.db2.gz STANWOGLFYXSDX-SFHVURJKSA-N 1 0 304.478 4.175 20 10 DICDRO CC(C)[C@@](C)(O)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765955492 1056623288 /nfs/dbraw/zinc/62/32/88/1056623288.db2.gz WNHSKIYBZVYVML-PXNSSMCTSA-N 1 0 318.505 4.125 20 10 DICDRO c1ccc([C@@H]2C[C@@H]([NH2+]Cc3ccc4c(c3)CCCO4)CCO2)cc1 ZINC000922000523 1056724003 /nfs/dbraw/zinc/72/40/03/1056724003.db2.gz MDGNCZHSXUFLBB-FPOVZHCZSA-N 1 0 323.436 4.022 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c1O ZINC001143103365 1056763101 /nfs/dbraw/zinc/76/31/01/1056763101.db2.gz ATGUMDJLJRDAGG-AWEZNQCLSA-N 1 0 315.379 4.259 20 10 DICDRO CC(C)Oc1ccc(N(C)C[C@H]2CCCC[N@@H+]2C(C)C)cc1 ZINC001617190192 1056791038 /nfs/dbraw/zinc/79/10/38/1056791038.db2.gz FEWQNIHTMYZXJG-GOSISDBHSA-N 1 0 304.478 4.173 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000186568450 1057051263 /nfs/dbraw/zinc/05/12/63/1057051263.db2.gz AWHHJRZPHAHDGL-DYVFJYSZSA-N 1 0 317.502 4.362 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000766005413 1057076621 /nfs/dbraw/zinc/07/66/21/1057076621.db2.gz ITXKVJHPWLXDLH-HKUYNNGSSA-N 1 0 323.484 4.072 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)c1ncc(C)s1)c1ccc(N(C)C)cc1 ZINC000186772667 1057121640 /nfs/dbraw/zinc/12/16/40/1057121640.db2.gz PWIRPYQLBUVAJH-SUMWQHHRSA-N 1 0 317.502 4.362 20 10 DICDRO Cc1cc(Br)cc([C@H](C)[NH2+]C/C=C\C2CC2)c1O ZINC001117749819 1057161156 /nfs/dbraw/zinc/16/11/56/1057161156.db2.gz CEGVITSKOSAOFU-BYCRGOAPSA-N 1 0 310.235 4.080 20 10 DICDRO CO[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@@H](C)C1 ZINC000282522665 1057281987 /nfs/dbraw/zinc/28/19/87/1057281987.db2.gz ZTJLTPCGRLBZDQ-HNAYVOBHSA-N 1 0 311.425 4.059 20 10 DICDRO Fc1cccc2c1CC[C@H]2[NH2+]CCCSc1nccs1 ZINC000766074252 1057285809 /nfs/dbraw/zinc/28/58/09/1057285809.db2.gz VGJBZXKBNMPGFY-CQSZACIVSA-N 1 0 308.447 4.042 20 10 DICDRO CSC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766082162 1057299737 /nfs/dbraw/zinc/29/97/37/1057299737.db2.gz BXNQYHLWZONDMR-HZPDHXFCSA-N 1 0 306.519 4.469 20 10 DICDRO COc1ccc(N2CCC([NH2+]CCCCC(C)C)CC2)cc1 ZINC000766118360 1057351425 /nfs/dbraw/zinc/35/14/25/1057351425.db2.gz FAJJTBLFCQJTTL-UHFFFAOYSA-N 1 0 304.478 4.080 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)C ZINC000766164011 1057529937 /nfs/dbraw/zinc/52/99/37/1057529937.db2.gz WPQSWFDGXDLJFE-MAUKXSAKSA-N 1 0 322.468 4.138 20 10 DICDRO COc1ccc(C[NH2+]CCc2ccc3ccccc3c2)cc1C ZINC001649134549 1057556500 /nfs/dbraw/zinc/55/65/00/1057556500.db2.gz ZTSSPURHNYEZAP-UHFFFAOYSA-N 1 0 305.421 4.489 20 10 DICDRO C[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C(C1CC1)C1CC1 ZINC000727165859 1057640650 /nfs/dbraw/zinc/64/06/50/1057640650.db2.gz JKGZXOPAFXYOHL-UHFFFAOYSA-N 1 0 303.446 4.016 20 10 DICDRO CCCCCC[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000727463940 1057655107 /nfs/dbraw/zinc/65/51/07/1057655107.db2.gz NHJDOGZQOIOSAH-MRXNPFEDSA-N 1 0 322.468 4.111 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC000727645282 1057662405 /nfs/dbraw/zinc/66/24/05/1057662405.db2.gz UWQXBEBLJNUPLD-MRXNPFEDSA-N 1 0 324.468 4.319 20 10 DICDRO C[N@H+](Cc1ccc(F)cc1Cl)Cc1cc2c(cc1O)CCC2 ZINC000730453954 1057715197 /nfs/dbraw/zinc/71/51/97/1057715197.db2.gz DLQOZZVUJFGKIU-UHFFFAOYSA-N 1 0 319.807 4.305 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000730453705 1057715465 /nfs/dbraw/zinc/71/54/65/1057715465.db2.gz ACIMLJFRSZWLHR-HNNXBMFYSA-N 1 0 322.383 4.069 20 10 DICDRO CCc1nc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)cs1 ZINC000730818488 1057726527 /nfs/dbraw/zinc/72/65/27/1057726527.db2.gz WCFSDTKQRUTBEE-UHFFFAOYSA-N 1 0 324.449 4.368 20 10 DICDRO Oc1ccccc1C[N@H+](CCOc1ccccc1)C1CCCC1 ZINC000731846424 1057756274 /nfs/dbraw/zinc/75/62/74/1057756274.db2.gz YRJLLTTZLRERNV-UHFFFAOYSA-N 1 0 311.425 4.216 20 10 DICDRO C[N@H+](CCOc1ccc2ccccc2c1)Cc1ccccc1O ZINC000732203356 1057770578 /nfs/dbraw/zinc/77/05/78/1057770578.db2.gz ZMERMLOJYHUSSH-UHFFFAOYSA-N 1 0 307.393 4.056 20 10 DICDRO C[N@H+](CCOc1cccc2ccccc21)Cc1ccccc1O ZINC000732202884 1057770815 /nfs/dbraw/zinc/77/08/15/1057770815.db2.gz HPKLVDFZDBFDAA-UHFFFAOYSA-N 1 0 307.393 4.056 20 10 DICDRO COc1ccc(C[N@H+](Cc2cc3c(cc2O)CCC3)C2CC2)cc1 ZINC000732474497 1057775921 /nfs/dbraw/zinc/77/59/21/1057775921.db2.gz PIZUQJIJRCVKKO-UHFFFAOYSA-N 1 0 323.436 4.054 20 10 DICDRO COc1cc(C[N@H+](C)Cc2ccsc2)c(O)c(C(C)(C)C)c1 ZINC000732521572 1057777982 /nfs/dbraw/zinc/77/79/82/1057777982.db2.gz XNZBSVDHEARTDF-UHFFFAOYSA-N 1 0 319.470 4.392 20 10 DICDRO C[C@H](c1ccc(Br)cc1)[N@H+](C)Cc1ccccc1O ZINC000732808053 1057788091 /nfs/dbraw/zinc/78/80/91/1057788091.db2.gz GSQKAVGARUTZCI-GFCCVEGCSA-N 1 0 320.230 4.348 20 10 DICDRO C[C@@H](c1ccc(Br)cc1)[N@H+](C)Cc1ccccc1O ZINC000732808054 1057788347 /nfs/dbraw/zinc/78/83/47/1057788347.db2.gz GSQKAVGARUTZCI-LBPRGKRZSA-N 1 0 320.230 4.348 20 10 DICDRO Cc1ccc(SCC[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000733322640 1057811840 /nfs/dbraw/zinc/81/18/40/1057811840.db2.gz QXSQBNQQVGMUAO-UHFFFAOYSA-N 1 0 318.461 4.082 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCCCOc1ccc(F)cc1 ZINC000733323946 1057811915 /nfs/dbraw/zinc/81/19/15/1057811915.db2.gz AWYNKOMDQSUULZ-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO Cc1ccc2c(CC[NH2+]Cc3c(O)cccc3Cl)c[nH]c2c1 ZINC000733327031 1057812680 /nfs/dbraw/zinc/81/26/80/1057812680.db2.gz JRUOUQDMJDMESP-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCc1ccc(F)cc1Cl ZINC000733330487 1057814198 /nfs/dbraw/zinc/81/41/98/1057814198.db2.gz ZLKJJTBENFXCHA-UHFFFAOYSA-N 1 0 314.187 4.170 20 10 DICDRO Cc1cc(-c2[nH+]ccc3c2ccn3Cc2ccccc2)cnc1N ZINC001245536209 1058215176 /nfs/dbraw/zinc/21/51/76/1058215176.db2.gz REYIOCDKCZOGGY-UHFFFAOYSA-N 1 0 314.392 4.037 20 10 DICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC001559492083 1059269425 /nfs/dbraw/zinc/26/94/25/1059269425.db2.gz DIAKZTJAGCBDRP-VBUUOAMHSA-N 1 0 322.443 4.254 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@H]1CCC2(CCC2)O1)C1CCCC1 ZINC001559529966 1059331003 /nfs/dbraw/zinc/33/10/03/1059331003.db2.gz GSCMDNYJJWJEFY-GOSISDBHSA-N 1 0 315.457 4.239 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3C)C2)cc1 ZINC001559575842 1059407778 /nfs/dbraw/zinc/40/77/78/1059407778.db2.gz MOIQAYWNLKHKPP-OAQYLSRUSA-N 1 0 324.468 4.025 20 10 DICDRO Cc1cc(C[N@@H+](C)[C@@H](C)Cc2ccsc2)ccc1N(C)C ZINC001559583307 1059415527 /nfs/dbraw/zinc/41/55/27/1059415527.db2.gz CNQIMNHUFPPCTB-HNNXBMFYSA-N 1 0 302.487 4.186 20 10 DICDRO CCC1(CC)[C@@H](OC)C[C@@H]1[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC001559612366 1059442947 /nfs/dbraw/zinc/44/29/47/1059442947.db2.gz ULUTVUORQBHSMD-OALUTQOASA-N 1 0 318.505 4.087 20 10 DICDRO CCOc1ccc(N2CC[NH+](C[C@@H]3CCC[C@H](C)C3)CC2)cc1 ZINC001559667087 1059495358 /nfs/dbraw/zinc/49/53/58/1059495358.db2.gz KKRZBPFCLPMMQX-ZWKOTPCHSA-N 1 0 316.489 4.034 20 10 DICDRO CCOc1ccc(N2CC[NH+]([C@@H]3C=CCCCCC3)CC2)cc1 ZINC001559667052 1059495752 /nfs/dbraw/zinc/49/57/52/1059495752.db2.gz JHQOZFCYEUZQFI-GOSISDBHSA-N 1 0 314.473 4.096 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)CC(C)(C)C ZINC001559709685 1059539390 /nfs/dbraw/zinc/53/93/90/1059539390.db2.gz NPQVMBHYIAUXKM-SJORKVTESA-N 1 0 318.505 4.246 20 10 DICDRO Cc1ccccc1C1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC001559735325 1059565070 /nfs/dbraw/zinc/56/50/70/1059565070.db2.gz KGUOAIPKXIWFHM-UHFFFAOYSA-N 1 0 308.469 4.441 20 10 DICDRO Cc1cccc([C@@H]2CC[N@@H+](Cc3ccc(N(C)C)c(C)c3)C2)c1 ZINC001559743904 1059577169 /nfs/dbraw/zinc/57/71/69/1059577169.db2.gz WXGXWJYLFFJURV-HXUWFJFHSA-N 1 0 308.469 4.359 20 10 DICDRO CCCC[N@H+](Cc1cc(F)cc(F)c1)Cc1ccccc1O ZINC001559790294 1059625418 /nfs/dbraw/zinc/62/54/18/1059625418.db2.gz NWTKZCOOROAZLB-UHFFFAOYSA-N 1 0 305.368 4.473 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)CC[C@H]2CCC[C@H](C)C2)cc1 ZINC001559966975 1059775173 /nfs/dbraw/zinc/77/51/73/1059775173.db2.gz PWGRNLFVJXYTSB-ZWKOTPCHSA-N 1 0 318.505 4.280 20 10 DICDRO COc1ccc(C)cc1CC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001560253184 1060021906 /nfs/dbraw/zinc/02/19/06/1060021906.db2.gz ZKKCPSHBTIESAP-UHFFFAOYSA-N 1 0 319.832 4.003 20 10 DICDRO CC(C)(C)c1cc(O)c(C[NH+]2CCC3(CCO3)CC2)cc1Cl ZINC001248883214 1060037435 /nfs/dbraw/zinc/03/74/35/1060037435.db2.gz AZLHHLNJKSTXGN-UHFFFAOYSA-N 1 0 323.864 4.098 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](C)c2ccc(C)cc2)ccc1OC ZINC001560276016 1060052373 /nfs/dbraw/zinc/05/23/73/1060052373.db2.gz ZNIYIDHVAIIMQK-INIZCTEOSA-N 1 0 313.441 4.391 20 10 DICDRO CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001560300909 1060085603 /nfs/dbraw/zinc/08/56/03/1060085603.db2.gz ALVMQMGWMDDSQJ-MNEFBYGVSA-N 1 0 301.474 4.420 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CC2(O)CCCCC2)cc1 ZINC001560307333 1060095091 /nfs/dbraw/zinc/09/50/91/1060095091.db2.gz UELZIRKLHGAFDQ-UHFFFAOYSA-N 1 0 318.505 4.098 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](C)Oc2ccccc2)cc1C ZINC001560338997 1060125414 /nfs/dbraw/zinc/12/54/14/1060125414.db2.gz VYUXUTQCAVTHNA-QGZVFWFLSA-N 1 0 313.441 4.341 20 10 DICDRO CC[C@H](C[NH2+]Cc1c(O)cccc1Cl)Oc1ccccc1C ZINC001560357067 1060143313 /nfs/dbraw/zinc/14/33/13/1060143313.db2.gz DNKQOBYKCJBTBY-CQSZACIVSA-N 1 0 319.832 4.301 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001560379798 1060165360 /nfs/dbraw/zinc/16/53/60/1060165360.db2.gz APNUABITPURZET-KKHYBRAUSA-N 1 0 322.452 4.052 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001560379800 1060165467 /nfs/dbraw/zinc/16/54/67/1060165467.db2.gz APNUABITPURZET-RRFGBZISSA-N 1 0 322.452 4.052 20 10 DICDRO Cc1c2ccccc2n(C)c1CNc1ccc(CC[NH+](C)C)cc1 ZINC001560383278 1060169664 /nfs/dbraw/zinc/16/96/64/1060169664.db2.gz VBGMIPBRRRHCPW-UHFFFAOYSA-N 1 0 321.468 4.203 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccsc2)cc1F ZINC001560402800 1060187606 /nfs/dbraw/zinc/18/76/06/1060187606.db2.gz HCZJCIYXGSSONW-UHFFFAOYSA-N 1 0 306.450 4.066 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CC[C@H]4CCC[C@@H]4C3)ccc2O1 ZINC001249230504 1060197442 /nfs/dbraw/zinc/19/74/42/1060197442.db2.gz JNQPJRMZROURFC-HUUCEWRRSA-N 1 0 313.441 4.198 20 10 DICDRO CC(C)[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)CC1CC1 ZINC001249245167 1060199736 /nfs/dbraw/zinc/19/97/36/1060199736.db2.gz ZOSQUDUCPWOVGJ-UHFFFAOYSA-N 1 0 301.430 4.197 20 10 DICDRO CS[C@@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)C(C)(C)C ZINC001560437312 1060225566 /nfs/dbraw/zinc/22/55/66/1060225566.db2.gz LEQRQBNHZZPLFJ-AWEZNQCLSA-N 1 0 301.883 4.221 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001560444699 1060234357 /nfs/dbraw/zinc/23/43/57/1060234357.db2.gz BUZBXAIOYSWIBA-INIZCTEOSA-N 1 0 321.468 4.404 20 10 DICDRO CCSc1ccccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001249440341 1060250376 /nfs/dbraw/zinc/25/03/76/1060250376.db2.gz ICIPETHTSNSLMG-UHFFFAOYSA-N 1 0 314.498 4.497 20 10 DICDRO COc1cc(C[NH2+]C[C@@H]2C[C@H]2C(C)C)c(O)c(C(C)(C)C)c1 ZINC001560474655 1060264129 /nfs/dbraw/zinc/26/41/29/1060264129.db2.gz YAWAFPKCGBTNPZ-BBRMVZONSA-N 1 0 305.462 4.080 20 10 DICDRO CC/C=C/C[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560485814 1060278446 /nfs/dbraw/zinc/27/84/46/1060278446.db2.gz HPLPRESPMIVXOU-XVNBXDOJSA-N 1 0 306.453 4.305 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+][C@H]3CCCC(C)(C)C3)C2)cc1 ZINC001560512305 1060308456 /nfs/dbraw/zinc/30/84/56/1060308456.db2.gz QKKRPOYQCJZTNC-SJORKVTESA-N 1 0 316.489 4.080 20 10 DICDRO CC[C@@H]1C[C@H]([NH2+]Cc2cc(C)n(-c3ccccc3)c2C)CCO1 ZINC001560556419 1060366172 /nfs/dbraw/zinc/36/61/72/1060366172.db2.gz XBBBLBCFFVIASN-UYAOXDASSA-N 1 0 312.457 4.141 20 10 DICDRO CCC(CC)(C[NH2+]Cc1ccc2c(c1)CCO2)C(F)(F)F ZINC001560563385 1060372757 /nfs/dbraw/zinc/37/27/57/1060372757.db2.gz GXAVNFSOQHKCKF-UHFFFAOYSA-N 1 0 301.352 4.080 20 10 DICDRO CCC[C@@H](C)CC[NH2+]Cc1c(O)cccc1Br ZINC001560573458 1060389147 /nfs/dbraw/zinc/38/91/47/1060389147.db2.gz TYLHSIPVRUFZTI-LLVKDONJSA-N 1 0 300.240 4.071 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCSC(C)(C)C2)cc1 ZINC001560602479 1060417556 /nfs/dbraw/zinc/41/75/56/1060417556.db2.gz RKBBYAFEPOOMCX-JFDDCEBESA-N 1 0 304.503 4.030 20 10 DICDRO C[C@@H]1c2ccccc2CC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001560627884 1060436501 /nfs/dbraw/zinc/43/65/01/1060436501.db2.gz LUVIJPINIOVWFW-JTGQJZMRSA-N 1 0 306.453 4.385 20 10 DICDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2cc(C(C)C)ccc2O)C1(C)C ZINC001560635317 1060447850 /nfs/dbraw/zinc/44/78/50/1060447850.db2.gz AIDHIKXTEVNLTN-ZWKOTPCHSA-N 1 0 305.462 4.151 20 10 DICDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cc(C(C)C)ccc2O)C1(C)C ZINC001560635315 1060448932 /nfs/dbraw/zinc/44/89/32/1060448932.db2.gz AIDHIKXTEVNLTN-QZTJIDSGSA-N 1 0 305.462 4.151 20 10 DICDRO COc1ccc(O)c(C[N@H+](Cc2cccc(Cl)c2)C(C)C)c1 ZINC001560638497 1060455717 /nfs/dbraw/zinc/45/57/17/1060455717.db2.gz DTWJHKUMLFDHDW-UHFFFAOYSA-N 1 0 319.832 4.465 20 10 DICDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)c(C)cc2O)n1 ZINC001560644810 1060466192 /nfs/dbraw/zinc/46/61/92/1060466192.db2.gz HGODNTCTWIAGAC-QGZVFWFLSA-N 1 0 316.832 4.395 20 10 DICDRO COc1ccc(O)c(C[N@@H+](Cc2ccccc2F)CC(C)C)c1 ZINC001560652347 1060476864 /nfs/dbraw/zinc/47/68/64/1060476864.db2.gz WQBNPZLIZXAHQL-UHFFFAOYSA-N 1 0 317.404 4.198 20 10 DICDRO COc1ccc(C[N@@H+]2CCCCC[C@@H]2CC(C)C)c(O)c1OC ZINC001560677812 1060518746 /nfs/dbraw/zinc/51/87/46/1060518746.db2.gz LSCRDZPSNOLGEO-MRXNPFEDSA-N 1 0 321.461 4.200 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC001560728525 1060593965 /nfs/dbraw/zinc/59/39/65/1060593965.db2.gz WFOLGIKRLACYQB-OAQYLSRUSA-N 1 0 308.469 4.268 20 10 DICDRO Cc1oc2ccccc2c1C[NH2+]Cc1ccc(Cl)cc1O ZINC001560736826 1060606248 /nfs/dbraw/zinc/60/62/48/1060606248.db2.gz NOKSCVWRXJKZHK-UHFFFAOYSA-N 1 0 301.773 4.390 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCCC3(CCCC3)C2)cc1F ZINC001560765702 1060629169 /nfs/dbraw/zinc/62/91/69/1060629169.db2.gz RMHYNXPXGFNVLZ-UHFFFAOYSA-N 1 0 308.416 4.187 20 10 DICDRO Cc1cc(C[NH+]2C3CCCC2CCC3)c(O)cc1Br ZINC001250133219 1060635174 /nfs/dbraw/zinc/63/51/74/1060635174.db2.gz JWLBTPIBFCQQKM-UHFFFAOYSA-N 1 0 324.262 4.370 20 10 DICDRO Cc1ccc(F)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2C)c1 ZINC001560792870 1060651526 /nfs/dbraw/zinc/65/15/26/1060651526.db2.gz XSAXMANOUKMNIP-UHFFFAOYSA-N 1 0 300.421 4.141 20 10 DICDRO CCCN(CCCc1ccc(F)c(F)c1)c1ccc(C[NH3+])cc1 ZINC001560809149 1060669359 /nfs/dbraw/zinc/66/93/59/1060669359.db2.gz ZOQVCDHXFCJMHI-UHFFFAOYSA-N 1 0 318.411 4.273 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)c1 ZINC001560815081 1060674227 /nfs/dbraw/zinc/67/42/27/1060674227.db2.gz QDFKHCUWGWNAGW-ZJIFWQFVSA-N 1 0 303.446 4.410 20 10 DICDRO CN(C)c1cc(F)c(C[NH+]2CCC(C)(C3CC3)CC2)cc1F ZINC001560861354 1060719765 /nfs/dbraw/zinc/71/97/65/1060719765.db2.gz LFOJZRVBEDAENY-UHFFFAOYSA-N 1 0 308.416 4.043 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccc(F)cc2F)cc1Cl ZINC001560887754 1060748206 /nfs/dbraw/zinc/74/82/06/1060748206.db2.gz OLTLMSMEXVYDJQ-JTQLQIEISA-N 1 0 311.759 4.483 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC001560921635 1060787020 /nfs/dbraw/zinc/78/70/20/1060787020.db2.gz TVLMDOJFIDGTHB-IBGZPJMESA-N 1 0 300.490 4.463 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cc3nc(Cl)ccc3s2)c1 ZINC001560938114 1060802812 /nfs/dbraw/zinc/80/28/12/1060802812.db2.gz WCYGLPLWSOAUGH-UHFFFAOYSA-N 1 0 318.829 4.254 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C(C)(C2CC2)C2CC2)c1O ZINC001560940369 1060804502 /nfs/dbraw/zinc/80/45/02/1060804502.db2.gz KIGQFIXCLCHSTQ-UHFFFAOYSA-N 1 0 324.262 4.131 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC[C@H]2CCCC2(C)C)c1O ZINC001560941943 1060805395 /nfs/dbraw/zinc/80/53/95/1060805395.db2.gz BORWVFLMFHPQAM-CYBMUJFWSA-N 1 0 311.853 4.360 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC(C2CCC2)C2CCC2)c1O ZINC001560944727 1060809954 /nfs/dbraw/zinc/80/99/54/1060809954.db2.gz JCZKGOAOYXHFCX-UHFFFAOYSA-N 1 0 323.864 4.360 20 10 DICDRO Cc1ccc(C[NH2+]Cc2cc(C(C)C)ccc2O)cc1[N+](=O)[O-] ZINC001560970398 1060834939 /nfs/dbraw/zinc/83/49/39/1060834939.db2.gz UWGJFFJMCSEIES-UHFFFAOYSA-N 1 0 314.385 4.022 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C(C)C)ccc1O)[C@H](O)c1ccccc1 ZINC001560998991 1060858571 /nfs/dbraw/zinc/85/85/71/1060858571.db2.gz LBNRABWAJPPBSL-UYAOXDASSA-N 1 0 313.441 4.117 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@H]2CCSC3(CCC3)C2)c1 ZINC001561034268 1060886566 /nfs/dbraw/zinc/88/65/66/1060886566.db2.gz LLWISXBZGRRPIA-INIZCTEOSA-N 1 0 305.487 4.424 20 10 DICDRO CCc1cccc(C[NH2+]C2(Cc3cccc(F)c3)CCC2)c1O ZINC001462125401 1060947272 /nfs/dbraw/zinc/94/72/72/1060947272.db2.gz FQAMUJLNWOWNPJ-UHFFFAOYSA-N 1 0 313.416 4.349 20 10 DICDRO CC(C)C1C[NH+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC001462159323 1060983402 /nfs/dbraw/zinc/98/34/02/1060983402.db2.gz VOCCMBUDXXRRLQ-UHFFFAOYSA-N 1 0 314.498 4.472 20 10 DICDRO CSc1ccccc1C[N@H+](C)Cc1ccc(Cl)cc1O ZINC001462180402 1061000225 /nfs/dbraw/zinc/00/02/25/1061000225.db2.gz YVPHABSGCMRHSC-UHFFFAOYSA-N 1 0 307.846 4.400 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)[C@@H]1COc2ccccc2C1 ZINC001462190898 1061013173 /nfs/dbraw/zinc/01/31/73/1061013173.db2.gz SNWRLUNLDGXJOK-LPHOPBHVSA-N 1 0 324.468 4.002 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@H](c3ccccc3F)C2)cc1 ZINC001462272919 1061066573 /nfs/dbraw/zinc/06/65/73/1061066573.db2.gz OJEBCDHWAQICEX-QWNKOJSDSA-N 1 0 324.443 4.394 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2c(C)cc(OC)cc2O)c1 ZINC001462303471 1061092191 /nfs/dbraw/zinc/09/21/91/1061092191.db2.gz CKWODWYWOAUWHO-UHFFFAOYSA-N 1 0 317.454 4.111 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@H](C(C)(C)C)C[C@@H]2C)cc1OC ZINC001462315180 1061100089 /nfs/dbraw/zinc/10/00/89/1061100089.db2.gz NKGMWSURHYLTBL-ZFWWWQNUSA-N 1 0 321.461 4.056 20 10 DICDRO C[C@@H]([NH2+]CCSCc1ccccc1)c1ccc(N(C)C)cc1 ZINC001473400141 1061137152 /nfs/dbraw/zinc/13/71/52/1061137152.db2.gz KZAICVFWWBYTOG-MRXNPFEDSA-N 1 0 314.498 4.337 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCC2(CCCC2)O1 ZINC001473424926 1061153772 /nfs/dbraw/zinc/15/37/72/1061153772.db2.gz UNURBUBNXSUKNX-SFHVURJKSA-N 1 0 317.473 4.486 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](CC)Cc2ccc(F)cc2)c1O ZINC001462423076 1061164398 /nfs/dbraw/zinc/16/43/98/1061164398.db2.gz ZHDCWOWTJMKECU-SFHVURJKSA-N 1 0 301.405 4.205 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](C(C)(C)C)C[C@H]2C)c1O ZINC001473520611 1061217058 /nfs/dbraw/zinc/21/70/58/1061217058.db2.gz YQNDJTSJLSJJKV-DOMZBBRYSA-N 1 0 321.436 4.381 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@H](Oc2ccccc2)C1(C)C)c1ccccc1O ZINC001462510335 1061220026 /nfs/dbraw/zinc/22/00/26/1061220026.db2.gz FLQGGBKUJMLRFJ-CCKFTAQKSA-N 1 0 311.425 4.289 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2c(F)cc(F)cc2F)cc1Cl ZINC001462561834 1061260735 /nfs/dbraw/zinc/26/07/35/1061260735.db2.gz CVBGATOZSNMSHI-UHFFFAOYSA-N 1 0 315.722 4.061 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CCc2cnc3ccccc3c2)c1 ZINC001462569352 1061269122 /nfs/dbraw/zinc/26/91/22/1061269122.db2.gz ZXIRMIIZAAPWHA-UHFFFAOYSA-N 1 0 320.436 4.396 20 10 DICDRO C[N@H+](CCCF)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001462592651 1061285895 /nfs/dbraw/zinc/28/58/95/1061285895.db2.gz FVEKFUADJBCVJZ-UHFFFAOYSA-N 1 0 312.432 4.041 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)cc1 ZINC001473683313 1061339808 /nfs/dbraw/zinc/33/98/08/1061339808.db2.gz NDNCEHOXGBJNPA-LJQANCHMSA-N 1 0 309.457 4.121 20 10 DICDRO COc1ccc([C@H](C)[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001473965008 1061506005 /nfs/dbraw/zinc/50/60/05/1061506005.db2.gz SBOYPJNOZXNELQ-JFDDCEBESA-N 1 0 310.441 4.125 20 10 DICDRO COc1ccc([C@H](C)[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001473965009 1061506643 /nfs/dbraw/zinc/50/66/43/1061506643.db2.gz SBOYPJNOZXNELQ-KJPDOMRESA-N 1 0 310.441 4.125 20 10 DICDRO c1cc(C[NH2+]Cc2ccc3c(c2)CCO3)cc(OC2CCCC2)c1 ZINC001473970716 1061515243 /nfs/dbraw/zinc/51/52/43/1061515243.db2.gz ZCKGFUXWCRQEHN-UHFFFAOYSA-N 1 0 323.436 4.233 20 10 DICDRO CCC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001473978960 1061521084 /nfs/dbraw/zinc/52/10/84/1061521084.db2.gz UKAPKSNANKNPNS-DYVFJYSZSA-N 1 0 310.432 4.479 20 10 DICDRO CCC[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001473978959 1061522290 /nfs/dbraw/zinc/52/22/90/1061522290.db2.gz UKAPKSNANKNPNS-CXAGYDPISA-N 1 0 310.432 4.479 20 10 DICDRO CC(C)[C@@H]1CCC[C@@H]([NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001473986822 1061527984 /nfs/dbraw/zinc/52/79/84/1061527984.db2.gz QVVIFCUBBRAYNP-UKRRQHHQSA-N 1 0 310.432 4.335 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)c2ccc(F)cc2)c(Cl)c1 ZINC001473988499 1061531049 /nfs/dbraw/zinc/53/10/49/1061531049.db2.gz NFTKNDRXLCASQC-GFCCVEGCSA-N 1 0 307.796 4.386 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCCO2)Cc1ccccc1 ZINC001474003259 1061544844 /nfs/dbraw/zinc/54/48/44/1061544844.db2.gz RACGGMRXOJVPAP-UHFFFAOYSA-N 1 0 309.453 4.370 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(F)cc1F ZINC001474024458 1061563343 /nfs/dbraw/zinc/56/33/43/1061563343.db2.gz KPZXNFMBYHFIRQ-ZDUSSCGKSA-N 1 0 317.379 4.183 20 10 DICDRO c1nc(-c2ccccc2)sc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001474034242 1061577389 /nfs/dbraw/zinc/57/73/89/1061577389.db2.gz OTLATXWFMKLILB-UHFFFAOYSA-N 1 0 322.433 4.035 20 10 DICDRO Cc1c2ccccc2n(C)c1CNc1ccc(C)cc1C[NH+](C)C ZINC001474058420 1061605471 /nfs/dbraw/zinc/60/54/71/1061605471.db2.gz PKXKEGJRLFJQPP-UHFFFAOYSA-N 1 0 321.468 4.469 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC001474069333 1061616110 /nfs/dbraw/zinc/61/61/10/1061616110.db2.gz RTLOYLOSSDVDEI-INIZCTEOSA-N 1 0 312.457 4.068 20 10 DICDRO CC(C)C[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC001474080790 1061626331 /nfs/dbraw/zinc/62/63/31/1061626331.db2.gz FXODQTRKDLZCGK-OAHLLOKOSA-N 1 0 319.449 4.109 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC(C)(C)OC2(C)C)cc1F ZINC001474089771 1061636870 /nfs/dbraw/zinc/63/68/70/1061636870.db2.gz JQZXLALITLMHRT-QGZVFWFLSA-N 1 0 322.468 4.108 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1C ZINC001474099243 1061645111 /nfs/dbraw/zinc/64/51/11/1061645111.db2.gz IJXVBGUBTVYTMO-IEBWSBKVSA-N 1 0 319.489 4.467 20 10 DICDRO C=Cc1ccc(CC[NH2+]Cc2c(C)c3ccccc3n2C)cc1 ZINC001474156319 1061698215 /nfs/dbraw/zinc/69/82/15/1061698215.db2.gz ZNAYWIUWQYMTSS-UHFFFAOYSA-N 1 0 304.437 4.462 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H]2COc3ccccc32)cc1C ZINC001474167725 1061711634 /nfs/dbraw/zinc/71/16/34/1061711634.db2.gz QABDAENQDFSDQO-KRWDZBQOSA-N 1 0 311.425 4.050 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@H]1CCCC[C@@H]1C ZINC001474184586 1061733752 /nfs/dbraw/zinc/73/37/52/1061733752.db2.gz GNZYSNRSUMUPCD-VDZJLULYSA-N 1 0 302.506 4.408 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+]Cc3cccc(C(C)C)c3)C2)cc1 ZINC001474205245 1061761412 /nfs/dbraw/zinc/76/14/12/1061761412.db2.gz CQIHRGBWMAOZOA-LJQANCHMSA-N 1 0 324.468 4.187 20 10 DICDRO COc1cccc(C2([NH2+]Cc3ccc4c(c3)CCCO4)CCC2)c1 ZINC001474219753 1061778681 /nfs/dbraw/zinc/77/86/81/1061778681.db2.gz MBMKQHJGUURKMG-UHFFFAOYSA-N 1 0 323.436 4.189 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@]23CCC[C@H]2OCC3)cc1 ZINC001474245677 1061810482 /nfs/dbraw/zinc/81/04/82/1061810482.db2.gz RJMOCYFTWJQMLX-UXHICEINSA-N 1 0 316.489 4.114 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(Oc2ccccn2)c1)c1ccccc1O ZINC001474252992 1061819506 /nfs/dbraw/zinc/81/95/06/1061819506.db2.gz DSWAXBUZDAUXQN-OAHLLOKOSA-N 1 0 320.392 4.430 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2CC(C)(C)CO2)cc1 ZINC001474257965 1061825610 /nfs/dbraw/zinc/82/56/10/1061825610.db2.gz WBKIAAOLLXDZAI-IBGZPJMESA-N 1 0 318.505 4.218 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H]2CCC3(CCC3)CO2)cc1C ZINC001474269275 1061835157 /nfs/dbraw/zinc/83/51/57/1061835157.db2.gz WXFGDLNDJQAFGU-GOSISDBHSA-N 1 0 317.473 4.223 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H]2CCC3(CCC3)CO2)cc1C ZINC001474269277 1061836138 /nfs/dbraw/zinc/83/61/38/1061836138.db2.gz WXFGDLNDJQAFGU-SFHVURJKSA-N 1 0 317.473 4.223 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCC2(c3ccccc3)CC2)cc1 ZINC001474271897 1061838784 /nfs/dbraw/zinc/83/87/84/1061838784.db2.gz JKLHIOJMYUCEGY-VOTSOKGWSA-N 1 0 320.480 4.477 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC001474276650 1061844591 /nfs/dbraw/zinc/84/45/91/1061844591.db2.gz FORVWANAWOIMNS-HXUWFJFHSA-N 1 0 305.425 4.123 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@]2(C)CCCCO2)cc1 ZINC001474284907 1061855379 /nfs/dbraw/zinc/85/53/79/1061855379.db2.gz KXYZNAOCMSGJOL-HXUWFJFHSA-N 1 0 318.505 4.362 20 10 DICDRO CC[C@H](C)[C@H](C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)OC ZINC001474307585 1061872953 /nfs/dbraw/zinc/87/29/53/1061872953.db2.gz ORFOAAOGSABXQU-PXNSSMCTSA-N 1 0 318.505 4.170 20 10 DICDRO C[C@@H]([NH2+]Cc1c(O)cccc1Cl)c1cc(F)ccc1N(C)C ZINC001474305344 1061873432 /nfs/dbraw/zinc/87/34/32/1061873432.db2.gz KRZMQKJDOUXGOX-LLVKDONJSA-N 1 0 322.811 4.102 20 10 DICDRO COc1cc(C)c(C[N@H+](Cc2ccc(F)cc2)C2CC2)c(O)c1 ZINC001474307411 1061874467 /nfs/dbraw/zinc/87/44/67/1061874467.db2.gz LRVHUZVTYYSPCJ-UHFFFAOYSA-N 1 0 315.388 4.013 20 10 DICDRO Cc1ccc(C[C@@H]2CCC[N@H+](Cc3cc(F)ccc3O)C2)cc1 ZINC001474309947 1061876680 /nfs/dbraw/zinc/87/66/80/1061876680.db2.gz IHIFJYNWLYIAGJ-KRWDZBQOSA-N 1 0 313.416 4.294 20 10 DICDRO CC(C)[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCS1 ZINC001474361109 1061984216 /nfs/dbraw/zinc/98/42/16/1061984216.db2.gz XVSHUWNHKLPFKE-KRWDZBQOSA-N 1 0 301.455 4.119 20 10 DICDRO COc1cc(C[N@H+](C)Cc2ccoc2C)c(O)c(C(C)(C)C)c1 ZINC001474365314 1061999167 /nfs/dbraw/zinc/99/91/67/1061999167.db2.gz CACGVZCMOIUOOJ-UHFFFAOYSA-N 1 0 317.429 4.232 20 10 DICDRO CC[C@@H]1C[N@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)CCS1 ZINC001474369449 1062002267 /nfs/dbraw/zinc/00/22/67/1062002267.db2.gz LNDGBSSFALSONF-OAHLLOKOSA-N 1 0 323.502 4.026 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@H+](C)[C@@H]2CCc3ccccc32)cc1 ZINC001474413028 1062077468 /nfs/dbraw/zinc/07/74/68/1062077468.db2.gz QYPIWSAQFMCZHS-IZRJCCQOSA-N 1 0 306.453 4.385 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@H+](C)[C@H]2CCc3ccccc32)cc1 ZINC001474413029 1062079500 /nfs/dbraw/zinc/07/95/00/1062079500.db2.gz QYPIWSAQFMCZHS-NGXITPROSA-N 1 0 306.453 4.385 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2CCc2ccccc2)cc1 ZINC001459336036 1062095575 /nfs/dbraw/zinc/09/55/75/1062095575.db2.gz MDQOEEVOGJYCCC-NRFANRHFSA-N 1 0 308.469 4.350 20 10 DICDRO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001474445468 1062124017 /nfs/dbraw/zinc/12/40/17/1062124017.db2.gz FVKNKPVZKJTBEW-LBPRGKRZSA-N 1 0 307.743 4.208 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](C(C)C)CC2)c(O)c1OC ZINC001474461839 1062140274 /nfs/dbraw/zinc/14/02/74/1062140274.db2.gz WJHFUINJROZKCZ-GOEBONIOSA-N 1 0 321.461 4.104 20 10 DICDRO CCC[C@H](CCc1ccccc1)[NH2+]Cc1ccc(OC)cc1O ZINC001474473514 1062152534 /nfs/dbraw/zinc/15/25/34/1062152534.db2.gz UCXJSMLFZBDTCF-GOSISDBHSA-N 1 0 313.441 4.292 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)c(Cl)c1 ZINC001474474320 1062155614 /nfs/dbraw/zinc/15/56/14/1062155614.db2.gz GGLPHTKVIXULMR-SFHVURJKSA-N 1 0 319.807 4.425 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC001474476912 1062158278 /nfs/dbraw/zinc/15/82/78/1062158278.db2.gz KIRRYIUPQTXKJX-PHWHVTFISA-N 1 0 324.443 4.394 20 10 DICDRO CC(C)c1ccc(O)c(C[NH+]2CCC(c3cccnc3)CC2)c1 ZINC001474500683 1062181332 /nfs/dbraw/zinc/18/13/32/1062181332.db2.gz OIEYZPQLHMOPDN-UHFFFAOYSA-N 1 0 310.441 4.290 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H](OC(C)(C)C)C2(C)C)c1 ZINC001474505048 1062187137 /nfs/dbraw/zinc/18/71/37/1062187137.db2.gz NAGQRFJGOOHKNH-AFAVFJNCSA-N 1 0 321.461 4.034 20 10 DICDRO CC[N@H+](CC1=CCCC1)Cc1cc(Br)ccc1O ZINC001459582047 1062226577 /nfs/dbraw/zinc/22/65/77/1062226577.db2.gz XPZKORRDIHLMRI-UHFFFAOYSA-N 1 0 310.235 4.087 20 10 DICDRO COc1ccc(O)c(C[NH2+]C[C@H]2CCC[C@H]2c2ccccc2)c1 ZINC001474544545 1062238388 /nfs/dbraw/zinc/23/83/88/1062238388.db2.gz RCEWCKLMQHHDHR-APWZRJJASA-N 1 0 311.425 4.074 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)c1 ZINC001474544435 1062238472 /nfs/dbraw/zinc/23/84/72/1062238472.db2.gz HFUMBQDQKNTDDG-CLCXKQKWSA-N 1 0 311.425 4.167 20 10 DICDRO COC[C@H]([NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C)c1ccc(C)o1 ZINC001254721948 1062242311 /nfs/dbraw/zinc/24/23/11/1062242311.db2.gz XBRISWFGCYHALY-QEJZJMRPSA-N 1 0 315.413 4.128 20 10 DICDRO COc1cc(C[N@@H+]2CC(C)(C)C[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001474582720 1062291654 /nfs/dbraw/zinc/29/16/54/1062291654.db2.gz NYTMEIHBLLXUAX-ZDUSSCGKSA-N 1 0 305.462 4.319 20 10 DICDRO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001474592951 1062303495 /nfs/dbraw/zinc/30/34/95/1062303495.db2.gz YFVMUZDZCHLMJN-KSZLIROESA-N 1 0 318.505 4.326 20 10 DICDRO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)C1(C)C ZINC001474608813 1062321040 /nfs/dbraw/zinc/32/10/40/1062321040.db2.gz JUYABYCVRZWZFT-LSDHHAIUSA-N 1 0 311.853 4.117 20 10 DICDRO C[C@@H](CCc1ccc(F)cc1)[NH2+]Cc1cc(Cl)ccc1O ZINC001474608576 1062322180 /nfs/dbraw/zinc/32/21/80/1062322180.db2.gz GWJFJDNNJULDOV-LBPRGKRZSA-N 1 0 307.796 4.296 20 10 DICDRO CCC(CC)(CC)C[NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001474624732 1062345194 /nfs/dbraw/zinc/34/51/94/1062345194.db2.gz ZVZBMYJKGJDNFA-MRXNPFEDSA-N 1 0 304.478 4.080 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H](C)C[C@H](C)CC(C)C)C2)cc1 ZINC001474624442 1062345745 /nfs/dbraw/zinc/34/57/45/1062345745.db2.gz UBPGRIQFMBGRGY-KURKYZTESA-N 1 0 318.505 4.324 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H](C)[C@H]3CCCC[C@@H]3C)C2)cc1 ZINC001474624289 1062347264 /nfs/dbraw/zinc/34/72/64/1062347264.db2.gz PLPILGROAAIHDW-CLWJZODNSA-N 1 0 316.489 4.078 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)COc1ccccc1F)c1ccccc1O ZINC001255175400 1062349915 /nfs/dbraw/zinc/34/99/15/1062349915.db2.gz LAONNKRSIATCRE-BBRMVZONSA-N 1 0 303.377 4.040 20 10 DICDRO Cc1cc(CC[NH2+]CCSC(C)C)c(C)n1-c1ccccc1 ZINC001474654353 1062386418 /nfs/dbraw/zinc/38/64/18/1062386418.db2.gz WHNYPEAEFDEQPR-UHFFFAOYSA-N 1 0 316.514 4.368 20 10 DICDRO CCOc1ccc(N2CC[NH+]([C@@H](C)c3ccccc3C)CC2)cc1 ZINC001459794139 1062404422 /nfs/dbraw/zinc/40/44/22/1062404422.db2.gz BVBWIZAKYAMLKJ-SFHVURJKSA-N 1 0 324.468 4.277 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H]3[C@H](C2)C3(F)F)ccc1N1CCCCC1 ZINC001459796612 1062408224 /nfs/dbraw/zinc/40/82/24/1062408224.db2.gz JTUSWFFZWBXNNR-SJORKVTESA-N 1 0 320.427 4.072 20 10 DICDRO CC[N@H+](Cc1ccccc1O)C1CCC(C(F)(F)F)CC1 ZINC001255521008 1062473281 /nfs/dbraw/zinc/47/32/81/1062473281.db2.gz QFBZFPLZMKKLHO-UHFFFAOYSA-N 1 0 301.352 4.335 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)ccc1N(C)C ZINC001459949082 1062517470 /nfs/dbraw/zinc/51/74/70/1062517470.db2.gz GXNLBQFKOYQXKV-OAHLLOKOSA-N 1 0 314.395 4.224 20 10 DICDRO Cc1cc(C[N@H+](C)CC2(c3ccccc3)CC2)ccc1N(C)C ZINC001459952996 1062523311 /nfs/dbraw/zinc/52/33/11/1062523311.db2.gz NXLJYOPPDPFQQJ-UHFFFAOYSA-N 1 0 308.469 4.225 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC001255719221 1062536920 /nfs/dbraw/zinc/53/69/20/1062536920.db2.gz CHORTTDCINTCLH-GOEBONIOSA-N 1 0 314.395 4.306 20 10 DICDRO C[C@H](CSc1ccc(F)cc1)[NH2+][C@H](C)c1ccccc1O ZINC001255729401 1062549565 /nfs/dbraw/zinc/54/95/65/1062549565.db2.gz HKXNVDYIINDGOE-CHWSQXEVSA-N 1 0 305.418 4.363 20 10 DICDRO Cc1cccc(C[NH2+][C@@H](C)CSc2ccc(F)cc2)c1O ZINC001255736320 1062558983 /nfs/dbraw/zinc/55/89/83/1062558983.db2.gz WGSQBLGUGFVLDK-ZDUSSCGKSA-N 1 0 305.418 4.110 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC001460029720 1062587023 /nfs/dbraw/zinc/58/70/23/1062587023.db2.gz AWBBESPNHPDMRC-SFHVURJKSA-N 1 0 312.432 4.271 20 10 DICDRO C[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1cc2ccccc2cc1O ZINC001255864137 1062641049 /nfs/dbraw/zinc/64/10/49/1062641049.db2.gz WSUVTLVICICTRM-AWEZNQCLSA-N 1 0 309.384 4.405 20 10 DICDRO COc1cccc(C[C@@H](C)[NH2+]Cc2cc3ccccc3cc2O)c1 ZINC001256153628 1062731652 /nfs/dbraw/zinc/73/16/52/1062731652.db2.gz JRPHCZJQSKCFTM-OAHLLOKOSA-N 1 0 321.420 4.275 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)[C@@H]2CCCc3ccccc32)cc1 ZINC001460332506 1062785183 /nfs/dbraw/zinc/78/51/83/1062785183.db2.gz ABWXLETWSOVHMX-OAQYLSRUSA-N 1 0 324.468 4.141 20 10 DICDRO C[C@@H]([NH2+]Cc1csc(Cc2ccccc2)n1)c1ccccc1O ZINC001460634481 1062954409 /nfs/dbraw/zinc/95/44/09/1062954409.db2.gz COMMTLCALLUPAI-CQSZACIVSA-N 1 0 324.449 4.290 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@H]2CCO[C@@H](c3ccccc3)C2)cc1 ZINC001256820929 1063003138 /nfs/dbraw/zinc/00/31/38/1063003138.db2.gz LSDSQDDOYNQBRN-LEWJYISDSA-N 1 0 324.468 4.105 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCCc2ccccc2)c(Cl)c1 ZINC001461014484 1063188077 /nfs/dbraw/zinc/18/80/77/1063188077.db2.gz BBLLBAYZUSXOHL-UHFFFAOYSA-N 1 0 303.833 4.467 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2ccc(Cl)s2)cc1 ZINC001461012061 1063188540 /nfs/dbraw/zinc/18/85/40/1063188540.db2.gz OOLZKAYAWFMSQI-ARJAWSKDSA-N 1 0 306.862 4.271 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2ccc(Cl)s2)cc1 ZINC001461012062 1063188843 /nfs/dbraw/zinc/18/88/43/1063188843.db2.gz OOLZKAYAWFMSQI-ONEGZZNKSA-N 1 0 306.862 4.271 20 10 DICDRO CC[C@@H](C[NH2+]Cc1ccc(OC)c(C)c1)Oc1cccc(C)c1 ZINC001461054419 1063220922 /nfs/dbraw/zinc/22/09/22/1063220922.db2.gz XGKXBAZZGNEMQV-SFHVURJKSA-N 1 0 313.441 4.259 20 10 DICDRO CC[C@H](C[NH2+]Cc1ccc(OC)c(C)c1)Oc1cccc(C)c1 ZINC001461054417 1063222020 /nfs/dbraw/zinc/22/20/20/1063222020.db2.gz XGKXBAZZGNEMQV-GOSISDBHSA-N 1 0 313.441 4.259 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCO[C@H]2CCCC[C@H]2C)c(Cl)c1 ZINC001461053842 1063222491 /nfs/dbraw/zinc/22/24/91/1063222491.db2.gz PITWCFYQFLMSHJ-DYVFJYSZSA-N 1 0 311.853 4.039 20 10 DICDRO C[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)CC1 ZINC001461058289 1063224816 /nfs/dbraw/zinc/22/48/16/1063224816.db2.gz XVEIJCGIPZLAHM-WMZOPIPTSA-N 1 0 318.530 4.298 20 10 DICDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)CC1 ZINC001461058278 1063225407 /nfs/dbraw/zinc/22/54/07/1063225407.db2.gz XVEIJCGIPZLAHM-AEFFLSMTSA-N 1 0 318.530 4.298 20 10 DICDRO CCCCCC1CCC([NH2+]CCc2cc(O)c(O)cc2O)CC1 ZINC001257370611 1063239333 /nfs/dbraw/zinc/23/93/33/1063239333.db2.gz RJMAOQYHOYDNNX-UHFFFAOYSA-N 1 0 321.461 4.075 20 10 DICDRO C[C@@H](Cc1ccsc1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001461091265 1063247670 /nfs/dbraw/zinc/24/76/70/1063247670.db2.gz JJNDYTMVICJHRD-XVWMLYKFSA-N 1 0 300.471 4.048 20 10 DICDRO C[C@@H](Cc1ccsc1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001461091263 1063248611 /nfs/dbraw/zinc/24/86/11/1063248611.db2.gz JJNDYTMVICJHRD-RGDDUWESSA-N 1 0 300.471 4.048 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2cccc3cccnc32)cc1 ZINC001461121336 1063272620 /nfs/dbraw/zinc/27/26/20/1063272620.db2.gz PNIZWUYYFNRGIG-XQRVVYSFSA-N 1 0 317.436 4.104 20 10 DICDRO COc1cc(C[NH2+][C@H]2CC[C@H](C)CC2)c(O)c(C(C)(C)C)c1 ZINC001461181365 1063317230 /nfs/dbraw/zinc/31/72/30/1063317230.db2.gz XIOIOHLWBPMLFK-CTYIDZIISA-N 1 0 305.462 4.367 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)CCc2cccn2C)cc1C ZINC001461209536 1063335858 /nfs/dbraw/zinc/33/58/58/1063335858.db2.gz MMGMTHLEFLKSKO-KRWDZBQOSA-N 1 0 314.473 4.233 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@@H]2Cc2ccccc2)cc1 ZINC001461221816 1063342773 /nfs/dbraw/zinc/34/27/73/1063342773.db2.gz JYVIOKFLBGIQCB-FPOVZHCZSA-N 1 0 308.469 4.254 20 10 DICDRO CCCc1cccc(C[NH2+]CCCSc2nccs2)c1 ZINC001461234135 1063355854 /nfs/dbraw/zinc/35/58/54/1063355854.db2.gz YBCUSANYWRLQCN-UHFFFAOYSA-N 1 0 306.500 4.368 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2C[C@](C)(OC)C2(C)C)cc1C ZINC001461239088 1063356828 /nfs/dbraw/zinc/35/68/28/1063356828.db2.gz OBNQCVIZKCGRKR-HKUYNNGSSA-N 1 0 305.462 4.077 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H](C)Cc1ccco1 ZINC001258186061 1063551696 /nfs/dbraw/zinc/55/16/96/1063551696.db2.gz VMTCDSRJKQUODB-LIRRHRJNSA-N 1 0 313.441 4.446 20 10 DICDRO Oc1ccc(Cl)c(F)c1CNc1cc2c(c[nH+]1)CCCC2 ZINC001461541773 1063569976 /nfs/dbraw/zinc/56/99/76/1063569976.db2.gz RRAXENPZIQCFBQ-UHFFFAOYSA-N 1 0 306.768 4.071 20 10 DICDRO COc1ccc(C[NH2+]CC2(c3ccc(C)cc3C)CC2)cc1C ZINC001461545104 1063571154 /nfs/dbraw/zinc/57/11/54/1063571154.db2.gz XGXICRJDEVLDMM-UHFFFAOYSA-N 1 0 309.453 4.442 20 10 DICDRO [O-]c1ccc(Cl)c(F)c1C[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC001461610164 1063611126 /nfs/dbraw/zinc/61/11/26/1063611126.db2.gz ULVNMQOMCDRHGP-CHWSQXEVSA-N 1 0 305.780 4.078 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CO1 ZINC001461618352 1063616889 /nfs/dbraw/zinc/61/68/89/1063616889.db2.gz UGFANODBAWFVIR-CZUORRHYSA-N 1 0 319.489 4.254 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cccc3ncccc23)c(Cl)c1 ZINC001461733465 1063685923 /nfs/dbraw/zinc/68/59/23/1063685923.db2.gz DPBXVRWMBSGKCY-UHFFFAOYSA-N 1 0 312.800 4.192 20 10 DICDRO COc1cc(C[NH2+]C(C)(C)/C=C\Cl)c(O)c(C(C)(C)C)c1 ZINC001461766857 1063705223 /nfs/dbraw/zinc/70/52/23/1063705223.db2.gz QZISWKYWSAIHGB-FPLPWBNLSA-N 1 0 311.853 4.319 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@]1(C)CCOc2ccccc21 ZINC001461781065 1063712816 /nfs/dbraw/zinc/71/28/16/1063712816.db2.gz OMGWDSXPONIZFU-OAQYLSRUSA-N 1 0 320.436 4.274 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCCc2cccnc21 ZINC001461788375 1063718904 /nfs/dbraw/zinc/71/89/04/1063718904.db2.gz ALTIDDSDVJFMNT-QGZVFWFLSA-N 1 0 305.425 4.049 20 10 DICDRO CSCc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC001461837327 1063744349 /nfs/dbraw/zinc/74/43/49/1063744349.db2.gz GENVUFFQPNWQKN-UHFFFAOYSA-N 1 0 314.498 4.248 20 10 DICDRO COc1cc(Cl)cc(C[NH+]2CCC(C3CCCC3)CC2)c1O ZINC001461847805 1063748049 /nfs/dbraw/zinc/74/80/49/1063748049.db2.gz XIIOACSUKDJOQB-UHFFFAOYSA-N 1 0 323.864 4.456 20 10 DICDRO CCCCO[C@H]1C[C@H]([N@H+](C)Cc2cccc(CC)c2O)C1(C)C ZINC001461881178 1063773288 /nfs/dbraw/zinc/77/32/88/1063773288.db2.gz LRSUQZZCIPZNCE-ROUUACIJSA-N 1 0 319.489 4.370 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)c1 ZINC001461885208 1063775502 /nfs/dbraw/zinc/77/55/02/1063775502.db2.gz VANVHNMBGPNXNV-SUMWQHHRSA-N 1 0 315.413 4.275 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCCc2ccccc2)c(Cl)c1 ZINC001461927827 1063811292 /nfs/dbraw/zinc/81/12/92/1063811292.db2.gz SMZUBVWSRWLSHG-UHFFFAOYSA-N 1 0 303.833 4.419 20 10 DICDRO CC(C)C1CCC([N@@H+]2CCCc3cc(O)c(O)cc3C2)CC1 ZINC001258805160 1063837137 /nfs/dbraw/zinc/83/71/37/1063837137.db2.gz HESQFAWGNHALCF-UHFFFAOYSA-N 1 0 303.446 4.061 20 10 DICDRO CCC[N@H+](Cc1ccc(F)cc1F)Cc1cc(F)ccc1O ZINC001461967575 1063844191 /nfs/dbraw/zinc/84/41/91/1063844191.db2.gz COZJBJXOMCFYEB-UHFFFAOYSA-N 1 0 309.331 4.222 20 10 DICDRO C[C@H]1C[NH+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C[C@@H]1C ZINC001461965033 1063844631 /nfs/dbraw/zinc/84/46/31/1063844631.db2.gz YWJCSLBNUVAKID-ROUUACIJSA-N 1 0 320.480 4.337 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2c2ccc(C)cc2)c1 ZINC001461991742 1063863458 /nfs/dbraw/zinc/86/34/58/1063863458.db2.gz ZIROJIHGTDMJQW-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO C[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001462008910 1063875978 /nfs/dbraw/zinc/87/59/78/1063875978.db2.gz RWYAWUANZKSQOD-GFCCVEGCSA-N 1 0 300.368 4.003 20 10 DICDRO CS[C@@H](C[NH2+]Cc1cc(Cl)c(C)cc1O)C(C)(C)C ZINC001462081686 1063919195 /nfs/dbraw/zinc/91/91/95/1063919195.db2.gz BBIHLXJZGVLPBH-AWEZNQCLSA-N 1 0 301.883 4.221 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@H]2CCCc3sccc32)cc1F ZINC001261814279 1063946964 /nfs/dbraw/zinc/94/69/64/1063946964.db2.gz WNFVPHNUXKBMCI-HNNXBMFYSA-N 1 0 322.424 4.260 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@H+](Cc2ccc(N)cc2)CC1 ZINC001262488325 1063966484 /nfs/dbraw/zinc/96/64/84/1063966484.db2.gz YOAATAMZCFMVKR-QGZVFWFLSA-N 1 0 310.441 4.047 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCOCc1ccccc1 ZINC000390060866 1064145755 /nfs/dbraw/zinc/14/57/55/1064145755.db2.gz TXZCMYFHCOSHIH-WBVHZDCISA-N 1 0 311.425 4.055 20 10 DICDRO CC[C@@H](C)C[N@H+](CC)Cc1ccc(Br)cc1[O-] ZINC000701175539 1064239863 /nfs/dbraw/zinc/23/98/63/1064239863.db2.gz QXISNUAJEHSKBH-LLVKDONJSA-N 1 0 300.240 4.023 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000743870539 1064974356 /nfs/dbraw/zinc/97/43/56/1064974356.db2.gz WRDZGGYSBYWMDU-CQSZACIVSA-N 1 0 314.385 4.274 20 10 DICDRO CCC1([NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CCC1 ZINC000748098890 1065111243 /nfs/dbraw/zinc/11/12/43/1065111243.db2.gz RLHMMHZNDUJXIY-UHFFFAOYSA-N 1 0 317.433 4.007 20 10 DICDRO CCC(C)(C)CC[N@@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC001307425012 1065385390 /nfs/dbraw/zinc/38/53/90/1065385390.db2.gz ZTFLIYNEEQVZQE-UHFFFAOYSA-N 1 0 304.478 4.034 20 10 DICDRO CCOc1ccc(N2CC[NH+](CCCC(C)(C)C)CC2)cc1 ZINC001307600237 1065507143 /nfs/dbraw/zinc/50/71/43/1065507143.db2.gz VRWQPUDIOQHVBG-UHFFFAOYSA-N 1 0 304.478 4.034 20 10 DICDRO CCCC[N@H+](CCCc1scnc1C)Cc1ccccc1O ZINC001307721271 1065586822 /nfs/dbraw/zinc/58/68/22/1065586822.db2.gz HXPQLTVGJAIRCN-UHFFFAOYSA-N 1 0 318.486 4.392 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)c(C)c2)nc1 ZINC001307795882 1065626448 /nfs/dbraw/zinc/62/64/48/1065626448.db2.gz PDUOYNWSIIMUQB-UHFFFAOYSA-N 1 0 323.484 4.321 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)CCO1 ZINC001308232713 1065838670 /nfs/dbraw/zinc/83/86/70/1065838670.db2.gz ZXGSBWOTRGFKSC-SJLPKXTDSA-N 1 0 316.489 4.113 20 10 DICDRO Cc1cccc(O[C@@H](C)C[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC001308275329 1065874008 /nfs/dbraw/zinc/87/40/08/1065874008.db2.gz QXYRALMPASUGOC-IWHGQQBYSA-N 1 0 324.468 4.131 20 10 DICDRO Fc1ccc(C[NH2+]CCCSc2nccs2)cc1Cl ZINC001308282483 1065880301 /nfs/dbraw/zinc/88/03/01/1065880301.db2.gz PQJLKIJTAVYMAU-UHFFFAOYSA-N 1 0 316.854 4.208 20 10 DICDRO Cc1cc(C)[nH+]c(NCc2ccc(N(C)C)cc2C(F)(F)F)c1 ZINC001308340313 1065924371 /nfs/dbraw/zinc/92/43/71/1065924371.db2.gz XKKVZCKFWGTHNZ-UHFFFAOYSA-N 1 0 323.362 4.395 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2([C@H](C)CCO)CCC2)cc1C ZINC001308348322 1065931355 /nfs/dbraw/zinc/93/13/55/1065931355.db2.gz BGZNQXNEBRNPAJ-QGZVFWFLSA-N 1 0 319.489 4.062 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2CCC[C@H](C)CC2)ccc1OC ZINC001308375322 1065950105 /nfs/dbraw/zinc/95/01/05/1065950105.db2.gz WTVSCZPXTLJKMD-YJBOKZPZSA-N 1 0 305.462 4.290 20 10 DICDRO COc1cc(C[NH2+]C[C@@H]2CCC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308382288 1065953741 /nfs/dbraw/zinc/95/37/41/1065953741.db2.gz DRXQNFHQDUKMCC-KGLIPLIRSA-N 1 0 305.462 4.224 20 10 DICDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308394611 1065960193 /nfs/dbraw/zinc/96/01/93/1065960193.db2.gz DIYIUQVDTPSKJI-GFCCVEGCSA-N 1 0 301.352 4.222 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CSC[C@H]2C)cc1 ZINC001308400741 1065963861 /nfs/dbraw/zinc/96/38/61/1065963861.db2.gz DCCRSTWHXIECIZ-CRAIPNDOSA-N 1 0 306.519 4.154 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](C)CCC=C(C)C)ccc1OC ZINC001308411450 1065970486 /nfs/dbraw/zinc/97/04/86/1065970486.db2.gz QAXVEHBYLZDLHW-INIZCTEOSA-N 1 0 305.462 4.456 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC3CCC2CC3)cc1F ZINC001308413858 1065971136 /nfs/dbraw/zinc/97/11/36/1065971136.db2.gz HLCHDBZXMIPYDI-PVARCSIZSA-N 1 0 304.453 4.340 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001308424205 1065980311 /nfs/dbraw/zinc/98/03/11/1065980311.db2.gz PFTGIHBYNSYQOH-UHFFFAOYSA-N 1 0 313.466 4.413 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC[C@@H]2C2CC2)cc1 ZINC001308436858 1065988042 /nfs/dbraw/zinc/98/80/42/1065988042.db2.gz WFEVAAFESQOBLP-AZUAARDMSA-N 1 0 300.490 4.449 20 10 DICDRO Cc1cccc(C2([NH2+]Cc3ccc4c(c3)CCCO4)CCC2)c1 ZINC001308446023 1065993822 /nfs/dbraw/zinc/99/38/22/1065993822.db2.gz HKUVLAQAFRSKNE-UHFFFAOYSA-N 1 0 307.437 4.489 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCS[C@H]2C)cc1 ZINC001308458440 1066002407 /nfs/dbraw/zinc/00/24/07/1066002407.db2.gz WSSMXEQCFBJMAO-MAUKXSAKSA-N 1 0 306.519 4.297 20 10 DICDRO CC[C@@H](C[NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)c1ccccc1 ZINC001308461723 1066002855 /nfs/dbraw/zinc/00/28/55/1066002855.db2.gz RKDOOAHHGGCFKN-PKOBYXMFSA-N 1 0 324.468 4.057 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+]C3CCC(C(C)C)CC3)C2)cc1 ZINC001308461591 1066003520 /nfs/dbraw/zinc/00/35/20/1066003520.db2.gz ZFFRNQDQELKFGD-ABHNRTSZSA-N 1 0 316.489 4.078 20 10 DICDRO CC1(C)C[C@]1(C[NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1 ZINC001308473991 1066013537 /nfs/dbraw/zinc/01/35/37/1066013537.db2.gz XSWCJNJMXOJHBJ-QFIPXVFZSA-N 1 0 321.464 4.469 20 10 DICDRO CC(C)([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@H]1CCCCO1 ZINC001308495643 1066027379 /nfs/dbraw/zinc/02/73/79/1066027379.db2.gz CTMQCUPDCXTACU-LJQANCHMSA-N 1 0 316.489 4.114 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(C)nc2Cl)cc1C ZINC001308503788 1066032478 /nfs/dbraw/zinc/03/24/78/1066032478.db2.gz BAYREIIQLZDGNQ-UHFFFAOYSA-N 1 0 318.848 4.430 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1C ZINC001308512728 1066039355 /nfs/dbraw/zinc/03/93/55/1066039355.db2.gz HPMLRGSASFLZHO-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CC(C)(C)OC2(C)C)cc1 ZINC001308532398 1066051807 /nfs/dbraw/zinc/05/18/07/1066051807.db2.gz IVNWCPOBHZTVOL-KRWDZBQOSA-N 1 0 318.505 4.216 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCSC3(CCC3)C2)cc1 ZINC001308540632 1066057189 /nfs/dbraw/zinc/05/71/89/1066057189.db2.gz NQLBWQAHJDPLMY-MAVJXHJTSA-N 1 0 316.514 4.174 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H](C(C)(C)C)CC2)cc1OC ZINC001308572956 1066085153 /nfs/dbraw/zinc/08/51/53/1066085153.db2.gz BBYMACBGFRMVOG-OAHLLOKOSA-N 1 0 321.461 4.058 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c(O)c1 ZINC001308573694 1066086552 /nfs/dbraw/zinc/08/65/52/1066086552.db2.gz REMVJHXMLBRBPG-LJQANCHMSA-N 1 0 301.430 4.032 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)Cc2cccc3ccccc32)c1O ZINC001308579902 1066097165 /nfs/dbraw/zinc/09/71/65/1066097165.db2.gz HDENKAVIIGXZIK-UHFFFAOYSA-N 1 0 321.420 4.494 20 10 DICDRO CC[N@H+](Cc1c(C)cc(OC)cc1O)[C@@H](C)c1ccc(F)cc1 ZINC001308591376 1066102535 /nfs/dbraw/zinc/10/25/35/1066102535.db2.gz DFQMXIMURUPSKQ-AWEZNQCLSA-N 1 0 317.404 4.431 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2c1OCC2 ZINC001308597627 1066108932 /nfs/dbraw/zinc/10/89/32/1066108932.db2.gz VVAOPFOTSBYPAN-UHFFFAOYSA-N 1 0 324.468 4.098 20 10 DICDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)c(C)cc2O)C12CCC2 ZINC001308607505 1066114327 /nfs/dbraw/zinc/11/43/27/1066114327.db2.gz MXLKAADYTBMTDW-IAGOWNOFSA-N 1 0 323.864 4.134 20 10 DICDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)c(C)cc2O)C12CCC2 ZINC001308607507 1066115037 /nfs/dbraw/zinc/11/50/37/1066115037.db2.gz MXLKAADYTBMTDW-SJORKVTESA-N 1 0 323.864 4.134 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)CCc2ccccc2F)c1 ZINC001308613725 1066118604 /nfs/dbraw/zinc/11/86/04/1066118604.db2.gz MYOTYFSQQDUKHY-UHFFFAOYSA-N 1 0 301.405 4.329 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2)c(O)c1 ZINC001308642462 1066133826 /nfs/dbraw/zinc/13/38/26/1066133826.db2.gz CLZBLVWZIKGWSF-UHFFFAOYSA-N 1 0 307.393 4.496 20 10 DICDRO Cc1csc([C@@H](C)C[NH2+]Cc2cc(C(C)C)ccc2O)n1 ZINC001308668950 1066146786 /nfs/dbraw/zinc/14/67/86/1066146786.db2.gz HXJHOEPKMYLBLE-LBPRGKRZSA-N 1 0 304.459 4.174 20 10 DICDRO Cc1cccc([C@@H]2CC[N@H+](Cc3cccc(Cl)c3[O-])C2)c1 ZINC001308683350 1066153744 /nfs/dbraw/zinc/15/37/44/1066153744.db2.gz BMYFWXIHCQECGJ-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cccc2c1C[N@H+](C/C=C\c1ccc(N(C)C)cc1)CC2 ZINC001308687129 1066181190 /nfs/dbraw/zinc/18/11/90/1066181190.db2.gz NRSZHZHSSFQEKD-ALCCZGGFSA-N 1 0 306.453 4.133 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H](C(C)(C)C)C2)cc1F ZINC001308718550 1066197168 /nfs/dbraw/zinc/19/71/68/1066197168.db2.gz RTQVWIBEPHZOFR-AWEZNQCLSA-N 1 0 310.432 4.289 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H](C(C)(C)C)C2)cc1F ZINC001308718551 1066197263 /nfs/dbraw/zinc/19/72/63/1066197263.db2.gz RTQVWIBEPHZOFR-CQSZACIVSA-N 1 0 310.432 4.289 20 10 DICDRO CCCN(Cc1nc(C(C)(C)C)cs1)c1ccc(C[NH3+])cc1 ZINC001308741443 1066216608 /nfs/dbraw/zinc/21/66/08/1066216608.db2.gz UWAJCFIDGMQMOE-UHFFFAOYSA-N 1 0 317.502 4.316 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2Cc3cc(C)ccc3CC2(C)C)c1 ZINC001308782683 1066255318 /nfs/dbraw/zinc/25/53/18/1066255318.db2.gz PFAXEGBQSUURML-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO Oc1c(CNc2cc3c(c[nH+]2)CCCC3)ccc2ccccc21 ZINC001308784627 1066259839 /nfs/dbraw/zinc/25/98/39/1066259839.db2.gz KPFHTVMRZVALCP-UHFFFAOYSA-N 1 0 304.393 4.431 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@H](Oc3ccc(Cl)cc3)C2)c(O)c1 ZINC001308788124 1066261368 /nfs/dbraw/zinc/26/13/68/1066261368.db2.gz FHNHNFLYOTXOPE-KRWDZBQOSA-N 1 0 317.816 4.007 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)c(O)c1 ZINC001308789740 1066263927 /nfs/dbraw/zinc/26/39/27/1066263927.db2.gz IPEDCAJDDBARTJ-KRWDZBQOSA-N 1 0 303.352 4.146 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C2(C3CCC3)CCC2)c1O ZINC001308811055 1066287144 /nfs/dbraw/zinc/28/71/44/1066287144.db2.gz KDAMGJNPHXZMLY-UHFFFAOYSA-N 1 0 324.262 4.276 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[C@@H]2CCCC[C@@H]21 ZINC001308825880 1066301207 /nfs/dbraw/zinc/30/12/07/1066301207.db2.gz QGIGIAOQKUSFDC-UHMOLFJZSA-N 1 0 300.490 4.160 20 10 DICDRO CCCCCC[C@@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001308830131 1066306646 /nfs/dbraw/zinc/30/66/46/1066306646.db2.gz HYZBRFJFTLVXPS-MSOLQXFVSA-N 1 0 318.505 4.470 20 10 DICDRO CCCCCC[C@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001308830133 1066308251 /nfs/dbraw/zinc/30/82/51/1066308251.db2.gz HYZBRFJFTLVXPS-ROUUACIJSA-N 1 0 318.505 4.470 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CCc2ccc(C)c(C)c2)c1O ZINC001308857254 1066339269 /nfs/dbraw/zinc/33/92/69/1066339269.db2.gz RLDIKXUBNLLOHP-UHFFFAOYSA-N 1 0 319.832 4.003 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)cc1Cl ZINC001308863013 1066341508 /nfs/dbraw/zinc/34/15/08/1066341508.db2.gz CYSHPIYFKQKFOQ-KDOFPFPSSA-N 1 0 323.864 4.135 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC(C)(C)CC(C)(C)C2)c(O)c1 ZINC001308860449 1066341652 /nfs/dbraw/zinc/34/16/52/1066341652.db2.gz PDRZWACCSSUAAH-UHFFFAOYSA-N 1 0 305.462 4.357 20 10 DICDRO Cc1cc(O)c(C[NH+]2CC(C)(c3ccccc3)C2)c(Cl)c1 ZINC001308872267 1066353178 /nfs/dbraw/zinc/35/31/78/1066353178.db2.gz DJJZJBMDMRFQAU-UHFFFAOYSA-N 1 0 301.817 4.128 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]Cc1cc(Cl)cc(Cl)c1F ZINC001308902776 1066379427 /nfs/dbraw/zinc/37/94/27/1066379427.db2.gz VDXRFDXUSGJPSC-UHFFFAOYSA-N 1 0 318.150 4.267 20 10 DICDRO CCOC(=O)C(C)(C)CCC[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC001308903081 1066381971 /nfs/dbraw/zinc/38/19/71/1066381971.db2.gz VFQHZZZDIDDCQA-CABCVRRESA-N 1 0 321.461 4.191 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]C[C@H]1C=CCC1 ZINC001308918402 1066397353 /nfs/dbraw/zinc/39/73/53/1066397353.db2.gz LAZBEMRKYZNKFZ-INIZCTEOSA-N 1 0 309.409 4.027 20 10 DICDRO CCOc1ccc(CC[NH2+]Cc2cc(Cl)c(C)cc2O)cc1 ZINC001308966858 1066423219 /nfs/dbraw/zinc/42/32/19/1066423219.db2.gz COLQSUKLHYAKML-UHFFFAOYSA-N 1 0 319.832 4.085 20 10 DICDRO CN(C)c1ccc([C@@H](C[NH2+]C2CCCCCCC2)N(C)C)cc1 ZINC001308971274 1066426246 /nfs/dbraw/zinc/42/62/46/1066426246.db2.gz HAJILJXLZCKRRQ-HXUWFJFHSA-N 1 0 317.521 4.058 20 10 DICDRO COc1cc(C)cc(C[NH2+]CCC2CCC(F)(F)CC2)c1O ZINC001308975190 1066427585 /nfs/dbraw/zinc/42/75/85/1066427585.db2.gz QHDJZZKMMOSSKU-UHFFFAOYSA-N 1 0 313.388 4.014 20 10 DICDRO CC[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(N(C)C)cc1 ZINC000090459390 185297719 /nfs/dbraw/zinc/29/77/19/185297719.db2.gz HGWHBDLZARRTGK-INIZCTEOSA-N 1 0 315.486 4.327 20 10 DICDRO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000188281359 200221222 /nfs/dbraw/zinc/22/12/22/200221222.db2.gz JTIMDWAHZSZSFG-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCSc2ccccc21)c1cc(F)ccc1O ZINC000094617494 193385369 /nfs/dbraw/zinc/38/53/69/193385369.db2.gz SMJBCDSBQRBYOZ-ABAIWWIYSA-N 1 0 303.402 4.419 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(Cl)cc2Cl)cc1 ZINC000020024730 182180332 /nfs/dbraw/zinc/18/03/32/182180332.db2.gz VHSBKERHJUWPOY-UHFFFAOYSA-N 1 0 309.240 4.349 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3sccc32)c1 ZINC000061331115 184168666 /nfs/dbraw/zinc/16/86/66/184168666.db2.gz IOXNZUPELPKYAO-IAQYHMDHSA-N 1 0 303.427 4.191 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1OC ZINC000272824571 130067953 /nfs/dbraw/zinc/06/79/53/130067953.db2.gz GKOZLBAAABZFKJ-CQSZACIVSA-N 1 0 315.413 4.040 20 10 DICDRO Cc1cnccc1CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000273352997 130109059 /nfs/dbraw/zinc/10/90/59/130109059.db2.gz CCFWWCNFWHVKIS-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(O)c1 ZINC000273345825 130109331 /nfs/dbraw/zinc/10/93/31/130109331.db2.gz ASBVKPPMXWETMD-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000273430394 130120517 /nfs/dbraw/zinc/12/05/17/130120517.db2.gz VLHPDOJSFDSIII-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(O)c1C ZINC000273431229 130121165 /nfs/dbraw/zinc/12/11/65/130121165.db2.gz VTLQWTKMLFBGKH-ZIAGYGMSSA-N 1 0 314.385 4.329 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000273446652 130122212 /nfs/dbraw/zinc/12/22/12/130122212.db2.gz FFVBWSAJWUWJBW-CHWSQXEVSA-N 1 0 300.358 4.021 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2cccs2)c(O)c1C ZINC000273455254 130123733 /nfs/dbraw/zinc/12/37/33/130123733.db2.gz HARPWFPRJUDJDN-NOLJZWGESA-N 1 0 319.470 4.233 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)c(O)c1C ZINC000273485551 130127445 /nfs/dbraw/zinc/12/74/45/130127445.db2.gz NEUQFQHMQCAYCD-YQQAZPJKSA-N 1 0 305.462 4.253 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1cc2c(cc1O)CCCC2 ZINC000273528132 130132285 /nfs/dbraw/zinc/13/22/85/130132285.db2.gz VVHLMRHAUXRBRD-WMLDXEAASA-N 1 0 315.457 4.023 20 10 DICDRO C[C@H]([NH2+]CCCc1nccs1)c1ccc2ccccc2c1O ZINC000273539469 130133489 /nfs/dbraw/zinc/13/34/89/130133489.db2.gz XXOXRIRIRVOBPT-ZDUSSCGKSA-N 1 0 312.438 4.285 20 10 DICDRO CC(C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc3ccccc3c2O)[nH]1 ZINC000273542904 130134896 /nfs/dbraw/zinc/13/48/96/130134896.db2.gz YROHFMNGTPUWRT-OLZOCXBDSA-N 1 0 324.428 4.199 20 10 DICDRO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273571642 130138135 /nfs/dbraw/zinc/13/81/35/130138135.db2.gz KURFXLBNLLALMD-QWHCGFSZSA-N 1 0 304.459 4.440 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000284966657 131127327 /nfs/dbraw/zinc/12/73/27/131127327.db2.gz FQWGCYMFKLQGSI-OLZOCXBDSA-N 1 0 302.418 4.068 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)c(O)c1 ZINC000286888175 131253898 /nfs/dbraw/zinc/25/38/98/131253898.db2.gz CWFDUMPWBRNQML-JKSUJKDBSA-N 1 0 321.424 4.298 20 10 DICDRO C[C@@H]([NH2+]CC1=CCCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000286986483 131259099 /nfs/dbraw/zinc/25/90/99/131259099.db2.gz JJSHNXPXGAINOR-QGZVFWFLSA-N 1 0 314.473 4.064 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCOC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000287315651 131275232 /nfs/dbraw/zinc/27/52/32/131275232.db2.gz FEXQIIJYRCLGFD-JENIJYKNSA-N 1 0 316.489 4.000 20 10 DICDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000290351996 131479450 /nfs/dbraw/zinc/47/94/50/131479450.db2.gz GCUSPKRAPVKGNZ-OAHLLOKOSA-N 1 0 320.820 4.032 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cnn(-c3ccccc3)c2)c(O)c1 ZINC000293882806 131779305 /nfs/dbraw/zinc/77/93/05/131779305.db2.gz VLQSFXASLNWIDH-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO COc1ccc([C@@H]([NH2+][C@H]2CCc3cccc(O)c32)C2CC2)cc1 ZINC000296017540 131935318 /nfs/dbraw/zinc/93/53/18/131935318.db2.gz PDQMHPIVKIGVTB-PXNSSMCTSA-N 1 0 309.409 4.129 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C(F)F)cc2)c1 ZINC000183989624 333190723 /nfs/dbraw/zinc/19/07/23/333190723.db2.gz QCLMKVSAVYVLHE-NSHDSACASA-N 1 0 307.340 4.189 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000184611584 333198914 /nfs/dbraw/zinc/19/89/14/333198914.db2.gz XDNWXGDQNZNIDY-UONOGXRCSA-N 1 0 315.461 4.372 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCCc3sccc32)c1O ZINC000185206678 333368978 /nfs/dbraw/zinc/36/89/78/333368978.db2.gz YVWNZPQPLVOSKQ-CYBMUJFWSA-N 1 0 323.845 4.283 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1O ZINC000295938328 335138671 /nfs/dbraw/zinc/13/86/71/335138671.db2.gz GDUCWWIDLNBSFG-LRDDRELGSA-N 1 0 300.358 4.102 20 10 DICDRO C[C@H](CCCCO)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000296373668 335143869 /nfs/dbraw/zinc/14/38/69/335143869.db2.gz JIEHMLSLDQIFPQ-CVEARBPZSA-N 1 0 322.468 4.018 20 10 DICDRO C[C@@H](CCCCO)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000296373671 335143944 /nfs/dbraw/zinc/14/39/44/335143944.db2.gz JIEHMLSLDQIFPQ-HOTGVXAUSA-N 1 0 322.468 4.018 20 10 DICDRO CC[C@@](C)([NH2+]Cc1ccc(OC)c(C)c1)c1nc(C)cs1 ZINC000266172442 333971925 /nfs/dbraw/zinc/97/19/25/333971925.db2.gz RUCQVYXILCDVSH-QGZVFWFLSA-N 1 0 304.459 4.184 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C)cc1O ZINC000280231521 334115529 /nfs/dbraw/zinc/11/55/29/334115529.db2.gz VIUSEIODYFKSPR-CXAGYDPISA-N 1 0 314.385 4.411 20 10 DICDRO Cc1c[nH+]ccc1N1CC=C(c2c[nH]c3cc(F)ccc32)CC1 ZINC000358932266 336648068 /nfs/dbraw/zinc/64/80/68/336648068.db2.gz KZOYUDCKXLLMDF-UHFFFAOYSA-N 1 0 307.372 4.304 20 10 DICDRO C[C@@H]([NH2+][C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccccc1O ZINC000367829149 336830246 /nfs/dbraw/zinc/83/02/46/336830246.db2.gz WCUSRLFQNMGRFI-WBMJQRKESA-N 1 0 315.388 4.484 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)c1 ZINC000373257119 336954667 /nfs/dbraw/zinc/95/46/67/336954667.db2.gz TWWUQQJHRLTVFA-XAUMDUMWSA-N 1 0 311.425 4.129 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c(O)c1C ZINC000375346525 337008670 /nfs/dbraw/zinc/00/86/70/337008670.db2.gz ZQFVYZPSUHLKIK-SUMWQHHRSA-N 1 0 315.388 4.323 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2-n2cccn2)c(O)c1 ZINC000185742200 337251033 /nfs/dbraw/zinc/25/10/33/337251033.db2.gz GNVWEBGBMVDKGS-HOTGVXAUSA-N 1 0 321.424 4.298 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3ccccc3)CC2)cc1 ZINC000129473380 337429623 /nfs/dbraw/zinc/42/96/23/337429623.db2.gz VVIPXCBOBKWDEK-MRXNPFEDSA-N 1 0 310.441 4.015 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000136742515 337455000 /nfs/dbraw/zinc/45/50/00/337455000.db2.gz YNTWKKMGKDTXGR-OAHLLOKOSA-N 1 0 309.837 4.017 20 10 DICDRO Cc1[nH]c2ccc(F)cc2c1CC[NH2+][C@H](C)c1ccccc1O ZINC000527998330 337779107 /nfs/dbraw/zinc/77/91/07/337779107.db2.gz YILQWAKKTODVLO-GFCCVEGCSA-N 1 0 312.388 4.214 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)C1CCSCC1 ZINC000475199798 339441306 /nfs/dbraw/zinc/44/13/06/339441306.db2.gz ASRCUKXMGYUIGI-AWEZNQCLSA-N 1 0 302.487 4.108 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000479457987 339536059 /nfs/dbraw/zinc/53/60/59/339536059.db2.gz UUPHIVQQEFGHQO-INIZCTEOSA-N 1 0 321.468 4.404 20 10 DICDRO Cc1cccnc1CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000296331356 341717737 /nfs/dbraw/zinc/71/77/37/341717737.db2.gz HGRCHQXTSIAZEZ-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(Cl)nc2)cc1 ZINC000178247343 520287669 /nfs/dbraw/zinc/28/76/69/520287669.db2.gz PBJOZKZBPFQDGB-ZDUSSCGKSA-N 1 0 303.837 4.042 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3O)cc1 ZINC000130312873 520287936 /nfs/dbraw/zinc/28/79/36/520287936.db2.gz ZDSFRSXYRKRQKK-AUUYWEPGSA-N 1 0 310.441 4.186 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)cc1 ZINC000182381072 520374396 /nfs/dbraw/zinc/37/43/96/520374396.db2.gz BTPOKBSKZIUHQP-CQSZACIVSA-N 1 0 315.413 4.040 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@](C)(CC)c2nccs2)cc1 ZINC000152638851 520910322 /nfs/dbraw/zinc/91/03/22/520910322.db2.gz TUAKHXLVBQJQOG-GOSISDBHSA-N 1 0 317.502 4.404 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)c2cc3ccccc3o2)c1 ZINC000189094132 521155167 /nfs/dbraw/zinc/15/51/67/521155167.db2.gz GWNAXGDALAPQKS-ZDUSSCGKSA-N 1 0 311.381 4.388 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(COC)cc1)c1ccc(N(C)C)cc1 ZINC000124420095 522646426 /nfs/dbraw/zinc/64/64/26/522646426.db2.gz LCDBYILRVHMZSR-FQEVSTJZSA-N 1 0 312.457 4.140 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)c1ccccc1O ZINC000157901349 522649005 /nfs/dbraw/zinc/64/90/05/522649005.db2.gz JIBJBWVSGLCZSJ-INIZCTEOSA-N 1 0 314.429 4.205 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1cc(F)ccc1F ZINC000186071063 522695664 /nfs/dbraw/zinc/69/56/64/522695664.db2.gz CXNFUOFTDHQJSX-GTNSWQLSSA-N 1 0 321.367 4.481 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc(-n2cccn2)c1)c1ccccc1O ZINC000156151230 522698310 /nfs/dbraw/zinc/69/83/10/522698310.db2.gz YAWGWHHOUKTQMQ-KXBFYZLASA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccc(F)cc1F ZINC000182391928 522738956 /nfs/dbraw/zinc/73/89/56/522738956.db2.gz UWLGWTBHLDSWIT-DIFFPNOSSA-N 1 0 321.367 4.481 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc(-n2cccn2)c1)c1ccccc1O ZINC000156151351 522914075 /nfs/dbraw/zinc/91/40/75/522914075.db2.gz YAWGWHHOUKTQMQ-HNAYVOBHSA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccc(F)cc1F ZINC000182391947 522935601 /nfs/dbraw/zinc/93/56/01/522935601.db2.gz UWLGWTBHLDSWIT-PIGZYNQJSA-N 1 0 321.367 4.481 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)c1 ZINC000182442675 524762085 /nfs/dbraw/zinc/76/20/85/524762085.db2.gz RIDNGXLIBJUNLC-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3ccc(F)cc32)c1 ZINC000182381205 524766669 /nfs/dbraw/zinc/76/66/69/524766669.db2.gz BWXDMOAIWPFLHC-XIKOKIGWSA-N 1 0 315.388 4.268 20 10 DICDRO C[C@H]([NH2+]CCCc1ccccn1)c1ccc2ccccc2c1O ZINC000186140752 525343792 /nfs/dbraw/zinc/34/37/92/525343792.db2.gz GMSXOOJUEMYAPA-HNNXBMFYSA-N 1 0 306.409 4.224 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c1 ZINC000186009236 525364388 /nfs/dbraw/zinc/36/43/88/525364388.db2.gz PNXADIXHINRFIZ-BLLLJJGKSA-N 1 0 301.361 4.014 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(OC(F)F)cc1 ZINC000179874546 525535109 /nfs/dbraw/zinc/53/51/09/525535109.db2.gz ZRJRMMISVSDDJB-RYUDHWBXSA-N 1 0 307.340 4.405 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccc(N(C)C)cc1 ZINC000180716253 525578421 /nfs/dbraw/zinc/57/84/21/525578421.db2.gz ZUWHVLUJTOLMSE-SCLBCKFNSA-N 1 0 314.404 4.066 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)c1cccnc1 ZINC000158551552 525608685 /nfs/dbraw/zinc/60/86/85/525608685.db2.gz GAGJYJAOWWGIHD-DLBZAZTESA-N 1 0 309.457 4.484 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)c1cc(F)ccc1O ZINC000158057221 525646098 /nfs/dbraw/zinc/64/60/98/525646098.db2.gz WFDXMSGLOZMHRL-NRXGSXMXSA-N 1 0 315.388 4.102 20 10 DICDRO Cc1ccc([C@@H]([NH2+]Cc2cccc(C)c2O)c2ccccn2)cc1 ZINC000366269492 525776471 /nfs/dbraw/zinc/77/64/71/525776471.db2.gz MODKFVOCXWJCIG-HXUWFJFHSA-N 1 0 318.420 4.283 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)CCC2 ZINC000364962680 527113530 /nfs/dbraw/zinc/11/35/30/527113530.db2.gz OPRQYGUWDHECDV-NOZJJQNGSA-N 1 0 306.406 4.024 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(C)o1 ZINC000273422428 536807595 /nfs/dbraw/zinc/80/75/95/536807595.db2.gz JPBDMIKHOLKXRM-GOEBONIOSA-N 1 0 303.402 4.030 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(C)o1 ZINC000272706388 536808694 /nfs/dbraw/zinc/80/86/94/536808694.db2.gz ZUFKNTJFIHXVEE-MAUKXSAKSA-N 1 0 316.445 4.082 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCSC(F)(F)F)cc1F ZINC000740004214 1050594158 /nfs/dbraw/zinc/59/41/58/1050594158.db2.gz JLHGWBFZTCTECG-UHFFFAOYSA-N 1 0 324.387 4.015 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1O)c1cccc(OC(F)(F)F)c1 ZINC000175755070 1035777355 /nfs/dbraw/zinc/77/73/55/1035777355.db2.gz XLKUBCPJCFQBMU-NSHDSACASA-N 1 0 311.303 4.142 20 10 DICDRO CC(C)[N@H+](CCSC(C)(C)C)Cc1ccc(N(C)C)cc1 ZINC001167107229 1036088708 /nfs/dbraw/zinc/08/87/08/1036088708.db2.gz APLIQEMLNDXFOE-UHFFFAOYSA-N 1 0 308.535 4.495 20 10 DICDRO CC[C@H]([NH2+]CCc1csc(C(C)C)n1)c1ccccc1O ZINC000155568515 1036836886 /nfs/dbraw/zinc/83/68/86/1036836886.db2.gz XTAMDMSMBYITGF-HNNXBMFYSA-N 1 0 304.459 4.256 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC001167424254 1037227742 /nfs/dbraw/zinc/22/77/42/1037227742.db2.gz FRLJRYRJMJSPGD-QGZVFWFLSA-N 1 0 314.860 4.396 20 10 DICDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1c(O)cccc1Br ZINC000706833834 1037480326 /nfs/dbraw/zinc/48/03/26/1037480326.db2.gz JUXMGXHDJTXPCB-NWDGAFQWSA-N 1 0 312.251 4.071 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2sc(C)nc2C)cc1 ZINC000157916839 1037961833 /nfs/dbraw/zinc/96/18/33/1037961833.db2.gz LSERODDUXJEISO-ZDUSSCGKSA-N 1 0 317.502 4.109 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2ccccc2)N2CCCC2)c(O)c1 ZINC000323907785 1038242115 /nfs/dbraw/zinc/24/21/15/1038242115.db2.gz RBUCMUMUARXURP-FXAWDEMLSA-N 1 0 324.468 4.188 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)c(O)c1C ZINC000277003530 1038348280 /nfs/dbraw/zinc/34/82/80/1038348280.db2.gz ZQFVYZPSUHLKIK-DYVFJYSZSA-N 1 0 315.388 4.323 20 10 DICDRO COc1ccccc1[C@@H](NCc1cc(C)ccc1O)c1ccco1 ZINC000151130046 1038432336 /nfs/dbraw/zinc/43/23/36/1038432336.db2.gz VHHVJEIULDZOFV-HXUWFJFHSA-N 1 0 323.392 4.181 20 10 DICDRO CC[N@H+](CCCC(C)C)Cc1cc(Br)ccc1O ZINC001167512451 1038535110 /nfs/dbraw/zinc/53/51/10/1038535110.db2.gz NOKUNQUPXLIOEA-UHFFFAOYSA-N 1 0 314.267 4.413 20 10 DICDRO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001167533714 1038552476 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CCC[C@H](CCO)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152404291 1040067416 /nfs/dbraw/zinc/06/74/16/1040067416.db2.gz PFFQZVMWOBAAIV-QZTJIDSGSA-N 1 0 318.505 4.126 20 10 DICDRO CCC[C@@H](CCO)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152403998 1040068550 /nfs/dbraw/zinc/06/85/50/1040068550.db2.gz PFFQZVMWOBAAIV-ROUUACIJSA-N 1 0 318.505 4.126 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CCC[NH+](CC)CC)c1ccc(F)cc1[O-] ZINC000796663671 1040210533 /nfs/dbraw/zinc/21/05/33/1040210533.db2.gz OKDYAPFCELMUNP-WMLDXEAASA-N 1 0 310.457 4.083 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000310156517 1040448044 /nfs/dbraw/zinc/44/80/44/1040448044.db2.gz HELAYVPAJJJTDL-SQGPQFPESA-N 1 0 324.468 4.014 20 10 DICDRO C[NH+](C)CCC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000725841735 1040545940 /nfs/dbraw/zinc/54/59/40/1040545940.db2.gz YTWIKIPRDAUTTF-UHFFFAOYSA-N 1 0 320.521 4.029 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccc(N(C)C)cc1 ZINC000178120647 1040929284 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CC[C@@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccc(F)cc1 ZINC000182323391 1041566839 /nfs/dbraw/zinc/56/68/39/1041566839.db2.gz HWMNUJMBNSHNLR-SJKOYZFVSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1cccc(C[N@H+](C)Cc2ccccc2O)c1Br ZINC001141092199 1041583479 /nfs/dbraw/zinc/58/34/79/1041583479.db2.gz KTYBDILHUGHNIB-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(F)c(F)c2)c2c1c(F)ccc2O ZINC000756457840 1041592422 /nfs/dbraw/zinc/59/24/22/1041592422.db2.gz RQWVJHWYEFAZTO-XPTSAGLGSA-N 1 0 307.315 4.148 20 10 DICDRO Cc1nc2ccccc2n1CCC[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000184869697 1041600523 /nfs/dbraw/zinc/60/05/23/1041600523.db2.gz PRPYTCWZOKFWDP-HNNXBMFYSA-N 1 0 323.440 4.100 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C)c1cc(F)ccc1O ZINC000185489104 1041615751 /nfs/dbraw/zinc/61/57/51/1041615751.db2.gz MGBULJUZYGGWOZ-DCGLDWPTSA-N 1 0 309.425 4.023 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2ccc3ccccc3c2O)CCC1 ZINC000185753118 1041620738 /nfs/dbraw/zinc/62/07/38/1041620738.db2.gz 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ZINC000310071365 1041701770 /nfs/dbraw/zinc/70/17/70/1041701770.db2.gz AGYVAHYUGCREDX-LSTHTHJFSA-N 1 0 324.468 4.096 20 10 DICDRO CCOCc1cc(C[NH2+][C@H]2CCCC[C@H]2CC)ccc1OC ZINC000747854622 1041702680 /nfs/dbraw/zinc/70/26/80/1041702680.db2.gz UADFFOKHVOXROV-AEFFLSMTSA-N 1 0 305.462 4.290 20 10 DICDRO CC(C)CC(CC(C)C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000728782987 1041722915 /nfs/dbraw/zinc/72/29/15/1041722915.db2.gz VWVUCMTVNXGUFH-UHFFFAOYSA-N 1 0 318.505 4.074 20 10 DICDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2c(O)cccc2Cl)s1 ZINC000123171680 1041733907 /nfs/dbraw/zinc/73/39/07/1041733907.db2.gz RXCWCPXCIDCWOP-SNVBAGLBSA-N 1 0 310.850 4.312 20 10 DICDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])Cc1c(O)ccc2ccccc21 ZINC000025478895 1041751962 /nfs/dbraw/zinc/75/19/62/1041751962.db2.gz VETCQJYMWNFHFR-UHFFFAOYSA-N 1 0 322.364 4.086 20 10 DICDRO CC1(C)CN(Cc2c(O)cccc2Cl)[C@H]1c1cccnc1 ZINC000814171497 1041777677 /nfs/dbraw/zinc/77/76/77/1041777677.db2.gz QZBGPEOCGZDWLK-INIZCTEOSA-N 1 0 302.805 4.024 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCCc2sc(Cl)cc21 ZINC000814175171 1041778807 /nfs/dbraw/zinc/77/88/07/1041778807.db2.gz QJPWHEHUULJYKY-GFCCVEGCSA-N 1 0 311.809 4.413 20 10 DICDRO Oc1ccccc1C[N@@H+]1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000814178954 1041780581 /nfs/dbraw/zinc/78/05/81/1041780581.db2.gz KNAFPYIZTVQEAR-INIZCTEOSA-N 1 0 319.857 4.412 20 10 DICDRO CC[C@H]([NH2+][C@@H](COC)c1ccc(Cl)cc1)c1ccccc1O ZINC000194254091 1041786003 /nfs/dbraw/zinc/78/60/03/1041786003.db2.gz VJTMCLRAQMVNMN-IRXDYDNUSA-N 1 0 319.832 4.474 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(Cl)cc1 ZINC000756608462 1041788329 /nfs/dbraw/zinc/78/83/29/1041788329.db2.gz CDJUZOMADLSEHS-SCLBCKFNSA-N 1 0 319.832 4.392 20 10 DICDRO Oc1ccccc1C[NH2+][C@@H]1CCOc2c(Cl)c(Cl)ccc21 ZINC000364457166 1041795991 /nfs/dbraw/zinc/79/59/91/1041795991.db2.gz IWJJBZYETKRGTG-CYBMUJFWSA-N 1 0 324.207 4.312 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2ncccc2c1)c1cc(Cl)ccc1O ZINC000195147011 1041802251 /nfs/dbraw/zinc/80/22/51/1041802251.db2.gz VHQQRMUCZCXCTQ-LBPRGKRZSA-N 1 0 312.800 4.445 20 10 DICDRO CCOc1cccc(C[NH2+]C[C@H](c2ccccc2)C2CC2)c1O ZINC000814298090 1041807172 /nfs/dbraw/zinc/80/71/72/1041807172.db2.gz OGZGIIIRNSDBRV-GOSISDBHSA-N 1 0 311.425 4.074 20 10 DICDRO C[C@H]([NH2+]CCCC(F)(F)F)c1cc2c(cc1O)CCCC2 ZINC000756626266 1041807881 /nfs/dbraw/zinc/80/78/81/1041807881.db2.gz NMKQCQGEOCYMGI-NSHDSACASA-N 1 0 301.352 4.264 20 10 DICDRO COc1ccc(C(C)(C)C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756682152 1041870029 /nfs/dbraw/zinc/87/00/29/1041870029.db2.gz NICLULJOKFKMFG-CYBMUJFWSA-N 1 0 317.404 4.168 20 10 DICDRO Cc1ccc(C2CC[NH+](Cc3ccc(N(C)C)c(C)c3)CC2)cn1 ZINC000815091858 1041909107 /nfs/dbraw/zinc/90/91/07/1041909107.db2.gz SSHYGFUOVLOBEE-UHFFFAOYSA-N 1 0 323.484 4.144 20 10 DICDRO Cc1cc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)ccc1N(C)C ZINC000815092925 1041910390 /nfs/dbraw/zinc/91/03/90/1041910390.db2.gz VXLAODYMHVMGBT-FOIQADDNSA-N 1 0 309.457 4.039 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C(C)(C)c2ccccc2F)cc1 ZINC000815121839 1041914783 /nfs/dbraw/zinc/91/47/83/1041914783.db2.gz YGOMJKMXMYMBEV-UHFFFAOYSA-N 1 0 300.421 4.307 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](c2ccsc2)N(C)C)c(O)c1 ZINC000815556141 1041962697 /nfs/dbraw/zinc/96/26/97/1041962697.db2.gz OPUAXZUWQHNMSQ-GOEBONIOSA-N 1 0 318.486 4.024 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccn(-c3ccccc3)n2)c(O)c1 ZINC000815570282 1041963910 /nfs/dbraw/zinc/96/39/10/1041963910.db2.gz YDAJEVUHWDCKCZ-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc3ccccc3n2)c(O)c1 ZINC000815566727 1041964056 /nfs/dbraw/zinc/96/40/56/1041964056.db2.gz CUKCWDQXXRYSOQ-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cc1F ZINC000815577002 1041965673 /nfs/dbraw/zinc/96/56/73/1041965673.db2.gz DPBVGDFZCNREAD-AWEZNQCLSA-N 1 0 317.404 4.398 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCOc3ccccc32)c(O)c1 ZINC000815578340 1041965722 /nfs/dbraw/zinc/96/57/22/1041965722.db2.gz MIUSZAQCYHLVEI-HZPDHXFCSA-N 1 0 311.425 4.226 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000815580547 1041965972 /nfs/dbraw/zinc/96/59/72/1041965972.db2.gz MGTSTIKGQISDNL-ROUUACIJSA-N 1 0 324.468 4.329 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815577281 1041966161 /nfs/dbraw/zinc/96/61/61/1041966161.db2.gz LSHVKAOMFNPBAR-MRXNPFEDSA-N 1 0 312.457 4.316 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCCSc2nccs2)c(O)c1 ZINC000815581782 1041967442 /nfs/dbraw/zinc/96/74/42/1041967442.db2.gz PHQRENRAZMGPKO-ZDUSSCGKSA-N 1 0 322.499 4.299 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+][C@@H]1CCSC1 ZINC000815595242 1041969591 /nfs/dbraw/zinc/96/95/91/1041969591.db2.gz LNCBGRCUZHWNDT-AEFFLSMTSA-N 1 0 313.466 4.161 20 10 DICDRO CS[C@H](C)C[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815597948 1041970389 /nfs/dbraw/zinc/97/03/89/1041970389.db2.gz JIPGCAUGKDTHIS-CRAIPNDOSA-N 1 0 315.482 4.407 20 10 DICDRO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000815571327 1041971415 /nfs/dbraw/zinc/97/14/15/1041971415.db2.gz APCQUTLPFRTEJN-ZDUSSCGKSA-N 1 0 304.384 4.190 20 10 DICDRO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000815571773 1041972437 /nfs/dbraw/zinc/97/24/37/1041972437.db2.gz LQDXRXJCULVHIP-HNNXBMFYSA-N 1 0 312.432 4.367 20 10 DICDRO CO[C@@H](C)CC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815573179 1041972967 /nfs/dbraw/zinc/97/29/67/1041972967.db2.gz ALGJVEKPPKRHHC-QFBILLFUSA-N 1 0 313.441 4.081 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccc(F)c(F)c2)c(O)c1 ZINC000815619300 1041975301 /nfs/dbraw/zinc/97/53/01/1041975301.db2.gz JFFDMSAFARLOOO-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO CC(C)OCC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815616772 1041975579 /nfs/dbraw/zinc/97/55/79/1041975579.db2.gz XWXCPBMRNYKYEX-LJQANCHMSA-N 1 0 313.441 4.081 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000756758541 1041977368 /nfs/dbraw/zinc/97/73/68/1041977368.db2.gz GOGCMGNBYNMSQS-INIZCTEOSA-N 1 0 305.462 4.257 20 10 DICDRO CC[C@@H](C[NH2+][C@H](CCc1ccccc1)c1ccccc1O)OC ZINC000815628321 1041978886 /nfs/dbraw/zinc/97/88/86/1041978886.db2.gz XPQCNHCTOWJBTO-PKOBYXMFSA-N 1 0 313.441 4.081 20 10 DICDRO C[C@@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(N2CCOCC2)cc1 ZINC000815657381 1041980564 /nfs/dbraw/zinc/98/05/64/1041980564.db2.gz XPBFFTOJBLBPBU-MRXNPFEDSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1cc[nH]c(=O)c1 ZINC000815642989 1041982976 /nfs/dbraw/zinc/98/29/76/1041982976.db2.gz QJUIXCOOBXGCSS-OLZOCXBDSA-N 1 0 308.381 4.058 20 10 DICDRO C[C@@H](F)CC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815645359 1041983371 /nfs/dbraw/zinc/98/33/71/1041983371.db2.gz CQSVWCQGAHGVBD-CRAIPNDOSA-N 1 0 301.405 4.404 20 10 DICDRO CC[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(C)cc1O ZINC000815649991 1041984108 /nfs/dbraw/zinc/98/41/08/1041984108.db2.gz DXDGIVDIPVAUMP-INIZCTEOSA-N 1 0 309.331 4.359 20 10 DICDRO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(Cl)ccc1O ZINC000815649611 1041984461 /nfs/dbraw/zinc/98/44/61/1041984461.db2.gz UXRJOEYFWNCOKK-QMMMGPOBSA-N 1 0 315.722 4.314 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(C)cc1O ZINC000815649992 1041984638 /nfs/dbraw/zinc/98/46/38/1041984638.db2.gz DXDGIVDIPVAUMP-MRXNPFEDSA-N 1 0 309.331 4.359 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1O ZINC000748046802 1042026012 /nfs/dbraw/zinc/02/60/12/1042026012.db2.gz PFCTXHOFPLZGSQ-OAHLLOKOSA-N 1 0 319.401 4.133 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@H]2c2ccccc2)c1O ZINC000748050996 1042031049 /nfs/dbraw/zinc/03/10/49/1042031049.db2.gz LVZJDWKPHVFJOD-SFHVURJKSA-N 1 0 313.372 4.071 20 10 DICDRO C[N@H+](Cc1ccc(F)cc1F)Cc1ccc2ccccc2c1O ZINC000816484213 1042055352 /nfs/dbraw/zinc/05/53/52/1042055352.db2.gz UIXAXKHDGNZDLP-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO COc1ccccc1CC[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816504254 1042060004 /nfs/dbraw/zinc/06/00/04/1042060004.db2.gz FPKOVRUPOUPDRP-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO C[N@H+](Cc1ccc2ccccc2c1O)[C@@H](CCO)c1ccccc1 ZINC000816512298 1042062247 /nfs/dbraw/zinc/06/22/47/1042062247.db2.gz DYJMKGJBHYGIAX-FQEVSTJZSA-N 1 0 321.420 4.101 20 10 DICDRO CCOCc1ccc(C[NH2+]Cc2ccc3ccccc3c2O)cc1 ZINC000816534900 1042063356 /nfs/dbraw/zinc/06/33/56/1042063356.db2.gz YOKGRGPKODTISE-UHFFFAOYSA-N 1 0 321.420 4.372 20 10 DICDRO CS[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816549954 1042064896 /nfs/dbraw/zinc/06/48/96/1042064896.db2.gz DBVBYKOMCYRIFO-HZPDHXFCSA-N 1 0 301.455 4.309 20 10 DICDRO Oc1c(C[NH2+]CCc2cc(F)ccc2F)ccc2ccccc21 ZINC000816555380 1042066942 /nfs/dbraw/zinc/06/69/42/1042066942.db2.gz BRIQXZNAITUFLL-UHFFFAOYSA-N 1 0 313.347 4.156 20 10 DICDRO Cc1c(C[NH2+]Cc2ccc3ccccc3c2O)cccc1[N+](=O)[O-] ZINC000816591057 1042067093 /nfs/dbraw/zinc/06/70/93/1042067093.db2.gz SRBHTEXUVOKZPS-UHFFFAOYSA-N 1 0 322.364 4.052 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc3ccccc3c2O)c(C)c1 ZINC000816558445 1042067232 /nfs/dbraw/zinc/06/72/32/1042067232.db2.gz YZFDPCNDAUZUTE-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO CCO[C@H](C[NH2+]Cc1ccc2ccccc2c1O)c1ccccc1 ZINC000816593430 1042067345 /nfs/dbraw/zinc/06/73/45/1042067345.db2.gz RRGKMDVLACKHET-HXUWFJFHSA-N 1 0 321.420 4.413 20 10 DICDRO Oc1c(C[NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)ccc2ccccc21 ZINC000816556148 1042067503 /nfs/dbraw/zinc/06/75/03/1042067503.db2.gz BIPLTKWUDXHWDB-HBMCJLEFSA-N 1 0 315.416 4.221 20 10 DICDRO Oc1c(C[NH2+][C@H]2CCOC3(CCCC3)C2)ccc2ccccc21 ZINC000816556440 1042067789 /nfs/dbraw/zinc/06/77/89/1042067789.db2.gz IXHCVOJUFFEPHE-KRWDZBQOSA-N 1 0 311.425 4.127 20 10 DICDRO CS[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)C(C)(C)C ZINC000816567577 1042068500 /nfs/dbraw/zinc/06/85/00/1042068500.db2.gz GBELSLIZLKTDBY-INIZCTEOSA-N 1 0 303.471 4.413 20 10 DICDRO CS[C@H](C[NH2+]Cc1ccc2ccccc2c1O)C(C)(C)C ZINC000816567578 1042068907 /nfs/dbraw/zinc/06/89/07/1042068907.db2.gz GBELSLIZLKTDBY-MRXNPFEDSA-N 1 0 303.471 4.413 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1 ZINC000816632175 1042077387 /nfs/dbraw/zinc/07/73/87/1042077387.db2.gz XDFMTZBRSAAMAZ-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000817366437 1042105968 /nfs/dbraw/zinc/10/59/68/1042105968.db2.gz XBZNQWFGWQIKAJ-ZDUSSCGKSA-N 1 0 301.352 4.173 20 10 DICDRO COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000817574489 1042114989 /nfs/dbraw/zinc/11/49/89/1042114989.db2.gz OVPIRDDSLXWVGP-GFCCVEGCSA-N 1 0 317.816 4.134 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CC23CCSCC3)c(O)c1 ZINC000817588527 1042118210 /nfs/dbraw/zinc/11/82/10/1042118210.db2.gz GVWVOFKSYREVTF-LSDHHAIUSA-N 1 0 305.487 4.193 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CC23CCSCC3)c(O)c1 ZINC000817588524 1042118482 /nfs/dbraw/zinc/11/84/82/1042118482.db2.gz GVWVOFKSYREVTF-GJZGRUSLSA-N 1 0 305.487 4.193 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC23CCSCC3)c2c1c(F)ccc2O ZINC000817588265 1042118924 /nfs/dbraw/zinc/11/89/24/1042118924.db2.gz DFEIEPSYCMIGDI-MBNYWOFBSA-N 1 0 321.461 4.203 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CC12CCSCC2)c1cc(Cl)ccc1O ZINC000817588072 1042119986 /nfs/dbraw/zinc/11/99/86/1042119986.db2.gz BRXNSOBWQCQDFQ-VXGBXAGGSA-N 1 0 311.878 4.230 20 10 DICDRO C[NH2+]CCc1ccccc1C(=O)N(C)c1ccc(C(C)(C)C)cc1 ZINC000817923118 1042129641 /nfs/dbraw/zinc/12/96/41/1042129641.db2.gz DTTIQOJXCZVGBT-UHFFFAOYSA-N 1 0 324.468 4.023 20 10 DICDRO CC[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817947406 1042130665 /nfs/dbraw/zinc/13/06/65/1042130665.db2.gz NCFDKKJLKWQTQJ-SRHKJQAYSA-N 1 0 317.260 4.010 20 10 DICDRO Nc1ccc(CC[NH2+][C@H](c2cccs2)C2CCCC2)cc1 ZINC000817955759 1042131225 /nfs/dbraw/zinc/13/12/25/1042131225.db2.gz HBVZCIGDIIOGFH-SFHVURJKSA-N 1 0 300.471 4.394 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](N)c2ccc(C(C)C)cc2)c(O)c1 ZINC000817954141 1042131322 /nfs/dbraw/zinc/13/13/22/1042131322.db2.gz VIEOPGSSGPYGHQ-HNAYVOBHSA-N 1 0 312.457 4.175 20 10 DICDRO Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955405 1042131690 /nfs/dbraw/zinc/13/16/90/1042131690.db2.gz AAJARMICPKYPPI-LBPRGKRZSA-N 1 0 317.502 4.225 20 10 DICDRO COc1ccc2oc([C@H](C)[NH2+]CCc3ccc(N)cc3)c(C)c2c1 ZINC000817956141 1042131758 /nfs/dbraw/zinc/13/17/58/1042131758.db2.gz RQQBTUNMODPFFG-AWEZNQCLSA-N 1 0 324.424 4.225 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817969485 1042134613 /nfs/dbraw/zinc/13/46/13/1042134613.db2.gz DPYMRGCYTUIXRB-KWBADKCTSA-N 1 0 317.260 4.010 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccc(C)cc1O ZINC000817977611 1042134926 /nfs/dbraw/zinc/13/49/26/1042134926.db2.gz LKQZWHGVNQLJAZ-GOSISDBHSA-N 1 0 310.441 4.300 20 10 DICDRO C[C@H]([NH2+]Cc1cccc2c1CCCN2)c1cc(Cl)ccc1O ZINC000817974511 1042135039 /nfs/dbraw/zinc/13/50/39/1042135039.db2.gz BJTRWAKJUYTQKW-LBPRGKRZSA-N 1 0 316.832 4.255 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c(Cl)c1 ZINC000818329891 1042147545 /nfs/dbraw/zinc/14/75/45/1042147545.db2.gz HQRBAXGGGCGDLG-LBPRGKRZSA-N 1 0 317.816 4.134 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccc(Cl)c1 ZINC000752940805 1042157875 /nfs/dbraw/zinc/15/78/75/1042157875.db2.gz QFYLECBCFQIQTF-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1cccc(Cl)c1[O-] ZINC000317341121 1042224874 /nfs/dbraw/zinc/22/48/74/1042224874.db2.gz YXKRFCPXFWJPKC-CYBMUJFWSA-N 1 0 319.832 4.117 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccc(N(C)C)cc1 ZINC000178530384 1042241104 /nfs/dbraw/zinc/24/11/04/1042241104.db2.gz OEOUHOHTRLNMBZ-GOSISDBHSA-N 1 0 316.420 4.141 20 10 DICDRO CCCN(Cc1cnc2ccccc2c1)c1ccc(C[NH3+])cc1 ZINC000322224839 1042350783 /nfs/dbraw/zinc/35/07/83/1042350783.db2.gz ZCZLRXVPWOJTLB-UHFFFAOYSA-N 1 0 305.425 4.110 20 10 DICDRO CCOc1cccc(C[NH2+]C(C)(C)Cc2ccccc2C)c1O ZINC000236920045 1042411684 /nfs/dbraw/zinc/41/16/84/1042411684.db2.gz HJHQCNBKHDVWGD-UHFFFAOYSA-N 1 0 313.441 4.210 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)oc2C)cc1F ZINC000236924602 1042412766 /nfs/dbraw/zinc/41/27/66/1042412766.db2.gz LVQCVWAKVNLSNX-UHFFFAOYSA-N 1 0 304.409 4.172 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1O ZINC000894205398 1042503908 /nfs/dbraw/zinc/50/39/08/1042503908.db2.gz YOOLDLKQZWWDJD-MRXNPFEDSA-N 1 0 317.816 4.140 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC2CCC(C(F)(F)F)CC2)cc1 ZINC000237087119 1042519157 /nfs/dbraw/zinc/51/91/57/1042519157.db2.gz UZWQUEJGUQLKSV-UHFFFAOYSA-N 1 0 314.395 4.211 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccccc1C(F)(F)F ZINC000237092542 1042523102 /nfs/dbraw/zinc/52/31/02/1042523102.db2.gz QUVWCINTIBCMKJ-UHFFFAOYSA-N 1 0 322.374 4.370 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccc(Cl)cc1 ZINC000760014619 1042532610 /nfs/dbraw/zinc/53/26/10/1042532610.db2.gz BRJDBXWYDCNVCN-STQMWFEESA-N 1 0 305.805 4.164 20 10 DICDRO CC[C@H]([NH2+][C@H](CCOC)c1ccco1)c1ccc(C)cc1O ZINC000279998190 1042560716 /nfs/dbraw/zinc/56/07/16/1042560716.db2.gz FULRZLPZKOYFCC-JKSUJKDBSA-N 1 0 303.402 4.112 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCOC)c1ccco1)c1ccc(C)cc1O ZINC000279998180 1042560789 /nfs/dbraw/zinc/56/07/89/1042560789.db2.gz FULRZLPZKOYFCC-CVEARBPZSA-N 1 0 303.402 4.112 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(C)cc1O ZINC000280001486 1042562123 /nfs/dbraw/zinc/56/21/23/1042562123.db2.gz FXZQSHUFJCBDBD-NVXWUHKLSA-N 1 0 303.446 4.233 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000280028713 1042562176 /nfs/dbraw/zinc/56/21/76/1042562176.db2.gz HYEAQCGMFSPUDY-IBGZPJMESA-N 1 0 313.441 4.478 20 10 DICDRO CC[C@@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccc(C)cc1O ZINC000280036725 1042562198 /nfs/dbraw/zinc/56/21/98/1042562198.db2.gz IMYJIWDEJJAPND-HZPDHXFCSA-N 1 0 303.402 4.030 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)C[C@@H](O)c1cccs1)c1ccc(C)cc1O ZINC000280099147 1042564554 /nfs/dbraw/zinc/56/45/54/1042564554.db2.gz MYLKAULFSQTSQE-JLJPHGGASA-N 1 0 319.470 4.315 20 10 DICDRO Cc1cccc(C[NH+]2CCC(OC3CCCCC3)CC2)c1O ZINC000271734275 1042667242 /nfs/dbraw/zinc/66/72/42/1042667242.db2.gz NZWRAMDHPFOPQL-UHFFFAOYSA-N 1 0 303.446 4.014 20 10 DICDRO Cc1csc(C2([NH2+]Cc3cc(Cl)cc(C)c3O)CCC2)n1 ZINC000271890431 1042671733 /nfs/dbraw/zinc/67/17/33/1042671733.db2.gz RWXAAZUHBSEUAP-UHFFFAOYSA-N 1 0 322.861 4.288 20 10 DICDRO Oc1cccc(Cl)c1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000126439906 1042770737 /nfs/dbraw/zinc/77/07/37/1042770737.db2.gz JCZSPBUILCFMDT-UHFFFAOYSA-N 1 0 323.864 4.359 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2cc3ccccc3o2)c1O ZINC000894531644 1042966480 /nfs/dbraw/zinc/96/64/80/1042966480.db2.gz BNBMIMOEWIKIGB-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CCc1ccc(O)cc1)c1ccc(C)cc1O ZINC000794805417 1043049771 /nfs/dbraw/zinc/04/97/71/1043049771.db2.gz GNGYKDIZRUYKBF-BEFAXECRSA-N 1 0 313.441 4.468 20 10 DICDRO CC(C)[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(F)ccc1F ZINC000794802783 1043049964 /nfs/dbraw/zinc/04/99/64/1043049964.db2.gz GQJHUUHJGSPHFW-LJQANCHMSA-N 1 0 317.379 4.387 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](CC)c2ccc(C)cc2O)C12CCC2 ZINC000794803692 1043051166 /nfs/dbraw/zinc/05/11/66/1043051166.db2.gz RVOPETLYQMYWJF-BPQIPLTHSA-N 1 0 303.446 4.089 20 10 DICDRO CC[C@@H]([NH2+]CC1(CCOC)CCCC1)c1ccc(C)cc1O ZINC000794809719 1043056012 /nfs/dbraw/zinc/05/60/12/1043056012.db2.gz ITXWPYNCDFMUSD-QGZVFWFLSA-N 1 0 305.462 4.338 20 10 DICDRO CC[C@@H]([NH2+][C@H]1COc2c1ccc(C)c2C)c1ccc(C)cc1O ZINC000794812315 1043060521 /nfs/dbraw/zinc/06/05/21/1043060521.db2.gz VUIQMXIUEFXQFT-MSOLQXFVSA-N 1 0 311.425 4.492 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1cccc(F)c1)c1ccc(C)cc1O ZINC000794816610 1043062662 /nfs/dbraw/zinc/06/26/62/1043062662.db2.gz NYZPYXBHMPTMJV-IXDGSTSKSA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@@H]([NH2+][C@H](CC)c1ccc(C)cc1O)c1c(C)noc1C ZINC000794820210 1043064164 /nfs/dbraw/zinc/06/41/64/1043064164.db2.gz YYXMCPASPJXFKW-HZPDHXFCSA-N 1 0 302.418 4.497 20 10 DICDRO C[C@H]([NH2+]CCC1(C)CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000794828503 1043065849 /nfs/dbraw/zinc/06/58/49/1043065849.db2.gz PWULZVYPRVSZPI-AWEZNQCLSA-N 1 0 322.880 4.017 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)cc1F)c1ccc(C)cc1O ZINC000794819658 1043065924 /nfs/dbraw/zinc/06/59/24/1043065924.db2.gz XAZGEDVBKLVDII-QGZVFWFLSA-N 1 0 303.377 4.089 20 10 DICDRO COCCC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccccc1O ZINC000794827498 1043066644 /nfs/dbraw/zinc/06/66/44/1043066644.db2.gz ZJYXGSWWWLUKGV-AEFFLSMTSA-N 1 0 313.441 4.081 20 10 DICDRO CCC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)[C@H](O)c1ccccc1 ZINC000794830521 1043067345 /nfs/dbraw/zinc/06/73/45/1043067345.db2.gz JSPYLSYDOYSFAY-MOXGXCLJSA-N 1 0 313.441 4.254 20 10 DICDRO Cc1cccc(CC[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000794830078 1043068095 /nfs/dbraw/zinc/06/80/95/1043068095.db2.gz YEFGECNRZUXVLD-SFHVURJKSA-N 1 0 323.484 4.274 20 10 DICDRO CCC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)[C@@H](O)c1ccccc1 ZINC000794832481 1043068744 /nfs/dbraw/zinc/06/87/44/1043068744.db2.gz SRNGIHDMOZWPHW-BPAFIMBUSA-N 1 0 313.441 4.254 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc3ccccc32)c1 ZINC000120489038 1043081024 /nfs/dbraw/zinc/08/10/24/1043081024.db2.gz QLRWOFFNHJESBD-CQSZACIVSA-N 1 0 307.393 4.405 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](CC(C)C)C2)cc1 ZINC000777310038 1043099288 /nfs/dbraw/zinc/09/92/88/1043099288.db2.gz RONCKLKNGXELLT-XKGZKEIXSA-N 1 0 318.505 4.387 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(CC(F)(F)F)cc2)c1 ZINC000865640123 1043121108 /nfs/dbraw/zinc/12/11/08/1043121108.db2.gz DEHSANJQSPZQRD-UHFFFAOYSA-N 1 0 309.331 4.095 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc2ccccc2n1 ZINC000178188245 1043123562 /nfs/dbraw/zinc/12/35/62/1043123562.db2.gz UQCOZFSMOPMVLJ-CQSZACIVSA-N 1 0 323.415 4.291 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(C)c(F)c2)c1 ZINC000120789093 1043143890 /nfs/dbraw/zinc/14/38/90/1043143890.db2.gz YHQHLSYFXOBXGF-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1OC(F)(F)F)c1ccccc1O ZINC000183393036 1043163478 /nfs/dbraw/zinc/16/34/78/1043163478.db2.gz ADSFQVZRPVQYFA-LLVKDONJSA-N 1 0 311.303 4.142 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(N2CCCC2)c1 ZINC000183553174 1043167212 /nfs/dbraw/zinc/16/72/12/1043167212.db2.gz UJFGLDQFXIIXHY-CVEARBPZSA-N 1 0 310.441 4.404 20 10 DICDRO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000183608720 1043169184 /nfs/dbraw/zinc/16/91/84/1043169184.db2.gz KFHICRIYDBARNV-ZIAGYGMSSA-N 1 0 309.413 4.174 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1F ZINC000184927543 1043192442 /nfs/dbraw/zinc/19/24/42/1043192442.db2.gz GEWDGFQPKPPUCO-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO CC(C)Oc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cn1 ZINC000185045984 1043194060 /nfs/dbraw/zinc/19/40/60/1043194060.db2.gz SHLOVMFHVOTINE-LBPRGKRZSA-N 1 0 320.820 4.079 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1cccc([N+](=O)[O-])c1 ZINC000185149585 1043197405 /nfs/dbraw/zinc/19/74/05/1043197405.db2.gz GJDNMHONKAVWLU-MNOVXSKESA-N 1 0 320.776 4.366 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)c1 ZINC000185288905 1043197937 /nfs/dbraw/zinc/19/79/37/1043197937.db2.gz YFDCKDOEXJVZGE-NVXWUHKLSA-N 1 0 317.429 4.358 20 10 DICDRO CC(C)COC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccco1 ZINC000185289428 1043199356 /nfs/dbraw/zinc/19/93/56/1043199356.db2.gz WDGHPQQIMQDJNJ-BBRMVZONSA-N 1 0 321.392 4.189 20 10 DICDRO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cc(F)ccc1O ZINC000185374549 1043199857 /nfs/dbraw/zinc/19/98/57/1043199857.db2.gz MOQIZPARAFBVMS-JTQLQIEISA-N 1 0 308.422 4.136 20 10 DICDRO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccc2ccccc2c1O ZINC000185534585 1043202061 /nfs/dbraw/zinc/20/20/61/1043202061.db2.gz OZOCHSPZXRTBGP-MNXTYGCHSA-N 1 0 311.425 4.010 20 10 DICDRO Cc1nccn1CCCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185545151 1043202280 /nfs/dbraw/zinc/20/22/80/1043202280.db2.gz ZZAXFFNDCWIPQE-HNNXBMFYSA-N 1 0 323.440 4.181 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ncccc2C)C(C)C)c1 ZINC000185457817 1043202663 /nfs/dbraw/zinc/20/26/63/1043202663.db2.gz HIOQMSRVRUXVDN-KBXCAEBGSA-N 1 0 314.429 4.152 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)on1 ZINC000185561884 1043204631 /nfs/dbraw/zinc/20/46/31/1043204631.db2.gz DBDJMYALCDJYBT-LBPRGKRZSA-N 1 0 318.417 4.143 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000185611295 1043204885 /nfs/dbraw/zinc/20/48/85/1043204885.db2.gz FUUNHISLTIUMRX-HOTGVXAUSA-N 1 0 321.424 4.298 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cc(F)ccc2O)on1 ZINC000185562226 1043205121 /nfs/dbraw/zinc/20/51/21/1043205121.db2.gz MXNMYJKSBNUVTA-NSHDSACASA-N 1 0 306.381 4.274 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(-n3cccn3)cc2)c(O)c1 ZINC000185611910 1043205234 /nfs/dbraw/zinc/20/52/34/1043205234.db2.gz ZHKVUQLURSVGIV-JKSUJKDBSA-N 1 0 321.424 4.298 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@H](C)c2cc(OC)ccc2O)on1 ZINC000185561902 1043205440 /nfs/dbraw/zinc/20/54/40/1043205440.db2.gz DBDJMYALCDJYBT-GFCCVEGCSA-N 1 0 318.417 4.143 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc2[nH]c(=O)oc2c1)c1ccccc1O ZINC000866486001 1043209333 /nfs/dbraw/zinc/20/93/33/1043209333.db2.gz VKMBKJCAQIDBPX-BXUZGUMPSA-N 1 0 312.369 4.041 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(OCC(F)F)c2)c1 ZINC000185982432 1043209887 /nfs/dbraw/zinc/20/98/87/1043209887.db2.gz WCCMHKCMDCQSSO-ZDUSSCGKSA-N 1 0 321.367 4.195 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(O)c1 ZINC000186093050 1043215209 /nfs/dbraw/zinc/21/52/09/1043215209.db2.gz ZWGFKQZPMGSUHB-KGLIPLIRSA-N 1 0 314.385 4.329 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)c1ccccc1O ZINC000186147534 1043215528 /nfs/dbraw/zinc/21/55/28/1043215528.db2.gz YBBOHKMSAXHUAL-YSIASYRMSA-N 1 0 311.425 4.353 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(OC(C)(C)C)nc2)c1 ZINC000186507519 1043227119 /nfs/dbraw/zinc/22/71/19/1043227119.db2.gz VKYLBCQGRLORNF-AWEZNQCLSA-N 1 0 314.429 4.124 20 10 DICDRO C[C@@H]([NH2+][C@H]1CC12CCCC2)c1cc(Br)ccc1O ZINC000760040488 1043228984 /nfs/dbraw/zinc/22/89/84/1043228984.db2.gz KSYKILUBPXXCIL-YGRLFVJLSA-N 1 0 310.235 4.138 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCn2nccc21)c1ccc(N2CCCCC2)cc1 ZINC000866632699 1043240818 /nfs/dbraw/zinc/24/08/18/1043240818.db2.gz OCDFDUYKHGFTFN-QFBILLFUSA-N 1 0 324.472 4.059 20 10 DICDRO CCSc1cc(C[NH2+][C@H](C)c2ccc(C)cc2O)ccn1 ZINC000187799503 1043250423 /nfs/dbraw/zinc/25/04/23/1043250423.db2.gz QOBKJNRVYUYXAN-CYBMUJFWSA-N 1 0 302.443 4.058 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)c1O ZINC000777440646 1043252999 /nfs/dbraw/zinc/25/29/99/1043252999.db2.gz OQUYDGPKIXTLHU-HOTGVXAUSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)c(O)c1 ZINC000191854584 1043263299 /nfs/dbraw/zinc/26/32/99/1043263299.db2.gz FIKFIQGPVNRQFW-KNBMTAEXSA-N 1 0 311.425 4.129 20 10 DICDRO C[C@@H]1C[C@@H]([NH3+])CN1C(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000868090654 1043272203 /nfs/dbraw/zinc/27/22/03/1043272203.db2.gz MUFAQUDNEGDJRT-ZIAGYGMSSA-N 1 0 323.400 4.055 20 10 DICDRO C[C@@H]([NH2+]C[C@]1(C)CCCS1)c1ccc2ccccc2c1O ZINC000121991491 1043272965 /nfs/dbraw/zinc/27/29/65/1043272965.db2.gz IVVKIAVJRFWVMX-ACJLOTCBSA-N 1 0 301.455 4.482 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000194257059 1043291350 /nfs/dbraw/zinc/29/13/50/1043291350.db2.gz XJPOKOZLBGRYAJ-LRDDRELGSA-N 1 0 305.805 4.084 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1 ZINC000122716305 1043323795 /nfs/dbraw/zinc/32/37/95/1043323795.db2.gz JAMBJQAGENAXKR-LBPRGKRZSA-N 1 0 322.374 4.329 20 10 DICDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(N(C)C)c(F)c2)s1 ZINC000123160830 1043350532 /nfs/dbraw/zinc/35/05/32/1043350532.db2.gz HJXZFLSBMVEAPS-GFCCVEGCSA-N 1 0 321.465 4.158 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(C(F)(F)F)s1)CC2 ZINC000872107843 1043460066 /nfs/dbraw/zinc/46/00/66/1043460066.db2.gz PLHIHFXYDUFUCT-LLVKDONJSA-N 1 0 313.344 4.250 20 10 DICDRO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1cc2c(cc1O)CCCC2 ZINC000872117016 1043465347 /nfs/dbraw/zinc/46/53/47/1043465347.db2.gz WWNCPADGIWVSFA-JTQLQIEISA-N 1 0 322.861 4.232 20 10 DICDRO C[C@H]([NH2+]Cc1cccc2ncccc12)c1ccc(N(C)C)cc1 ZINC000872125101 1043470654 /nfs/dbraw/zinc/47/06/54/1043470654.db2.gz XWYGFFXBZIRQIU-HNNXBMFYSA-N 1 0 305.425 4.152 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc(C(F)(F)F)nc1 ZINC000872130982 1043472880 /nfs/dbraw/zinc/47/28/80/1043472880.db2.gz UVESAKOODOCKSS-MFKMUULPSA-N 1 0 322.330 4.144 20 10 DICDRO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000872134641 1043475864 /nfs/dbraw/zinc/47/58/64/1043475864.db2.gz SWPPLQPOGBRYSL-TZMCWYRMSA-N 1 0 307.397 4.056 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2c[nH]c3c2cccc3F)cc1 ZINC001137059186 1043494202 /nfs/dbraw/zinc/49/42/02/1043494202.db2.gz PVBPDDGYWBKRSR-UHFFFAOYSA-N 1 0 311.404 4.005 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)c2c(C)noc2C)cc1C ZINC000873049304 1043513605 /nfs/dbraw/zinc/51/36/05/1043513605.db2.gz FPMKBITVFICMAV-ZDUSSCGKSA-N 1 0 302.418 4.239 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)nc2)cc1C ZINC000873185137 1043523248 /nfs/dbraw/zinc/52/32/48/1043523248.db2.gz PVGNCDSPWVAENB-GFCCVEGCSA-N 1 0 324.346 4.268 20 10 DICDRO [NH3+][C@@H]1C[C@H]1c1ccc(NCc2ccc(N3CCCCC3)cc2)cc1 ZINC000873217009 1043528924 /nfs/dbraw/zinc/52/89/24/1043528924.db2.gz FCZCWUGCGDCOEJ-LEWJYISDSA-N 1 0 321.468 4.104 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000124471922 1043531461 /nfs/dbraw/zinc/53/14/61/1043531461.db2.gz VWAXXGBMLKQDGU-HOTGVXAUSA-N 1 0 312.457 4.481 20 10 DICDRO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000074336363 1043556034 /nfs/dbraw/zinc/55/60/34/1043556034.db2.gz NMOQEKQCFZSCID-INIZCTEOSA-N 1 0 312.457 4.391 20 10 DICDRO CC[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc(C)cc1O ZINC000926919360 1043655970 /nfs/dbraw/zinc/65/59/70/1043655970.db2.gz NAMORZITCMLVMF-CQSZACIVSA-N 1 0 316.470 4.277 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccc2ccccc2c1O ZINC000926949878 1043661649 /nfs/dbraw/zinc/66/16/49/1043661649.db2.gz OTMXRMGOULKHBY-IFUGULHKSA-N 1 0 309.331 4.394 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1[C@@H](c2ccccc2)C1(F)F)c1cc(F)ccc1O ZINC000926971929 1043664881 /nfs/dbraw/zinc/66/48/81/1043664881.db2.gz AFLYRWWEKSDMKC-UXEPBGEESA-N 1 0 321.342 4.231 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1[C@@H](c3ccccc3)C1(F)F)CC2 ZINC000926977673 1043667174 /nfs/dbraw/zinc/66/71/74/1043667174.db2.gz PAZYQBBDOLJQBG-IIDMSEBBSA-N 1 0 315.363 4.018 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCCc3cccnc32)c1O ZINC000927064219 1043679713 /nfs/dbraw/zinc/67/97/13/1043679713.db2.gz RDNQVUAKKMVOPX-LRDDRELGSA-N 1 0 316.832 4.477 20 10 DICDRO CC(C)[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1cnn(C)c1 ZINC000927067778 1043680428 /nfs/dbraw/zinc/68/04/28/1043680428.db2.gz GRTXCPJRTJFFIW-AUUYWEPGSA-N 1 0 323.440 4.327 20 10 DICDRO Cc1ccc(C[NH+]2CCC(OC3CCCCC3)CC2)c(O)c1 ZINC000876658477 1043702892 /nfs/dbraw/zinc/70/28/92/1043702892.db2.gz XGAKLEUUCSOWLG-UHFFFAOYSA-N 1 0 303.446 4.014 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2CCSc3c(F)cccc32)c(O)c1 ZINC000876912779 1043722882 /nfs/dbraw/zinc/72/28/82/1043722882.db2.gz YIVJCAIHAXIHBF-HNNXBMFYSA-N 1 0 303.402 4.166 20 10 DICDRO Cc1cccc(O)c1C[NH2+]C1CCN([C@H](C)c2ccccc2)CC1 ZINC000877038782 1043735325 /nfs/dbraw/zinc/73/53/25/1043735325.db2.gz YAJNSBVDFPOEOF-QGZVFWFLSA-N 1 0 324.468 4.016 20 10 DICDRO CC[N@H+](Cc1cc(Cl)c(C)cc1O)[C@H](C)c1cccnc1 ZINC000825935518 1043747423 /nfs/dbraw/zinc/74/74/23/1043747423.db2.gz WRXGJJVCTXTXGU-CYBMUJFWSA-N 1 0 304.821 4.332 20 10 DICDRO CCn1nc(C)c(C[N@H+](C)Cc2ccc3ccccc3c2O)c1C ZINC000877663914 1043788902 /nfs/dbraw/zinc/78/89/02/1043788902.db2.gz IDXSQUWYSFPFGH-UHFFFAOYSA-N 1 0 323.440 4.011 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1)c1ccccc1O ZINC000877756521 1043791695 /nfs/dbraw/zinc/79/16/95/1043791695.db2.gz OZMYUQNMJHWPLF-YQVWRLOYSA-N 1 0 324.468 4.096 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)nc2)c1O ZINC000877827621 1043806262 /nfs/dbraw/zinc/80/62/62/1043806262.db2.gz FYKANIDDCCSFBY-LLVKDONJSA-N 1 0 324.346 4.219 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2nc(C)c(C)s2)cc1 ZINC000127698215 1043960586 /nfs/dbraw/zinc/96/05/86/1043960586.db2.gz GMXGLTJKZNFKEO-CQSZACIVSA-N 1 0 317.502 4.109 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2cccnc2)c(C)n1-c1ccccc1 ZINC000320340264 1044025003 /nfs/dbraw/zinc/02/50/03/1044025003.db2.gz OGAFBEIYPVUGEM-INIZCTEOSA-N 1 0 305.425 4.340 20 10 DICDRO CC[C@H]([NH2+]C[C@H](c1ccccc1)N1CCCC1)c1ccccc1O ZINC000324040108 1044028939 /nfs/dbraw/zinc/02/89/39/1044028939.db2.gz RCDXELNEOAQEGZ-VQTJNVASSA-N 1 0 324.468 4.270 20 10 DICDRO CCc1nc(C)c(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)o1 ZINC000291756673 1044101285 /nfs/dbraw/zinc/10/12/85/1044101285.db2.gz QUXWNEFLFYBJBS-UHFFFAOYSA-N 1 0 322.408 4.208 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2OCCc3sccc32)c(O)c1 ZINC000291953382 1044119790 /nfs/dbraw/zinc/11/97/90/1044119790.db2.gz RBRGXTNNZLXNFO-VEVIJQCQSA-N 1 0 317.454 4.115 20 10 DICDRO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(Cl)ccc1O ZINC000780792705 1044256041 /nfs/dbraw/zinc/25/60/41/1044256041.db2.gz IOJMYMNCOWWDDZ-MWLCHTKSSA-N 1 0 307.743 4.208 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c(Cl)n1 ZINC000883301696 1044263802 /nfs/dbraw/zinc/26/38/02/1044263802.db2.gz GXCOLFHBTKVMCK-JTQLQIEISA-N 1 0 311.212 4.253 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c1O ZINC000131568619 1044279892 /nfs/dbraw/zinc/27/98/92/1044279892.db2.gz YIBZHZVYUYOOGF-LBPRGKRZSA-N 1 0 321.367 4.262 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1ccc(F)cc1[O-] ZINC000293669461 1044309584 /nfs/dbraw/zinc/30/95/84/1044309584.db2.gz JIOZEKKKEBYVLA-NSHDSACASA-N 1 0 309.331 4.494 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCCO2)CC(F)(F)F ZINC001203221016 1044313065 /nfs/dbraw/zinc/31/30/65/1044313065.db2.gz BUROOQUUZJFJQN-UHFFFAOYSA-N 1 0 301.352 4.080 20 10 DICDRO Fc1ccc2c(c1)CC[C@H]2[NH2+]CCCSc1nccs1 ZINC000132151728 1044315577 /nfs/dbraw/zinc/31/55/77/1044315577.db2.gz JOYGTBGROUEFAI-CQSZACIVSA-N 1 0 308.447 4.042 20 10 DICDRO CC(C)C[C@@H]([NH2+]CCCSc1nccs1)c1ccccn1 ZINC000132159312 1044316308 /nfs/dbraw/zinc/31/63/08/1044316308.db2.gz SMMJDCISKGZADX-OAHLLOKOSA-N 1 0 321.515 4.397 20 10 DICDRO C[C@@H](CSC(C)(C)C)[NH2+]CCCSc1nccs1 ZINC000132228969 1044317984 /nfs/dbraw/zinc/31/79/84/1044317984.db2.gz JRFNIVCGPRJPIA-NSHDSACASA-N 1 0 304.550 4.135 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1cc(F)cc(F)c1 ZINC000132237260 1044318153 /nfs/dbraw/zinc/31/81/53/1044318153.db2.gz RHMBUQXXMULFCE-JTQLQIEISA-N 1 0 314.426 4.254 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)cc1 ZINC000067501655 1044336120 /nfs/dbraw/zinc/33/61/20/1044336120.db2.gz HSVOCITUKGYOJJ-GOSISDBHSA-N 1 0 300.833 4.183 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)CCOC)c1ccc(C(F)(F)F)cc1O ZINC000840836499 1044357592 /nfs/dbraw/zinc/35/75/92/1044357592.db2.gz ZEXRLHCGMNMQLQ-SMDDNHRTSA-N 1 0 319.367 4.124 20 10 DICDRO COCC[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000840838638 1044368270 /nfs/dbraw/zinc/36/82/70/1044368270.db2.gz SASIETVGQGKZBL-IRXDYDNUSA-N 1 0 304.478 4.000 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccccc1O ZINC000361292549 1044385101 /nfs/dbraw/zinc/38/51/01/1044385101.db2.gz HCOZALBJTNTBJX-QRWLVFNGSA-N 1 0 304.393 4.227 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]Cc1c(Cl)cccc1Cl ZINC000696874248 1044388879 /nfs/dbraw/zinc/38/88/79/1044388879.db2.gz QUXKVCHPCNXRRE-UHFFFAOYSA-N 1 0 300.160 4.128 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000120871471 1044514931 /nfs/dbraw/zinc/51/49/31/1044514931.db2.gz LZQIAPOLGXQNQC-RXVVDRJESA-N 1 0 324.468 4.010 20 10 DICDRO C[C@H]([NH2+]CCc1cscn1)c1ccc(N2CCCCC2)cc1 ZINC000134859927 1044531335 /nfs/dbraw/zinc/53/13/35/1044531335.db2.gz ZLBKKTJVUOOFKE-HNNXBMFYSA-N 1 0 315.486 4.027 20 10 DICDRO CCSCC[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000135296204 1044544884 /nfs/dbraw/zinc/54/48/84/1044544884.db2.gz BSEBJXSRDRXFLI-INIZCTEOSA-N 1 0 306.519 4.298 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCSc3c(F)cccc31)CC2 ZINC000296004310 1044582261 /nfs/dbraw/zinc/58/22/61/1044582261.db2.gz OOVWVCKNKZQXBG-CABCVRRESA-N 1 0 315.413 4.345 20 10 DICDRO COC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(Cl)cc1 ZINC000296575130 1044629266 /nfs/dbraw/zinc/62/92/66/1044629266.db2.gz VLBFKZHRULKLHF-HZPDHXFCSA-N 1 0 317.816 4.010 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCCOc3cc(F)ccc31)CC2 ZINC000296714214 1044645015 /nfs/dbraw/zinc/64/50/15/1044645015.db2.gz IJKLIHFWGZSHBE-HOTGVXAUSA-N 1 0 313.372 4.022 20 10 DICDRO CC[C@@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1ccccc1O ZINC000886773799 1044695345 /nfs/dbraw/zinc/69/53/45/1044695345.db2.gz BEKAEKOQVFQVLE-SJLPKXTDSA-N 1 0 303.446 4.172 20 10 DICDRO CC[C@H]([NH2+]C[C@H](c1ccco1)N(CC)CC)c1ccccc1O ZINC000155455539 1044698574 /nfs/dbraw/zinc/69/85/74/1044698574.db2.gz HERCDQLZKJDHFS-DLBZAZTESA-N 1 0 316.445 4.109 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1O ZINC000155487667 1044700311 /nfs/dbraw/zinc/70/03/11/1044700311.db2.gz ZOEJVGMTCNZDOG-SFHVURJKSA-N 1 0 310.441 4.016 20 10 DICDRO CC[C@H]([NH2+]CCc1nc(C(C)(C)C)cs1)c1ccccc1O ZINC000155703761 1044718500 /nfs/dbraw/zinc/71/85/00/1044718500.db2.gz DEOOSOMQGWQUAP-AWEZNQCLSA-N 1 0 318.486 4.430 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C)c1ccccc1O ZINC000155887774 1044736913 /nfs/dbraw/zinc/73/69/13/1044736913.db2.gz LBVOHKARDHSOIW-ZVZYQTTQSA-N 1 0 305.462 4.274 20 10 DICDRO CC[C@H]([NH2+]CCCSc1nccs1)c1ccccc1O ZINC000155890484 1044738169 /nfs/dbraw/zinc/73/81/69/1044738169.db2.gz VCHCSHKXQYWPHU-ZDUSSCGKSA-N 1 0 308.472 4.072 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCCS1)c1ccc2ccccc2c1O ZINC000156318582 1044790588 /nfs/dbraw/zinc/79/05/88/1044790588.db2.gz HZFQHYAWYQNPHN-UKRRQHHQSA-N 1 0 301.455 4.482 20 10 DICDRO Cc1csc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000126271611 1044812032 /nfs/dbraw/zinc/81/20/32/1044812032.db2.gz RQEXUUGDPKWAHH-HNNXBMFYSA-N 1 0 315.486 4.293 20 10 DICDRO Oc1ccc2ccncc2c1C[N@H+](Cc1ccccc1)C1CC1 ZINC000887563152 1044856703 /nfs/dbraw/zinc/85/67/03/1044856703.db2.gz LTDUAWDGSZVSMA-UHFFFAOYSA-N 1 0 304.393 4.105 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)CCC2 ZINC000371602812 1044884560 /nfs/dbraw/zinc/88/45/60/1044884560.db2.gz UFSIKZYGLIHNFS-BLLLJJGKSA-N 1 0 315.486 4.246 20 10 DICDRO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc(N(C)C)cc1)CCC2 ZINC000093364819 1045009068 /nfs/dbraw/zinc/00/90/68/1045009068.db2.gz UPWYCZBKIHHKTP-KRWDZBQOSA-N 1 0 315.486 4.027 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)Cc2c(C)noc2C)cc1 ZINC000152092648 1045036090 /nfs/dbraw/zinc/03/60/90/1045036090.db2.gz XEBMIZCKSBZJTG-KBPBESRZSA-N 1 0 315.461 4.029 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccn1 ZINC000158885277 1045080615 /nfs/dbraw/zinc/08/06/15/1045080615.db2.gz CGAQIMCPWSKNQL-GOSISDBHSA-N 1 0 309.457 4.095 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(Br)cc2)cc1C ZINC000048162231 1045146272 /nfs/dbraw/zinc/14/62/72/1045146272.db2.gz VJKFWYWEPJQXOM-UHFFFAOYSA-N 1 0 320.230 4.056 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1F ZINC000779044518 1045198513 /nfs/dbraw/zinc/19/85/13/1045198513.db2.gz XENMDLPGPKQCDX-KRWDZBQOSA-N 1 0 304.384 4.272 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCSC1)c1ccc(N2CCCCC2)cc1 ZINC000159517166 1045200330 /nfs/dbraw/zinc/20/03/30/1045200330.db2.gz VUAFQJQHXXFFGJ-WBVHZDCISA-N 1 0 304.503 4.223 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@H]2c2ccsc2)c(O)cc1C ZINC000159841291 1045279852 /nfs/dbraw/zinc/27/98/52/1045279852.db2.gz BXKMHGAXDWIEGR-HNNXBMFYSA-N 1 0 303.427 4.108 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCN1C1CCCC1)c1ccc2ccccc2c1O ZINC000528005408 1045293174 /nfs/dbraw/zinc/29/31/74/1045293174.db2.gz ZXFRWXJLEAEZKK-CRAIPNDOSA-N 1 0 324.468 4.213 20 10 DICDRO CO[C@@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000779150859 1045322959 /nfs/dbraw/zinc/32/29/59/1045322959.db2.gz YFGRZAYWABQQEQ-SCLBCKFNSA-N 1 0 319.832 4.220 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(CSC)c1)c1ccccc1O ZINC000188715524 1045338772 /nfs/dbraw/zinc/33/87/72/1045338772.db2.gz OTLPLBGTKBZVBN-QGZVFWFLSA-N 1 0 301.455 4.496 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000779178509 1045349308 /nfs/dbraw/zinc/34/93/08/1045349308.db2.gz QRLQUZAIYKWTMZ-QSFXBCCZSA-N 1 0 318.505 4.387 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccnn1C1CCCC1 ZINC000449292561 1045374680 /nfs/dbraw/zinc/37/46/80/1045374680.db2.gz DJZXTRUIZGFBKG-UHFFFAOYSA-N 1 0 322.456 4.088 20 10 DICDRO Cc1nc(C(C)(C)[NH2+]Cc2cc(Cl)ccc2O)sc1C ZINC000076904677 1045376999 /nfs/dbraw/zinc/37/69/99/1045376999.db2.gz VIYOWXFWNZDGSW-UHFFFAOYSA-N 1 0 310.850 4.144 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@H]3CCSc4ccccc43)ccc21 ZINC000320767292 1045395973 /nfs/dbraw/zinc/39/59/73/1045395973.db2.gz PLONTZCXIPQOBV-SFHVURJKSA-N 1 0 324.493 4.396 20 10 DICDRO Nc1ccc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)cc1 ZINC001120371738 1045537119 /nfs/dbraw/zinc/53/71/19/1045537119.db2.gz PILMCAKVTODBQQ-UHFFFAOYSA-N 1 0 320.358 4.457 20 10 DICDRO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cccc(Cl)c1[O-] ZINC000380879317 1045555813 /nfs/dbraw/zinc/55/58/13/1045555813.db2.gz UFXMTPBEGKRNSC-NSHDSACASA-N 1 0 307.743 4.208 20 10 DICDRO Cc1c2ccccc2oc1C[NH2+]Cc1c(O)cccc1Cl ZINC000115620252 1045572805 /nfs/dbraw/zinc/57/28/05/1045572805.db2.gz XXOXKAYFFSHFQD-UHFFFAOYSA-N 1 0 301.773 4.390 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)c2c1c(F)ccc2O ZINC000800494526 1045632497 /nfs/dbraw/zinc/63/24/97/1045632497.db2.gz XETVRVPVUXPUMG-NQBHXWOUSA-N 1 0 313.363 4.495 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)c(O)c1 ZINC000800496862 1045633878 /nfs/dbraw/zinc/63/38/78/1045633878.db2.gz ZVEIFZHJNXEKEU-MLGOLLRUSA-N 1 0 301.817 4.172 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)c1 ZINC000800494863 1045633956 /nfs/dbraw/zinc/63/39/56/1045633956.db2.gz GIPXEPWTIXHBBP-BLLLJJGKSA-N 1 0 301.817 4.172 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCC12CCOCC2)c1cc(Cl)ccc1O ZINC000800498482 1045635354 /nfs/dbraw/zinc/63/53/54/1045635354.db2.gz LCOLAJUTHTUITC-RDJZCZTQSA-N 1 0 323.864 4.436 20 10 DICDRO CCCN(CCC)c1ccc(C[NH+]2CCC3(CCO3)CC2)cc1 ZINC000800537896 1045638752 /nfs/dbraw/zinc/63/87/52/1045638752.db2.gz HVXOXTVHPLQIFN-UHFFFAOYSA-N 1 0 316.489 4.068 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]CC2CCC(F)(F)CC2)c1O ZINC000800536807 1045639698 /nfs/dbraw/zinc/63/96/98/1045639698.db2.gz XFGALSPTRYBXGZ-UHFFFAOYSA-N 1 0 303.780 4.269 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CCC[C@H](c2cccnc2)C1 ZINC000800525310 1045639800 /nfs/dbraw/zinc/63/98/00/1045639800.db2.gz SOPPDMIVAMYTMM-RXVVDRJESA-N 1 0 323.484 4.483 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000783674202 1045641178 /nfs/dbraw/zinc/64/11/78/1045641178.db2.gz VRVXJKUTYLBKIT-GOSISDBHSA-N 1 0 319.408 4.119 20 10 DICDRO FCCC[C@H]1CCC[C@@H]1[NH2+]CCCSc1nccs1 ZINC000800971242 1045671236 /nfs/dbraw/zinc/67/12/36/1045671236.db2.gz HVMDUFDHEJFMKK-OLZOCXBDSA-N 1 0 302.484 4.133 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2ccc(OC)c(C)c2)C2CC2)cc1 ZINC000078303019 1045675003 /nfs/dbraw/zinc/67/50/03/1045675003.db2.gz OKDUNUZWAYXOPX-FQEVSTJZSA-N 1 0 311.425 4.253 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2ccccc2OC1)c1ccc(C)cc1O ZINC000800986615 1045678606 /nfs/dbraw/zinc/67/86/06/1045678606.db2.gz JRXIYTLFWVHQDB-WMZOPIPTSA-N 1 0 311.425 4.135 20 10 DICDRO Cc1cc(C)cc([C@@H](O)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000800991210 1045678710 /nfs/dbraw/zinc/67/87/10/1045678710.db2.gz BQKQIJKNXUYQFE-LPHOPBHVSA-N 1 0 313.441 4.010 20 10 DICDRO Cc1cccc(C[N@H+]2CC=C(c3c[nH]c4ccccc34)CC2)c1O ZINC000779431728 1045715514 /nfs/dbraw/zinc/71/55/14/1045715514.db2.gz CXJQIALEYFBQPK-UHFFFAOYSA-N 1 0 318.420 4.471 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1Cl ZINC000752939841 1045716744 /nfs/dbraw/zinc/71/67/44/1045716744.db2.gz JMHPMDFBHQBEAT-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Cl)nc1Cl)c1ccc(N(C)C)cc1 ZINC000801544232 1045735906 /nfs/dbraw/zinc/73/59/06/1045735906.db2.gz DNPJGNHDOIRCHL-NSHDSACASA-N 1 0 324.255 4.305 20 10 DICDRO CCCC[N@H+](Cc1nc2ccccc2o1)Cc1ccccc1O ZINC000801595964 1045747894 /nfs/dbraw/zinc/74/78/94/1045747894.db2.gz XAZUYYKZLGIFSE-UHFFFAOYSA-N 1 0 310.397 4.336 20 10 DICDRO CCCC[N@H+](Cc1cccc(COC)c1)Cc1ccccc1O ZINC000801597509 1045748517 /nfs/dbraw/zinc/74/85/17/1045748517.db2.gz IXIJYKCHHDSGJH-UHFFFAOYSA-N 1 0 313.441 4.341 20 10 DICDRO CCCC[N@H+](Cc1ncc(C2CC2)o1)Cc1ccccc1O ZINC000801594836 1045749730 /nfs/dbraw/zinc/74/97/30/1045749730.db2.gz ADUABVJWRHMRLP-UHFFFAOYSA-N 1 0 300.402 4.060 20 10 DICDRO CCCC[N@H+](Cc1ncc(C(C)C)o1)Cc1ccccc1O ZINC000801599687 1045753106 /nfs/dbraw/zinc/75/31/06/1045753106.db2.gz ZEPSEZVFKSLMMO-UHFFFAOYSA-N 1 0 302.418 4.306 20 10 DICDRO CC(C)(C)[C@H]1C[C@H]([NH2+]CCCSc2nccs2)CS1 ZINC000754145053 1045854965 /nfs/dbraw/zinc/85/49/65/1045854965.db2.gz SOIVFVYGJQVCIB-NWDGAFQWSA-N 1 0 316.561 4.135 20 10 DICDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000828614542 1045920426 /nfs/dbraw/zinc/92/04/26/1045920426.db2.gz QCDSHJHMYHYWJB-WMZOPIPTSA-N 1 0 316.489 4.065 20 10 DICDRO COc1ccc([C@H]2CC[N@H+](Cc3cc(C)cc(C)c3O)C2)cc1 ZINC000754729945 1045921170 /nfs/dbraw/zinc/92/11/70/1045921170.db2.gz HFYHAVAQGDZADF-KRWDZBQOSA-N 1 0 311.425 4.007 20 10 DICDRO COc1cc(C)cc(C[N@H+](Cc2cccc(F)c2)C2CC2)c1O ZINC000754722609 1045921186 /nfs/dbraw/zinc/92/11/86/1045921186.db2.gz JHZKYDJTCPKJLV-UHFFFAOYSA-N 1 0 315.388 4.013 20 10 DICDRO COc1cc(C)cc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)c1O ZINC000754728265 1045921908 /nfs/dbraw/zinc/92/19/08/1045921908.db2.gz ZYLHRIBNAWJCHZ-IBGZPJMESA-N 1 0 323.436 4.361 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2cccnc2)ccc1N1CCCCC1 ZINC000828629620 1045923279 /nfs/dbraw/zinc/92/32/79/1045923279.db2.gz RYRJYULJVRAYBV-QGZVFWFLSA-N 1 0 309.457 4.231 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(C)cccc2Cl)c1 ZINC000828681279 1045925275 /nfs/dbraw/zinc/92/52/75/1045925275.db2.gz CCFQMMROSHTFHT-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2F)c1 ZINC000192707358 1045926402 /nfs/dbraw/zinc/92/64/02/1045926402.db2.gz BSJDKHWXRJJSML-GHMZBOCLSA-N 1 0 307.340 4.091 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000802308595 1045951725 /nfs/dbraw/zinc/95/17/25/1045951725.db2.gz FSOHFWOGOXUAQG-MHORFTMASA-N 1 0 318.505 4.387 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000802308599 1045952280 /nfs/dbraw/zinc/95/22/80/1045952280.db2.gz FSOHFWOGOXUAQG-XMTFNYHQSA-N 1 0 318.505 4.387 20 10 DICDRO CO[C@H]1CCC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001137858106 1045987205 /nfs/dbraw/zinc/98/72/05/1045987205.db2.gz WZTGEJCCEKBBKD-FQEVSTJZSA-N 1 0 312.457 4.095 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)c2ncc(C)s2)cc1 ZINC000080346437 1046025831 /nfs/dbraw/zinc/02/58/31/1046025831.db2.gz PHOOAIFUVOYWOZ-UHFFFAOYSA-N 1 0 317.502 4.323 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCO[C@@H](CC)C1 ZINC000802657333 1046026022 /nfs/dbraw/zinc/02/60/22/1046026022.db2.gz AZWFZXSEPHCROZ-WMZOPIPTSA-N 1 0 305.462 4.200 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000755928772 1046030939 /nfs/dbraw/zinc/03/09/39/1046030939.db2.gz ZMDDCSWZCWHNTB-INIZCTEOSA-N 1 0 322.383 4.069 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccccc23)c2c1c(F)ccc2O ZINC000756343500 1046066925 /nfs/dbraw/zinc/06/69/25/1046066925.db2.gz MXTZRXJIYXWJTA-YVEFUNNKSA-N 1 0 324.399 4.393 20 10 DICDRO CC[NH+](CC)CCC[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000756340246 1046067172 /nfs/dbraw/zinc/06/71/72/1046067172.db2.gz IINIWWLDENGLAU-NSHDSACASA-N 1 0 319.276 4.082 20 10 DICDRO C[C@H]([NH2+]CCc1ccccc1)c1ccc(Br)cc1O ZINC000756354940 1046067504 /nfs/dbraw/zinc/06/75/04/1046067504.db2.gz LISHXHXSQVEOJB-LBPRGKRZSA-N 1 0 320.230 4.048 20 10 DICDRO C[C@@H]([NH2+]CCCO[C@@H](C)c1ccccc1)c1cc(F)ccc1O ZINC000756359136 1046068488 /nfs/dbraw/zinc/06/84/88/1046068488.db2.gz NYEAMPPYEZBFNC-CABCVRRESA-N 1 0 317.404 4.350 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCOCc2ccccc2)c(O)c1C ZINC000756359268 1046068737 /nfs/dbraw/zinc/06/87/37/1046068737.db2.gz OUMMLCGBCWABCG-QGZVFWFLSA-N 1 0 313.441 4.267 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)c(O)c1C ZINC000756358123 1046070611 /nfs/dbraw/zinc/07/06/11/1046070611.db2.gz RNHVEQRCMCOCHM-CYBMUJFWSA-N 1 0 321.367 4.461 20 10 DICDRO C[C@@H]([NH2+]CCCOC1CCCCC1)c1cc(Cl)ccc1O ZINC000756361441 1046070705 /nfs/dbraw/zinc/07/07/05/1046070705.db2.gz ZICUMABRYKNRPD-CYBMUJFWSA-N 1 0 311.853 4.436 20 10 DICDRO C[C@@H]([NH2+]CCCOc1ccccc1)c1cc(Cl)ccc1O ZINC000756365241 1046071134 /nfs/dbraw/zinc/07/11/34/1046071134.db2.gz OIBOAWVTOVTFAG-CYBMUJFWSA-N 1 0 305.805 4.165 20 10 DICDRO CSC1(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000193816326 1046071463 /nfs/dbraw/zinc/07/14/63/1046071463.db2.gz AZYCHEQQNNUUAP-OAHLLOKOSA-N 1 0 304.503 4.223 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc(Cl)cc2)c(O)c1C ZINC000756365554 1046071651 /nfs/dbraw/zinc/07/16/51/1046071651.db2.gz BAOGHJFUWIAKHX-DYVFJYSZSA-N 1 0 319.832 4.047 20 10 DICDRO C[C@@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1cc(Cl)ccc1O ZINC000756369203 1046072466 /nfs/dbraw/zinc/07/24/66/1046072466.db2.gz BBZRPBURJPVIBV-IAQYHMDHSA-N 1 0 324.877 4.061 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCSc2ccccc2)c1 ZINC000756373988 1046073084 /nfs/dbraw/zinc/07/30/84/1046073084.db2.gz WMHCTOUGHPOWNJ-CQSZACIVSA-N 1 0 317.454 4.234 20 10 DICDRO C[C@H](Cc1cccs1)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756379651 1046073723 /nfs/dbraw/zinc/07/37/23/1046073723.db2.gz QBLQDFWHMSHUGD-GYSYKLTISA-N 1 0 305.418 4.362 20 10 DICDRO CC[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)N1CCCC1 ZINC000756399253 1046076900 /nfs/dbraw/zinc/07/69/00/1046076900.db2.gz AGRKYPKFOCRVCV-NVXWUHKLSA-N 1 0 312.457 4.070 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2c(F)cccc2F)c(O)c1C ZINC000756422976 1046077820 /nfs/dbraw/zinc/07/78/20/1046077820.db2.gz PJBXXNZFDFUWNX-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO COCc1cccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756420251 1046077836 /nfs/dbraw/zinc/07/78/36/1046077836.db2.gz HYYTUZIIINCBEL-BLLLJJGKSA-N 1 0 315.388 4.016 20 10 DICDRO CCc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)s1 ZINC000756413984 1046078978 /nfs/dbraw/zinc/07/89/78/1046078978.db2.gz HFIAGNONNSSDOI-YGRLFVJLSA-N 1 0 305.418 4.493 20 10 DICDRO CCc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)s1 ZINC000756413981 1046079697 /nfs/dbraw/zinc/07/96/97/1046079697.db2.gz HFIAGNONNSSDOI-QMTHXVAHSA-N 1 0 305.418 4.493 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3n2)c2c1c(F)ccc2O ZINC000756453982 1046080649 /nfs/dbraw/zinc/08/06/49/1046080649.db2.gz BUJWYUOHRDDVDA-YVEFUNNKSA-N 1 0 322.383 4.418 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3n2)c2c1c(F)ccc2O ZINC000756453978 1046081134 /nfs/dbraw/zinc/08/11/34/1046081134.db2.gz BUJWYUOHRDDVDA-SJCJKPOMSA-N 1 0 322.383 4.418 20 10 DICDRO C[C@@H]([NH2+]CCCCN(C)c1ccccc1)c1cc(F)ccc1O ZINC000756443698 1046082310 /nfs/dbraw/zinc/08/23/10/1046082310.db2.gz IASYOUVDEFBCEW-OAHLLOKOSA-N 1 0 316.420 4.099 20 10 DICDRO C[C@@H]([NH2+][C@H](Cn1ccnc1)C(C)(C)C)c1cc(Cl)ccc1O ZINC000756440757 1046082812 /nfs/dbraw/zinc/08/28/12/1046082812.db2.gz GTFVWINQHXGNLV-MLGOLLRUSA-N 1 0 321.852 4.008 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(c3ccccc3)CC2)c(O)c1C ZINC000756445267 1046083069 /nfs/dbraw/zinc/08/30/69/1046083069.db2.gz MKTJQJOAOYNIDX-QGZVFWFLSA-N 1 0 324.468 4.329 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)CCC3)c1 ZINC000756454974 1046083979 /nfs/dbraw/zinc/08/39/79/1046083979.db2.gz GWPPAKYGXNKHOD-KGLIPLIRSA-N 1 0 311.425 4.301 20 10 DICDRO COc1ccc(CCC[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000756460712 1046085470 /nfs/dbraw/zinc/08/54/70/1046085470.db2.gz QZVXVFJFZJGEMU-MRXNPFEDSA-N 1 0 313.441 4.301 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ccc(Cl)cc2)c(O)c1 ZINC000756471708 1046086307 /nfs/dbraw/zinc/08/63/07/1046086307.db2.gz WPRYGNQSSMOIPN-CYBMUJFWSA-N 1 0 305.805 4.084 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(-n3ccnc3)cc2)c(O)c1C ZINC000756476241 1046086379 /nfs/dbraw/zinc/08/63/79/1046086379.db2.gz RERHAIYFCNDCFY-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOc2ccc(F)cc21)c1cc(F)ccc1O ZINC000756483772 1046086754 /nfs/dbraw/zinc/08/67/54/1046086754.db2.gz XMFDJVHTSVRLPO-BDJLRTHQSA-N 1 0 319.351 4.235 20 10 DICDRO CC(C)OCc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756466385 1046087259 /nfs/dbraw/zinc/08/72/59/1046087259.db2.gz QGZMTJOMQDWPSV-CQSZACIVSA-N 1 0 317.404 4.307 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1cc(F)ccc1C(F)(F)F ZINC001138093796 1046089474 /nfs/dbraw/zinc/08/94/74/1046089474.db2.gz KJWSNHABPJOEDP-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cc(F)ccc32)c2c1c(F)ccc2O ZINC000756489256 1046089652 /nfs/dbraw/zinc/08/96/52/1046089652.db2.gz HTIDWKSRHQOLDD-UHNFBRDESA-N 1 0 315.363 4.496 20 10 DICDRO C[C@H](COc1ccccc1)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756494875 1046091274 /nfs/dbraw/zinc/09/12/74/1046091274.db2.gz OXIAGLCNMOPXDN-CHWSQXEVSA-N 1 0 305.805 4.164 20 10 DICDRO C[C@@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1cc(F)ccc1O ZINC000756510723 1046093375 /nfs/dbraw/zinc/09/33/75/1046093375.db2.gz UPANYXCRKHTRFS-LLVKDONJSA-N 1 0 316.351 4.045 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2c[nH]c3cc(F)ccc23)c(O)c1 ZINC000756507742 1046093651 /nfs/dbraw/zinc/09/36/51/1046093651.db2.gz DRGWFGPNMVMXLU-CYBMUJFWSA-N 1 0 312.388 4.214 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@H](C)c3cc(C)ccc3O)c[nH]c2c1 ZINC000756517241 1046095146 /nfs/dbraw/zinc/09/51/46/1046095146.db2.gz OMUGFNOGYRXRBG-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756536347 1046095550 /nfs/dbraw/zinc/09/55/50/1046095550.db2.gz VCBNCJITSQFJBU-HSMVNMDESA-N 1 0 315.388 4.006 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000756531863 1046096515 /nfs/dbraw/zinc/09/65/15/1046096515.db2.gz AKGQDEBHRWPCKQ-LNLFQRSKSA-N 1 0 324.468 4.187 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC2(c3ccccc3C)CC2)c1 ZINC000756529648 1046096955 /nfs/dbraw/zinc/09/69/55/1046096955.db2.gz VCSUUNPZDQULCK-HNNXBMFYSA-N 1 0 311.425 4.092 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccc2ccccc2c1O ZINC000756532691 1046097032 /nfs/dbraw/zinc/09/70/32/1046097032.db2.gz GNGQZTWWLBXCKG-HNNXBMFYSA-N 1 0 320.436 4.462 20 10 DICDRO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756534364 1046097279 /nfs/dbraw/zinc/09/72/79/1046097279.db2.gz KHJCSEUNHQWUCA-STQMWFEESA-N 1 0 319.832 4.423 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](Nc2ccccc2)C(C)C)c(O)c1 ZINC000756554972 1046097996 /nfs/dbraw/zinc/09/79/96/1046097996.db2.gz KZCMMWGOHMIOFF-VQIMIIECSA-N 1 0 312.457 4.488 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1cc2c(cc1O)CCCC2 ZINC000756550880 1046098514 /nfs/dbraw/zinc/09/85/14/1046098514.db2.gz UBTUZHKMRLONNO-YJYMSZOUSA-N 1 0 323.436 4.315 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)c2ccc(F)cc2)c1 ZINC000756540010 1046098757 /nfs/dbraw/zinc/09/87/57/1046098757.db2.gz ZXVWDTAIXUACRS-ZDUSSCGKSA-N 1 0 317.404 4.168 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3c2cccc3O)c2c1c(F)ccc2O ZINC000756549948 1046099100 /nfs/dbraw/zinc/09/91/00/1046099100.db2.gz PPEYBSDHOGLDGX-KMUNFCNLSA-N 1 0 313.372 4.062 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCc2c[nH]c3ccccc23)c(O)c1 ZINC000756554190 1046099284 /nfs/dbraw/zinc/09/92/84/1046099284.db2.gz OIHLACQSOOPEAG-OAHLLOKOSA-N 1 0 308.425 4.465 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@@H]2c2ccccc2)c1 ZINC000756568682 1046100725 /nfs/dbraw/zinc/10/07/25/1046100725.db2.gz HQVVGQHUAUSNGU-YJLNNSPDSA-N 1 0 311.425 4.388 20 10 DICDRO CC(C)[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Nc1ccccc1 ZINC000756555962 1046101069 /nfs/dbraw/zinc/10/10/69/1046101069.db2.gz NNKGFZSCQDHUNV-KBXCAEBGSA-N 1 0 316.420 4.319 20 10 DICDRO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cn1 ZINC000756572558 1046102091 /nfs/dbraw/zinc/10/20/91/1046102091.db2.gz GPHVHWBQWUOETD-RYUDHWBXSA-N 1 0 307.825 4.235 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCCSc2nccs2)c(O)c1C ZINC000756584592 1046104599 /nfs/dbraw/zinc/10/45/99/1046104599.db2.gz GRNXATVUDGWJPT-CYBMUJFWSA-N 1 0 322.499 4.299 20 10 DICDRO C[C@@H]([NH2+]CC1(c2cccc(F)c2)CC1)c1cc(F)ccc1O ZINC000756590443 1046104779 /nfs/dbraw/zinc/10/47/79/1046104779.db2.gz CCNNGJTVDVWAAL-GFCCVEGCSA-N 1 0 303.352 4.053 20 10 DICDRO CS[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC000756587517 1046104935 /nfs/dbraw/zinc/10/49/35/1046104935.db2.gz ASSCDKHKOUGVRL-FMSGJZPZSA-N 1 0 309.450 4.343 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2c[nH]c3c2cccc3C)c(O)c1 ZINC000756596773 1046106021 /nfs/dbraw/zinc/10/60/21/1046106021.db2.gz GOQJNZCQYRKOOG-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO Cc1cccc2c(CC[NH2+][C@@H](C)c3cc(F)ccc3O)c[nH]c21 ZINC000756597063 1046106794 /nfs/dbraw/zinc/10/67/94/1046106794.db2.gz JTWZGAWRNKTKOQ-ZDUSSCGKSA-N 1 0 312.388 4.214 20 10 DICDRO CC(C)CC[C@@](C)(O)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756605081 1046108234 /nfs/dbraw/zinc/10/82/34/1046108234.db2.gz QHQGSUAJYWOZCI-FOIQADDNSA-N 1 0 315.457 4.383 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)Oc1ccccc1F ZINC000756609744 1046110027 /nfs/dbraw/zinc/11/00/27/1046110027.db2.gz NGIFLBQEDUPTQT-VXGBXAGGSA-N 1 0 323.795 4.303 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(Cl)cc1 ZINC000756614715 1046110319 /nfs/dbraw/zinc/11/03/19/1046110319.db2.gz UXLYFEROBDYUPH-UGSOOPFHSA-N 1 0 319.832 4.392 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)ccc2SC)c1 ZINC000756628855 1046112484 /nfs/dbraw/zinc/11/24/84/1046112484.db2.gz YKSFLZNQXLNXCM-NSHDSACASA-N 1 0 321.417 4.113 20 10 DICDRO CCO[C@H](CC[NH2+][C@H](C)c1cc(F)ccc1O)C1CCCC1 ZINC000756638092 1046113878 /nfs/dbraw/zinc/11/38/78/1046113878.db2.gz RNNFNSRUESHHAB-FZKQIMNGSA-N 1 0 309.425 4.167 20 10 DICDRO C[C@H]([NH2+]C[C@H]1SCCc2ccccc21)c1cc(F)ccc1O ZINC000756636859 1046113891 /nfs/dbraw/zinc/11/38/91/1046113891.db2.gz XENVZSBXXHFASO-KPZWWZAWSA-N 1 0 317.429 4.213 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1ccncc1 ZINC000756636285 1046114166 /nfs/dbraw/zinc/11/41/66/1046114166.db2.gz WMHAROZNFUDJDA-GJZGRUSLSA-N 1 0 310.441 4.120 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2ccccn2)ccc1N1CCCCC1 ZINC000831039322 1046114204 /nfs/dbraw/zinc/11/42/04/1046114204.db2.gz YXNNEYFRTRNQJW-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cc(F)ccc2F)c(O)c1C ZINC000756638543 1046114421 /nfs/dbraw/zinc/11/44/21/1046114421.db2.gz SQIWYRZSIVMCOI-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO C[C@H](Cc1ccncc1)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756632986 1046114437 /nfs/dbraw/zinc/11/44/37/1046114437.db2.gz GJSQJJXJNLMZQC-HUUCEWRRSA-N 1 0 306.409 4.222 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2SCCc3ccccc32)c(O)c1 ZINC000756634074 1046114596 /nfs/dbraw/zinc/11/45/96/1046114596.db2.gz LULWGJMOKXBCRW-KUHUBIRLSA-N 1 0 313.466 4.382 20 10 DICDRO C[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1cc2c(cc1O)CCCC2 ZINC000756646349 1046115648 /nfs/dbraw/zinc/11/56/48/1046115648.db2.gz LTJNTKYJOMNDKF-FZKQIMNGSA-N 1 0 305.487 4.207 20 10 DICDRO CSCc1cc(F)ccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756644518 1046116480 /nfs/dbraw/zinc/11/64/80/1046116480.db2.gz FHKUIHVDBDZLHD-NSHDSACASA-N 1 0 323.408 4.384 20 10 DICDRO COC1CCC(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000756641421 1046116649 /nfs/dbraw/zinc/11/66/49/1046116649.db2.gz HBFCJCCIJXULAK-KSTDHSDQSA-N 1 0 317.473 4.127 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H](CCO)C2CCCCC2)c2c1c(F)ccc2O ZINC000756659878 1046117478 /nfs/dbraw/zinc/11/74/78/1046117478.db2.gz GZBDQLKKYZLPDZ-WQVCFCJDSA-N 1 0 321.436 4.001 20 10 DICDRO CSc1cc(C)ccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756651903 1046118597 /nfs/dbraw/zinc/11/85/97/1046118597.db2.gz YVCIJJXBBIVWQI-GFCCVEGCSA-N 1 0 305.418 4.412 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCCc2cccc(Cl)c2)c1 ZINC000756682802 1046119625 /nfs/dbraw/zinc/11/96/25/1046119625.db2.gz PWBNGJPTRCIIPV-ZDUSSCGKSA-N 1 0 319.832 4.338 20 10 DICDRO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001138219614 1046120490 /nfs/dbraw/zinc/12/04/90/1046120490.db2.gz KDMWEHUFNFITPA-IBGZPJMESA-N 1 0 316.489 4.066 20 10 DICDRO CCC1(O)CCC([NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000756675430 1046120687 /nfs/dbraw/zinc/12/06/87/1046120687.db2.gz GJKNUDJLKXMWLS-GPWPYBQESA-N 1 0 313.441 4.280 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(F)cc2Cl)c1 ZINC000756706076 1046122507 /nfs/dbraw/zinc/12/25/07/1046122507.db2.gz OPHLZJSTBXNHEY-NSHDSACASA-N 1 0 323.795 4.087 20 10 DICDRO COc1cccc(C[C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000756706909 1046122525 /nfs/dbraw/zinc/12/25/25/1046122525.db2.gz ITUWPQGAMXZFLY-QWHCGFSZSA-N 1 0 319.832 4.336 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(F)cc32)c2c1c(F)ccc2O ZINC000756709059 1046122570 /nfs/dbraw/zinc/12/25/70/1046122570.db2.gz VXMWATHXSKVUCP-HPEXNQPKSA-N 1 0 315.363 4.496 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(F)cc32)c2c1c(F)ccc2O ZINC000756709060 1046122766 /nfs/dbraw/zinc/12/27/66/1046122766.db2.gz VXMWATHXSKVUCP-UHNFBRDESA-N 1 0 315.363 4.496 20 10 DICDRO C[C@H](C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)Oc1ccccc1 ZINC000756706515 1046122797 /nfs/dbraw/zinc/12/27/97/1046122797.db2.gz SNRLYDCKGBRNFY-ZENOOKHLSA-N 1 0 315.388 4.137 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)Oc2ccccc2Cl)c1 ZINC000756733885 1046123963 /nfs/dbraw/zinc/12/39/63/1046123963.db2.gz SZIAKQKSGMRGBR-ZIAGYGMSSA-N 1 0 319.832 4.472 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCO[C@@H]2C(C)C)c(O)c1C ZINC000756736907 1046124140 /nfs/dbraw/zinc/12/41/40/1046124140.db2.gz POCRNVLXESNKOC-FRQCXROJSA-N 1 0 305.462 4.111 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)c(O)c1 ZINC000756757490 1046125787 /nfs/dbraw/zinc/12/57/87/1046125787.db2.gz OGQYBXKUZQWCAI-XHDPSFHLSA-N 1 0 303.789 4.138 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000756755600 1046126129 /nfs/dbraw/zinc/12/61/29/1046126129.db2.gz BGODSHPGSZNUOP-MLGOLLRUSA-N 1 0 311.853 4.292 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2COc3c2cccc3Cl)c1 ZINC000756757375 1046126220 /nfs/dbraw/zinc/12/62/20/1046126220.db2.gz MZTKWMZULLVBDM-ABAIWWIYSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2COc3c2cccc3Cl)c(O)c1 ZINC000756757477 1046126280 /nfs/dbraw/zinc/12/62/80/1046126280.db2.gz OGQYBXKUZQWCAI-ABAIWWIYSA-N 1 0 303.789 4.138 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c(C)c1 ZINC000756757704 1046127461 /nfs/dbraw/zinc/12/74/61/1046127461.db2.gz APRUYFMZOAPSOL-WBMJQRKESA-N 1 0 315.388 4.186 20 10 DICDRO CCOCCC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CCC1 ZINC000756762036 1046127534 /nfs/dbraw/zinc/12/75/34/1046127534.db2.gz VZYBMMZPPZLQAK-ZFWWWQNUSA-N 1 0 321.436 4.266 20 10 DICDRO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cc(Cl)ccc1O ZINC000756757921 1046127738 /nfs/dbraw/zinc/12/77/38/1046127738.db2.gz OULMZADTJZZVJX-XPTSAGLGSA-N 1 0 324.207 4.483 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1Cl ZINC000756760153 1046127778 /nfs/dbraw/zinc/12/77/78/1046127778.db2.gz LZZQGTZKOXBIBW-SCLBCKFNSA-N 1 0 319.832 4.392 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2nc(C3CC3)cs2)c2c1c(F)ccc2O ZINC000756758421 1046127976 /nfs/dbraw/zinc/12/79/76/1046127976.db2.gz FMYFARYPAUQWFK-JOYOIKCWSA-N 1 0 318.417 4.203 20 10 DICDRO C[C@H]([NH2+]CCC[C@H]1CCCC[C@@H]1O)c1cc(Cl)ccc1O ZINC000756761751 1046127993 /nfs/dbraw/zinc/12/79/93/1046127993.db2.gz UZWHRCLTCXAMHS-ZENOOKHLSA-N 1 0 311.853 4.028 20 10 DICDRO CCOCCC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CCC1 ZINC000756762031 1046128149 /nfs/dbraw/zinc/12/81/49/1046128149.db2.gz VZYBMMZPPZLQAK-HIFRSBDPSA-N 1 0 321.436 4.266 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c(F)c1 ZINC000756759740 1046128292 /nfs/dbraw/zinc/12/82/92/1046128292.db2.gz XXEWNPGFHNTOBI-BMIGLBTASA-N 1 0 319.351 4.017 20 10 DICDRO Cc1c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c2ccccc2n1C ZINC001138252507 1046128939 /nfs/dbraw/zinc/12/89/39/1046128939.db2.gz JEZJWNBAUGVIAF-MRXNPFEDSA-N 1 0 310.363 4.056 20 10 DICDRO COc1cccc(C(C)(C)C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000756768839 1046129489 /nfs/dbraw/zinc/12/94/89/1046129489.db2.gz NUMIPOGKSORWDU-OAHLLOKOSA-N 1 0 313.441 4.338 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCOCc2ccc(Cl)cc2)c1 ZINC000756768922 1046130061 /nfs/dbraw/zinc/13/00/61/1046130061.db2.gz AUVVRWGGWQJTES-AWEZNQCLSA-N 1 0 319.832 4.221 20 10 DICDRO C[C@@H]([NH2+]CCOCc1ccc(Cl)cc1)c1cc(F)ccc1O ZINC000756770873 1046130068 /nfs/dbraw/zinc/13/00/68/1046130068.db2.gz PBNHJJNAPTXEPF-GFCCVEGCSA-N 1 0 323.795 4.052 20 10 DICDRO Cc1c(C[N@H+](C)CC/C=C/c2cccnc2)c2ccccc2n1C ZINC001138259911 1046132006 /nfs/dbraw/zinc/13/20/06/1046132006.db2.gz QVBODYWKWVSDLW-RMKNXTFCSA-N 1 0 319.452 4.417 20 10 DICDRO COc1ccc(C[C@@H](C)C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756785026 1046133478 /nfs/dbraw/zinc/13/34/78/1046133478.db2.gz RRBBQKOINSTQRS-KGLIPLIRSA-N 1 0 317.404 4.069 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756786132 1046133945 /nfs/dbraw/zinc/13/39/45/1046133945.db2.gz JPPBUZRHKOVJIG-RYUDHWBXSA-N 1 0 304.821 4.415 20 10 DICDRO Cc1ccsc1CC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756785565 1046134104 /nfs/dbraw/zinc/13/41/04/1046134104.db2.gz GEDJGMJRHVJWKD-WCQYABFASA-N 1 0 305.418 4.282 20 10 DICDRO COc1ccc(C[C@H](C)C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000756786019 1046134162 /nfs/dbraw/zinc/13/41/62/1046134162.db2.gz WQMPWCRRMDZBPS-HOTGVXAUSA-N 1 0 313.441 4.239 20 10 DICDRO CCCCn1cc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c(C)n1 ZINC000756788466 1046134991 /nfs/dbraw/zinc/13/49/91/1046134991.db2.gz VESKWBAGDSLNPW-CYBMUJFWSA-N 1 0 321.852 4.201 20 10 DICDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000756790692 1046135077 /nfs/dbraw/zinc/13/50/77/1046135077.db2.gz NYLAOWXMRCMXQM-TYILLQQXSA-N 1 0 317.404 4.267 20 10 DICDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000756790334 1046135243 /nfs/dbraw/zinc/13/52/43/1046135243.db2.gz MTPOCXSHKRPMHE-KSMMKXTCSA-N 1 0 317.404 4.267 20 10 DICDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756790910 1046135543 /nfs/dbraw/zinc/13/55/43/1046135543.db2.gz PROBXYMJAARSTB-FMTVUPSXSA-N 1 0 321.367 4.097 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CC(c3cccc(F)c3)C2)c1 ZINC000756817496 1046138554 /nfs/dbraw/zinc/13/85/54/1046138554.db2.gz KXVKIRVGUJWXKB-XEBKBJJBSA-N 1 0 315.388 4.137 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CC(c3cccc(F)c3)C2)c1 ZINC000756817497 1046139099 /nfs/dbraw/zinc/13/90/99/1046139099.db2.gz KXVKIRVGUJWXKB-YGONEPDPSA-N 1 0 315.388 4.137 20 10 DICDRO COc1ccc(-c2ccccc2)cc1C[NH2+]Cc1ccccc1O ZINC000756896439 1046149915 /nfs/dbraw/zinc/14/99/15/1046149915.db2.gz MVJWBSMTHOZQEY-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO Oc1ccc2ccccc2c1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000756911975 1046150772 /nfs/dbraw/zinc/15/07/72/1046150772.db2.gz VFADGIQPCXLDQA-UHFFFAOYSA-N 1 0 307.315 4.240 20 10 DICDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc2c(c1)CCCN2C ZINC001138355852 1046155144 /nfs/dbraw/zinc/15/51/44/1046155144.db2.gz FEZAVDJCRMAMNQ-MRXNPFEDSA-N 1 0 324.468 4.271 20 10 DICDRO CN1CCCc2cc(C[N@@H+]3CC[C@@H](c4ccccc4)C3)ccc21 ZINC001138354201 1046155378 /nfs/dbraw/zinc/15/53/78/1046155378.db2.gz ANINQYUEMHJMBW-HXUWFJFHSA-N 1 0 306.453 4.059 20 10 DICDRO CC[C@@H]([NH2+]Cc1nccc2c1CCCC2)c1ccc(C)cc1O ZINC000903181122 1046185509 /nfs/dbraw/zinc/18/55/09/1046185509.db2.gz DUNQXAMJVJLVLZ-GOSISDBHSA-N 1 0 310.441 4.215 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2nc3c(s2)CCC3)c1O ZINC000903190605 1046187893 /nfs/dbraw/zinc/18/78/93/1046187893.db2.gz BUIHXKIGWSEDKC-SNVBAGLBSA-N 1 0 322.861 4.150 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CC(C)(C)OC2(C)C)c2c1c(F)ccc2O ZINC000757632161 1046194994 /nfs/dbraw/zinc/19/49/94/1046194994.db2.gz VZJLRIXXBINEBC-MPKXVKKWSA-N 1 0 307.409 4.015 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1cncc(F)c1 ZINC000757639870 1046196245 /nfs/dbraw/zinc/19/62/45/1046196245.db2.gz PWYDJPOLGPLMDT-STQMWFEESA-N 1 0 314.404 4.217 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CC[C@H]1CCCCO1 ZINC000780015448 1046196345 /nfs/dbraw/zinc/19/63/45/1046196345.db2.gz SMNGRNKTGXTUFW-LJQANCHMSA-N 1 0 311.425 4.108 20 10 DICDRO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001138484249 1046196947 /nfs/dbraw/zinc/19/69/47/1046196947.db2.gz YWQKRBSBAGEZPD-UHFFFAOYSA-N 1 0 318.848 4.047 20 10 DICDRO COC1CCC(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000757681177 1046201179 /nfs/dbraw/zinc/20/11/79/1046201179.db2.gz XVSRSCWCYUNABW-UWLZSVRSSA-N 1 0 321.436 4.265 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)s1 ZINC000757703521 1046203393 /nfs/dbraw/zinc/20/33/93/1046203393.db2.gz VOKKENNRTVJXNA-CWSCBRNRSA-N 1 0 320.433 4.238 20 10 DICDRO COc1c(Cl)cccc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000903246105 1046206687 /nfs/dbraw/zinc/20/66/87/1046206687.db2.gz MLCVJGJKBZBEKJ-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@@H]([NH2+]CCN1CCCCCC1)c1ccc2ccccc2c1O ZINC000321196600 1046213311 /nfs/dbraw/zinc/21/33/11/1046213311.db2.gz WTTZCRTZJQKCLP-MRXNPFEDSA-N 1 0 312.457 4.072 20 10 DICDRO CCc1noc(C)c1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000757844922 1046218807 /nfs/dbraw/zinc/21/88/07/1046218807.db2.gz NYQQQGQPALCBNM-UHFFFAOYSA-N 1 0 314.429 4.196 20 10 DICDRO C[C@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1ccc2ccccc2c1O ZINC000903284044 1046222952 /nfs/dbraw/zinc/22/29/52/1046222952.db2.gz VBOGWKOFMRETAA-YHLAAPATSA-N 1 0 311.425 4.154 20 10 DICDRO C[N@H+](CCc1ccncc1)Cc1cc(-c2ccccc2)ccc1O ZINC000757886903 1046223633 /nfs/dbraw/zinc/22/36/33/1046223633.db2.gz GEKUCADHAOKBHJ-UHFFFAOYSA-N 1 0 318.420 4.129 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H](c2ccccn2)C2CC2)c2c1c(F)ccc2O ZINC000903335906 1046247796 /nfs/dbraw/zinc/24/77/96/1046247796.db2.gz UPHWRILDPCMNOP-KOXAJKMWSA-N 1 0 312.388 4.216 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccc(Cl)cc1O ZINC000903336090 1046248392 /nfs/dbraw/zinc/24/83/92/1046248392.db2.gz VWIIFCCVLQBSIG-GTNSWQLSSA-N 1 0 302.805 4.243 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000245627334 1046248561 /nfs/dbraw/zinc/24/85/61/1046248561.db2.gz YTSMWWLFASZMEK-ZMMAXQRCSA-N 1 0 316.489 4.284 20 10 DICDRO CC[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903338185 1046250914 /nfs/dbraw/zinc/25/09/14/1046250914.db2.gz GKNUHJUNBGONSX-QUCCMNQESA-N 1 0 309.457 4.340 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903338183 1046251713 /nfs/dbraw/zinc/25/17/13/1046251713.db2.gz GKNUHJUNBGONSX-AZUAARDMSA-N 1 0 309.457 4.340 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccccc1O)c1cc(F)ccc1OC ZINC000903371261 1046259116 /nfs/dbraw/zinc/25/91/16/1046259116.db2.gz QTWAGEKBIOEVJL-WBMJQRKESA-N 1 0 303.377 4.342 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cc(F)ccc1OC ZINC000903371168 1046260029 /nfs/dbraw/zinc/26/00/29/1046260029.db2.gz PPUJYFICRYXBIJ-HOTGVXAUSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cnn(CC3CCC3)c2)c(O)c1 ZINC000903404868 1046266698 /nfs/dbraw/zinc/26/66/98/1046266698.db2.gz MPZFAFLNRNPGIJ-CABCVRRESA-N 1 0 313.445 4.109 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1cc(Cl)ccc1O ZINC000903429108 1046277270 /nfs/dbraw/zinc/27/72/70/1046277270.db2.gz RUKIZOIQFCCESI-PIGZYNQJSA-N 1 0 302.805 4.243 20 10 DICDRO CC1([NH2+]Cc2ccc(N3CCCCC3)c(Br)c2)CC1 ZINC001308267860 1046281059 /nfs/dbraw/zinc/28/10/59/1046281059.db2.gz AQGKGSLVRQCHTP-UHFFFAOYSA-N 1 0 323.278 4.082 20 10 DICDRO CC[C@@H]([NH2+][C@@H](COC)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000089668345 1046297270 /nfs/dbraw/zinc/29/72/70/1046297270.db2.gz XYCVSJHSCTZCAJ-UXHICEINSA-N 1 0 312.457 4.181 20 10 DICDRO CC[N@H+](Cc1ccc(OCC(C)C)cc1)Cc1ccccc1O ZINC001138970782 1046346491 /nfs/dbraw/zinc/34/64/91/1046346491.db2.gz XCOMQUGLJGJXLZ-UHFFFAOYSA-N 1 0 313.441 4.449 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cnc(C)s2)cc1F ZINC000090409035 1046366741 /nfs/dbraw/zinc/36/67/41/1046366741.db2.gz LJUKUHCZAOJRBV-LBPRGKRZSA-N 1 0 321.465 4.288 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c1 ZINC000759693117 1046371719 /nfs/dbraw/zinc/37/17/19/1046371719.db2.gz RYOPCXNVLAHZPF-UHFFFAOYSA-N 1 0 324.468 4.318 20 10 DICDRO COC1(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)CCC1 ZINC000780743926 1046401859 /nfs/dbraw/zinc/40/18/59/1046401859.db2.gz BVRMIFUJBDYATJ-HNNXBMFYSA-N 1 0 320.452 4.036 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(ccn2C)c1 ZINC001139191027 1046406015 /nfs/dbraw/zinc/40/60/15/1046406015.db2.gz CNRQYQCSVFRIHC-UHFFFAOYSA-N 1 0 321.468 4.266 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(N(C)CC)cc2)CC1 ZINC000090723104 1046416618 /nfs/dbraw/zinc/41/66/18/1046416618.db2.gz WEIXRJXNKFYGCI-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO COc1ccc2c(c1)CCCCN2C[C@H]1CCCC[N@@H+]1C(C)C ZINC001168245207 1046447640 /nfs/dbraw/zinc/44/76/40/1046447640.db2.gz ZDFUONRKJXTRJR-GOSISDBHSA-N 1 0 316.489 4.101 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2ccccc2O)cc1Cl ZINC001139596846 1046482441 /nfs/dbraw/zinc/48/24/41/1046482441.db2.gz CSDDUUZXTNLBRH-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Cc1cc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)ccc1N(C)C ZINC001139673776 1046496338 /nfs/dbraw/zinc/49/63/38/1046496338.db2.gz ZQVZVAGVYAQIGW-KRWDZBQOSA-N 1 0 304.453 4.165 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)ccc1N(C)C ZINC001139672741 1046497572 /nfs/dbraw/zinc/49/75/72/1046497572.db2.gz DRELOOIVVJPEGC-GOSISDBHSA-N 1 0 312.432 4.190 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccc(Cl)cc3F)ccc21 ZINC000782523602 1046532336 /nfs/dbraw/zinc/53/23/36/1046532336.db2.gz BAEGSWQROMBXPI-UHFFFAOYSA-N 1 0 318.823 4.151 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](c2ccccc2F)C(C)C)c1 ZINC000827017968 1046540115 /nfs/dbraw/zinc/54/01/15/1046540115.db2.gz PRWHWUDTJJUJHS-SFHVURJKSA-N 1 0 303.377 4.027 20 10 DICDRO COc1cccc(O)c1C[NH2+]Cc1cc(C)cc2c(C)c(C)[nH]c21 ZINC000729681906 1046576628 /nfs/dbraw/zinc/57/66/28/1046576628.db2.gz NPWJJZQIVFHJNW-UHFFFAOYSA-N 1 0 324.424 4.097 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCC=CO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000783309702 1046578694 /nfs/dbraw/zinc/57/86/94/1046578694.db2.gz JOXTTWMKLQDAOM-WBVHZDCISA-N 1 0 318.436 4.159 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](CC(F)(F)F)C(C)C)c1 ZINC000783329583 1046583501 /nfs/dbraw/zinc/58/35/01/1046583501.db2.gz HSRXRHVHPRSULX-MFKMUULPSA-N 1 0 305.340 4.028 20 10 DICDRO Cc1cccc(C[N@@H+](C)Cc2c(O)cccc2Br)c1 ZINC001140098957 1046587773 /nfs/dbraw/zinc/58/77/73/1046587773.db2.gz VAJIHYSBJRUDTP-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO C[C@H]([NH2+]CC1(c2ccc(Cl)cc2)CC1)c1ccccc1O ZINC000783506328 1046601652 /nfs/dbraw/zinc/60/16/52/1046601652.db2.gz PWJBEKBONLTGNZ-ZDUSSCGKSA-N 1 0 301.817 4.428 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1ccccc1O ZINC000783504661 1046601897 /nfs/dbraw/zinc/60/18/97/1046601897.db2.gz IJRNYXOHBYIZCT-AGRHKRQWSA-N 1 0 315.388 4.102 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1Cl ZINC000783520750 1046603787 /nfs/dbraw/zinc/60/37/87/1046603787.db2.gz YNLAGJKKSHLLQG-SJCJKPOMSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1O ZINC000783521460 1046604217 /nfs/dbraw/zinc/60/42/17/1046604217.db2.gz YNFYONBODUPUMS-AVGNSLFASA-N 1 0 301.352 4.412 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(C)c(OC)c1 ZINC001140162023 1046604488 /nfs/dbraw/zinc/60/44/88/1046604488.db2.gz HMPSQJOQPHFFJO-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841746272 1046606018 /nfs/dbraw/zinc/60/60/18/1046606018.db2.gz XGJYQVXABIHCQE-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO CC[N@H+](CCc1ccc(OC)cc1)Cc1c(C)ccc(C)c1O ZINC001140184901 1046609417 /nfs/dbraw/zinc/60/94/17/1046609417.db2.gz KDORJNVSBRMQIJ-UHFFFAOYSA-N 1 0 313.441 4.082 20 10 DICDRO Cc1ccc(C)c(C[N@@H+](CC(=O)c2ccccc2)C(C)C)c1O ZINC001140183379 1046609612 /nfs/dbraw/zinc/60/96/12/1046609612.db2.gz DNCCCDIMTYJARM-UHFFFAOYSA-N 1 0 311.425 4.102 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(C)ccc(C)c1O ZINC001140182260 1046609668 /nfs/dbraw/zinc/60/96/68/1046609668.db2.gz MVPVJEPSKMJIBJ-SFHVURJKSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cccc([C@@H]2CC[N@H+](Cc3c(C)ccc(C)c3O)C2)c1 ZINC001140185200 1046609870 /nfs/dbraw/zinc/60/98/70/1046609870.db2.gz RKVNDZJOSCOBHJ-QGZVFWFLSA-N 1 0 311.425 4.007 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@@H](O)c2ccc(F)cc2)c(O)c1 ZINC000248494119 1046618682 /nfs/dbraw/zinc/61/86/82/1046618682.db2.gz KJBPZMNJVAYOCC-SUNYJGFJSA-N 1 0 317.404 4.003 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(C)ccc2O)CCO1 ZINC000248520913 1046620770 /nfs/dbraw/zinc/62/07/70/1046620770.db2.gz RGOLTODVSCZZHD-OGWOLHLISA-N 1 0 305.462 4.335 20 10 DICDRO COc1ccc([C@H]([NH2+][C@@H]2CCc3cccc(O)c32)C(C)C)cc1 ZINC000834496986 1046622731 /nfs/dbraw/zinc/62/27/31/1046622731.db2.gz UUUJCVXWAWDUDW-YLJYHZDGSA-N 1 0 311.425 4.375 20 10 DICDRO COc1ccc([C@H]([NH2+][C@H]2CCc3cccc(O)c32)C(C)C)cc1 ZINC000834496983 1046623480 /nfs/dbraw/zinc/62/34/80/1046623480.db2.gz UUUJCVXWAWDUDW-FXAWDEMLSA-N 1 0 311.425 4.375 20 10 DICDRO C[C@@H](OCCC[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834496613 1046623549 /nfs/dbraw/zinc/62/35/49/1046623549.db2.gz NYFSFLQNMKGRAG-CRAIPNDOSA-N 1 0 311.425 4.137 20 10 DICDRO C[C@@H](CCCc1cccnc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000834509091 1046624824 /nfs/dbraw/zinc/62/48/24/1046624824.db2.gz WDTLAPNUPBAWCP-SFHVURJKSA-N 1 0 323.484 4.183 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1OC1CCCC1)CC2 ZINC000834518252 1046624928 /nfs/dbraw/zinc/62/49/28/1046624928.db2.gz GSZDERPCXQXKOU-GOSISDBHSA-N 1 0 323.436 4.491 20 10 DICDRO Cc1[nH]c2ccc(C[NH2+][C@@H]3CCc4cccc(O)c43)cc2c1C ZINC000834534493 1046626572 /nfs/dbraw/zinc/62/65/72/1046626572.db2.gz QTTZXOFFJWUCTM-GOSISDBHSA-N 1 0 306.409 4.267 20 10 DICDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)n1 ZINC000093453362 1046629886 /nfs/dbraw/zinc/62/98/86/1046629886.db2.gz ODTXTDCXIINXPP-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1ccc2c(CC[NH2+][C@@H]3CCc4cccc(O)c43)c[nH]c2c1 ZINC000834551624 1046631013 /nfs/dbraw/zinc/63/10/13/1046631013.db2.gz HYDOPRGLMWJJID-QGZVFWFLSA-N 1 0 306.409 4.002 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]CCCc1c[nH]c3ccccc13)CC2 ZINC000834576219 1046633718 /nfs/dbraw/zinc/63/37/18/1046633718.db2.gz UOLWIINMFWEHRS-SFHVURJKSA-N 1 0 306.409 4.083 20 10 DICDRO CO[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccc(Cl)cc1 ZINC000834602010 1046635660 /nfs/dbraw/zinc/63/56/60/1046635660.db2.gz HHGNWOBGHUGVBI-RDJZCZTQSA-N 1 0 317.816 4.010 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834611047 1046637591 /nfs/dbraw/zinc/63/75/91/1046637591.db2.gz CNTQNVUFCFBMSM-CQSZACIVSA-N 1 0 303.402 4.030 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)C1)CC2 ZINC000834615703 1046639874 /nfs/dbraw/zinc/63/98/74/1046639874.db2.gz IAPTYYUGJDFPOE-IACUBPJLSA-N 1 0 313.363 4.338 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(OC3CCCC3)cc1)CC2 ZINC000834640517 1046643652 /nfs/dbraw/zinc/64/36/52/1046643652.db2.gz NLZODPFYHJRELB-LJQANCHMSA-N 1 0 323.436 4.491 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1OC1CCC1)CC2 ZINC000834654832 1046644580 /nfs/dbraw/zinc/64/45/80/1046644580.db2.gz SVWARVQFTHHGGZ-KRWDZBQOSA-N 1 0 309.409 4.101 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cc(F)ccc1F ZINC000834669003 1046646763 /nfs/dbraw/zinc/64/67/63/1046646763.db2.gz QATFKVLQCAPUAR-JKSUJKDBSA-N 1 0 303.352 4.399 20 10 DICDRO CCOc1cc(Cl)ccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834688983 1046650098 /nfs/dbraw/zinc/65/00/98/1046650098.db2.gz HGMQWNGVFPNTTH-OAHLLOKOSA-N 1 0 317.816 4.221 20 10 DICDRO Oc1cccc(Cl)c1C[NH+]1CCC(c2cccs2)CC1 ZINC001140345661 1046667867 /nfs/dbraw/zinc/66/78/67/1046667867.db2.gz XLXUCDAGQXQOLK-UHFFFAOYSA-N 1 0 307.846 4.487 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(C(F)(F)F)n2)c(O)c1 ZINC000834855932 1046688429 /nfs/dbraw/zinc/68/84/29/1046688429.db2.gz IHNKHTNMJWNZOV-GFCCVEGCSA-N 1 0 324.346 4.274 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)ccn1 ZINC000834859794 1046688992 /nfs/dbraw/zinc/68/89/92/1046688992.db2.gz JGOQERUAEVYBER-QGZVFWFLSA-N 1 0 309.457 4.231 20 10 DICDRO C[C@H](CCCO)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834870148 1046690034 /nfs/dbraw/zinc/69/00/34/1046690034.db2.gz GZIPHCSRVUQVCT-MSOLQXFVSA-N 1 0 318.505 4.126 20 10 DICDRO C[C@H](CC(C)(C)O)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000834880215 1046694827 /nfs/dbraw/zinc/69/48/27/1046694827.db2.gz OFCMHPVYBCTVML-IAGOWNOFSA-N 1 0 318.505 4.267 20 10 DICDRO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841762973 1046696152 /nfs/dbraw/zinc/69/61/52/1046696152.db2.gz LBHMKRJONVARIC-VXGBXAGGSA-N 1 0 307.825 4.235 20 10 DICDRO Cc1cccnc1CCC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000834882488 1046696957 /nfs/dbraw/zinc/69/69/57/1046696957.db2.gz BFSJXGLJCWYDFY-CYBMUJFWSA-N 1 0 304.821 4.032 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000834882267 1046697184 /nfs/dbraw/zinc/69/71/84/1046697184.db2.gz IFVYJXKNNGHSSV-CZUORRHYSA-N 1 0 323.864 4.436 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@@]2(C)CC2(Cl)Cl)c2c1c(F)ccc2O ZINC000834885751 1046698799 /nfs/dbraw/zinc/69/87/99/1046698799.db2.gz XSTADHQXNVPXOW-PJCOJXEDSA-N 1 0 318.219 4.253 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCO[C@@H](C(C)C)C1)c1ccc(C)cc1O ZINC000834885943 1046700562 /nfs/dbraw/zinc/70/05/62/1046700562.db2.gz NSMUOKXNCPIPLX-VDZJLULYSA-N 1 0 305.462 4.193 20 10 DICDRO CCCN(CCC)c1ccc(C[N@H+](C)[C@H]2CC[C@H](O)CC2)cc1 ZINC000784670091 1046706966 /nfs/dbraw/zinc/70/69/66/1046706966.db2.gz MDJHPBARVJVFQR-KESTWPANSA-N 1 0 318.505 4.048 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1cc(F)ccc1O ZINC000834899522 1046708841 /nfs/dbraw/zinc/70/88/41/1046708841.db2.gz KMIMSZJESVPDIV-NORZTCDRSA-N 1 0 321.417 4.164 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCN(C)c3ccccc32)c(O)c1 ZINC000834902629 1046711916 /nfs/dbraw/zinc/71/19/16/1046711916.db2.gz HRNSVMWZPGTPOB-QAPCUYQASA-N 1 0 310.441 4.323 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cnn(CC)c1)c1cc(Cl)ccc1O ZINC000834902140 1046714006 /nfs/dbraw/zinc/71/40/06/1046714006.db2.gz DUEIYPKGWSEGHI-NHYWBVRUSA-N 1 0 307.825 4.064 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cnn(CC)c1)c1cc(Cl)ccc1O ZINC000834902141 1046714269 /nfs/dbraw/zinc/71/42/69/1046714269.db2.gz DUEIYPKGWSEGHI-XHDPSFHLSA-N 1 0 307.825 4.064 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCN(C)c2ccccc21)c1ccc(N(C)C)cc1 ZINC000834905201 1046715623 /nfs/dbraw/zinc/71/56/23/1046715623.db2.gz RIBGTWZVURBTHM-OXJNMPFZSA-N 1 0 323.484 4.375 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C2CCC(OC(F)F)CC2)c(O)c1 ZINC000834906250 1046716950 /nfs/dbraw/zinc/71/69/50/1046716950.db2.gz WSJOGVIHACUEEM-HSBZDZAISA-N 1 0 313.388 4.210 20 10 DICDRO CC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(F)cc1[O-] ZINC000796696745 1046717543 /nfs/dbraw/zinc/71/75/43/1046717543.db2.gz UFWIVOMTTKXWJR-MAUKXSAKSA-N 1 0 322.468 4.084 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c1O ZINC000834908621 1046717800 /nfs/dbraw/zinc/71/78/00/1046717800.db2.gz GTVXEOMJUMBOLU-CHWSQXEVSA-N 1 0 311.853 4.210 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c1O ZINC000834908625 1046718184 /nfs/dbraw/zinc/71/81/84/1046718184.db2.gz GTVXEOMJUMBOLU-OLZOCXBDSA-N 1 0 311.853 4.210 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccc(C)c1 ZINC000796722319 1046722974 /nfs/dbraw/zinc/72/29/74/1046722974.db2.gz BJEQRPZMVIHBHX-GOSISDBHSA-N 1 0 300.421 4.441 20 10 DICDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2O)cn1 ZINC001140465160 1046738008 /nfs/dbraw/zinc/73/80/08/1046738008.db2.gz HROBTNMCVORJCS-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001140466454 1046738308 /nfs/dbraw/zinc/73/83/08/1046738308.db2.gz GDRPVYLFESUPIH-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2O)cc1 ZINC001140466624 1046739408 /nfs/dbraw/zinc/73/94/08/1046739408.db2.gz ILUDCZGQKDDEBQ-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO CC(C)[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cccnc1 ZINC000835043568 1046745722 /nfs/dbraw/zinc/74/57/22/1046745722.db2.gz SCMGUCFYSGOJLP-GZNAHNRGSA-N 1 0 323.484 4.190 20 10 DICDRO Cc1cnc(C(C)(C)[NH2+]C/C=C/c2ccc(N(C)C)cc2)s1 ZINC000835043557 1046747598 /nfs/dbraw/zinc/74/75/98/1046747598.db2.gz RXNBDHSEGCTHSM-VOTSOKGWSA-N 1 0 315.486 4.056 20 10 DICDRO CC[C@H](c1ccncc1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835054440 1046750824 /nfs/dbraw/zinc/75/08/24/1046750824.db2.gz VNPJXHIRBQVXDC-PXDRNWIDSA-N 1 0 309.457 4.244 20 10 DICDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)[C@@H](C)c1cccnc1 ZINC000835053893 1046751483 /nfs/dbraw/zinc/75/14/83/1046751483.db2.gz PZRCVHVVFDVSAQ-OZSKJFCKSA-N 1 0 309.457 4.244 20 10 DICDRO Cc1cccc(CCC[NH2+][C@@H](C)c2cc(Cl)ccc2O)n1 ZINC000797020515 1046773638 /nfs/dbraw/zinc/77/36/38/1046773638.db2.gz ZOESUHDDHFMIAA-ZDUSSCGKSA-N 1 0 304.821 4.032 20 10 DICDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000797058783 1046781800 /nfs/dbraw/zinc/78/18/00/1046781800.db2.gz GWLJMWRINDOAIQ-RZQQEMMASA-N 1 0 313.441 4.090 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CC2(C(F)(F)F)CC2)c2c1c(F)ccc2O ZINC000797072137 1046786154 /nfs/dbraw/zinc/78/61/54/1046786154.db2.gz WYXZMGIXFAETFH-WCBMZHEXSA-N 1 0 303.299 4.012 20 10 DICDRO C[C@@]1(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C[C@]1(F)Cl ZINC001203048237 1046789236 /nfs/dbraw/zinc/78/92/36/1046789236.db2.gz JKCJIAVFTXTREX-QZTJIDSGSA-N 1 0 324.871 4.471 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC2(c3ccccn3)CCC2)c(O)c1C ZINC000797100843 1046789751 /nfs/dbraw/zinc/78/97/51/1046789751.db2.gz QEIJIZIYQJCZLG-INIZCTEOSA-N 1 0 310.441 4.177 20 10 DICDRO CSCc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000797105189 1046791780 /nfs/dbraw/zinc/79/17/80/1046791780.db2.gz HTIQRBZHWIMCTL-OAHLLOKOSA-N 1 0 314.498 4.466 20 10 DICDRO Cc1cc2cc(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)ccc2[nH]1 ZINC000797131779 1046793698 /nfs/dbraw/zinc/79/36/98/1046793698.db2.gz CDBMIAHSPFTOJD-OAHLLOKOSA-N 1 0 307.441 4.393 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1)Cc1c([O-])cc(F)cc1F ZINC001140584463 1046795298 /nfs/dbraw/zinc/79/52/98/1046795298.db2.gz SCRFYXJJSOEYCP-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO [O-]c1cc(F)cc(F)c1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001140584427 1046796293 /nfs/dbraw/zinc/79/62/93/1046796293.db2.gz QRCLAOKOOWXTKA-MRXNPFEDSA-N 1 0 307.315 4.147 20 10 DICDRO Cc1ccc(F)cc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001140593189 1046799100 /nfs/dbraw/zinc/79/91/00/1046799100.db2.gz VCINPJHCYKAPAB-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO CC[N@H+](Cc1cc(C)ccc1O)[C@H](C)Cc1ccc(OC)cc1 ZINC001140617320 1046812682 /nfs/dbraw/zinc/81/26/82/1046812682.db2.gz MRZPIEQCHQRHFT-MRXNPFEDSA-N 1 0 313.441 4.162 20 10 DICDRO Cc1ccc(O)c(C[N@H+](Cc2ccccn2)C2CCCCC2)c1 ZINC001140622739 1046814453 /nfs/dbraw/zinc/81/44/53/1046814453.db2.gz FFSVIHHBSNZMQN-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c1 ZINC001140620939 1046815181 /nfs/dbraw/zinc/81/51/81/1046815181.db2.gz JDIITDOWJDZTJI-AWEZNQCLSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC3(CCc4ccccc43)CC2)c1 ZINC001140619755 1046815994 /nfs/dbraw/zinc/81/59/94/1046815994.db2.gz NELOKDAWZCMEOU-UHFFFAOYSA-N 1 0 307.437 4.181 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC3(CCc4ccccc4O3)CC2)c1 ZINC001140623790 1046817199 /nfs/dbraw/zinc/81/71/99/1046817199.db2.gz RSFKAHXGTMWLMW-UHFFFAOYSA-N 1 0 323.436 4.060 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCSC[C@H]2c2ccc(F)cc2)c1 ZINC001140623352 1046817569 /nfs/dbraw/zinc/81/75/69/1046817569.db2.gz OKWXJFNFLJPTJJ-KRWDZBQOSA-N 1 0 317.429 4.130 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1c(Cl)ncc2ccccc21 ZINC001140723922 1046873609 /nfs/dbraw/zinc/87/36/09/1046873609.db2.gz JDJAVJPVLWFTKX-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c1O ZINC001140746053 1046882996 /nfs/dbraw/zinc/88/29/96/1046882996.db2.gz UDNZMIQBMCFELV-INIZCTEOSA-N 1 0 317.816 4.397 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccc(O)c(C)c2O)C2CC2)c1C ZINC001140750079 1046884943 /nfs/dbraw/zinc/88/49/43/1046884943.db2.gz UWVCFZAGIHVQJQ-UHFFFAOYSA-N 1 0 311.425 4.188 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000797878949 1046900430 /nfs/dbraw/zinc/90/04/30/1046900430.db2.gz CCQZMRIFBPZINR-MQMHXKEQSA-N 1 0 305.780 4.221 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1ccc(N(C)C)cc1 ZINC000797999502 1046918085 /nfs/dbraw/zinc/91/80/85/1046918085.db2.gz WKGGVDQIZKORCG-XIRDDKMYSA-N 1 0 312.432 4.489 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccccc2C)c(O)c1 ZINC001140854996 1046931098 /nfs/dbraw/zinc/93/10/98/1046931098.db2.gz JHRILJILKNZANZ-UHFFFAOYSA-N 1 0 312.457 4.179 20 10 DICDRO 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NSQGKRNPRITRRQ-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO [O-]c1c(Cl)cccc1C[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000827390220 1046959587 /nfs/dbraw/zinc/95/95/87/1046959587.db2.gz VWNGXNSRFJERGH-UHFFFAOYSA-N 1 0 301.764 4.103 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000827390576 1046960505 /nfs/dbraw/zinc/96/05/05/1046960505.db2.gz XQTBIMZVVKXAJX-UHFFFAOYSA-N 1 0 308.416 4.119 20 10 DICDRO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(C)cc1O ZINC001140954778 1046963235 /nfs/dbraw/zinc/96/32/35/1046963235.db2.gz YXSMVPQWCLPGKI-GOSISDBHSA-N 1 0 311.425 4.184 20 10 DICDRO C[N@H+](Cc1ccccc1)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141074659 1046997981 /nfs/dbraw/zinc/99/79/81/1046997981.db2.gz QAIIRTVJSZDEIB-UHFFFAOYSA-N 1 0 306.453 4.017 20 10 DICDRO CSCCC[N@H+](C)Cc1cc2oc3ccccc3c2cc1O ZINC000799161672 1047004915 /nfs/dbraw/zinc/00/49/15/1047004915.db2.gz XTJHTLDOLLMCOA-UHFFFAOYSA-N 1 0 315.438 4.477 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000096970848 1047007500 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CC1(C)CCc2cc(C[N@@H+]3CCc4cccc(O)c4C3)ccc2O1 ZINC001141185187 1047038076 /nfs/dbraw/zinc/03/80/76/1047038076.db2.gz YXCAGCBANYOWMD-UHFFFAOYSA-N 1 0 323.436 4.054 20 10 DICDRO Cc1cc(Cl)ccc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001141233958 1047058308 /nfs/dbraw/zinc/05/83/08/1047058308.db2.gz YSZQLOGYSYXHDZ-UHFFFAOYSA-N 1 0 317.816 4.008 20 10 DICDRO C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1cc(Cl)ccc1O ZINC000799728933 1047059710 /nfs/dbraw/zinc/05/97/10/1047059710.db2.gz NOPNZKJXCTZXFU-LBPRGKRZSA-N 1 0 314.816 4.420 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCC(OC)CC2)cc1)[C@H](C)C(C)C ZINC000827510806 1047100388 /nfs/dbraw/zinc/10/03/88/1047100388.db2.gz HQOUOIBUKKZUNA-QGZVFWFLSA-N 1 0 318.505 4.168 20 10 DICDRO CS[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC001116444888 1047141630 /nfs/dbraw/zinc/14/16/30/1047141630.db2.gz CXOQJOKUHJLMIS-MOPGFXCFSA-N 1 0 318.530 4.393 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CC2(Cl)Cl)cc1 ZINC000838529994 1047146919 /nfs/dbraw/zinc/14/69/19/1047146919.db2.gz 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Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCOCc2ccccc2)c1 ZINC000389930233 1047292901 /nfs/dbraw/zinc/29/29/01/1047292901.db2.gz HXSHIRJPMQEZBB-SJORKVTESA-N 1 0 313.441 4.347 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc2ccccc2c1O ZINC000390425936 1047296813 /nfs/dbraw/zinc/29/68/13/1047296813.db2.gz QKABNDSKNGDJHI-AWEZNQCLSA-N 1 0 302.377 4.268 20 10 DICDRO CCN(CC)[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1ccccc1 ZINC000390364169 1047298090 /nfs/dbraw/zinc/29/80/90/1047298090.db2.gz RVGQXSUYRXALDY-APWZRJJASA-N 1 0 312.457 4.126 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCN2Cc2ccccc2)c(O)c1 ZINC000390577316 1047300102 /nfs/dbraw/zinc/30/01/02/1047300102.db2.gz XFZZFTJJTBOSIJ-PKOBYXMFSA-N 1 0 324.468 4.016 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cc(F)ccc1F ZINC000390637112 1047300275 /nfs/dbraw/zinc/30/02/75/1047300275.db2.gz KCRVCBJMJTUVHP-CYBMUJFWSA-N 1 0 316.395 4.198 20 10 DICDRO C[C@@H]([NH2+]CCOc1ccccc1)c1ccc2ccccc2c1O ZINC000390886600 1047302260 /nfs/dbraw/zinc/30/22/60/1047302260.db2.gz XEQNUPYIMKMGPA-OAHLLOKOSA-N 1 0 307.393 4.275 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)N1CCCCC1 ZINC000390933129 1047302386 /nfs/dbraw/zinc/30/23/86/1047302386.db2.gz MWKPSOHDDMJIEG-HOTGVXAUSA-N 1 0 312.457 4.070 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001118813062 1047312723 /nfs/dbraw/zinc/31/27/23/1047312723.db2.gz SJTVSQZLOWJRDU-BLLLJJGKSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000725777843 1047314179 /nfs/dbraw/zinc/31/41/79/1047314179.db2.gz HITAHNSWBVEYEM-KRWDZBQOSA-N 1 0 318.420 4.238 20 10 DICDRO Oc1ccc2ccncc2c1C[N@H+](CC1CCCCC1)C1CC1 ZINC000725772188 1047314833 /nfs/dbraw/zinc/31/48/33/1047314833.db2.gz RHFCKDXUGMBUPN-UHFFFAOYSA-N 1 0 310.441 4.485 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1cccc2c1CCOC2 ZINC001118932728 1047316564 /nfs/dbraw/zinc/31/65/64/1047316564.db2.gz BZQVIKXJZPDRPY-RDTXWAMCSA-N 1 0 323.436 4.111 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](c2cccs2)C2CC2)c1O ZINC000725844480 1047318346 /nfs/dbraw/zinc/31/83/46/1047318346.db2.gz ZIDMCRQAUKXOFN-INIZCTEOSA-N 1 0 303.427 4.093 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](CC)c2ccccc2OC)c1 ZINC000725847337 1047319326 /nfs/dbraw/zinc/31/93/26/1047319326.db2.gz IQQCPOXEIUWNTR-KRWDZBQOSA-N 1 0 315.413 4.040 20 10 DICDRO COc1ccc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)cc1 ZINC000725841558 1047320121 /nfs/dbraw/zinc/32/01/21/1047320121.db2.gz NRIHVQBEDBHBLV-UHFFFAOYSA-N 1 0 319.404 4.358 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2cc3ccccc3s2)c1O ZINC000725848429 1047321170 /nfs/dbraw/zinc/32/11/70/1047321170.db2.gz UGWYLINFUDDFIC-UHFFFAOYSA-N 1 0 313.422 4.295 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000398235206 1047327996 /nfs/dbraw/zinc/32/79/96/1047327996.db2.gz YMIIBIGUCGYBRO-AOIWGVFYSA-N 1 0 324.468 4.014 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](c2ccncc2)C2CC2)cc1C ZINC000898318192 1047338847 /nfs/dbraw/zinc/33/88/47/1047338847.db2.gz OZGBVFMIGTXWML-FQEVSTJZSA-N 1 0 310.441 4.420 20 10 DICDRO C[C@H](C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)CC(F)(F)F ZINC000840874363 1047351758 /nfs/dbraw/zinc/35/17/58/1047351758.db2.gz YPHWBEABRZEPEI-QXEWZRGKSA-N 1 0 305.315 4.258 20 10 DICDRO CCOCc1ccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)cc1 ZINC000840880859 1047352270 /nfs/dbraw/zinc/35/22/70/1047352270.db2.gz XFTSJXYLACUVEB-UHFFFAOYSA-N 1 0 319.832 4.180 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(C)(C)c2cccnc2)c1O ZINC000840892445 1047356035 /nfs/dbraw/zinc/35/60/35/1047356035.db2.gz SKYUBVGVKSYZBZ-CYBMUJFWSA-N 1 0 318.848 4.377 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)c(Cl)c1 ZINC000840906426 1047358985 /nfs/dbraw/zinc/35/89/85/1047358985.db2.gz HCHMNSQWKCECIE-WBMJQRKESA-N 1 0 311.853 4.037 20 10 DICDRO Cc1nc2c(s1)[C@H]([NH2+]Cc1c(O)cc(C)cc1Cl)CCC2 ZINC000840937341 1047360402 /nfs/dbraw/zinc/36/04/02/1047360402.db2.gz RSABXGIVFUPMAK-CYBMUJFWSA-N 1 0 322.861 4.286 20 10 DICDRO CC(C)(C)c1ccncc1C[NH2+]Cc1cc(Cl)ccc1O ZINC000840959269 1047363509 /nfs/dbraw/zinc/36/35/09/1047363509.db2.gz QCQVZGCGCXQTQJ-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cc(C)ccc2Br)c1 ZINC000840963947 1047365225 /nfs/dbraw/zinc/36/52/25/1047365225.db2.gz OXNRBNJGFDHNSB-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc(N2CCCCC2)cc1)c1cccnc1 ZINC000840974805 1047367822 /nfs/dbraw/zinc/36/78/22/1047367822.db2.gz HEIPCVCPSFZBJK-UHFFFAOYSA-N 1 0 323.484 4.139 20 10 DICDRO [NH3+][C@H]1CCCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 ZINC000841004881 1047370001 /nfs/dbraw/zinc/37/00/01/1047370001.db2.gz QZLMFWGBYCAYFT-AWEZNQCLSA-N 1 0 323.400 4.057 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@@H]2c2ccccc2Cl)cc1 ZINC000841033848 1047372422 /nfs/dbraw/zinc/37/24/22/1047372422.db2.gz BYBSEPUTXQEDNK-MJGOQNOKSA-N 1 0 314.860 4.391 20 10 DICDRO C[C@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)c1ccncc1 ZINC000749298957 1047409133 /nfs/dbraw/zinc/40/91/33/1047409133.db2.gz ZQZQBQBYQKAVFD-MRXNPFEDSA-N 1 0 318.420 4.348 20 10 DICDRO COCc1cccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000749513295 1047424453 /nfs/dbraw/zinc/42/44/53/1047424453.db2.gz BVJFURWBPIZPSQ-UHFFFAOYSA-N 1 0 324.468 4.064 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1ccc(Cl)cc1O ZINC000841743649 1047447013 /nfs/dbraw/zinc/44/70/13/1047447013.db2.gz JDSQLVUAKXYRLX-RISCZKNCSA-N 1 0 324.877 4.061 20 10 DICDRO CC(C)Oc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841744351 1047447455 /nfs/dbraw/zinc/44/74/55/1047447455.db2.gz HBKMZAJHMZVVCI-GFCCVEGCSA-N 1 0 320.820 4.079 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841745392 1047448142 /nfs/dbraw/zinc/44/81/42/1047448142.db2.gz YXGMTHWKQVUCLD-CYBMUJFWSA-N 1 0 319.832 4.433 20 10 DICDRO COCc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000841745277 1047448357 /nfs/dbraw/zinc/44/83/57/1047448357.db2.gz PHGJDPRBDAJIBN-LBPRGKRZSA-N 1 0 305.805 4.043 20 10 DICDRO C[C@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccc(Cl)cc1O ZINC000841748951 1047450495 /nfs/dbraw/zinc/45/04/95/1047450495.db2.gz CFCDKMMTMOHFEL-GUYCJALGSA-N 1 0 319.832 4.210 20 10 DICDRO C[C@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccc(Cl)cc1O ZINC000841748952 1047450845 /nfs/dbraw/zinc/45/08/45/1047450845.db2.gz CFCDKMMTMOHFEL-SUMWQHHRSA-N 1 0 319.832 4.210 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1c(C)noc1C ZINC000841751965 1047452166 /nfs/dbraw/zinc/45/21/66/1047452166.db2.gz POESKRASBCOJAC-OTYXRUKQSA-N 1 0 308.809 4.452 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2COCc3ccccc32)cc1 ZINC000841759403 1047453884 /nfs/dbraw/zinc/45/38/84/1047453884.db2.gz FPYCLEBBSBLGRR-QRWLVFNGSA-N 1 0 310.441 4.065 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC3(C[C@H]2C)CCOCC3)cc1C(C)C ZINC000842637774 1047494577 /nfs/dbraw/zinc/49/45/77/1047494577.db2.gz QZMAFTUWYSCADI-MRXNPFEDSA-N 1 0 317.473 4.215 20 10 DICDRO C[N@H+](Cc1ccc(C(F)(F)F)c(F)c1)Cc1ccccc1O ZINC001204887270 1047506099 /nfs/dbraw/zinc/50/60/99/1047506099.db2.gz YAFKPXLPUIQVTM-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](CC(C)C)c1ccncc1 ZINC000842842362 1047506937 /nfs/dbraw/zinc/50/69/37/1047506937.db2.gz XHHWZGOEDYXIHH-FQEVSTJZSA-N 1 0 311.473 4.333 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1ccc(Br)cc1O)CC(F)F ZINC000842889816 1047511737 /nfs/dbraw/zinc/51/17/37/1047511737.db2.gz HISIZQMCVDWDIN-IUCAKERBSA-N 1 0 322.193 4.097 20 10 DICDRO CC[C@H]([NH2+][C@H](CCO)c1ccccc1F)c1ccc(C)cc1O ZINC000842924663 1047513883 /nfs/dbraw/zinc/51/38/83/1047513883.db2.gz RQMKCOWDSFEDAN-ZWKOTPCHSA-N 1 0 317.404 4.004 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCc3sccc3C2)c1O ZINC001143105177 1047531990 /nfs/dbraw/zinc/53/19/90/1047531990.db2.gz LXTSWYNCVAOZLH-UHFFFAOYSA-N 1 0 301.455 4.310 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c1O ZINC001143110587 1047532315 /nfs/dbraw/zinc/53/23/15/1047532315.db2.gz KHIMYYJKHDTXAJ-ZDUSSCGKSA-N 1 0 315.379 4.464 20 10 DICDRO COCC[C@@H]1CCCC[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143111064 1047532460 /nfs/dbraw/zinc/53/24/60/1047532460.db2.gz WGNINHLUADAYQR-INIZCTEOSA-N 1 0 305.462 4.081 20 10 DICDRO CC(C)(C)c1cccc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c1O ZINC001143105160 1047532776 /nfs/dbraw/zinc/53/27/76/1047532776.db2.gz LNOZTYIDLVKTNK-OKILXGFUSA-N 1 0 309.400 4.167 20 10 DICDRO CCCOC1CC[NH+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143110425 1047532843 /nfs/dbraw/zinc/53/28/43/1047532843.db2.gz FSRCGABSDYLCEG-UHFFFAOYSA-N 1 0 305.462 4.081 20 10 DICDRO CC(C)(C)c1cccc(C[N@H+](C2CCC2)C2CCOCC2)c1O ZINC001143117100 1047533687 /nfs/dbraw/zinc/53/36/87/1047533687.db2.gz SMFLEJXIBAQSMQ-UHFFFAOYSA-N 1 0 317.473 4.223 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)cc(OC)c1 ZINC001143161084 1047536031 /nfs/dbraw/zinc/53/60/31/1047536031.db2.gz YLWYUGIUSSGOOH-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO CCOc1ccc(C[N@H+](CC)Cc2ccccc2O)c(F)c1F ZINC001143278962 1047547675 /nfs/dbraw/zinc/54/76/75/1047547675.db2.gz ULDGLDDKNLHGSY-UHFFFAOYSA-N 1 0 321.367 4.091 20 10 DICDRO c1cncc([C@@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)c1 ZINC000843419797 1047548445 /nfs/dbraw/zinc/54/84/45/1047548445.db2.gz UEVFVICYOSVGSD-HXUWFJFHSA-N 1 0 321.468 4.061 20 10 DICDRO COc1ccc(O)c(C[NH2+]C2(c3cccc(Cl)c3)CCC2)c1 ZINC000843430725 1047550973 /nfs/dbraw/zinc/55/09/73/1047550973.db2.gz FHYOYZQUVKCEAO-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001204381224 1047620672 /nfs/dbraw/zinc/62/06/72/1047620672.db2.gz ATAOWSCICDBIPA-QGZVFWFLSA-N 1 0 319.807 4.392 20 10 DICDRO CC[N@H+](Cc1ccccc1O)C(C)(C)c1ccnc(Cl)c1 ZINC001154890859 1047661353 /nfs/dbraw/zinc/66/13/53/1047661353.db2.gz SJAJTQANOIQJMD-UHFFFAOYSA-N 1 0 304.821 4.198 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)c1ccc2ccccc2c1O ZINC000927035075 1047765268 /nfs/dbraw/zinc/76/52/68/1047765268.db2.gz ZYUUVIWTHYTHJX-UMVBOHGHSA-N 1 0 301.455 4.480 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1ccc(C)cc1O)CC3 ZINC001182783196 1047844790 /nfs/dbraw/zinc/84/47/90/1047844790.db2.gz VHZYGENXUSBUOG-UHFFFAOYSA-N 1 0 306.409 4.049 20 10 DICDRO Nc1ccc(NC2=C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001159485543 1047853775 /nfs/dbraw/zinc/85/37/75/1047853775.db2.gz LSOXJCLSIAWNHG-UXHICEINSA-N 1 0 305.425 4.002 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]C1(c2ccc(F)cc2)CCC1 ZINC001183045368 1047879512 /nfs/dbraw/zinc/87/95/12/1047879512.db2.gz IOGGTEVXFOZUAF-UHFFFAOYSA-N 1 0 305.780 4.354 20 10 DICDRO Cc1cc(CC[NH2+][C@H]2C[C@@H]3CCC[C@@H]32)c(C)n1-c1ccccc1 ZINC001183179588 1047899507 /nfs/dbraw/zinc/89/95/07/1047899507.db2.gz GTFSXPHUPVRFHZ-JBACZVJFSA-N 1 0 308.469 4.415 20 10 DICDRO Cc1cc(CC[NH2+][C@H]2CC[C@@H]2C2CC2)c(C)n1-c1ccccc1 ZINC001183180583 1047900730 /nfs/dbraw/zinc/90/07/30/1047900730.db2.gz PFPLKCVLNJSMJS-RTWAWAEBSA-N 1 0 308.469 4.415 20 10 DICDRO COc1cc(C)c(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c(O)c1 ZINC001183157044 1047903055 /nfs/dbraw/zinc/90/30/55/1047903055.db2.gz QNCPAQXHXSJYGN-QGZVFWFLSA-N 1 0 317.816 4.140 20 10 DICDRO Nc1ccc(N(c2ccccc2)c2cccc3c2CC[NH2+]C3)cc1 ZINC001159703429 1047905488 /nfs/dbraw/zinc/90/54/88/1047905488.db2.gz IYEOXKQRVXQWTA-UHFFFAOYSA-N 1 0 315.420 4.384 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@@H](Oc2ccccc2)C1(C)C)c1ccccc1O ZINC001183362888 1047918658 /nfs/dbraw/zinc/91/86/58/1047918658.db2.gz FLQGGBKUJMLRFJ-ZOCIIQOWSA-N 1 0 311.425 4.289 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)CCc1ccc(F)cc1F)c1ccccc1O ZINC001183355493 1047919411 /nfs/dbraw/zinc/91/94/11/1047919411.db2.gz QWLZNJXLTCKTJP-QWHCGFSZSA-N 1 0 305.368 4.342 20 10 DICDRO COc1ccccc1CCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000775838366 1047941907 /nfs/dbraw/zinc/94/19/07/1047941907.db2.gz XXHUYZQTVKWRBC-INIZCTEOSA-N 1 0 312.457 4.045 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c1 ZINC001183896895 1047977023 /nfs/dbraw/zinc/97/70/23/1047977023.db2.gz JWWCNTCTHDMMBU-IBGZPJMESA-N 1 0 317.473 4.345 20 10 DICDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(Br)cc(C)c1O ZINC000160953850 1048021547 /nfs/dbraw/zinc/02/15/47/1048021547.db2.gz CTXVTWFIRVXHHH-AWEZNQCLSA-N 1 0 312.251 4.228 20 10 DICDRO CC1(C)C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCS1 ZINC001184023709 1047989183 /nfs/dbraw/zinc/98/91/83/1047989183.db2.gz PDPBJYZHKXRZHR-OAHLLOKOSA-N 1 0 301.455 4.309 20 10 DICDRO Cn1ccc2c1cc[nH+]c2NCc1cc2ccccc2cc1O ZINC001160206943 1047995957 /nfs/dbraw/zinc/99/59/57/1047995957.db2.gz OTGLDRDSFJGHAX-UHFFFAOYSA-N 1 0 303.365 4.044 20 10 DICDRO CC(C)OCc1ccccc1C[NH2+]Cc1c(O)cccc1Cl ZINC000775889736 1048005599 /nfs/dbraw/zinc/00/55/99/1048005599.db2.gz GJPSKVJMQJLYRZ-UHFFFAOYSA-N 1 0 319.832 4.260 20 10 DICDRO Oc1c(C[NH2+]CC[C@@H]2CCC(F)(F)C2)ccc2ccccc21 ZINC001184239277 1048016070 /nfs/dbraw/zinc/01/60/70/1048016070.db2.gz LDTHZGWCOCVJLS-ZDUSSCGKSA-N 1 0 305.368 4.461 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](C)N2CCCC[C@@H]2C)cc1C ZINC001199296691 1048054836 /nfs/dbraw/zinc/05/48/36/1048054836.db2.gz XOYFHVXGZWFOIC-ZWKOTPCHSA-N 1 0 318.505 4.136 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)cc1 ZINC001203934290 1048065366 /nfs/dbraw/zinc/06/53/66/1048065366.db2.gz OYBOOTNHKLKWDM-LJQANCHMSA-N 1 0 312.482 4.043 20 10 DICDRO Cc1cccc(C)c1OCC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001199571854 1048077393 /nfs/dbraw/zinc/07/73/93/1048077393.db2.gz XRKBWUMONIIVJX-TWGQIWQCSA-N 1 0 324.468 4.051 20 10 DICDRO Cc1cccc(OCC[N@@H+](C)Cc2c(O)ccc3ccccc32)c1 ZINC000105154089 1048081697 /nfs/dbraw/zinc/08/16/97/1048081697.db2.gz VHOYDPFIIGDEDG-UHFFFAOYSA-N 1 0 321.420 4.365 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(OCC)cc2)cc1C ZINC001199752001 1048096760 /nfs/dbraw/zinc/09/67/60/1048096760.db2.gz VUJIITPKMYIXSO-UHFFFAOYSA-N 1 0 313.441 4.472 20 10 DICDRO FC(F)(F)c1ccccc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001199863537 1048108774 /nfs/dbraw/zinc/10/87/74/1048108774.db2.gz APEUCJHDDKUGHZ-UHFFFAOYSA-N 1 0 321.342 4.320 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CCc2ccccc2Cl)cc1F ZINC001199883050 1048114900 /nfs/dbraw/zinc/11/49/00/1048114900.db2.gz FEESBWPMNNGPQT-UHFFFAOYSA-N 1 0 324.802 4.017 20 10 DICDRO CCC[C@@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)c1ccccc1 ZINC000774816463 1048124569 /nfs/dbraw/zinc/12/45/69/1048124569.db2.gz YMGUYLRBUAAKMX-GOSISDBHSA-N 1 0 315.388 4.365 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1c(F)cccc1Cl ZINC000776117288 1048149992 /nfs/dbraw/zinc/14/99/92/1048149992.db2.gz NBDOWRGVUMHKGZ-UHFFFAOYSA-N 1 0 300.160 4.128 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2(CCOC)CCC2)cc1C ZINC001200978820 1048164953 /nfs/dbraw/zinc/16/49/53/1048164953.db2.gz GURZUTSKMVJCGJ-UHFFFAOYSA-N 1 0 305.462 4.080 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2COc3ccc(C)cc32)cc1C ZINC001201035826 1048182787 /nfs/dbraw/zinc/18/27/87/1048182787.db2.gz KQQQEYFQFGCZGJ-SFHVURJKSA-N 1 0 311.425 4.316 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000776157939 1048241726 /nfs/dbraw/zinc/24/17/26/1048241726.db2.gz RIPVAEKMSGWRAO-FQEVSTJZSA-N 1 0 312.432 4.367 20 10 DICDRO Fc1ccc2c(c1)[C@H]([NH2+]CCCSc1nccs1)CCC2 ZINC000776162755 1048259830 /nfs/dbraw/zinc/25/98/30/1048259830.db2.gz KOHPBDKZXPGOAI-OAHLLOKOSA-N 1 0 322.474 4.432 20 10 DICDRO COc1ccc(O)c(C[NH2+]Cc2c(Cl)oc3ccccc32)c1 ZINC000776175542 1048270124 /nfs/dbraw/zinc/27/01/24/1048270124.db2.gz STQWLCMWNMZGJI-UHFFFAOYSA-N 1 0 317.772 4.090 20 10 DICDRO CCCOc1cccc(CC[NH2+]Cc2ccc(OC)c(C)c2)c1 ZINC001201541356 1048300711 /nfs/dbraw/zinc/30/07/11/1048300711.db2.gz DOXLCCZVHYCIRY-UHFFFAOYSA-N 1 0 313.441 4.125 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@H]2CCC[C@@H]2OC)cc1 ZINC001201715061 1048353015 /nfs/dbraw/zinc/35/30/15/1048353015.db2.gz UUOVTUALZOKRDL-QUCCMNQESA-N 1 0 318.505 4.218 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)CCO1 ZINC001201742294 1048363430 /nfs/dbraw/zinc/36/34/30/1048363430.db2.gz MOEUKYRHRMZGNU-QUCCMNQESA-N 1 0 317.473 4.085 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CSc3ccccc32)c1O ZINC000776207900 1048367317 /nfs/dbraw/zinc/36/73/17/1048367317.db2.gz QVGRDSSFXWDUSE-AWEZNQCLSA-N 1 0 305.830 4.291 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCc3ccccc3C2)cc1 ZINC001201733810 1048373104 /nfs/dbraw/zinc/37/31/04/1048373104.db2.gz BZLSNNCJATUCAG-SFFCAUCYSA-N 1 0 320.480 4.161 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001203658459 1048390098 /nfs/dbraw/zinc/39/00/98/1048390098.db2.gz WCGMUJDXPBDNKU-QGZVFWFLSA-N 1 0 317.816 4.089 20 10 DICDRO CC[N@H+](Cc1cccc(OC)c1)Cc1cc(Cl)ccc1O ZINC001203664153 1048404261 /nfs/dbraw/zinc/40/42/61/1048404261.db2.gz OUKTZBMZWYJNEH-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CNc1ccccc1N[C@@H]1CC2(CC[NH2+]CC2)c2ccc(C)cc21 ZINC001163036477 1048406373 /nfs/dbraw/zinc/40/63/73/1048406373.db2.gz HUVFVUARFUGELZ-HXUWFJFHSA-N 1 0 321.468 4.215 20 10 DICDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)cn1 ZINC001203664259 1048409284 /nfs/dbraw/zinc/40/92/84/1048409284.db2.gz UQIMALLGOOTVOK-MRXNPFEDSA-N 1 0 302.805 4.086 20 10 DICDRO C[C@H]([NH2+]CCSc1ccc(Cl)cc1)c1ccccc1O ZINC000775128367 1048409858 /nfs/dbraw/zinc/40/98/58/1048409858.db2.gz AGUFWXVECYEMTM-LBPRGKRZSA-N 1 0 307.846 4.489 20 10 DICDRO COc1cccc(C2([NH2+]Cc3cc(Cl)cc(C)c3O)CC2)c1 ZINC000776242138 1048454205 /nfs/dbraw/zinc/45/42/05/1048454205.db2.gz OINNZONJWOXMHA-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO CC(C)(C)c1nc(CC[NH2+]Cc2c(O)cccc2Cl)cs1 ZINC000776252778 1048465053 /nfs/dbraw/zinc/46/50/53/1048465053.db2.gz FWHLEOFARWPAED-UHFFFAOYSA-N 1 0 324.877 4.132 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)c1O ZINC000776252815 1048467137 /nfs/dbraw/zinc/46/71/37/1048467137.db2.gz FXTVZJBRNABOJZ-CABCVRRESA-N 1 0 311.853 4.037 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)cc1 ZINC001202168642 1048470198 /nfs/dbraw/zinc/47/01/98/1048470198.db2.gz PPJVDKCWLGNGBH-DRBHRISKSA-N 1 0 324.443 4.441 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@@H](C)Cc2ccccc2C)c1O ZINC000775205229 1048561359 /nfs/dbraw/zinc/56/13/59/1048561359.db2.gz WLRAPZJSSXSBBO-INIZCTEOSA-N 1 0 313.441 4.162 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](Cc2ccccc2)C(C)C)cc1 ZINC001176130066 1048578944 /nfs/dbraw/zinc/57/89/44/1048578944.db2.gz RESHTHXBPQZBGY-OAQYLSRUSA-N 1 0 310.485 4.500 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)Cc1nc(C)c2ccccc2n1 ZINC000107896913 1048597305 /nfs/dbraw/zinc/59/73/05/1048597305.db2.gz DDKPNTUSSMOETH-UHFFFAOYSA-N 1 0 321.424 4.056 20 10 DICDRO Cc1ccc2cc(C[NH2+]Cc3ccc4c(c3)CCCN4C)[nH]c2c1 ZINC000850099619 1048618829 /nfs/dbraw/zinc/61/88/29/1048618829.db2.gz QDMIGPOQXBHEFB-UHFFFAOYSA-N 1 0 319.452 4.149 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](c2ccccc2F)C(C)C)c(O)c1 ZINC000850361827 1048638319 /nfs/dbraw/zinc/63/83/19/1048638319.db2.gz FRIYEHBPJWHIJV-IBGZPJMESA-N 1 0 317.404 4.417 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C2CCC3(CC3(F)F)CC2)cc1 ZINC000850391780 1048646852 /nfs/dbraw/zinc/64/68/52/1048646852.db2.gz ZBSULZZMOWQTMM-ONEGZZNKSA-N 1 0 320.427 4.323 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cc2cnccc2o1 ZINC000850423680 1048652538 /nfs/dbraw/zinc/65/25/38/1048652538.db2.gz YFQBNLMTQPPNJF-HNNXBMFYSA-N 1 0 321.424 4.279 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2cc3cnccc3o2)ccc1N(C)C ZINC000850443991 1048658737 /nfs/dbraw/zinc/65/87/37/1048658737.db2.gz PGRUGCIZZMPXPZ-AWEZNQCLSA-N 1 0 309.413 4.053 20 10 DICDRO CC[C@H]([NH2+]CCc1cnccc1C)c1cc(Cl)ccc1O ZINC000850504860 1048672895 /nfs/dbraw/zinc/67/28/95/1048672895.db2.gz GWZCTSWOKDUBIV-INIZCTEOSA-N 1 0 304.821 4.032 20 10 DICDRO CC[C@@H]([NH2+]CCc1cnccc1C)c1cc(Cl)ccc1O ZINC000850504861 1048673363 /nfs/dbraw/zinc/67/33/63/1048673363.db2.gz GWZCTSWOKDUBIV-MRXNPFEDSA-N 1 0 304.821 4.032 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccccc1O ZINC000850521169 1048676359 /nfs/dbraw/zinc/67/63/59/1048676359.db2.gz ONYFUSYQYBKWJG-INIZCTEOSA-N 1 0 315.388 4.313 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)COc2c(F)cccc2F)c(O)c1 ZINC000850522381 1048676887 /nfs/dbraw/zinc/67/68/87/1048676887.db2.gz ARUJZUUATVECKG-CHWSQXEVSA-N 1 0 321.367 4.097 20 10 DICDRO C[C@H]([NH2+][C@@H]1C[C@@H](O)c2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000850530512 1048682626 /nfs/dbraw/zinc/68/26/26/1048682626.db2.gz ZGYWPIBFRJKFCF-DRWCTHJISA-N 1 0 323.436 4.100 20 10 DICDRO C[C@@H]([NH2+]Cc1c(C2CC2)cnn1C)c1ccc2ccccc2c1O ZINC000850535293 1048684400 /nfs/dbraw/zinc/68/44/00/1048684400.db2.gz ULPRHACUNMJUSQ-CYBMUJFWSA-N 1 0 321.424 4.007 20 10 DICDRO C[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(N2CCCCC2)cc1 ZINC000850534450 1048685076 /nfs/dbraw/zinc/68/50/76/1048685076.db2.gz JVXMYQPURYKHNL-PBHICJAKSA-N 1 0 308.416 4.373 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cc2c(cc1O)CCCC2 ZINC000850543384 1048686793 /nfs/dbraw/zinc/68/67/93/1048686793.db2.gz ILRJIWMIZSZCCC-RBZFPXEDSA-N 1 0 323.436 4.315 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cc2c(cc1O)CCCC2 ZINC000850543385 1048686999 /nfs/dbraw/zinc/68/69/99/1048686999.db2.gz ILRJIWMIZSZCCC-RNODOKPDSA-N 1 0 323.436 4.315 20 10 DICDRO CCSC1(C[NH2+][C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000850550997 1048688575 /nfs/dbraw/zinc/68/85/75/1048688575.db2.gz FYYNTJJGAFHUKU-CYBMUJFWSA-N 1 0 301.455 4.482 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc2ccccc2c1O ZINC000850553097 1048689125 /nfs/dbraw/zinc/68/91/25/1048689125.db2.gz RSBLZAZPVFMOCD-IAQYHMDHSA-N 1 0 305.368 4.487 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)c1 ZINC000850544594 1048689648 /nfs/dbraw/zinc/68/96/48/1048689648.db2.gz YDEFLHZHAOERLO-LRDNONRASA-N 1 0 311.425 4.293 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCOC1(C)C)c1ccc(N2CCCCC2)cc1 ZINC000850571070 1048697713 /nfs/dbraw/zinc/69/77/13/1048697713.db2.gz MBJLHGOCSYXJAG-WMZOPIPTSA-N 1 0 316.489 4.143 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H](C)O)c1O ZINC000850582387 1048701197 /nfs/dbraw/zinc/70/11/97/1048701197.db2.gz FNAOVISMMXDPSC-OGHNNQOOSA-N 1 0 319.832 4.127 20 10 DICDRO COc1ccccc1/C=C/C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000775365065 1048703856 /nfs/dbraw/zinc/70/38/56/1048703856.db2.gz RWVLCOFVZZPONF-MNDMWVCDSA-N 1 0 310.441 4.125 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2c(F)cccc2Cl)c1 ZINC000775363411 1048704822 /nfs/dbraw/zinc/70/48/22/1048704822.db2.gz KQHZTQJEQGZQNT-NSHDSACASA-N 1 0 323.795 4.087 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)OCO2)c1ccc2ccccc2c1O ZINC000192918250 1048707930 /nfs/dbraw/zinc/70/79/30/1048707930.db2.gz DDOMGFRWCWAQGX-ZDUSSCGKSA-N 1 0 321.376 4.125 20 10 DICDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000776498587 1048722424 /nfs/dbraw/zinc/72/24/24/1048722424.db2.gz OQCSGXDNVFCKGJ-DIFFPNOSSA-N 1 0 323.795 4.051 20 10 DICDRO Oc1ccccc1C[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000775381467 1048739792 /nfs/dbraw/zinc/73/97/92/1048739792.db2.gz QQIKUIDKZLHPGN-HNNXBMFYSA-N 1 0 303.789 4.049 20 10 DICDRO Cc1oc(-c2cccs2)nc1CN(C)Cc1ccccc1O ZINC000109769002 1048741806 /nfs/dbraw/zinc/74/18/06/1048741806.db2.gz NFMFOVPNTZRGAJ-UHFFFAOYSA-N 1 0 314.410 4.049 20 10 DICDRO CN(Cc1ccccc1O)Cc1cc2ccccc2nc1Cl ZINC000109771111 1048742660 /nfs/dbraw/zinc/74/26/60/1048742660.db2.gz OGYRERHJRPDMFQ-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO CC[C@@](C)([NH2+]Cc1cc(F)cc(C(C)=O)c1O)c1ccccc1 ZINC000775393878 1048748977 /nfs/dbraw/zinc/74/89/77/1048748977.db2.gz JHXXRLFGAQJORJ-LJQANCHMSA-N 1 0 315.388 4.149 20 10 DICDRO CC[C@H]([NH2+]CCOc1ccccc1Cl)c1ccccc1O ZINC000775414972 1048791434 /nfs/dbraw/zinc/79/14/34/1048791434.db2.gz NBRBBFRGUMDRRW-HNNXBMFYSA-N 1 0 305.805 4.165 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@H](C3CCCC3)C2)c1O ZINC001176932251 1048802667 /nfs/dbraw/zinc/80/26/67/1048802667.db2.gz GJIKXWWXRZATKG-HNNXBMFYSA-N 1 0 319.420 4.136 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2ccccc2O)C2CCCC2)cc1 ZINC001190903501 1048805188 /nfs/dbraw/zinc/80/51/88/1048805188.db2.gz BRTSLSISQKMQRY-UHFFFAOYSA-N 1 0 324.468 4.403 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1Cl ZINC000851949787 1048815223 /nfs/dbraw/zinc/81/52/23/1048815223.db2.gz JIAPSKQKLDOBPZ-ZDUSSCGKSA-N 1 0 318.848 4.265 20 10 DICDRO C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001191003720 1048817258 /nfs/dbraw/zinc/81/72/58/1048817258.db2.gz JMBNHPLXBGMKQM-HNNXBMFYSA-N 1 0 316.876 4.469 20 10 DICDRO Cc1cc(C[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001191003926 1048818371 /nfs/dbraw/zinc/81/83/71/1048818371.db2.gz MEBZZALPFATAHD-XLIONFOSSA-N 1 0 308.469 4.439 20 10 DICDRO CCCOc1ccc(C[NH2+]CCc2ccccc2F)cc1C ZINC001177108984 1048832096 /nfs/dbraw/zinc/83/20/96/1048832096.db2.gz VFQADEPAIZYDTI-UHFFFAOYSA-N 1 0 301.405 4.255 20 10 DICDRO c1ccc(CN2CCc3cc(C[NH2+]C4CCCC4)ccc32)cc1 ZINC001177104634 1048832648 /nfs/dbraw/zinc/83/26/48/1048832648.db2.gz YGTJOLKRQZEERJ-UHFFFAOYSA-N 1 0 306.453 4.282 20 10 DICDRO c1ccc(C2(C[NH2+]Cc3ccc(N4CCCCC4)cc3)CC2)cc1 ZINC000110568965 1048837015 /nfs/dbraw/zinc/83/70/15/1048837015.db2.gz SMRSADOKYXADIO-UHFFFAOYSA-N 1 0 320.480 4.498 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccc2c(c1)CCCO2 ZINC000853239489 1048888077 /nfs/dbraw/zinc/88/80/77/1048888077.db2.gz BWSMYYBWCAULHH-STQMWFEESA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000853239785 1048891275 /nfs/dbraw/zinc/89/12/75/1048891275.db2.gz DMWYKIMHKGNOEB-LSDHHAIUSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccncc2)c1 ZINC000853628918 1048911416 /nfs/dbraw/zinc/91/14/16/1048911416.db2.gz FPHAVTZHXPGYDW-LJQANCHMSA-N 1 0 308.425 4.131 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccncc2)cc1C ZINC000853628843 1048911654 /nfs/dbraw/zinc/91/16/54/1048911654.db2.gz CTLJFCWBZKFBBO-LJQANCHMSA-N 1 0 308.425 4.131 20 10 DICDRO COc1ccc(N2CCC([NH2+]Cc3cc(C)ccc3C)CC2)cc1 ZINC001177604963 1048924488 /nfs/dbraw/zinc/92/44/88/1048924488.db2.gz VOPAWZVUFOHLNC-UHFFFAOYSA-N 1 0 324.468 4.071 20 10 DICDRO CC[C@@H](Cc1ccccc1)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177624436 1048926084 /nfs/dbraw/zinc/92/60/84/1048926084.db2.gz OGSURKDECPBZFI-INIZCTEOSA-N 1 0 318.411 4.142 20 10 DICDRO Cc1cccc2c1CC[C@H]2[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001177774183 1048936480 /nfs/dbraw/zinc/93/64/80/1048936480.db2.gz BIZNWPACYBWVNQ-GZNAHNRGSA-N 1 0 306.453 4.351 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c(O)c1 ZINC001203628022 1048943920 /nfs/dbraw/zinc/94/39/20/1048943920.db2.gz VZSJOXOZCFGMHJ-QGZVFWFLSA-N 1 0 319.351 4.016 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c(O)c1 ZINC001203634464 1048944006 /nfs/dbraw/zinc/94/40/06/1048944006.db2.gz HIIDYCGVJCCPKU-KRWDZBQOSA-N 1 0 319.351 4.016 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c(O)c1 ZINC001203628936 1048944061 /nfs/dbraw/zinc/94/40/61/1048944061.db2.gz LWKBYKXYLCWTFK-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(C)c2F)cc1F ZINC001177795408 1048945172 /nfs/dbraw/zinc/94/51/72/1048945172.db2.gz RYDLXOSZFOFLCZ-UHFFFAOYSA-N 1 0 318.411 4.409 20 10 DICDRO Cc1cc(C[N@H+]2CC[C@H](c3ccccc3)[C@@H]2C)ccc1N(C)C ZINC001191445771 1048945689 /nfs/dbraw/zinc/94/56/89/1048945689.db2.gz WOSOYIJPUXGHAW-PXNSSMCTSA-N 1 0 308.469 4.439 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)cc1 ZINC001203658508 1048950505 /nfs/dbraw/zinc/95/05/05/1048950505.db2.gz YQTQZEKYFOMENZ-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC001203657786 1048952043 /nfs/dbraw/zinc/95/20/43/1048952043.db2.gz NJSLCCZNYIBBGO-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(Cl)ccc1O ZINC001203664268 1048954411 /nfs/dbraw/zinc/95/44/11/1048954411.db2.gz UUNHGBUYDPRUCC-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO C[C@H](CCc1ccccc1)C[NH2+]CCCSc1nccs1 ZINC001177906060 1048960351 /nfs/dbraw/zinc/96/03/51/1048960351.db2.gz YUSUTULPJCAUBE-OAHLLOKOSA-N 1 0 320.527 4.484 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCCSCC(C)C)c(Cl)c1 ZINC001178203236 1048997940 /nfs/dbraw/zinc/99/79/40/1048997940.db2.gz CAQWTMDFKRCPFD-UHFFFAOYSA-N 1 0 301.883 4.223 20 10 DICDRO CCOCCC1(C[NH2+]Cc2ccc(OC)c(C)c2)CCCC1 ZINC001177977274 1048976556 /nfs/dbraw/zinc/97/65/56/1048976556.db2.gz WOHVXBZRNYIDKK-UHFFFAOYSA-N 1 0 305.462 4.080 20 10 DICDRO C[C@H]1COC[C@@H]1[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001203769988 1048994297 /nfs/dbraw/zinc/99/42/97/1048994297.db2.gz BFKARQNAAWIXHB-GUYCJALGSA-N 1 0 319.489 4.112 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(COC)c1)c1cc(Cl)ccc1O ZINC000775486508 1049007080 /nfs/dbraw/zinc/00/70/80/1049007080.db2.gz CKCVQNVKLKWNPO-KRWDZBQOSA-N 1 0 319.832 4.433 20 10 DICDRO Cc1cc(C)c(O)c(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)c1 ZINC000776780242 1049009938 /nfs/dbraw/zinc/00/99/38/1049009938.db2.gz YMGRELIKXRTAGK-UHFFFAOYSA-N 1 0 309.331 4.058 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCC3(CC3)C2)cc1F ZINC001203829377 1049012508 /nfs/dbraw/zinc/01/25/08/1049012508.db2.gz CMRBACNZGSCKPD-MRXNPFEDSA-N 1 0 304.453 4.484 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)COc1cccc(F)c1)c1ccccc1O ZINC000775491264 1049013673 /nfs/dbraw/zinc/01/36/73/1049013673.db2.gz HAGYLFRUYCNGRN-GUYCJALGSA-N 1 0 303.377 4.040 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1C[C@H](c2ccc(F)cc2F)C1 ZINC001203831481 1049014046 /nfs/dbraw/zinc/01/40/46/1049014046.db2.gz VSNWTJTXZAJBCT-UMSPYCQHSA-N 1 0 323.770 4.360 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccccc1O ZINC000775489617 1049015091 /nfs/dbraw/zinc/01/50/91/1049015091.db2.gz VVVMOFPFFBIUET-CXAGYDPISA-N 1 0 324.424 4.079 20 10 DICDRO CC[C@@H]([NH2+]CCCCN(C)c1ccccc1)c1ccccc1O ZINC000775491847 1049020387 /nfs/dbraw/zinc/02/03/87/1049020387.db2.gz MICWJYGCJYYSNH-LJQANCHMSA-N 1 0 312.457 4.350 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000776800438 1049020404 /nfs/dbraw/zinc/02/04/04/1049020404.db2.gz MVICJPIEMUAZOM-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO C[N@H+](Cc1ccc(O)c(O)c1)C(c1ccccc1)c1ccccc1 ZINC001203874379 1049021573 /nfs/dbraw/zinc/02/15/73/1049021573.db2.gz VMWHJUADOUIMTR-UHFFFAOYSA-N 1 0 319.404 4.319 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775497852 1049030891 /nfs/dbraw/zinc/03/08/91/1049030891.db2.gz WSMQIGJHHRNTNM-MFKMUULPSA-N 1 0 319.276 4.080 20 10 DICDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000775497845 1049032098 /nfs/dbraw/zinc/03/20/98/1049032098.db2.gz WMKHFWACKGOJSS-LLVKDONJSA-N 1 0 306.347 4.102 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](O)C1CCCCC1)c1cc(Cl)ccc1O ZINC000775497771 1049033990 /nfs/dbraw/zinc/03/39/90/1049033990.db2.gz FPRSLPONBYUFMO-DOTOQJQBSA-N 1 0 311.853 4.028 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(COC(C)(C)C)c2)c1 ZINC000113332858 1049034119 /nfs/dbraw/zinc/03/41/19/1049034119.db2.gz GJXULBWZSYEZDZ-UHFFFAOYSA-N 1 0 313.441 4.306 20 10 DICDRO COc1ccccc1C1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC001203937614 1049034811 /nfs/dbraw/zinc/03/48/11/1049034811.db2.gz HGWLQEBAVMFAQN-UHFFFAOYSA-N 1 0 324.468 4.141 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](c3ccccn3)C2)cc1 ZINC001203939397 1049034879 /nfs/dbraw/zinc/03/48/79/1049034879.db2.gz PWDFZOYYJHDOKE-IBGZPJMESA-N 1 0 323.484 4.307 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)cc1 ZINC001203939422 1049035035 /nfs/dbraw/zinc/03/50/35/1049035035.db2.gz QAHDQUXYTOVWSO-OAQYLSRUSA-N 1 0 323.484 4.135 20 10 DICDRO COc1ccc(C2=CC[N@H+](Cc3ccc(N(C)C)cc3)CC2)cc1 ZINC001203937537 1049035338 /nfs/dbraw/zinc/03/53/38/1049035338.db2.gz VGDNQOASVGSLGO-UHFFFAOYSA-N 1 0 322.452 4.051 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCc3sccc3C2)cc1 ZINC001203939588 1049036192 /nfs/dbraw/zinc/03/61/92/1049036192.db2.gz DDXGYNKGBYWHRV-UHFFFAOYSA-N 1 0 300.471 4.153 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(c3ccccc3F)CC2)cc1 ZINC001203934397 1049036258 /nfs/dbraw/zinc/03/62/58/1049036258.db2.gz UJSWTPAIHJKEEI-UHFFFAOYSA-N 1 0 312.432 4.271 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)cc1 ZINC001203940665 1049038153 /nfs/dbraw/zinc/03/81/53/1049038153.db2.gz UETFXSIRBWFFMI-UHFFFAOYSA-N 1 0 310.432 4.400 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(O)c1)c1cc(Cl)ccc1O ZINC000775500871 1049039189 /nfs/dbraw/zinc/03/91/89/1049039189.db2.gz MBXQUOZPUWYVFX-CQSZACIVSA-N 1 0 321.804 4.001 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1cc(Cl)ccc1O ZINC000775501571 1049040106 /nfs/dbraw/zinc/04/01/06/1049040106.db2.gz IAOLOMQRLUADNZ-HOTGVXAUSA-N 1 0 317.816 4.479 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C(C)C)no1)c1cc(Cl)ccc1O ZINC000775508340 1049043165 /nfs/dbraw/zinc/04/31/65/1049043165.db2.gz UARQEYPCVLWLCJ-CQSZACIVSA-N 1 0 308.809 4.398 20 10 DICDRO CC[C@@H]([NH2+]Cc1nccn1CC(C)C)c1cc(Cl)ccc1O ZINC000775510140 1049043987 /nfs/dbraw/zinc/04/39/87/1049043987.db2.gz VOUMNDPKMYLOAN-OAHLLOKOSA-N 1 0 321.852 4.139 20 10 DICDRO CC[C@H]([NH2+][C@@H](Cn1cccn1)c1ccccc1)c1ccccc1O ZINC000775509968 1049045180 /nfs/dbraw/zinc/04/51/80/1049045180.db2.gz STGZUPAWCPEDSR-OALUTQOASA-N 1 0 321.424 4.071 20 10 DICDRO CC[C@@H]([NH2+]CCc1c[nH]c2ccc(OC)cc12)c1ccccc1O ZINC000775504058 1049047005 /nfs/dbraw/zinc/04/70/05/1049047005.db2.gz RLMGUNLHULMJKE-GOSISDBHSA-N 1 0 324.424 4.166 20 10 DICDRO C[C@@H](CCCC(F)(F)F)[NH2+]CCCSc1nccs1 ZINC000775506821 1049047529 /nfs/dbraw/zinc/04/75/29/1049047529.db2.gz FHQVQGSHXVFNAW-JTQLQIEISA-N 1 0 312.426 4.336 20 10 DICDRO CCCCOc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)cc1 ZINC001203972123 1049049721 /nfs/dbraw/zinc/04/97/21/1049049721.db2.gz NXKUZBNVDMMEPN-UHFFFAOYSA-N 1 0 311.425 4.129 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)C[C@@H](O)c1ccco1)c1cc(Cl)ccc1O ZINC000775513445 1049049898 /nfs/dbraw/zinc/04/98/98/1049049898.db2.gz JKVCRTCNOGJLII-HZUKXOBISA-N 1 0 323.820 4.192 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCCC2)c(C)c1)Cc1ccccn1 ZINC001192199579 1049051638 /nfs/dbraw/zinc/05/16/38/1049051638.db2.gz OGQWROCBIFBZMB-UHFFFAOYSA-N 1 0 323.484 4.402 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1cc(Cl)ccc1O ZINC000775511819 1049054209 /nfs/dbraw/zinc/05/42/09/1049054209.db2.gz JYYNVBUCLISZMF-MLGOLLRUSA-N 1 0 304.821 4.285 20 10 DICDRO CC[C@@H]([NH2+]CC1CCC(OC)CC1)c1cc(Cl)ccc1O ZINC000775511339 1049054578 /nfs/dbraw/zinc/05/45/78/1049054578.db2.gz DSGWUHYDOREJFO-LDZOIKDWSA-N 1 0 311.853 4.292 20 10 DICDRO CC[C@H]([NH2+]C[C@@]1(C)CCCC[C@@H]1O)c1cc(Cl)ccc1O ZINC000775512451 1049056402 /nfs/dbraw/zinc/05/64/02/1049056402.db2.gz PRNFZSZMDKRQFI-BHYGNILZSA-N 1 0 311.853 4.028 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1SCCc2ccccc21)c1ccccc1O ZINC000775512982 1049056491 /nfs/dbraw/zinc/05/64/91/1049056491.db2.gz VHBNPQXKZFYPQK-IEBWSBKVSA-N 1 0 313.466 4.464 20 10 DICDRO CC[C@@H]([NH2+]CCc1nc(C)c(C)s1)c1cc(Cl)ccc1O ZINC000775513113 1049058342 /nfs/dbraw/zinc/05/83/42/1049058342.db2.gz GASUTERXZFNQRN-CQSZACIVSA-N 1 0 324.877 4.402 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCCC23CCOCC3)cc1C ZINC001178552844 1049059028 /nfs/dbraw/zinc/05/90/28/1049059028.db2.gz HMLIDZCHIVAABL-IBGZPJMESA-N 1 0 317.473 4.223 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Cl)ccc1O ZINC000775520698 1049071834 /nfs/dbraw/zinc/07/18/34/1049071834.db2.gz VTRQBSLYHNKQLC-CQSZACIVSA-N 1 0 320.776 4.195 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]C(C2CCC2)C2CCC2)cc1F ZINC001178666966 1049072860 /nfs/dbraw/zinc/07/28/60/1049072860.db2.gz LGEORLPHHJAPQX-UHFFFAOYSA-N 1 0 308.416 4.089 20 10 DICDRO CC[C@@H]([NH2+]CCCc1ccccn1)c1cc(Cl)ccc1O ZINC000775522578 1049082503 /nfs/dbraw/zinc/08/25/03/1049082503.db2.gz VAOBNYWUOHWZEG-MRXNPFEDSA-N 1 0 304.821 4.114 20 10 DICDRO CC[C@H]([NH2+]CCNc1ccc2ccccc2n1)c1ccccc1O ZINC000775525026 1049088419 /nfs/dbraw/zinc/08/84/19/1049088419.db2.gz DCJNEIHYSNLXTK-KRWDZBQOSA-N 1 0 321.424 4.093 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CC[C@H]1CCc2ccccc21 ZINC001178831264 1049097844 /nfs/dbraw/zinc/09/78/44/1049097844.db2.gz MVJICSPFRQIJHZ-CQSZACIVSA-N 1 0 301.817 4.255 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)ccn1 ZINC000856719858 1049099587 /nfs/dbraw/zinc/09/95/87/1049099587.db2.gz WCBDTCLVEJPZMJ-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc[nH]1)c1cc(Br)ccc1O ZINC000775527410 1049099739 /nfs/dbraw/zinc/09/97/39/1049099739.db2.gz XJWPZDMCFLOCRO-GWCFXTLKSA-N 1 0 323.234 4.285 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1cc(Cl)ccc1O ZINC000775525706 1049100561 /nfs/dbraw/zinc/10/05/61/1049100561.db2.gz MJKCQMCYXOJGHV-GXFFZTMASA-N 1 0 322.840 4.089 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CC[C@H]1CC1(F)F ZINC000856802417 1049105464 /nfs/dbraw/zinc/10/54/64/1049105464.db2.gz OVTBXTQVSPFDSJ-INIZCTEOSA-N 1 0 303.352 4.194 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@](C)(F)C2)c2ccccc21 ZINC001204234108 1049112789 /nfs/dbraw/zinc/11/27/89/1049112789.db2.gz WUGFOGMABHZNCU-IBGZPJMESA-N 1 0 300.421 4.230 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(Cl)cn1)c1cc(Cl)ccc1O ZINC000775532159 1049113000 /nfs/dbraw/zinc/11/30/00/1049113000.db2.gz RXVDRQXTRKTZRN-AWEZNQCLSA-N 1 0 311.212 4.335 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCC[C@H](F)C2)c2ccccc21 ZINC001204233643 1049116079 /nfs/dbraw/zinc/11/60/79/1049116079.db2.gz TVLSJIUAPUBUCH-INIZCTEOSA-N 1 0 300.421 4.230 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cccc(O)c2)c2ccccc21 ZINC001204232345 1049116316 /nfs/dbraw/zinc/11/63/16/1049116316.db2.gz ASOSHDPNOAXBSY-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001178998957 1049120189 /nfs/dbraw/zinc/12/01/89/1049120189.db2.gz VBYRBCSUIXAPGI-UXHICEINSA-N 1 0 310.416 4.014 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@@]1(F)c1ccccc1 ZINC001178998382 1049121443 /nfs/dbraw/zinc/12/14/43/1049121443.db2.gz LPXCBEJDFKLPJR-WOJBJXKFSA-N 1 0 308.400 4.214 20 10 DICDRO CC1([NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)CC=CC1 ZINC001179049113 1049124081 /nfs/dbraw/zinc/12/40/81/1049124081.db2.gz CCYVDSGJCCKFPN-UHFFFAOYSA-N 1 0 318.464 4.448 20 10 DICDRO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c(O)c1 ZINC001204275277 1049124886 /nfs/dbraw/zinc/12/48/86/1049124886.db2.gz NRQQXBWBBUYQHZ-INIZCTEOSA-N 1 0 303.789 4.088 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000857081395 1049126076 /nfs/dbraw/zinc/12/60/76/1049126076.db2.gz OGIQLTCOJNNUEY-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO Oc1ccc(C[NH+]2CCC(c3cccc(Cl)c3)CC2)c(O)c1 ZINC001204276851 1049126486 /nfs/dbraw/zinc/12/64/86/1049126486.db2.gz SLJLENDXJKGQMX-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO Oc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c(O)c1 ZINC001204279636 1049126569 /nfs/dbraw/zinc/12/65/69/1049126569.db2.gz DGPPODKUZKCBCZ-INIZCTEOSA-N 1 0 303.789 4.088 20 10 DICDRO C[C@@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1cc(Cl)ccc1O ZINC000857082563 1049127384 /nfs/dbraw/zinc/12/73/84/1049127384.db2.gz OMRWDRQHJIVUST-RKDXNWHRSA-N 1 0 308.636 4.280 20 10 DICDRO CC[C@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1ccc(C)cc1O ZINC000857082879 1049127867 /nfs/dbraw/zinc/12/78/67/1049127867.db2.gz RHZZQXHQRNMHJP-YPMHNXCESA-N 1 0 302.245 4.325 20 10 DICDRO C[N@H+](CCC1CC1)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001204287598 1049128576 /nfs/dbraw/zinc/12/85/76/1049128576.db2.gz MSLZXUSYMPOFIU-UHFFFAOYSA-N 1 0 320.480 4.481 20 10 DICDRO CC[C@H]([NH2+]CCc1cc(F)c(F)c(F)c1)c1ccccc1O ZINC000775548516 1049139372 /nfs/dbraw/zinc/13/93/72/1049139372.db2.gz UOMQHESKHBNFPA-HNNXBMFYSA-N 1 0 309.331 4.093 20 10 DICDRO CC[N@H+](Cc1cn(C)c2ccccc12)Cc1ccc(N(C)C)cc1 ZINC001204319241 1049139963 /nfs/dbraw/zinc/13/99/63/1049139963.db2.gz LTFUGHMMCSXPMV-UHFFFAOYSA-N 1 0 321.468 4.266 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccccc1F ZINC001204321792 1049142051 /nfs/dbraw/zinc/14/20/51/1049142051.db2.gz KSYONNFBTKOQMC-UHFFFAOYSA-N 1 0 312.432 4.448 20 10 DICDRO Fc1ccc([C@@H]2CC[N@H+](Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001204322642 1049142768 /nfs/dbraw/zinc/14/27/68/1049142768.db2.gz UNGPRCAGQOAJDE-LJQANCHMSA-N 1 0 324.443 4.415 20 10 DICDRO c1ccc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCCC3)cc2)nc1 ZINC001204325774 1049143096 /nfs/dbraw/zinc/14/30/96/1049143096.db2.gz AJTOYQQLCXLGTL-FQEVSTJZSA-N 1 0 307.441 4.019 20 10 DICDRO Cc1ccc2c(c1)CC[N@@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001204329588 1049144731 /nfs/dbraw/zinc/14/47/31/1049144731.db2.gz RCHSEAYXAJTSOJ-UHFFFAOYSA-N 1 0 306.453 4.154 20 10 DICDRO Cc1ccc(C[NH2+]CCc2cc(C)n(-c3ccccc3)c2C)o1 ZINC001179295413 1049150692 /nfs/dbraw/zinc/15/06/92/1049150692.db2.gz LENARDLIIRJGOJ-UHFFFAOYSA-N 1 0 308.425 4.328 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1nnc(C)s1)c1cc(Cl)ccc1O ZINC000775555921 1049153359 /nfs/dbraw/zinc/15/33/59/1049153359.db2.gz SMZKKBMNNSXUJL-PRHODGIISA-N 1 0 311.838 4.007 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1nnc(C)s1)c1cc(Cl)ccc1O ZINC000775555922 1049154288 /nfs/dbraw/zinc/15/42/88/1049154288.db2.gz SMZKKBMNNSXUJL-QPUJVOFHSA-N 1 0 311.838 4.007 20 10 DICDRO CCc1cccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)c1O ZINC001204432117 1049161855 /nfs/dbraw/zinc/16/18/55/1049161855.db2.gz RKTMKILEPLRGSX-UHFFFAOYSA-N 1 0 311.425 4.072 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC[C@@H]2CCCC2(F)F)cc1 ZINC001179443908 1049165142 /nfs/dbraw/zinc/16/51/42/1049165142.db2.gz WRGVUTCUOMNKKK-APHBUQMISA-N 1 0 308.416 4.181 20 10 DICDRO COC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CCCCC1 ZINC000775562362 1049167973 /nfs/dbraw/zinc/16/79/73/1049167973.db2.gz HZINDKQWPWAUMN-GXTWGEPZSA-N 1 0 307.409 4.019 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@]2(C)CC2(C)C)c(C(F)(F)F)c1 ZINC001179468436 1049169359 /nfs/dbraw/zinc/16/93/59/1049169359.db2.gz BNXOWUPCSTVASW-INIZCTEOSA-N 1 0 314.395 4.297 20 10 DICDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001179541343 1049179588 /nfs/dbraw/zinc/17/95/88/1049179588.db2.gz KMLSWXBKUKYMFP-GFCCVEGCSA-N 1 0 322.374 4.329 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(F)c(F)c(F)c1 ZINC001204531590 1049182541 /nfs/dbraw/zinc/18/25/41/1049182541.db2.gz XNFPQMSJTRXJCC-UHFFFAOYSA-N 1 0 322.374 4.192 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC001204543436 1049187767 /nfs/dbraw/zinc/18/77/67/1049187767.db2.gz QMISVHIBLJUJIX-UTKZUKDTSA-N 1 0 308.469 4.439 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@H]1CCC(C)(C)CO1 ZINC001179685155 1049192507 /nfs/dbraw/zinc/19/25/07/1049192507.db2.gz DYAISIOZQPMDPH-MRXNPFEDSA-N 1 0 314.473 4.172 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCO[C@H]2CC(C)C)c(O)c1C ZINC000775585824 1049192745 /nfs/dbraw/zinc/19/27/45/1049192745.db2.gz KGSHERRAFCFXGZ-JQHSSLGASA-N 1 0 305.462 4.253 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(Cl)nc2)cc1 ZINC000857757766 1049196385 /nfs/dbraw/zinc/19/63/85/1049196385.db2.gz STPXDCFBLSJGEA-UHFFFAOYSA-N 1 0 317.864 4.213 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCOC12CCCCC2 ZINC001179717085 1049198693 /nfs/dbraw/zinc/19/86/93/1049198693.db2.gz NIJIDCKSCAAFAE-LJQANCHMSA-N 1 0 312.457 4.068 20 10 DICDRO CCOc1ccc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001179722913 1049200528 /nfs/dbraw/zinc/20/05/28/1049200528.db2.gz ZKQGVZYCCXWTDE-UHFFFAOYSA-N 1 0 324.468 4.018 20 10 DICDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)CC)cc2)cc1 ZINC000773826130 1049206102 /nfs/dbraw/zinc/20/61/02/1049206102.db2.gz ZKPBERMXORTZSR-MRXNPFEDSA-N 1 0 312.457 4.392 20 10 DICDRO CC[N@H+](Cc1ccncc1)Cc1cc(-c2ccccc2)ccc1O ZINC000012243991 1049214701 /nfs/dbraw/zinc/21/47/01/1049214701.db2.gz YPWRFEGZLXQYIC-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C/C=C\c2ccc(F)c(F)c2)cc1 ZINC001179845586 1049215065 /nfs/dbraw/zinc/21/50/65/1049215065.db2.gz VHZAUUVHMKTYDO-PLNGDYQASA-N 1 0 316.395 4.176 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cc(C(F)(F)F)ccc2F)c1 ZINC000858237124 1049229080 /nfs/dbraw/zinc/22/90/80/1049229080.db2.gz GLINNAARUDTXJH-UHFFFAOYSA-N 1 0 313.294 4.148 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cc(C)c(OC(F)F)c(C)c2)c1 ZINC000858238164 1049229627 /nfs/dbraw/zinc/22/96/27/1049229627.db2.gz WQGDNUDMZVGOJB-UHFFFAOYSA-N 1 0 321.367 4.209 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cc(C)cc(Br)c2)c1 ZINC000858238957 1049229819 /nfs/dbraw/zinc/22/98/19/1049229819.db2.gz FVWVXKMOJHXODK-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO C[C@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1cc(F)ccc1O ZINC001179937556 1049233254 /nfs/dbraw/zinc/23/32/54/1049233254.db2.gz MRPHETOGFBDHAH-GFCCVEGCSA-N 1 0 307.796 4.248 20 10 DICDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2cccc(CC)c2O)C1(CC)CC ZINC001179953712 1049233753 /nfs/dbraw/zinc/23/37/53/1049233753.db2.gz YURSICGNNKKGEG-ZWKOTPCHSA-N 1 0 319.489 4.370 20 10 DICDRO C[C@H]([NH2+]CCCOC1CCCCC1)c1ccc(N(C)C)cc1 ZINC000195616019 1049241357 /nfs/dbraw/zinc/24/13/57/1049241357.db2.gz KYCNHGCRHWIQGZ-INIZCTEOSA-N 1 0 304.478 4.143 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCc3c(C)cccc3C2)c(Cl)c1 ZINC001204755839 1049254429 /nfs/dbraw/zinc/25/44/29/1049254429.db2.gz DXXPRHDOZITXSY-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1csc([C@H](C)[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)n1 ZINC000858426835 1049256162 /nfs/dbraw/zinc/25/61/62/1049256162.db2.gz UFMASLXOKZBGFI-HIFRSBDPSA-N 1 0 317.502 4.108 20 10 DICDRO CCc1cccc(C[N@@H+]2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c1O ZINC001180017481 1049257669 /nfs/dbraw/zinc/25/76/69/1049257669.db2.gz CLLYITPAXKJRSZ-KSSFIOAISA-N 1 0 313.416 4.472 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccc(N(C)C)cc2)nc1 ZINC000858489114 1049264655 /nfs/dbraw/zinc/26/46/55/1049264655.db2.gz TZPCVYUJBWNNEA-MRXNPFEDSA-N 1 0 311.473 4.084 20 10 DICDRO CC(C)CCO[C@H]1CC[C@H]([NH2+][C@H](C)c2ccccc2O)CC1 ZINC000858509300 1049267958 /nfs/dbraw/zinc/26/79/58/1049267958.db2.gz VPNCTFFBLBRNPK-BRWVUGGUSA-N 1 0 305.462 4.417 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c1 ZINC000858568676 1049275971 /nfs/dbraw/zinc/27/59/71/1049275971.db2.gz OWCYULHJVZMXKN-NSHDSACASA-N 1 0 317.351 4.174 20 10 DICDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001180141757 1049282974 /nfs/dbraw/zinc/28/29/74/1049282974.db2.gz ILBFVSRSHRAQBQ-ZWKOTPCHSA-N 1 0 306.519 4.167 20 10 DICDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cc(F)ccc2O)C12CCCCC2 ZINC001180099081 1049285864 /nfs/dbraw/zinc/28/58/64/1049285864.db2.gz SNEVWOXJNUFLGM-QZTJIDSGSA-N 1 0 321.436 4.091 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1C[C@H]2CCCC[C@@]21c1ccccc1 ZINC001180113635 1049289499 /nfs/dbraw/zinc/28/94/99/1049289499.db2.gz ZNKXCUMIMHETTM-YLJYHZDGSA-N 1 0 311.400 4.433 20 10 DICDRO COc1ccc(N(Cc2ccccc2)CC2CC[NH+](C)CC2)cc1 ZINC001204929713 1049312420 /nfs/dbraw/zinc/31/24/20/1049312420.db2.gz AGWKVQFSDRTHOA-UHFFFAOYSA-N 1 0 324.468 4.044 20 10 DICDRO CC(C)[C@@H]1CC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001204976707 1049328828 /nfs/dbraw/zinc/32/88/28/1049328828.db2.gz QZDXNIWSSLHVGD-IBGZPJMESA-N 1 0 311.425 4.202 20 10 DICDRO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2cc(C(C)C)ccc2O)CCO1 ZINC001180326687 1049344551 /nfs/dbraw/zinc/34/45/51/1049344551.db2.gz OUMRUHNQRFXFAI-ZWKOTPCHSA-N 1 0 305.462 4.199 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@]2(C)CCCS2)cc1 ZINC001205023648 1049346304 /nfs/dbraw/zinc/34/63/04/1049346304.db2.gz FZBATZADOZONBI-GOSISDBHSA-N 1 0 306.519 4.250 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)cc1F ZINC001205081787 1049368639 /nfs/dbraw/zinc/36/86/39/1049368639.db2.gz KVZXPLLEJZNKAV-KGLIPLIRSA-N 1 0 308.416 4.043 20 10 DICDRO CC(C)CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC001205101320 1049378436 /nfs/dbraw/zinc/37/84/36/1049378436.db2.gz PYKSNMNIHCGNJU-GOSISDBHSA-N 1 0 305.462 4.200 20 10 DICDRO Cc1ccc([C@@H]2CC[N@H+](Cc3ccc(Cl)cc3O)C2)cc1 ZINC001180819815 1049409628 /nfs/dbraw/zinc/40/96/28/1049409628.db2.gz KZFKOYAGADTHLP-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2ccc(C3CCC3)cc2)c1O ZINC001180884611 1049409908 /nfs/dbraw/zinc/40/99/08/1049409908.db2.gz MGPUOISJVSOWER-UHFFFAOYSA-N 1 0 311.425 4.267 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cc1Cl ZINC001205292024 1049429592 /nfs/dbraw/zinc/42/95/92/1049429592.db2.gz VKZCSZAZYUCAGU-SJKOYZFVSA-N 1 0 316.832 4.332 20 10 DICDRO CN(C)c1cc(F)c(C[N@H+](CC2CC2)CC2CCC2)cc1F ZINC001181206542 1049450195 /nfs/dbraw/zinc/45/01/95/1049450195.db2.gz VAGIFWBTJFOSFF-UHFFFAOYSA-N 1 0 308.416 4.043 20 10 DICDRO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1c(C)cc(OC)cc1O ZINC001205423418 1049466914 /nfs/dbraw/zinc/46/69/14/1049466914.db2.gz QEPAAQFHRALDKR-UHFFFAOYSA-N 1 0 324.424 4.213 20 10 DICDRO CCCCO[C@@H]1C[C@H](N(CCC)c2ccc(C[NH3+])cc2)C1(C)C ZINC001181457071 1049479293 /nfs/dbraw/zinc/47/92/93/1049479293.db2.gz NRZJUKWOOIOQTR-RBUKOAKNSA-N 1 0 318.505 4.346 20 10 DICDRO CO[C@H](C)[C@H](C)[NH2+]Cc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 ZINC001205531080 1049492863 /nfs/dbraw/zinc/49/28/63/1049492863.db2.gz WKNSYQHJPNEWAL-QLFBSQMISA-N 1 0 324.896 4.089 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCC[C@H](c3ncccc3C)C2)c1 ZINC000862478766 1049496260 /nfs/dbraw/zinc/49/62/60/1049496260.db2.gz PSYYZBHHYNXSTO-FUHWJXTLSA-N 1 0 310.441 4.220 20 10 DICDRO CC1=CCC[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC001205548336 1049496839 /nfs/dbraw/zinc/49/68/39/1049496839.db2.gz UIHUDRMKHWOVLZ-UHFFFAOYSA-N 1 0 318.464 4.401 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccccc2Cl)c1 ZINC000775648282 1049500350 /nfs/dbraw/zinc/50/03/50/1049500350.db2.gz CUSUORRPKQDKLA-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)s1)Cc1cc(OC)ccc1O ZINC000775647626 1049512867 /nfs/dbraw/zinc/51/28/67/1049512867.db2.gz ZRZGHMZEPAGCJB-UHFFFAOYSA-N 1 0 311.834 4.138 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1)Cc1cc(OC)ccc1O ZINC000775650504 1049520743 /nfs/dbraw/zinc/52/07/43/1049520743.db2.gz DZEBXRVNRVLEQQ-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC001205655774 1049522173 /nfs/dbraw/zinc/52/21/73/1049522173.db2.gz BETWCEGKGHIMEE-DLBZAZTESA-N 1 0 306.519 4.282 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CS[C@H](C(C)(C)C)C1 ZINC001205655776 1049523744 /nfs/dbraw/zinc/52/37/44/1049523744.db2.gz BETWCEGKGHIMEE-IRXDYDNUSA-N 1 0 306.519 4.282 20 10 DICDRO C[C@@H](C1CC1)[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001181827745 1049527398 /nfs/dbraw/zinc/52/73/98/1049527398.db2.gz OLVAOQHTNNDOBT-NSHDSACASA-N 1 0 300.368 4.002 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H]([C@H]3CCCC3(C)C)C2)cc1 ZINC001195427368 1049532422 /nfs/dbraw/zinc/53/24/22/1049532422.db2.gz RPIWOTJVDSDCLJ-IEBWSBKVSA-N 1 0 300.490 4.401 20 10 DICDRO COc1cc(C)ccc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001205708828 1049540346 /nfs/dbraw/zinc/54/03/46/1049540346.db2.gz KRBIPRAQCKEGAF-UHFFFAOYSA-N 1 0 324.468 4.236 20 10 DICDRO Cc1ccc(C[NH2+]CCCc2c[nH]c3ccc(F)cc23)c(O)c1 ZINC001205782110 1049562823 /nfs/dbraw/zinc/56/28/23/1049562823.db2.gz YLLHAGRBYFHEIN-UHFFFAOYSA-N 1 0 312.388 4.043 20 10 DICDRO CCCN(CC[NH+]1CCCCCC1)Cc1ccc(Cl)cc1O ZINC001182141506 1049578489 /nfs/dbraw/zinc/57/84/89/1049578489.db2.gz VBYRXFGOGMBKLP-UHFFFAOYSA-N 1 0 324.896 4.134 20 10 DICDRO Cc1ccc(C[NH2+]Cc2nc(-c3ccccc3)cs2)c(O)c1 ZINC001182161956 1049579528 /nfs/dbraw/zinc/57/95/28/1049579528.db2.gz VFMGIKBGIWKALB-UHFFFAOYSA-N 1 0 310.422 4.114 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC000119590751 1049589454 /nfs/dbraw/zinc/58/94/54/1049589454.db2.gz YTWDBKBHBSONRB-GOSISDBHSA-N 1 0 304.384 4.272 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@@H](C)C2CCCC2)c1O ZINC001182310483 1049617535 /nfs/dbraw/zinc/61/75/35/1049617535.db2.gz ZMWCYNMCQPVPHE-NSHDSACASA-N 1 0 312.251 4.131 20 10 DICDRO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001206016232 1049629383 /nfs/dbraw/zinc/62/93/83/1049629383.db2.gz OYTOXYVSZDATLH-LSDHHAIUSA-N 1 0 300.471 4.225 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccccc2O)C2CCCC2)c1O ZINC000775690007 1049630742 /nfs/dbraw/zinc/63/07/42/1049630742.db2.gz AGMJGTBAKIKZBO-UHFFFAOYSA-N 1 0 311.425 4.351 20 10 DICDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)Cc2ccc(Cl)cc2)c1 ZINC000775705271 1049634891 /nfs/dbraw/zinc/63/48/91/1049634891.db2.gz IEHJMQCLCXRYAY-ZDUSSCGKSA-N 1 0 319.832 4.117 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)c1 ZINC000775706990 1049639211 /nfs/dbraw/zinc/63/92/11/1049639211.db2.gz SXVJNYXHFMIRQH-SCLBCKFNSA-N 1 0 315.388 4.123 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccc(N(C)C)cc1 ZINC000119880639 1049645088 /nfs/dbraw/zinc/64/50/88/1049645088.db2.gz DJEPRBIQWSXLGE-HXUWFJFHSA-N 1 0 311.473 4.060 20 10 DICDRO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000794660069 1049653502 /nfs/dbraw/zinc/65/35/02/1049653502.db2.gz NDCMMRZNLCBBBW-XHDPSFHLSA-N 1 0 313.363 4.044 20 10 DICDRO Oc1ccc2oc3c(c2c1C[NH+]1CCC(F)(F)CC1)CCCC3 ZINC000794685337 1049654792 /nfs/dbraw/zinc/65/47/92/1049654792.db2.gz GLQWZPUKKWRGQU-UHFFFAOYSA-N 1 0 321.367 4.248 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](c2cccnc2)C(C)C)cc1 ZINC000774391572 1049657090 /nfs/dbraw/zinc/65/70/90/1049657090.db2.gz IRTNYEQRZGOWTI-FQEVSTJZSA-N 1 0 311.473 4.415 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)c1 ZINC000775722828 1049665365 /nfs/dbraw/zinc/66/53/65/1049665365.db2.gz DMJDLPYGFGRSRA-SFHVURJKSA-N 1 0 315.388 4.267 20 10 DICDRO CC[C@H]([NH2+]CCOc1ccc(F)cc1F)c1ccc(C)cc1O ZINC000794800699 1049697143 /nfs/dbraw/zinc/69/71/43/1049697143.db2.gz FVRPFJALQOTNJZ-INIZCTEOSA-N 1 0 321.367 4.099 20 10 DICDRO CC[C@@H]([NH2+]CCCn1cnc2ccccc21)c1ccc(C)cc1O ZINC000794794290 1049698212 /nfs/dbraw/zinc/69/82/12/1049698212.db2.gz QTSFWSCUMXLVRS-QGZVFWFLSA-N 1 0 323.440 4.181 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(C)cc1O ZINC000794802301 1049698350 /nfs/dbraw/zinc/69/83/50/1049698350.db2.gz DKTSABYRLQMWFD-QGZVFWFLSA-N 1 0 316.420 4.147 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(C)cc1O ZINC000794802297 1049698705 /nfs/dbraw/zinc/69/87/05/1049698705.db2.gz DKTSABYRLQMWFD-KRWDZBQOSA-N 1 0 316.420 4.147 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1ccc(C(F)F)c(F)c1 ZINC001182685290 1049700164 /nfs/dbraw/zinc/70/01/64/1049700164.db2.gz QCMPLLPAKYCQFZ-UHFFFAOYSA-N 1 0 315.722 4.412 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)ccc1N(C)C ZINC001196898470 1049703021 /nfs/dbraw/zinc/70/30/21/1049703021.db2.gz FFYNXIOKTXKUCV-WOJBJXKFSA-N 1 0 308.469 4.487 20 10 DICDRO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccccc3O)cs2)o1 ZINC001197004199 1049712710 /nfs/dbraw/zinc/71/27/10/1049712710.db2.gz PRLXVPVWKODSOD-LBPRGKRZSA-N 1 0 314.410 4.268 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCC2(CCCCCC2)O1)c1ccccc1O ZINC001197013022 1049714732 /nfs/dbraw/zinc/71/47/32/1049714732.db2.gz LEGJFEXCJVCXRU-JKSUJKDBSA-N 1 0 303.446 4.315 20 10 DICDRO CCCCC[C@@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206385529 1049724211 /nfs/dbraw/zinc/72/42/11/1049724211.db2.gz WFDIUSIBMNZGRZ-IAGOWNOFSA-N 1 0 304.478 4.080 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C2CCC2)C2CCCC2)c1O ZINC001206408609 1049728442 /nfs/dbraw/zinc/72/84/42/1049728442.db2.gz CXRAHGJLUAQFDR-SFHVURJKSA-N 1 0 303.446 4.158 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H](C2CCC2)C2CCCC2)c1O ZINC001206408608 1049728768 /nfs/dbraw/zinc/72/87/68/1049728768.db2.gz CXRAHGJLUAQFDR-GOSISDBHSA-N 1 0 303.446 4.158 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+]C[C@@H](C)C3CCCCC3)C2)cc1 ZINC001206645108 1049774771 /nfs/dbraw/zinc/77/47/71/1049774771.db2.gz LVVZUISHYKTZEW-SJLPKXTDSA-N 1 0 316.489 4.080 20 10 DICDRO CC[C@H](C)C[C@H](CC)[NH2+][C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206646218 1049774956 /nfs/dbraw/zinc/77/49/56/1049774956.db2.gz PYIGGKISXGSYFT-ULQDDVLXSA-N 1 0 304.478 4.078 20 10 DICDRO CCCCCC[C@H](C)[NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206645081 1049775103 /nfs/dbraw/zinc/77/51/03/1049775103.db2.gz LPHIFSKRALUZPT-DLBZAZTESA-N 1 0 304.478 4.222 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CC2(Cl)Cl)cc1Cl ZINC001206761794 1049793949 /nfs/dbraw/zinc/79/39/49/1049793949.db2.gz HLGFAEAHQHQKPG-JTQLQIEISA-N 1 0 308.636 4.028 20 10 DICDRO Cc1cc(CC[NH2+][C@@H](C)[C@@H]2CC2(F)F)c(C)n1-c1ccccc1 ZINC001207017069 1049820872 /nfs/dbraw/zinc/82/08/72/1049820872.db2.gz IBUZZFLUJPHGSG-KSSFIOAISA-N 1 0 318.411 4.270 20 10 DICDRO Cc1cc(C[NH2+]CCC[C@@H]2CCO2)c(C)n1-c1cccc(C)c1 ZINC001207094422 1049836147 /nfs/dbraw/zinc/83/61/47/1049836147.db2.gz REEMPPRTFJLAGI-HXUWFJFHSA-N 1 0 312.457 4.061 20 10 DICDRO CCC[N@H+](Cc1ccc(OC)cc1)Cc1cccc(CC)c1O ZINC001207130136 1049841042 /nfs/dbraw/zinc/84/10/42/1049841042.db2.gz XCWAGZNICBADJE-UHFFFAOYSA-N 1 0 313.441 4.375 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)c1ccnnc1 ZINC000924854908 1049845968 /nfs/dbraw/zinc/84/59/68/1049845968.db2.gz NVDQAGMFLQVTMA-MRXNPFEDSA-N 1 0 324.472 4.096 20 10 DICDRO Oc1cccc2c1C[N@H+](C[C@@H]1C[C@H]1c1ccc(Cl)cc1)CC2 ZINC001207189306 1049855856 /nfs/dbraw/zinc/85/58/56/1049855856.db2.gz AIKMZMWNIIOXCD-RDJZCZTQSA-N 1 0 313.828 4.207 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@](F)(c3ccccc3)C2)c1O ZINC001207209882 1049861737 /nfs/dbraw/zinc/86/17/37/1049861737.db2.gz SGCOCGZHGWBJPS-FQEVSTJZSA-N 1 0 313.416 4.415 20 10 DICDRO CC[N@H+](CC[C@H](C)CCCC(C)(C)O)Cc1ccccc1O ZINC001207678459 1049925811 /nfs/dbraw/zinc/92/58/11/1049925811.db2.gz MFRDAPOHCKKGPA-MRXNPFEDSA-N 1 0 307.478 4.182 20 10 DICDRO C[C@@H](CCCC(C)(C)O)CC[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001207683283 1049927571 /nfs/dbraw/zinc/92/75/71/1049927571.db2.gz OZLNZIVMZUXFLY-KRWDZBQOSA-N 1 0 320.521 4.152 20 10 DICDRO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC001207748665 1049934161 /nfs/dbraw/zinc/93/41/61/1049934161.db2.gz NOGRNQYZDXXTMI-SQGPQFPESA-N 1 0 319.537 4.160 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@@H]2Cc2ccccc2)cc1Cl ZINC001207806263 1049941665 /nfs/dbraw/zinc/94/16/65/1049941665.db2.gz SAJGURDHBHHKQE-HOTGVXAUSA-N 1 0 315.844 4.322 20 10 DICDRO CC[N@H+](CCCc1ccc(C)o1)Cc1ccc(N(C)C)cc1 ZINC001207949906 1049963804 /nfs/dbraw/zinc/96/38/04/1049963804.db2.gz KJKHUMNCGKMDRH-UHFFFAOYSA-N 1 0 300.446 4.109 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCC[C@H]2OCC[C@H]21 ZINC000760712184 1050004939 /nfs/dbraw/zinc/00/49/39/1050004939.db2.gz CSOMZRWJYWDDPG-QKNQBKEWSA-N 1 0 323.436 4.106 20 10 DICDRO CC[C@H]([NH2+]CCc1csc(C(C)(C)C)n1)c1ccccc1O ZINC000156985279 1050035682 /nfs/dbraw/zinc/03/56/82/1050035682.db2.gz GIVPEKOUXDRFKD-HNNXBMFYSA-N 1 0 318.486 4.430 20 10 DICDRO CCOC1CC[NH+](Cc2ccc(-n3c(C)ccc3C)cc2)CC1 ZINC001209517354 1050066386 /nfs/dbraw/zinc/06/63/86/1050066386.db2.gz GAVBAADEUYGJOA-UHFFFAOYSA-N 1 0 312.457 4.095 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[NH+]2CC(c3cccnc3)C2)cc1 ZINC001209519676 1050066438 /nfs/dbraw/zinc/06/64/38/1050066438.db2.gz DQSYTBPTABEAAR-UHFFFAOYSA-N 1 0 317.436 4.089 20 10 DICDRO c1cc(Nc2ccc3c(c2)OCCN3)ccc1C[NH+]1CCCCC1 ZINC001209728231 1050078824 /nfs/dbraw/zinc/07/88/24/1050078824.db2.gz NUDAMZMMEVHIAH-UHFFFAOYSA-N 1 0 323.440 4.220 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)cc1C ZINC000823753516 1050152662 /nfs/dbraw/zinc/15/26/62/1050152662.db2.gz WTVPCQCNMAPOFO-AWEZNQCLSA-N 1 0 321.342 4.198 20 10 DICDRO Cc1nc([C@H](C)[NH2+]CCCSc2nccs2)c(C)s1 ZINC000772875935 1050153029 /nfs/dbraw/zinc/15/30/29/1050153029.db2.gz CXEGEHCJPRUOBD-VIFPVBQESA-N 1 0 313.517 4.049 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000770511038 1050162635 /nfs/dbraw/zinc/16/26/35/1050162635.db2.gz WKALZBYSZPKDBA-UHFFFAOYSA-N 1 0 324.399 4.392 20 10 DICDRO CCC[N@H+](Cc1nn(CC)c2ccccc12)Cc1ccccc1O ZINC000770630263 1050182504 /nfs/dbraw/zinc/18/25/04/1050182504.db2.gz DBNALSQOPIHMAO-UHFFFAOYSA-N 1 0 323.440 4.174 20 10 DICDRO COc1cccc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)c1O ZINC000378879474 1050192503 /nfs/dbraw/zinc/19/25/03/1050192503.db2.gz FDDJVNXDELOUHW-QGZVFWFLSA-N 1 0 303.377 4.027 20 10 DICDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000770750117 1050192906 /nfs/dbraw/zinc/19/29/06/1050192906.db2.gz ZNHIBSRRMQGMRJ-QGZVFWFLSA-N 1 0 309.457 4.231 20 10 DICDRO Oc1ccccc1C[NH2+]C1(c2ccc(OC(F)(F)F)cc2)CC1 ZINC000824522557 1050216891 /nfs/dbraw/zinc/21/68/91/1050216891.db2.gz WPSOQPXQZOMOQW-UHFFFAOYSA-N 1 0 323.314 4.070 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1 ZINC000824548583 1050223410 /nfs/dbraw/zinc/22/34/10/1050223410.db2.gz JWUFAHRJMILHNV-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CCCCO)c1ccc(C(F)(F)F)cc1O ZINC000824653980 1050229271 /nfs/dbraw/zinc/22/92/71/1050229271.db2.gz KBFHDCZKEFLIRS-BXUZGUMPSA-N 1 0 319.367 4.003 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2CCCC[C@H]2CC(F)(F)F)c1 ZINC000824653714 1050230916 /nfs/dbraw/zinc/23/09/16/1050230916.db2.gz GITKAXWFADBUOF-JSGCOSHPSA-N 1 0 301.352 4.301 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c(C)n1 ZINC000771381689 1050242188 /nfs/dbraw/zinc/24/21/88/1050242188.db2.gz GSENXNRZJCXVMO-MRXNPFEDSA-N 1 0 309.457 4.149 20 10 DICDRO CC[C@H]([NH2+]CC[C@@]1(C)CC1(Cl)Cl)c1ccccc1O ZINC000824976563 1050263850 /nfs/dbraw/zinc/26/38/50/1050263850.db2.gz BZLJEUVSVQAVJI-JSGCOSHPSA-N 1 0 302.245 4.407 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)cc1F ZINC000825063417 1050270524 /nfs/dbraw/zinc/27/05/24/1050270524.db2.gz DAGUNISMLDIEKP-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000734476362 1050277105 /nfs/dbraw/zinc/27/71/05/1050277105.db2.gz FNCYEDWZNDFPTC-HNAYVOBHSA-N 1 0 307.437 4.259 20 10 DICDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000734476363 1050277501 /nfs/dbraw/zinc/27/75/01/1050277501.db2.gz FNCYEDWZNDFPTC-KXBFYZLASA-N 1 0 307.437 4.259 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)cc1 ZINC000825137527 1050278852 /nfs/dbraw/zinc/27/88/52/1050278852.db2.gz BBNPCKXVFNLQEY-UHFFFAOYSA-N 1 0 305.805 4.043 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOc3c(C)cccc32)cc1Cl ZINC000825178668 1050282167 /nfs/dbraw/zinc/28/21/67/1050282167.db2.gz NTVNIYSIWQMSDI-MRXNPFEDSA-N 1 0 317.816 4.276 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825282948 1050289767 /nfs/dbraw/zinc/28/97/67/1050289767.db2.gz CDRLOZAYQFVHBR-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CSc3ccccc32)cc1Cl ZINC000825292031 1050290762 /nfs/dbraw/zinc/29/07/62/1050290762.db2.gz STWUBIZOOMUDEA-AWEZNQCLSA-N 1 0 305.830 4.291 20 10 DICDRO Cc1cnc([C@H]([NH2+]Cc2cc(Cl)c(C)cc2O)C2CC2)s1 ZINC000825310499 1050295178 /nfs/dbraw/zinc/29/51/78/1050295178.db2.gz XCUUASDODSFSNI-OAHLLOKOSA-N 1 0 322.861 4.360 20 10 DICDRO Cc1cnc([C@@H]([NH2+]Cc2cc(Cl)c(C)cc2O)C2CC2)s1 ZINC000825310498 1050296565 /nfs/dbraw/zinc/29/65/65/1050296565.db2.gz XCUUASDODSFSNI-HNNXBMFYSA-N 1 0 322.861 4.360 20 10 DICDRO CCOc1ccc(C[N@H+](Cc2ccc(F)cc2)C2CC2)c(O)c1 ZINC000771935377 1050301337 /nfs/dbraw/zinc/30/13/37/1050301337.db2.gz QEQJRIPSARCFIA-UHFFFAOYSA-N 1 0 315.388 4.095 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@H](CC(C)C)C2)cc1Cl ZINC000825412641 1050304850 /nfs/dbraw/zinc/30/48/50/1050304850.db2.gz KXDVSNVEHXNPEC-LSDHHAIUSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)cc1Cl ZINC000825412456 1050305124 /nfs/dbraw/zinc/30/51/24/1050305124.db2.gz KXDVSNVEHXNPEC-HUUCEWRRSA-N 1 0 311.853 4.037 20 10 DICDRO CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]Cc1cc(C)ccc1O ZINC000734850130 1050327439 /nfs/dbraw/zinc/32/74/39/1050327439.db2.gz QMOIUJOSOPFDKL-KRWDZBQOSA-N 1 0 303.833 4.465 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)ccc2F)cc1 ZINC000735084800 1050344609 /nfs/dbraw/zinc/34/46/09/1050344609.db2.gz UOUDPZSQGDENPZ-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO CCOc1c(F)cc(C[N@H+](C)Cc2ccccc2O)cc1Cl ZINC001143745225 1050350652 /nfs/dbraw/zinc/35/06/52/1050350652.db2.gz QCUVGCLRDZRMOV-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H]2CCc3cc(Cl)ccc3C2)c(O)c1 ZINC001171108929 1050359062 /nfs/dbraw/zinc/35/90/62/1050359062.db2.gz JFJUGLPBAGPBRH-QGZVFWFLSA-N 1 0 315.844 4.310 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(C)ccc1OC ZINC000772448518 1050359579 /nfs/dbraw/zinc/35/95/79/1050359579.db2.gz PFBUIQCMUXABBH-SFHVURJKSA-N 1 0 311.425 4.179 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CCc3cc(Cl)ccc3C2)c1O ZINC001171110776 1050373616 /nfs/dbraw/zinc/37/36/16/1050373616.db2.gz OKSVFUWLEOGWGU-KRWDZBQOSA-N 1 0 301.817 4.001 20 10 DICDRO COC[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)c1ccc(Cl)cc1 ZINC000785543406 1050386621 /nfs/dbraw/zinc/38/66/21/1050386621.db2.gz DPPSQSXDGOKQQK-QGZVFWFLSA-N 1 0 319.832 4.134 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H]3CCC[C@@H](C)CC3)CC2)cc1 ZINC000785570427 1050395552 /nfs/dbraw/zinc/39/55/52/1050395552.db2.gz QZZAIUSCPHYMMN-SJORKVTESA-N 1 0 316.489 4.222 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2cc3ccccc3o2)c(O)c1 ZINC000786160623 1050454364 /nfs/dbraw/zinc/45/43/64/1050454364.db2.gz NNRABBASHKVUAJ-ZDUSSCGKSA-N 1 0 311.381 4.388 20 10 DICDRO CCC(CC)[C@H]1C[C@@H]([NH2+][C@@H](CC)c2ccccc2O)CCO1 ZINC000157892108 1050478495 /nfs/dbraw/zinc/47/84/95/1050478495.db2.gz NXVUERJNASUOCC-VDZJLULYSA-N 1 0 305.462 4.417 20 10 DICDRO Oc1ccc2ccccc2c1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000844724738 1050487758 /nfs/dbraw/zinc/48/77/58/1050487758.db2.gz CCYLZYOETYHLMU-UHFFFAOYSA-N 1 0 303.352 4.167 20 10 DICDRO CO[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000786576465 1050498852 /nfs/dbraw/zinc/49/88/52/1050498852.db2.gz UVNVINYQIHGRHP-GVDBMIGSSA-N 1 0 304.478 4.141 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1C[NH2+]C)c1cccc(Cl)c1[O-] ZINC000844926392 1050521830 /nfs/dbraw/zinc/52/18/30/1050521830.db2.gz ZFWVYFZRFUYRPU-KRWDZBQOSA-N 1 0 318.848 4.006 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000168203555 1050530856 /nfs/dbraw/zinc/53/08/56/1050530856.db2.gz GFJSLUDEBWVTMB-PXAZEXFGSA-N 1 0 301.434 4.159 20 10 DICDRO CCCC(O)(CCC)C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000738438762 1050535997 /nfs/dbraw/zinc/53/59/97/1050535997.db2.gz CMOGGHNFGDMDSG-UHFFFAOYSA-N 1 0 318.505 4.098 20 10 DICDRO Cc1ccc([C@@H](C)C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000738436791 1050536403 /nfs/dbraw/zinc/53/64/03/1050536403.db2.gz ZCARNXRLLKJXTQ-HNNXBMFYSA-N 1 0 300.421 4.093 20 10 DICDRO C[C@H](CC1CC1)[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766237015 1050540950 /nfs/dbraw/zinc/54/09/50/1050540950.db2.gz GMYJDLDYYTVFHQ-UKRRQHHQSA-N 1 0 324.415 4.035 20 10 DICDRO CCCN(Cc1ccc2cnccc2c1)c1ccc(C[NH3+])cc1 ZINC000787289957 1050583599 /nfs/dbraw/zinc/58/35/99/1050583599.db2.gz NDIPHBCYDFQCND-UHFFFAOYSA-N 1 0 305.425 4.110 20 10 DICDRO COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cccc(C)c1O ZINC000787330040 1050587009 /nfs/dbraw/zinc/58/70/09/1050587009.db2.gz CBGNYAUSTFQRCF-KRWDZBQOSA-N 1 0 319.832 4.174 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC000739864231 1050590827 /nfs/dbraw/zinc/59/08/27/1050590827.db2.gz ZXOPMNKYKQMCBK-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2(c3ccccc3)CC2)cc1F ZINC000740006405 1050594508 /nfs/dbraw/zinc/59/45/08/1050594508.db2.gz MDYJUXRCRFODFP-UHFFFAOYSA-N 1 0 312.432 4.451 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)[C@@H]2CCC[C@H](C)C2)c1O ZINC001171190443 1050596189 /nfs/dbraw/zinc/59/61/89/1050596189.db2.gz SICVIBUEAIVRLC-SGMGOOAPSA-N 1 0 307.409 4.038 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)[C@H](C)CO ZINC000740898723 1050639848 /nfs/dbraw/zinc/63/98/48/1050639848.db2.gz WYBBKBSMNHUVHB-ZIAGYGMSSA-N 1 0 321.505 4.094 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2(c3ccccc3C)CCC2)c1 ZINC000845995165 1050648168 /nfs/dbraw/zinc/64/81/68/1050648168.db2.gz QHWPYUBQIPVWGO-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO COc1cccc(C[NH2+]C2(c3ccccc3Cl)CCC2)c1O ZINC000845994708 1050648961 /nfs/dbraw/zinc/64/89/61/1050648961.db2.gz JCZXUAGQDFQECB-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO CC[C@H]([NH2+]CCC[C@H]1CC1(Cl)Cl)c1ccccc1O ZINC000846109398 1050665161 /nfs/dbraw/zinc/66/51/61/1050665161.db2.gz ILCLLTWAKUGORZ-AAEUAGOBSA-N 1 0 302.245 4.407 20 10 DICDRO CS[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000227378114 1050665950 /nfs/dbraw/zinc/66/59/50/1050665950.db2.gz BKRBSQOTJVDHNJ-FUHWJXTLSA-N 1 0 304.503 4.051 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cccc2cc[nH]c21 ZINC001144717075 1050668443 /nfs/dbraw/zinc/66/84/43/1050668443.db2.gz ZIDDHACAGFEWTM-UHFFFAOYSA-N 1 0 319.452 4.400 20 10 DICDRO CCOCc1cc(C[NH2+]Cc2cccc(CC)c2)ccc1OC ZINC000846100133 1050670149 /nfs/dbraw/zinc/67/01/49/1050670149.db2.gz IMFYRIRPUGZADC-UHFFFAOYSA-N 1 0 313.441 4.084 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)ccc2ccccc21 ZINC000846104491 1050670334 /nfs/dbraw/zinc/67/03/34/1050670334.db2.gz IEJLVRDSWNGTNF-QGZVFWFLSA-N 1 0 303.352 4.167 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2oc3ccccc3c2C)c1O ZINC000846147389 1050672303 /nfs/dbraw/zinc/67/23/03/1050672303.db2.gz UNZNOKGUKUZFGL-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(F)c2)c1O ZINC000846149820 1050672646 /nfs/dbraw/zinc/67/26/46/1050672646.db2.gz MOHZNCFCVMLWHP-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2cccc(F)c2F)c1O ZINC000846157905 1050675285 /nfs/dbraw/zinc/67/52/85/1050675285.db2.gz PGIHBNCFQZSISJ-MNOVXSKESA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCc3sccc32)c1O ZINC000846163247 1050677999 /nfs/dbraw/zinc/67/79/99/1050677999.db2.gz GYYPVOWSXCVISN-RISCZKNCSA-N 1 0 303.427 4.191 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCc3sccc32)c1O ZINC000846163231 1050678512 /nfs/dbraw/zinc/67/85/12/1050678512.db2.gz GYYPVOWSXCVISN-BXUZGUMPSA-N 1 0 303.427 4.191 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2cccc(CSC)c2)c1O ZINC000846166198 1050678745 /nfs/dbraw/zinc/67/87/45/1050678745.db2.gz UCQCZRNHCUXLMP-CYBMUJFWSA-N 1 0 317.454 4.115 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C(F)F)cc2)c1O ZINC000846165798 1050679040 /nfs/dbraw/zinc/67/90/40/1050679040.db2.gz YLSKNZKNBWDXQM-NSHDSACASA-N 1 0 307.340 4.189 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1O ZINC000846168646 1050680433 /nfs/dbraw/zinc/68/04/33/1050680433.db2.gz BTTQLNIHGPHPML-CHWSQXEVSA-N 1 0 313.388 4.267 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C2(c3ccc(C)cc3)CCC2)c1O ZINC000846170635 1050680857 /nfs/dbraw/zinc/68/08/57/1050680857.db2.gz BJCKYWRBFWSZHE-HNNXBMFYSA-N 1 0 311.425 4.439 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCc3c(F)cccc32)c1O ZINC000846171768 1050681059 /nfs/dbraw/zinc/68/10/59/1050681059.db2.gz WDCRJWBHIIPAEN-PXAZEXFGSA-N 1 0 315.388 4.268 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(OC)c2O)cc1 ZINC000846136731 1050682152 /nfs/dbraw/zinc/68/21/52/1050682152.db2.gz OBCJRMANTAPGPW-KBPBESRZSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2cc(C)sc2C)c1O ZINC000846135438 1050682242 /nfs/dbraw/zinc/68/22/42/1050682242.db2.gz DLTZUEYACPMKOJ-NWDGAFQWSA-N 1 0 305.443 4.491 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)c1O ZINC000846137833 1050682358 /nfs/dbraw/zinc/68/23/58/1050682358.db2.gz REZIPUVBRAZTFZ-GHMZBOCLSA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C[C@H](C)c2ccc(F)cc2F)c1O ZINC000846145510 1050683843 /nfs/dbraw/zinc/68/38/43/1050683843.db2.gz LBADKYPHDZZWJE-RYUDHWBXSA-N 1 0 321.367 4.133 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccc(F)cc1F ZINC000846145281 1050685241 /nfs/dbraw/zinc/68/52/41/1050685241.db2.gz NQARCVVQGWBSDC-MEDUHNTESA-N 1 0 321.367 4.481 20 10 DICDRO COc1ccc(CCC[NH2+][C@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000788563709 1050703260 /nfs/dbraw/zinc/70/32/60/1050703260.db2.gz QYUJEMGVBQYXEU-MRXNPFEDSA-N 1 0 313.441 4.301 20 10 DICDRO COCc1cc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)ccc1F ZINC000788604653 1050714415 /nfs/dbraw/zinc/71/44/15/1050714415.db2.gz VFGOCSVLWGKEFR-AWEZNQCLSA-N 1 0 317.404 4.145 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)Oc2ccccc2F)c(O)c1 ZINC000788616137 1050716382 /nfs/dbraw/zinc/71/63/82/1050716382.db2.gz XJBYWOMKANTMID-LSDHHAIUSA-N 1 0 317.404 4.266 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000788618748 1050718678 /nfs/dbraw/zinc/71/86/78/1050718678.db2.gz AVVHKCQCDVIHHW-ROUUACIJSA-N 1 0 324.468 4.268 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C(C)C)[C@H](O)c2ccccc2)c1 ZINC000788624697 1050720732 /nfs/dbraw/zinc/72/07/32/1050720732.db2.gz CMYLLKQWHWMJLP-RYGJVYDSSA-N 1 0 313.441 4.109 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C(C)C)[C@@H](O)c2ccccc2)c1 ZINC000788624695 1050721378 /nfs/dbraw/zinc/72/13/78/1050721378.db2.gz CMYLLKQWHWMJLP-BEVDRBHNSA-N 1 0 313.441 4.109 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccn(C3CCCC3)n2)c(O)c1 ZINC000788672210 1050729969 /nfs/dbraw/zinc/72/99/69/1050729969.db2.gz PEYOOTAZWPUEPQ-OAHLLOKOSA-N 1 0 313.445 4.171 20 10 DICDRO C[C@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1ccc(N(C)C)cc1 ZINC000772951762 1050752901 /nfs/dbraw/zinc/75/29/01/1050752901.db2.gz YORFSRMPVRSMFB-HNNXBMFYSA-N 1 0 321.424 4.258 20 10 DICDRO CCOC[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)C(C)C ZINC000788971125 1050767222 /nfs/dbraw/zinc/76/72/22/1050767222.db2.gz IABFRNRCJNCMKK-LJQANCHMSA-N 1 0 313.441 4.210 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CCC(F)(F)CC1 ZINC000788987607 1050773605 /nfs/dbraw/zinc/77/36/05/1050773605.db2.gz MAKHITTYBUGTRW-GFCCVEGCSA-N 1 0 314.395 4.195 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000772961415 1050807842 /nfs/dbraw/zinc/80/78/42/1050807842.db2.gz QKLCWYUJXOMWDP-QRWLVFNGSA-N 1 0 324.468 4.489 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H](C)Sc2ccccc2)cc1C ZINC000742382640 1050826863 /nfs/dbraw/zinc/82/68/63/1050826863.db2.gz GZVXFCBLHAUVLF-OAHLLOKOSA-N 1 0 301.455 4.274 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)Sc1ccccc1 ZINC000742382830 1050827325 /nfs/dbraw/zinc/82/73/25/1050827325.db2.gz KHRICOBPCIJENV-CQSZACIVSA-N 1 0 318.461 4.162 20 10 DICDRO CS[C@H]1CC[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000742382792 1050827467 /nfs/dbraw/zinc/82/74/67/1050827467.db2.gz GHILSCUQVGJEIA-MSOLQXFVSA-N 1 0 313.466 4.433 20 10 DICDRO CS[C@@H]1CC[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000742382796 1050827912 /nfs/dbraw/zinc/82/79/12/1050827912.db2.gz GHILSCUQVGJEIA-ZWKOTPCHSA-N 1 0 313.466 4.433 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)Sc1ccccc1 ZINC000742382826 1050828370 /nfs/dbraw/zinc/82/83/70/1050828370.db2.gz KHRICOBPCIJENV-AWEZNQCLSA-N 1 0 318.461 4.162 20 10 DICDRO Cc1cccc2c(CC[NH2+]Cc3c(O)cccc3Cl)c[nH]c21 ZINC000742373636 1050835871 /nfs/dbraw/zinc/83/58/71/1050835871.db2.gz QLODTFMXLUDUPI-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cc1C ZINC000789480338 1050836326 /nfs/dbraw/zinc/83/63/26/1050836326.db2.gz MFJOEWBKLVSHLP-LSDHHAIUSA-N 1 0 314.256 4.025 20 10 DICDRO COc1ccc([C@@H](C)CC[NH2+]Cc2ccc(OC)c(C)c2)cc1 ZINC000742374285 1050836721 /nfs/dbraw/zinc/83/67/21/1050836721.db2.gz UVUINXLPARNBLV-HNNXBMFYSA-N 1 0 313.441 4.296 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2c(C)cccc2F)cc1 ZINC000742380216 1050836873 /nfs/dbraw/zinc/83/68/73/1050836873.db2.gz KHCBVHGHNAYHBC-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H](C)Oc2ccccc2Cl)cc1C ZINC000742379084 1050836950 /nfs/dbraw/zinc/83/69/50/1050836950.db2.gz MAWHEGLHLYIIDQ-CQSZACIVSA-N 1 0 319.832 4.214 20 10 DICDRO COc1cccc(C[NH2+]C2CC(c3cccc(Cl)c3)C2)c1O ZINC000742377058 1050836973 /nfs/dbraw/zinc/83/69/73/1050836973.db2.gz GNKOMBXBNWFFBF-UHFFFAOYSA-N 1 0 317.816 4.090 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](CC2CC2)c2ccccc2)c1 ZINC000742377434 1050838440 /nfs/dbraw/zinc/83/84/40/1050838440.db2.gz CSSFOQVGSZHUNU-LJQANCHMSA-N 1 0 311.425 4.422 20 10 DICDRO COc1cccc(C[C@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000772977366 1050841108 /nfs/dbraw/zinc/84/11/08/1050841108.db2.gz MRKMBVRFXXPIPG-JKSUJKDBSA-N 1 0 312.457 4.043 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000789514325 1050843607 /nfs/dbraw/zinc/84/36/07/1050843607.db2.gz PRSWTFYRMPNLRH-MSOLQXFVSA-N 1 0 317.473 4.142 20 10 DICDRO Oc1cc2c(cc1C[NH+]1CCC(CC(F)(F)F)CC1)CCC2 ZINC000789528307 1050844224 /nfs/dbraw/zinc/84/42/24/1050844224.db2.gz QGCBCQYLIGBBEI-UHFFFAOYSA-N 1 0 313.363 4.045 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000789546100 1050845719 /nfs/dbraw/zinc/84/57/19/1050845719.db2.gz OQZVCWJYAGDPJC-UHFFFAOYSA-N 1 0 316.404 4.230 20 10 DICDRO CC[N@H+](Cc1cc2ccccc2[nH]1)Cc1ccc(N(C)C)cc1 ZINC000789723490 1050877591 /nfs/dbraw/zinc/87/75/91/1050877591.db2.gz QNMCHKYXZLYJHU-UHFFFAOYSA-N 1 0 307.441 4.256 20 10 DICDRO CC[N@H+](Cc1c(O)ccc2ccc(OC)cc21)[C@H](C)C(C)C ZINC000742556209 1050888017 /nfs/dbraw/zinc/88/80/17/1050888017.db2.gz DHZZDNDLWVKHNE-CQSZACIVSA-N 1 0 301.430 4.420 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C)cc(Cl)n1)c1ccc(N(C)C)cc1 ZINC000282712873 1050986779 /nfs/dbraw/zinc/98/67/79/1050986779.db2.gz LNRIAPVFDHYHQR-QGZVFWFLSA-N 1 0 317.864 4.350 20 10 DICDRO Cc1c(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cccc1[N+](=O)[O-] ZINC000790697273 1050987204 /nfs/dbraw/zinc/98/72/04/1050987204.db2.gz XYOMJFULHYPWLP-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO C[C@@H]([NH2+]CCCC1CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000773001766 1051016536 /nfs/dbraw/zinc/01/65/36/1051016536.db2.gz PSHJJBIZYSRFRS-CQSZACIVSA-N 1 0 322.880 4.017 20 10 DICDRO CC(C)[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCS1 ZINC000743394880 1051023007 /nfs/dbraw/zinc/02/30/07/1051023007.db2.gz DBJIIKKNPNBQDW-SFHVURJKSA-N 1 0 301.455 4.119 20 10 DICDRO CC[C@H](C)C[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000773022847 1051027132 /nfs/dbraw/zinc/02/71/32/1051027132.db2.gz FFAGLOOZLSHWSZ-HRCADAONSA-N 1 0 322.468 4.138 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCCO[C@@H]2C(C)C)cc1 ZINC000773048585 1051039539 /nfs/dbraw/zinc/03/95/39/1051039539.db2.gz RLGBJQLOJMSWFQ-ILZDJORESA-N 1 0 318.505 4.245 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2COc3ccc(C)cc32)cc1 ZINC000773060741 1051045624 /nfs/dbraw/zinc/04/56/24/1051045624.db2.gz RYZVWOSPKOCHER-HNAYVOBHSA-N 1 0 310.441 4.235 20 10 DICDRO C[C@@H]([NH2+][C@H](CO)CC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000773075316 1051051682 /nfs/dbraw/zinc/05/16/82/1051051682.db2.gz IRQIBHGQFSESNJ-AEFFLSMTSA-N 1 0 318.505 4.125 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccc(N(C)C)cc1 ZINC000773082807 1051056898 /nfs/dbraw/zinc/05/68/98/1051056898.db2.gz WTGOVTNLLZLQND-FQEVSTJZSA-N 1 0 310.441 4.024 20 10 DICDRO CC[C@H]([NH2+]CCC[C@@H]1CCCC[C@H]1O)c1ccc(N(C)C)cc1 ZINC000773081904 1051056921 /nfs/dbraw/zinc/05/69/21/1051056921.db2.gz SJBWMTTWGSMDKO-YSIASYRMSA-N 1 0 318.505 4.125 20 10 DICDRO CS[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000773090881 1051060081 /nfs/dbraw/zinc/06/00/81/1051060081.db2.gz HBXAKIKEZGBMCC-KBPBESRZSA-N 1 0 310.482 4.218 20 10 DICDRO C[C@@H]([NH2+]CCC[C@H](C)CO)c1ccc(N2CCCCCC2)cc1 ZINC000773114843 1051067384 /nfs/dbraw/zinc/06/73/84/1051067384.db2.gz KTSCZRMVCMPZPF-ZWKOTPCHSA-N 1 0 318.505 4.126 20 10 DICDRO CC[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000773119387 1051069999 /nfs/dbraw/zinc/06/99/99/1051069999.db2.gz OUGAOEBXKNSIDO-WOJBJXKFSA-N 1 0 309.457 4.340 20 10 DICDRO COc1ccc(N2CCC[N@@H+]([C@@H](C)c3cccc(C)c3)CC2)cc1 ZINC000743843586 1051070011 /nfs/dbraw/zinc/07/00/11/1051070011.db2.gz YVBAAKIFVSLLLQ-SFHVURJKSA-N 1 0 324.468 4.277 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1ccc(N(C)C)cc1 ZINC000773128972 1051071309 /nfs/dbraw/zinc/07/13/09/1051071309.db2.gz JARNNEZVYVRFOB-YTQUADARSA-N 1 0 318.505 4.387 20 10 DICDRO CN(C)c1ccccc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000743847740 1051071645 /nfs/dbraw/zinc/07/16/45/1051071645.db2.gz IBJWTJPYQIBUDB-UHFFFAOYSA-N 1 0 324.468 4.403 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)cc1 ZINC000773127767 1051073251 /nfs/dbraw/zinc/07/32/51/1051073251.db2.gz AQPKIEVBDYGGNR-VDZJLULYSA-N 1 0 318.505 4.387 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)cc1 ZINC000773127768 1051073645 /nfs/dbraw/zinc/07/36/45/1051073645.db2.gz AQPKIEVBDYGGNR-WDYCEAGBSA-N 1 0 318.505 4.387 20 10 DICDRO CCCNc1cc(C)[nH+]c(NCc2cc3ccccc3cc2O)n1 ZINC001171398422 1051085952 /nfs/dbraw/zinc/08/59/52/1051085952.db2.gz UMKFIOVSCIRZJS-UHFFFAOYSA-N 1 0 322.412 4.078 20 10 DICDRO C[C@@H]([NH2+]CCN(C)C1CCCC1)c1ccc2ccccc2c1O ZINC000390982153 1051088548 /nfs/dbraw/zinc/08/85/48/1051088548.db2.gz IVKUWHKKURHDAL-OAHLLOKOSA-N 1 0 312.457 4.070 20 10 DICDRO C[C@@H]([NH2+]CCSCc1ccccc1F)c1cc(F)ccc1O ZINC000756355498 1051105363 /nfs/dbraw/zinc/10/53/63/1051105363.db2.gz PFYUDUFCRPYNEQ-GFCCVEGCSA-N 1 0 323.408 4.254 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000037142048 1051113220 /nfs/dbraw/zinc/11/32/20/1051113220.db2.gz GPWTYVPGBBZKIX-CMPLNLGQSA-N 1 0 307.743 4.256 20 10 DICDRO CC[C@H](CSC)[N@H+](C)Cc1c(O)ccc2ccc(OC)cc21 ZINC000773255775 1051119214 /nfs/dbraw/zinc/11/92/14/1051119214.db2.gz PBHVGRNNUCFONU-CQSZACIVSA-N 1 0 319.470 4.127 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)c(O)c1 ZINC000756762552 1051128776 /nfs/dbraw/zinc/12/87/76/1051128776.db2.gz XQPMTKCPLFXMSS-XHDPSFHLSA-N 1 0 303.789 4.138 20 10 DICDRO C[C@H](Cc1ccccc1Cl)[N@@H+]1CCc2cccc(O)c2C1 ZINC001170288600 1051183655 /nfs/dbraw/zinc/18/36/55/1051183655.db2.gz QYGOVAAVYRNZQT-CYBMUJFWSA-N 1 0 301.817 4.035 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@H](c3ccc(C)cc3C)C2)c1O ZINC000793232468 1051266212 /nfs/dbraw/zinc/26/62/12/1051266212.db2.gz MQKZBSYZBHGRER-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000793309123 1051278571 /nfs/dbraw/zinc/27/85/71/1051278571.db2.gz LAKWDWHYBNEWAW-INIZCTEOSA-N 1 0 305.780 4.352 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)c(O)c1 ZINC000793388659 1051294778 /nfs/dbraw/zinc/29/47/78/1051294778.db2.gz RBCJBBGTRAZIJX-UHFFFAOYSA-N 1 0 323.392 4.259 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCC[C@H]2c2ccc(C)cc2)c(O)c1 ZINC000793386086 1051294888 /nfs/dbraw/zinc/29/48/88/1051294888.db2.gz IVCYNKULQFLKRG-OALUTQOASA-N 1 0 311.425 4.135 20 10 DICDRO CC(C)[N@H+](Cc1ccc(F)cc1)Cc1c(O)ccc2ccncc21 ZINC000746026732 1051309542 /nfs/dbraw/zinc/30/95/42/1051309542.db2.gz QCNBPVYCUOVEPF-UHFFFAOYSA-N 1 0 324.399 4.490 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC000746047707 1051310741 /nfs/dbraw/zinc/31/07/41/1051310741.db2.gz PYQOWXFHATUIJS-CYBMUJFWSA-N 1 0 304.384 4.190 20 10 DICDRO CC[N@H+](CCc1cccs1)Cc1cc2c(cc1O)CCC2 ZINC000746069921 1051317070 /nfs/dbraw/zinc/31/70/70/1051317070.db2.gz DJQJWVJSKKWERZ-UHFFFAOYSA-N 1 0 301.455 4.007 20 10 DICDRO CC[C@@H](C)OCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172340509 1051362633 /nfs/dbraw/zinc/36/26/33/1051362633.db2.gz KJGMQKGWTLWTRK-QZTJIDSGSA-N 1 0 318.505 4.312 20 10 DICDRO CC[C@H](C)OCC[C@H](C)[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001172346405 1051364202 /nfs/dbraw/zinc/36/42/02/1051364202.db2.gz JAYXUJAFGKUVMC-IRXDYDNUSA-N 1 0 306.494 4.168 20 10 DICDRO CC[C@H](C)OCC[C@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001172345334 1051364944 /nfs/dbraw/zinc/36/49/44/1051364944.db2.gz WOPMNRIPTJPSGN-GJZGRUSLSA-N 1 0 301.430 4.229 20 10 DICDRO CN(Cc1nccs1)Cc1cc2oc3ccccc3c2cc1O ZINC000746388949 1051391243 /nfs/dbraw/zinc/39/12/43/1051391243.db2.gz LKEVAKGQOLOMII-UHFFFAOYSA-N 1 0 324.405 4.380 20 10 DICDRO CC[C@@H](CC(C)C)[NH2+]Cc1cc(Br)ccc1O ZINC001172391890 1051394845 /nfs/dbraw/zinc/39/48/45/1051394845.db2.gz KJQPZMJLKXOSCI-ZDUSSCGKSA-N 1 0 300.240 4.069 20 10 DICDRO CC(C)COCC[C@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172468569 1051399646 /nfs/dbraw/zinc/39/96/46/1051399646.db2.gz LSNSEPWZYMJBEY-SFHVURJKSA-N 1 0 318.505 4.170 20 10 DICDRO CC[C@@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccc(N(C)C)cc1 ZINC000766380396 1051409592 /nfs/dbraw/zinc/40/95/92/1051409592.db2.gz WDAFQRZYHGYCBI-QGZVFWFLSA-N 1 0 322.456 4.178 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2nc3cc(C)ccc3[nH]2)cc1 ZINC000766378006 1051411101 /nfs/dbraw/zinc/41/11/01/1051411101.db2.gz NZWLMJCKTWDYRA-HNNXBMFYSA-N 1 0 322.456 4.178 20 10 DICDRO CCCC[C@H](CC)C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC001168802295 1051441335 /nfs/dbraw/zinc/44/13/35/1051441335.db2.gz XPEGSIWRGRRIOM-ROUUACIJSA-N 1 0 318.505 4.390 20 10 DICDRO CCCC[C@@H](CC)C[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC001168802294 1051441372 /nfs/dbraw/zinc/44/13/72/1051441372.db2.gz XPEGSIWRGRRIOM-QZTJIDSGSA-N 1 0 318.505 4.390 20 10 DICDRO C[C@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccc(N(C)C)cc1 ZINC001172711554 1051495759 /nfs/dbraw/zinc/49/57/59/1051495759.db2.gz GPKKKRWCASXTAK-UGSOOPFHSA-N 1 0 314.860 4.224 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(C)cc2OC)cc1 ZINC000766576395 1051499360 /nfs/dbraw/zinc/49/93/60/1051499360.db2.gz NXYYBXIEXAZXIA-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1OC)c1ccc(N(C)C)cc1 ZINC000766575290 1051506190 /nfs/dbraw/zinc/50/61/90/1051506190.db2.gz INMVOFXVQJFWNG-LJQANCHMSA-N 1 0 312.457 4.311 20 10 DICDRO Cc1ccsc1C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001204021008 1051509163 /nfs/dbraw/zinc/50/91/63/1051509163.db2.gz AAKCAVBFBIRIHN-UHFFFAOYSA-N 1 0 300.471 4.289 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(CCOC)CCCC2)cc1 ZINC000766583233 1051513826 /nfs/dbraw/zinc/51/38/26/1051513826.db2.gz CEVVWLACBZNDGU-KRWDZBQOSA-N 1 0 318.505 4.390 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)Cc1c(F)cccc1Cl)c1ccccc1O ZINC001172839911 1051528362 /nfs/dbraw/zinc/52/83/62/1051528362.db2.gz ANOAAENNKLHIMM-NWDGAFQWSA-N 1 0 307.796 4.467 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2c1cccc2OC)c1ccc(N(C)C)cc1 ZINC000766593705 1051530993 /nfs/dbraw/zinc/53/09/93/1051530993.db2.gz WQNRKROPCQADBS-PMACEKPBSA-N 1 0 324.468 4.489 20 10 DICDRO Oc1cccc2c1C[N@@H+](C1CCC(Oc3ccccc3)CC1)CC2 ZINC001173207164 1051645069 /nfs/dbraw/zinc/64/50/69/1051645069.db2.gz ZPOBVORSODYLGW-UHFFFAOYSA-N 1 0 323.436 4.141 20 10 DICDRO CCCC[C@H](CC(C)C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001173246525 1051651569 /nfs/dbraw/zinc/65/15/69/1051651569.db2.gz PQFYTFDAJOSVJR-LJQANCHMSA-N 1 0 318.505 4.218 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H](C)Cc1ccsc1 ZINC001169603665 1051654315 /nfs/dbraw/zinc/65/43/15/1051654315.db2.gz CPIPNJGKFFZESJ-OAHLLOKOSA-N 1 0 302.487 4.267 20 10 DICDRO CCO[C@H]1C[C@@H]([NH2+]Cc2ccc(OC)c(C)c2)C1(CC)CC ZINC001169582004 1051655950 /nfs/dbraw/zinc/65/59/50/1051655950.db2.gz NPIUVJHMFPDFJY-MSOLQXFVSA-N 1 0 305.462 4.077 20 10 DICDRO CCCC[N@H+](Cc1csc(NCC)n1)Cc1ccccc1O ZINC001169754283 1051692898 /nfs/dbraw/zinc/69/28/98/1051692898.db2.gz IXDWCPOXEVPEGY-UHFFFAOYSA-N 1 0 319.474 4.083 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cc(Cl)cc(Cl)c1[O-] ZINC000806135031 1051735271 /nfs/dbraw/zinc/73/52/71/1051735271.db2.gz FFFHEGDSWHGFGD-HZMBPMFUSA-N 1 0 319.276 4.080 20 10 DICDRO CC[C@@H]([NH2+]CCCC[NH+](C)C)c1cc(Cl)cc(Cl)c1[O-] ZINC000806136310 1051736649 /nfs/dbraw/zinc/73/66/49/1051736649.db2.gz WLIYLUQZPBFKET-CQSZACIVSA-N 1 0 319.276 4.082 20 10 DICDRO C[C@@H]([NH2+]CCC1(F)CCC1)c1ccc(Br)cc1O ZINC000806173863 1051745750 /nfs/dbraw/zinc/74/57/50/1051745750.db2.gz NIUJBGRZOCGWKT-SNVBAGLBSA-N 1 0 316.214 4.088 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@@H]1C(F)F)c1ccc(N2CCCCC2)c(F)c1 ZINC000806170011 1051746228 /nfs/dbraw/zinc/74/62/28/1051746228.db2.gz UXSTTZQDBDNKKT-WHOFXGATSA-N 1 0 312.379 4.120 20 10 DICDRO CC[C@@H]([NH2+]CCCC(C)(C)COC)c1ccc(N(C)C)cc1 ZINC000806176105 1051747612 /nfs/dbraw/zinc/74/76/12/1051747612.db2.gz KTRMEBBUHJXRLM-GOSISDBHSA-N 1 0 306.494 4.246 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](CCO)c2ccc(Cl)cc2)c(O)c1 ZINC000806176571 1051747646 /nfs/dbraw/zinc/74/76/46/1051747646.db2.gz MROQQWMLHORROF-SUMWQHHRSA-N 1 0 319.832 4.128 20 10 DICDRO COCC(C)(C)CCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000806175475 1051748723 /nfs/dbraw/zinc/74/87/23/1051748723.db2.gz BTCKTQZQLGKXNP-HNNXBMFYSA-N 1 0 319.489 4.374 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCSC1)c1ccc(N2CCCCC2)cc1 ZINC000806178365 1051772144 /nfs/dbraw/zinc/77/21/44/1051772144.db2.gz FTDCOSNAXOSSOF-SJORKVTESA-N 1 0 318.530 4.471 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCSC1)c1cc2c(cc1O)CCCC2 ZINC000806179676 1051772320 /nfs/dbraw/zinc/77/23/20/1051772320.db2.gz UJBCUEMWDVPWNI-UONOGXRCSA-N 1 0 305.487 4.065 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2[nH]ccc21 ZINC000768131997 1051887324 /nfs/dbraw/zinc/88/73/24/1051887324.db2.gz FYOJLLOUYLECED-UHFFFAOYSA-N 1 0 307.441 4.256 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccnc2ccccc12 ZINC000768134663 1051887450 /nfs/dbraw/zinc/88/74/50/1051887450.db2.gz SNTSAJSVIGFRCT-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1=Cc2ccccc2OC1 ZINC000768134053 1051887518 /nfs/dbraw/zinc/88/75/18/1051887518.db2.gz ONHMAGZVAGHBFH-UHFFFAOYSA-N 1 0 322.452 4.051 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2O)cc1 ZINC000768163623 1051891378 /nfs/dbraw/zinc/89/13/78/1051891378.db2.gz RIKIVLWENJFPBK-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc3c(c2)COC3)cc1 ZINC000768208009 1051894740 /nfs/dbraw/zinc/89/47/40/1051894740.db2.gz LXVUAPQWENGVBT-UHFFFAOYSA-N 1 0 324.468 4.195 20 10 DICDRO CCOc1cccc(C[N@H+](C)Cc2cccc(Cl)c2)c1O ZINC000768172893 1051895226 /nfs/dbraw/zinc/89/52/26/1051895226.db2.gz ARKPFNNLVGOBQB-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO Cc1cc(C)c(O)c(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)c1 ZINC000798190221 1051897364 /nfs/dbraw/zinc/89/73/64/1051897364.db2.gz KHFPWINNESOIIG-UHFFFAOYSA-N 1 0 311.400 4.437 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)s1)Cc1c(O)cccc1OC ZINC000768194073 1051899848 /nfs/dbraw/zinc/89/98/48/1051899848.db2.gz ZMZUZMUJHODKFM-UHFFFAOYSA-N 1 0 311.834 4.138 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2ccc3ccccc3c2)c1O ZINC000768195040 1051900715 /nfs/dbraw/zinc/90/07/15/1051900715.db2.gz JMZKFAMQFNIASI-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000768196327 1051901764 /nfs/dbraw/zinc/90/17/64/1051901764.db2.gz APKKBCMPNJGICM-NRFANRHFSA-N 1 0 323.484 4.353 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2ccccc2C)C2CC2)c1O ZINC000768253013 1051910026 /nfs/dbraw/zinc/91/00/26/1051910026.db2.gz URNLSMVFRAQKMC-UHFFFAOYSA-N 1 0 311.425 4.264 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)c1 ZINC000768267947 1051911768 /nfs/dbraw/zinc/91/17/68/1051911768.db2.gz ZTPDWPBGGSOZCR-GFCCVEGCSA-N 1 0 321.367 4.262 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c1 ZINC000768267950 1051912047 /nfs/dbraw/zinc/91/20/47/1051912047.db2.gz ZTPDWPBGGSOZCR-LBPRGKRZSA-N 1 0 321.367 4.262 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c1O ZINC000768316376 1051920971 /nfs/dbraw/zinc/92/09/71/1051920971.db2.gz DAJYFHHPFNMKIA-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO COc1cc(O)c(C[N@H+](CCC(C)C)C2CCCC2)cc1OC ZINC000768440250 1051931693 /nfs/dbraw/zinc/93/16/93/1051931693.db2.gz PQCNLVYWTIMWFP-UHFFFAOYSA-N 1 0 321.461 4.200 20 10 DICDRO COc1cc(C[N@H+](Cc2cccs2)C(C)C)c(O)cc1C ZINC000768440943 1051932054 /nfs/dbraw/zinc/93/20/54/1051932054.db2.gz BEFHSMONPGJKSS-UHFFFAOYSA-N 1 0 305.443 4.181 20 10 DICDRO 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Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)c1O ZINC000808691744 1052062883 /nfs/dbraw/zinc/06/28/83/1052062883.db2.gz NMADTSRSKUNWFG-OLZOCXBDSA-N 1 0 319.832 4.341 20 10 DICDRO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(N(C)C)cc2)s1 ZINC000769470698 1052064473 /nfs/dbraw/zinc/06/44/73/1052064473.db2.gz NSYGSUFWEFOFIG-CQSZACIVSA-N 1 0 317.502 4.273 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808672199 1052065328 /nfs/dbraw/zinc/06/53/28/1052065328.db2.gz GIIGIMZKWWQAJW-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO Cc1cccc(C[N@@H+](C)Cc2cc(-c3ccccc3)ccc2O)n1 ZINC000769477259 1052065947 /nfs/dbraw/zinc/06/59/47/1052065947.db2.gz ABNQVFTWCDJYRM-UHFFFAOYSA-N 1 0 318.420 4.395 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000769492452 1052066218 /nfs/dbraw/zinc/06/62/18/1052066218.db2.gz KARNTHWXYRPMKF-WBVHZDCISA-N 1 0 311.425 4.026 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc(Cl)nc2)c1O ZINC000808678085 1052066680 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CSC[C@H]1CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000769516039 1052071868 /nfs/dbraw/zinc/07/18/68/1052071868.db2.gz NTJRWIQURKHFOL-GOSISDBHSA-N 1 0 304.503 4.004 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(C)(C)[C@@H](O)C(C)C)c1O ZINC000808708537 1052071737 /nfs/dbraw/zinc/07/17/37/1052071737.db2.gz MRGBGWIOHZVBCT-WBMJQRKESA-N 1 0 313.869 4.048 20 10 DICDRO C[N@H+](CCOC(C)(C)C)Cc1cc(-c2ccccc2)ccc1O ZINC000769515206 1052072869 /nfs/dbraw/zinc/07/28/69/1052072869.db2.gz LCVMWYDVQKWEBS-UHFFFAOYSA-N 1 0 313.441 4.306 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@@H]2CCO[C@H](C)C2)c1O ZINC000808712425 1052073052 /nfs/dbraw/zinc/07/30/52/1052073052.db2.gz GNRLQPMVLTXVOG-HZSPNIEDSA-N 1 0 311.853 4.210 20 10 DICDRO CCOc1cccc(C[N@H+](C)Cc2ccc(Cl)c(F)c2)c1O ZINC000769531777 1052074204 /nfs/dbraw/zinc/07/42/04/1052074204.db2.gz XDWGHQKASCVLOV-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c1O ZINC000808715960 1052075418 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Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[C@H](c3ccccc3)O2)c1 ZINC000808728376 1052084107 /nfs/dbraw/zinc/08/41/07/1052084107.db2.gz QMNFNNVVAFRFHT-XAUMDUMWSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccc2ccccc2c1O ZINC000808727591 1052084648 /nfs/dbraw/zinc/08/46/48/1052084648.db2.gz JNMPTMSESXJKHF-GOEBONIOSA-N 1 0 319.404 4.372 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1COc2ccccc21)c1cc(Cl)ccc1O ZINC000808727260 1052084846 /nfs/dbraw/zinc/08/48/46/1052084846.db2.gz FTXFXPGJBOSBLF-LRDDRELGSA-N 1 0 317.816 4.263 20 10 DICDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]CCCSc2nccs2)CS1 ZINC000754145056 1052125325 /nfs/dbraw/zinc/12/53/25/1052125325.db2.gz SOIVFVYGJQVCIB-VXGBXAGGSA-N 1 0 316.561 4.135 20 10 DICDRO Cc1ccc(O[C@H]2C[NH2+]CC[C@@H]2F)c(/N=N/c2ccccc2)c1 ZINC001217958415 1052178317 /nfs/dbraw/zinc/17/83/17/1052178317.db2.gz DZNSJZRWYDBPAP-DOLXLOFVSA-N 1 0 313.376 4.489 20 10 DICDRO C[C@@H]1C[NH2+]C[C@H]1Oc1ccc(/N=N/c2ccc(N(C)C)cc2)cc1 ZINC001218033588 1052187875 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20 10 DICDRO Cc1nc(C)c(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC000315005464 1052328913 /nfs/dbraw/zinc/32/89/13/1052328913.db2.gz WZZGHHMTVWMWCZ-GXFFZTMASA-N 1 0 302.443 4.112 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)[C@H]2CCCC[C@@H]12 ZINC000915208801 1052366754 /nfs/dbraw/zinc/36/67/54/1052366754.db2.gz IDXAPMWWNPWXTC-ALKREAHSSA-N 1 0 310.441 4.341 20 10 DICDRO CC[N@H+](Cc1csc(C)c1C)Cc1ccc(N(C)C)cc1 ZINC001205143829 1052430314 /nfs/dbraw/zinc/43/03/14/1052430314.db2.gz ZVURLBZITVDBID-UHFFFAOYSA-N 1 0 302.487 4.453 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)cn1 ZINC000153681496 1052467537 /nfs/dbraw/zinc/46/75/37/1052467537.db2.gz QQIPTFSIMWXZBF-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO COc1cc(C)cc(CN(C)Cc2c(F)cccc2Cl)c1O ZINC000915822508 1052492194 /nfs/dbraw/zinc/49/21/94/1052492194.db2.gz MLVZBQIYJFVOPL-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)c(O)c(C)c2)cc1 ZINC000916837831 1052657754 /nfs/dbraw/zinc/65/77/54/1052657754.db2.gz VFGFDQCXOMYVKY-UHFFFAOYSA-N 1 0 312.457 4.145 20 10 DICDRO Oc1c(CNc2c[nH+]cc3cc[nH]c32)cc(Cl)c2cccnc12 ZINC001168523565 1052784205 /nfs/dbraw/zinc/78/42/05/1052784205.db2.gz POIYZOLURXJTEN-UHFFFAOYSA-N 1 0 324.771 4.082 20 10 DICDRO CC[C@H]([NH2+]CCCn1c(C)nc2ccccc21)c1ccccc1O ZINC000154893829 1052851081 /nfs/dbraw/zinc/85/10/81/1052851081.db2.gz WERWKXYMLUJYJL-KRWDZBQOSA-N 1 0 323.440 4.181 20 10 DICDRO CC(C)[N@H+](Cc1cccs1)Cc1cc2c(cc1O)CCC2 ZINC000919953742 1052906382 /nfs/dbraw/zinc/90/63/82/1052906382.db2.gz AJIRKBNLNGHQLN-UHFFFAOYSA-N 1 0 301.455 4.353 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C(C)C ZINC000920183672 1052926106 /nfs/dbraw/zinc/92/61/06/1052926106.db2.gz RSJVUWBLUKWBIR-MRXNPFEDSA-N 1 0 319.449 4.109 20 10 DICDRO CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000920183775 1052926346 /nfs/dbraw/zinc/92/63/46/1052926346.db2.gz WYNQFMCFTYVSJM-HUUCEWRRSA-N 1 0 319.449 4.109 20 10 DICDRO C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 ZINC000237545037 1053010286 /nfs/dbraw/zinc/01/02/86/1053010286.db2.gz HZHCYELDTWBTTM-QLFBSQMISA-N 1 0 324.415 4.035 20 10 DICDRO COCCCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000179642527 1053020263 /nfs/dbraw/zinc/02/02/63/1053020263.db2.gz YJDQADROLSHYHL-QGZVFWFLSA-N 1 0 313.441 4.382 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Oc1ccc(N(C)C)cc1 ZINC001227939257 1053030252 /nfs/dbraw/zinc/03/02/52/1053030252.db2.gz QBJONMJUMNGKGR-UTKZUKDTSA-N 1 0 324.468 4.042 20 10 DICDRO COc1cc(C[N@H+](C)Cc2cccc(C)c2O)ccc1SC ZINC000179919781 1053034845 /nfs/dbraw/zinc/03/48/45/1053034845.db2.gz ANPRIQBITDINSZ-UHFFFAOYSA-N 1 0 317.454 4.063 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]C1(c2ccc(F)cc2)CCCC1 ZINC000180566113 1053071498 /nfs/dbraw/zinc/07/14/98/1053071498.db2.gz FEZKYMSGQKRVEO-UHFFFAOYSA-N 1 0 303.352 4.230 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1C[NH+]2CCC1CC2 ZINC001228418007 1053097376 /nfs/dbraw/zinc/09/73/76/1053097376.db2.gz CSVQDQGNHYFQHQ-UOFXHNCJSA-N 1 0 323.396 4.281 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+][C@@H]1CCCc2cccnc21 ZINC001350987195 1053125652 /nfs/dbraw/zinc/12/56/52/1053125652.db2.gz JWSMHBLCYRXXJE-IMJJTQAJSA-N 1 0 308.425 4.311 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2nc(C)cs2)cc1 ZINC000069168497 1053128359 /nfs/dbraw/zinc/12/83/59/1053128359.db2.gz PRWPFOCTVSJRIU-AWEZNQCLSA-N 1 0 303.475 4.149 20 10 DICDRO Fc1ccccc1C1([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001318610127 1053177859 /nfs/dbraw/zinc/17/78/59/1053177859.db2.gz QODZJAGACSIDFD-UHFFFAOYSA-N 1 0 310.416 4.205 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001319690785 1053265017 /nfs/dbraw/zinc/26/50/17/1053265017.db2.gz GXZHMRYGQJKXIH-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccccc1C1([NH2+][C@H](C)c2ccc(N(C)C)cc2)CCC1 ZINC001319857420 1053281600 /nfs/dbraw/zinc/28/16/00/1053281600.db2.gz VNTFYOBJUXZPEV-MRXNPFEDSA-N 1 0 324.468 4.491 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@](C)(O)CCC(C)C ZINC001320119104 1053307964 /nfs/dbraw/zinc/30/79/64/1053307964.db2.gz WNRGKRIZIKZGDX-VCBZYWHSSA-N 1 0 305.462 4.026 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)C(C)C ZINC001320119082 1053308459 /nfs/dbraw/zinc/30/84/59/1053308459.db2.gz WLLVPDFJYUNFTK-BFYDXBDKSA-N 1 0 305.462 4.290 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)cc1 ZINC001320121427 1053308596 /nfs/dbraw/zinc/30/85/96/1053308596.db2.gz AVMKENWDYXPWFP-WMLDXEAASA-N 1 0 311.425 4.437 20 10 DICDRO COc1cccc2cc(C[NH2+][C@H](C)c3cc(C)ccc3O)oc21 ZINC001320248462 1053317869 /nfs/dbraw/zinc/31/78/69/1053317869.db2.gz VONOWGRIIVTTAZ-CYBMUJFWSA-N 1 0 311.381 4.306 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)C(C)(C)c1ccccc1 ZINC001200022015 1053318705 /nfs/dbraw/zinc/31/87/05/1053318705.db2.gz BHYPATXCUVIQOB-MRXNPFEDSA-N 1 0 309.453 4.468 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)C(C)(C)c1ccccc1 ZINC001200022011 1053318926 /nfs/dbraw/zinc/31/89/26/1053318926.db2.gz BHYPATXCUVIQOB-INIZCTEOSA-N 1 0 309.453 4.468 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)C12CCC2 ZINC001320410472 1053330989 /nfs/dbraw/zinc/33/09/89/1053330989.db2.gz BSJWTMMZHSXVKV-YQFWSFKMSA-N 1 0 315.457 4.186 20 10 DICDRO CC[C@@H]([NH2+]CCc1coc(-c2ccccc2)n1)c1ccccc1O ZINC001320527444 1053341501 /nfs/dbraw/zinc/34/15/01/1053341501.db2.gz XAEUXEBMAQQJKX-GOSISDBHSA-N 1 0 322.408 4.331 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@]1(C)CCO[C@@H]1C1CC1 ZINC001320570302 1053345831 /nfs/dbraw/zinc/34/58/31/1053345831.db2.gz SDQDUSOKTVTVOP-SWDCCWFVSA-N 1 0 315.457 4.044 20 10 DICDRO C[C@H]([NH2+]Cc1cnc(-c2ccccc2)s1)c1ccccc1O ZINC001320868086 1053370316 /nfs/dbraw/zinc/37/03/16/1053370316.db2.gz QQOWPGFMORJUMH-ZDUSSCGKSA-N 1 0 310.422 4.367 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1cccc(N(C)C)c1 ZINC001321023682 1053383116 /nfs/dbraw/zinc/38/31/16/1053383116.db2.gz OIPJRIOGRQBWPY-RHSMWYFYSA-N 1 0 310.441 4.105 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001321037587 1053385661 /nfs/dbraw/zinc/38/56/61/1053385661.db2.gz OQZXJKFLFWTVFO-WBMJQRKESA-N 1 0 315.388 4.186 20 10 DICDRO CC[C@@H]([NH2+]CCCOCc1ccccc1)c1ccc(C)cc1O ZINC001321072437 1053386682 /nfs/dbraw/zinc/38/66/82/1053386682.db2.gz JAWCZVNWIPNHCE-LJQANCHMSA-N 1 0 313.441 4.348 20 10 DICDRO Fc1cccc([C@H]2C[C@H]([NH2+]Cc3ccc(N4CCCC4)cc3)C2)c1 ZINC001321118514 1053392645 /nfs/dbraw/zinc/39/26/45/1053392645.db2.gz FBKFIXMRQRDSDD-KESTWPANSA-N 1 0 324.443 4.462 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCc1nc(C(C)(C)C)co1 ZINC001352774086 1053402804 /nfs/dbraw/zinc/40/28/04/1053402804.db2.gz GUEJERODKQVXOM-QWHCGFSZSA-N 1 0 314.429 4.324 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCc1nc(C(C)(C)C)co1 ZINC001352774080 1053403219 /nfs/dbraw/zinc/40/32/19/1053403219.db2.gz GUEJERODKQVXOM-CHWSQXEVSA-N 1 0 314.429 4.324 20 10 DICDRO CCN(C)c1ccccc1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001200142373 1053413014 /nfs/dbraw/zinc/41/30/14/1053413014.db2.gz VOTMYAWICPTNSK-CMDGGOBGSA-N 1 0 323.484 4.012 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)nc3ccccc23)c1 ZINC000182370068 1053422188 /nfs/dbraw/zinc/42/21/88/1053422188.db2.gz XPNZHQSEBDACNE-AWEZNQCLSA-N 1 0 322.408 4.108 20 10 DICDRO Oc1ccccc1C[N@H+](C/C(Cl)=C/Cl)C1CCCC1 ZINC000763541382 1053472306 /nfs/dbraw/zinc/47/23/06/1053472306.db2.gz FLFPEPFVXCZVON-LCYFTJDESA-N 1 0 300.229 4.456 20 10 DICDRO Cc1ccccc1C1(C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001322610254 1053527955 /nfs/dbraw/zinc/52/79/55/1053527955.db2.gz COIJIEPXONTACG-UHFFFAOYSA-N 1 0 320.480 4.417 20 10 DICDRO CS[C@H]1CC[C@@H]([N@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC001323271107 1053571523 /nfs/dbraw/zinc/57/15/23/1053571523.db2.gz YLBCAILTEBGVMY-CABCVRRESA-N 1 0 323.502 4.111 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@@H]3CCCC[C@]32c2ccccc2)c1O ZINC001323331061 1053574730 /nfs/dbraw/zinc/57/47/30/1053574730.db2.gz NOFOLGIKWWUIDW-RXVVDRJESA-N 1 0 323.436 4.302 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001323828853 1053602963 /nfs/dbraw/zinc/60/29/63/1053602963.db2.gz DUNZFXLOFZWRCH-WMLDXEAASA-N 1 0 311.425 4.356 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001323828849 1053603163 /nfs/dbraw/zinc/60/31/63/1053603163.db2.gz DUNZFXLOFZWRCH-PBHICJAKSA-N 1 0 311.425 4.356 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC001323829235 1053603379 /nfs/dbraw/zinc/60/33/79/1053603379.db2.gz IOZKCBPPGVMTHY-PNBKFKSVSA-N 1 0 317.473 4.432 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1cccc(F)c1F ZINC000183267380 1053618961 /nfs/dbraw/zinc/61/89/61/1053618961.db2.gz HJHKGRVVVVIMCY-SNVBAGLBSA-N 1 0 314.426 4.254 20 10 DICDRO CS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc3ccccc3c2O)C1 ZINC001324337992 1053646103 /nfs/dbraw/zinc/64/61/03/1053646103.db2.gz XTDABIRCPFSYAY-HZPDHXFCSA-N 1 0 301.455 4.261 20 10 DICDRO CS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001324749112 1053678925 /nfs/dbraw/zinc/67/89/25/1053678925.db2.gz DJYLSJPXVQJKIJ-ZWKOTPCHSA-N 1 0 304.503 4.003 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CCOC(C)(C)C1 ZINC001325315728 1053712982 /nfs/dbraw/zinc/71/29/82/1053712982.db2.gz PDDHIUSBUDVIOS-KFWWJZLASA-N 1 0 303.446 4.044 20 10 DICDRO COCc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)cc1 ZINC001325340847 1053714874 /nfs/dbraw/zinc/71/48/74/1053714874.db2.gz SGQHUPJSMWNUEH-YOEHRIQHSA-N 1 0 311.425 4.185 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CCCO[C@@H]1C(C)C ZINC001325357591 1053716362 /nfs/dbraw/zinc/71/63/62/1053716362.db2.gz VHOPUGVLZPFXPX-NARAOEGZSA-N 1 0 317.473 4.290 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CCCO[C@H]1C(C)C ZINC001325357592 1053717612 /nfs/dbraw/zinc/71/76/12/1053717612.db2.gz VHOPUGVLZPFXPX-OLPIVMHESA-N 1 0 317.473 4.290 20 10 DICDRO C[N@H+](CCC1CC1)Cc1ccc(OCc2ccccc2)cc1O ZINC001231470126 1053757714 /nfs/dbraw/zinc/75/77/14/1053757714.db2.gz OXCXFIMCJUVAHR-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO Cc1ccccc1C1([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001326172151 1053759311 /nfs/dbraw/zinc/75/93/11/1053759311.db2.gz KBKCPZDSIKRARF-UHFFFAOYSA-N 1 0 306.453 4.374 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001231586366 1053789588 /nfs/dbraw/zinc/78/95/88/1053789588.db2.gz FWOQXXXIQYOHOC-MRXNPFEDSA-N 1 0 309.331 4.115 20 10 DICDRO Cc1ccc(O[C@H]2CCC[N@H+](Cc3cccc(C)c3O)C2)cc1 ZINC001231593170 1053791124 /nfs/dbraw/zinc/79/11/24/1053791124.db2.gz QDJYQADGYWEKDF-IBGZPJMESA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1O ZINC001231591863 1053791643 /nfs/dbraw/zinc/79/16/43/1053791643.db2.gz BOUSVVRXFSKMCG-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001231588268 1053791898 /nfs/dbraw/zinc/79/18/98/1053791898.db2.gz KGWMYZJEOJVJNS-GOSISDBHSA-N 1 0 319.404 4.199 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](F)C(F)(F)CC1 ZINC001231588802 1053792971 /nfs/dbraw/zinc/79/29/71/1053792971.db2.gz UQHDRHPEUVJFPK-MRXNPFEDSA-N 1 0 309.331 4.115 20 10 DICDRO C[N@H+](CCC(=O)c1ccccc1)Cc1c(O)ccc2ccccc21 ZINC001231590109 1053793119 /nfs/dbraw/zinc/79/31/19/1053793119.db2.gz JXJXOYILVKJOPQ-UHFFFAOYSA-N 1 0 319.404 4.250 20 10 DICDRO COc1ccc2c(c1)CC[N@@H+](Cc1c(O)ccc3ccccc31)C2 ZINC001231588295 1053793492 /nfs/dbraw/zinc/79/34/92/1053793492.db2.gz OVZHZZCYOQKHHG-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO Cc1cccc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)c1O ZINC001231594850 1053796545 /nfs/dbraw/zinc/79/65/45/1053796545.db2.gz QEJXUQSUOYRAFE-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1cc(F)cnc1Cl ZINC001326621995 1053796465 /nfs/dbraw/zinc/79/64/65/1053796465.db2.gz BSDJKLUZRYJFAP-MFKMUULPSA-N 1 0 320.795 4.226 20 10 DICDRO COc1cc(C[N@H+](C)C2CCC(C(C)(C)C)CC2)c(O)cc1O ZINC001231637425 1053814918 /nfs/dbraw/zinc/81/49/18/1053814918.db2.gz MMYBUADWJYHRAM-UHFFFAOYSA-N 1 0 321.461 4.143 20 10 DICDRO c1ccc([C@@H]2C[C@H]2C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001326971537 1053815877 /nfs/dbraw/zinc/81/58/77/1053815877.db2.gz XGUFAXNGEBPIKP-FPOVZHCZSA-N 1 0 306.453 4.180 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@](C)(CO)C2CCCCC2)cc1C ZINC001200648388 1053849676 /nfs/dbraw/zinc/84/96/76/1053849676.db2.gz QCALBRBKDWOYTA-FQEVSTJZSA-N 1 0 319.489 4.205 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccc(N2CCCCC2)cc1 ZINC001327607533 1053868878 /nfs/dbraw/zinc/86/88/78/1053868878.db2.gz PUPALXPEDMQGTB-LFVTVUPYSA-N 1 0 320.427 4.371 20 10 DICDRO Cc1cc(C)c(C[NH+]2CCC(c3cccs3)CC2)c(O)c1 ZINC001231845540 1053884938 /nfs/dbraw/zinc/88/49/38/1053884938.db2.gz OUKHLMIRBODDKE-UHFFFAOYSA-N 1 0 301.455 4.450 20 10 DICDRO COc1ccc([C@@H]2CC[N@H+](Cc3c(C)cc(C)cc3O)C2)cc1 ZINC001231848758 1053889394 /nfs/dbraw/zinc/88/93/94/1053889394.db2.gz LJRHBPUGXZTEBI-QGZVFWFLSA-N 1 0 311.425 4.007 20 10 DICDRO Cc1cc(C)c(C[NH+]2CCC(c3cccc(O)c3)CC2)c(O)c1 ZINC001231850435 1053891455 /nfs/dbraw/zinc/89/14/55/1053891455.db2.gz PJHMQTDDYRCDLD-UHFFFAOYSA-N 1 0 311.425 4.094 20 10 DICDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)c(O)c1 ZINC001231846053 1053891529 /nfs/dbraw/zinc/89/15/29/1053891529.db2.gz ZQUBKLSKUSDJJR-GOSISDBHSA-N 1 0 311.425 4.052 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1Cl ZINC001231869245 1053899019 /nfs/dbraw/zinc/89/90/19/1053899019.db2.gz NKAGYXRTZGMSPH-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCC(=O)c2ccccc2)cc1Cl ZINC001231870459 1053900223 /nfs/dbraw/zinc/90/02/23/1053900223.db2.gz CDRQDNIFYJCVAB-UHFFFAOYSA-N 1 0 317.816 4.059 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)cc1Cl ZINC001231869119 1053900320 /nfs/dbraw/zinc/90/03/20/1053900320.db2.gz JAJUPZCCUSKZOE-LLVKDONJSA-N 1 0 307.743 4.128 20 10 DICDRO CC(C)c1ccccc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001231877615 1053903131 /nfs/dbraw/zinc/90/31/31/1053903131.db2.gz LZJIFHODPRFVDV-UHFFFAOYSA-N 1 0 311.425 4.170 20 10 DICDRO Oc1c(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)ccc2ccccc21 ZINC001231879652 1053903192 /nfs/dbraw/zinc/90/31/92/1053903192.db2.gz MJQPBTMMFATSGX-HNNXBMFYSA-N 1 0 309.331 4.115 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CCC1(F)F ZINC001231879484 1053903527 /nfs/dbraw/zinc/90/35/27/1053903527.db2.gz DUOMVKYKLCLRML-CYBMUJFWSA-N 1 0 305.368 4.413 20 10 DICDRO COc1cccc2c1C[N@H+](Cc1ccc3ccccc3c1O)CC2 ZINC001231879475 1053903599 /nfs/dbraw/zinc/90/35/99/1053903599.db2.gz DQIGWQHOCHTIDD-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO C[N@H+](CCc1ccc(F)cc1)Cc1ccc2ccccc2c1O ZINC001231880603 1053906893 /nfs/dbraw/zinc/90/68/93/1053906893.db2.gz KCAPVQRQZLCOCD-UHFFFAOYSA-N 1 0 309.384 4.359 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)C(C)(C)c1ccccc1 ZINC001200704526 1053908968 /nfs/dbraw/zinc/90/89/68/1053908968.db2.gz ULIFOAXWNBWDDZ-HXUWFJFHSA-N 1 0 309.453 4.468 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccc(F)cc1 ZINC001329674778 1054004130 /nfs/dbraw/zinc/00/41/30/1054004130.db2.gz JVRDINPBSLSVRG-LRDDRELGSA-N 1 0 303.377 4.342 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@H]2c2cccs2)cc1Cl ZINC001232261954 1054005309 /nfs/dbraw/zinc/00/53/09/1054005309.db2.gz VRGYGKCZGPSHAE-LBPRGKRZSA-N 1 0 309.818 4.150 20 10 DICDRO CCC[N@H+](Cc1ccccc1)Cc1cc(Cl)c(O)cc1O ZINC001232262072 1054005393 /nfs/dbraw/zinc/00/53/93/1054005393.db2.gz ZHHSCMMXXCUYFF-UHFFFAOYSA-N 1 0 305.805 4.163 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@@H]2C2CCCCC2)cc1Cl ZINC001232262741 1054006204 /nfs/dbraw/zinc/00/62/04/1054006204.db2.gz ODOVAQDLDAJDQQ-OAHLLOKOSA-N 1 0 309.837 4.296 20 10 DICDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)c(O)cc2O)c1 ZINC001232260830 1054007830 /nfs/dbraw/zinc/00/78/30/1054007830.db2.gz RSRLHIOMDZNXGT-MRXNPFEDSA-N 1 0 317.816 4.397 20 10 DICDRO COc1cc(O)c(C[N@@H+]2Cc3ccccc3C[C@@H]2C)cc1Cl ZINC001232269378 1054011085 /nfs/dbraw/zinc/01/10/85/1054011085.db2.gz XUGGQWJWEAXXPF-LBPRGKRZSA-N 1 0 317.816 4.001 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)[C@@H](C)c1ccccc1 ZINC001200854737 1054042830 /nfs/dbraw/zinc/04/28/30/1054042830.db2.gz SNTYWKFUFBFZNN-HUUCEWRRSA-N 1 0 300.421 4.174 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C(C2CCC2)C2CCC2)c1O ZINC000324995043 1054053669 /nfs/dbraw/zinc/05/36/69/1054053669.db2.gz XSYCANFCLUAVND-UHFFFAOYSA-N 1 0 309.837 4.113 20 10 DICDRO Cc1cccc(F)c1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001232484689 1054057870 /nfs/dbraw/zinc/05/78/70/1054057870.db2.gz KKWANUOPLVHVOW-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(Cl)cc1OC ZINC001232500649 1054060775 /nfs/dbraw/zinc/06/07/75/1054060775.db2.gz DAAPYMRWMATYCQ-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CN(C)c1ccc(C[N@H+](CCCC(F)(F)F)C2CC2)cc1 ZINC001355204649 1054081603 /nfs/dbraw/zinc/08/16/03/1054081603.db2.gz PHLMZPNVIAZHBY-UHFFFAOYSA-N 1 0 300.368 4.060 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(C(F)(F)F)cc1)CC2 ZINC000296152500 1054085210 /nfs/dbraw/zinc/08/52/10/1054085210.db2.gz WUOZWCGTFCVFKZ-CQSZACIVSA-N 1 0 307.315 4.188 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1OC(F)F ZINC000296024407 1054085928 /nfs/dbraw/zinc/08/59/28/1054085928.db2.gz PRQJCYJBGHOIDV-FZMZJTMJSA-N 1 0 319.351 4.332 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+]Cc2ccc(N3CCCC3)cc2)nc1 ZINC001331675530 1054086830 /nfs/dbraw/zinc/08/68/30/1054086830.db2.gz HHRPHSMRFQPJMS-UHFFFAOYSA-N 1 0 323.484 4.058 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2O)c1 ZINC001232834769 1054128271 /nfs/dbraw/zinc/12/82/71/1054128271.db2.gz LYPJTLMNHLMWSX-IBGZPJMESA-N 1 0 310.441 4.104 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCCc2cccnc21 ZINC001332912660 1054132293 /nfs/dbraw/zinc/13/22/93/1054132293.db2.gz JWSMHBLCYRXXJE-VNQPRFMTSA-N 1 0 308.425 4.311 20 10 DICDRO C[C@@H](Cc1ccccn1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000848566058 1054152702 /nfs/dbraw/zinc/15/27/02/1054152702.db2.gz WLNAXEKRLQSHRJ-ROUUACIJSA-N 1 0 323.484 4.354 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)c1cc(F)ccc1O ZINC000848567716 1054154822 /nfs/dbraw/zinc/15/48/22/1054154822.db2.gz LVJBROIMZAAOBN-WDEREUQCSA-N 1 0 301.352 4.396 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC3(CCCC3)O2)c(O)c1 ZINC000848571102 1054157400 /nfs/dbraw/zinc/15/74/00/1054157400.db2.gz PNXJYSAJOMNXFY-CVEARBPZSA-N 1 0 303.446 4.151 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]C1CC2(C1)COC(C)(C)C2 ZINC001334729926 1054196371 /nfs/dbraw/zinc/19/63/71/1054196371.db2.gz HKXGWGUJDVZRJX-UTFQJDELSA-N 1 0 315.457 4.186 20 10 DICDRO Nc1ccc(C[N@@H+]2CCC[C@@H](c3nc4ccccc4s3)C2)cc1 ZINC001334753335 1054197601 /nfs/dbraw/zinc/19/76/01/1054197601.db2.gz CTZWXEZPKXKBIX-OAHLLOKOSA-N 1 0 323.465 4.258 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2ccc(Cl)c(F)c2F)cc1 ZINC001233212639 1054204772 /nfs/dbraw/zinc/20/47/72/1054204772.db2.gz YCUVQLDCLKFJKL-UHFFFAOYSA-N 1 0 324.802 4.316 20 10 DICDRO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233286239 1054221195 /nfs/dbraw/zinc/22/11/95/1054221195.db2.gz LLYMBCVKHKRXAF-QGZVFWFLSA-N 1 0 305.462 4.079 20 10 DICDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(C(C)(C)C)ccc2O)no1 ZINC001233284450 1054221354 /nfs/dbraw/zinc/22/13/54/1054221354.db2.gz VENIQXQQTYVUEG-QGZVFWFLSA-N 1 0 314.429 4.323 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)c1 ZINC001233286560 1054224315 /nfs/dbraw/zinc/22/43/15/1054224315.db2.gz YWYMMCVHJYPIMR-LJQANCHMSA-N 1 0 324.468 4.292 20 10 DICDRO C[N@H+](CCc1cccs1)Cc1cc(C(C)(C)C)ccc1O ZINC001233286528 1054224529 /nfs/dbraw/zinc/22/45/29/1054224529.db2.gz XQAPJHDRJYGCKM-UHFFFAOYSA-N 1 0 303.471 4.426 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@H+](C2CCC2)C2CCOCC2)c1 ZINC001233287311 1054224650 /nfs/dbraw/zinc/22/46/50/1054224650.db2.gz IGGWKPPFYCFZQJ-UHFFFAOYSA-N 1 0 317.473 4.223 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c1 ZINC001233286482 1054226316 /nfs/dbraw/zinc/22/63/16/1054226316.db2.gz WAZUZFOONMEZDQ-MRXNPFEDSA-N 1 0 324.468 4.464 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2c([O-])ccc(F)c2F)c1 ZINC001233331872 1054234825 /nfs/dbraw/zinc/23/48/25/1054234825.db2.gz OIPHJILXWQKVBN-INIZCTEOSA-N 1 0 303.352 4.316 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc2c(cc1O)CCCC2 ZINC000184894796 1054253761 /nfs/dbraw/zinc/25/37/61/1054253761.db2.gz XTLPLVIWDFZIIT-OAHLLOKOSA-N 1 0 324.468 4.188 20 10 DICDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001337042436 1054255965 /nfs/dbraw/zinc/25/59/65/1054255965.db2.gz MMEKOHARKIYNLA-OALUTQOASA-N 1 0 318.530 4.393 20 10 DICDRO C[C@]1(F)CCCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233451858 1054275425 /nfs/dbraw/zinc/27/54/25/1054275425.db2.gz BWKCGJATUGCRBX-AWEZNQCLSA-N 1 0 305.315 4.125 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)c1O ZINC000848883846 1054283225 /nfs/dbraw/zinc/28/32/25/1054283225.db2.gz DPDAVYZQSBDTFG-GFCCVEGCSA-N 1 0 304.459 4.221 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@@H]2CCCc3nc(C)sc32)c1O ZINC000848886318 1054284371 /nfs/dbraw/zinc/28/43/71/1054284371.db2.gz ZCHKDQMZFSTSQM-MRXNPFEDSA-N 1 0 316.470 4.229 20 10 DICDRO CCc1cnc(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC001337785439 1054285378 /nfs/dbraw/zinc/28/53/78/1054285378.db2.gz MWFQMQVLMNLWBL-OCCSQVGLSA-N 1 0 316.470 4.100 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC001337784523 1054285809 /nfs/dbraw/zinc/28/58/09/1054285809.db2.gz BUIOICSAWUIJPZ-KEYYUXOJSA-N 1 0 311.425 4.175 20 10 DICDRO Cc1csc(CCC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC001337784708 1054285874 /nfs/dbraw/zinc/28/58/74/1054285874.db2.gz DHDSEIPOFCIUGQ-TZMCWYRMSA-N 1 0 316.470 4.236 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](C)Cc1ccc(O)cc1 ZINC001337784519 1054285929 /nfs/dbraw/zinc/28/59/29/1054285929.db2.gz BUIOICSAWUIJPZ-CPUCHLNUSA-N 1 0 311.425 4.175 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1COc2ccccc2C1 ZINC001337785303 1054286165 /nfs/dbraw/zinc/28/61/65/1054286165.db2.gz KJUGHVBPBJIIGM-INMHGKMJSA-N 1 0 323.436 4.090 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2ccccc2OC(F)F)c1O ZINC000848892568 1054286342 /nfs/dbraw/zinc/28/63/42/1054286342.db2.gz ARMCTVWUOLLNNK-GFCCVEGCSA-N 1 0 321.367 4.407 20 10 DICDRO COC1CCC(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001337785447 1054286570 /nfs/dbraw/zinc/28/65/70/1054286570.db2.gz NCOVCSOQVFTEDF-LMPOIIKSSA-N 1 0 303.446 4.044 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CCOc3c(CC)cccc32)c1O ZINC000848896240 1054287209 /nfs/dbraw/zinc/28/72/09/1054287209.db2.gz WCBHEFADDPMZOM-GOSISDBHSA-N 1 0 311.425 4.130 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCSc3ccc(F)cc32)c1O ZINC000848892911 1054287401 /nfs/dbraw/zinc/28/74/01/1054287401.db2.gz KAIXDJVBXZVHIB-INIZCTEOSA-N 1 0 317.429 4.420 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CCSc3c(F)cccc32)c1O ZINC000848893022 1054287556 /nfs/dbraw/zinc/28/75/56/1054287556.db2.gz NGGSEAXLIIERMG-MRXNPFEDSA-N 1 0 317.429 4.420 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)c1O ZINC000848893794 1054287773 /nfs/dbraw/zinc/28/77/73/1054287773.db2.gz HFXIJZLYRWRIMY-QGZVFWFLSA-N 1 0 315.388 4.097 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)c1O ZINC000848899228 1054290363 /nfs/dbraw/zinc/29/03/63/1054290363.db2.gz LKUKUWSKBVOETB-SFHVURJKSA-N 1 0 323.436 4.491 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](C)c2cn(C(C)(C)C)nc2C)c1O ZINC000848902696 1054291603 /nfs/dbraw/zinc/29/16/03/1054291603.db2.gz GMLKZKDXXOGDKP-ZDUSSCGKSA-N 1 0 315.461 4.065 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CCO[C@@H](C(CC)CC)C2)c1O ZINC000848901085 1054291839 /nfs/dbraw/zinc/29/18/39/1054291839.db2.gz OQRWDWZVCQUQHF-QZTJIDSGSA-N 1 0 305.462 4.028 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2ccc3ncsc3c2)c1O ZINC000848903997 1054292862 /nfs/dbraw/zinc/29/28/62/1054292862.db2.gz IELLUXSOMNTGHB-GFCCVEGCSA-N 1 0 312.438 4.415 20 10 DICDRO COc1cc(C)cc(C[N@H+]([C@H](C)c2ccco2)C2CC2)c1O ZINC001338234933 1054300443 /nfs/dbraw/zinc/30/04/43/1054300443.db2.gz PTULJVRSVKRSGS-CYBMUJFWSA-N 1 0 301.386 4.028 20 10 DICDRO Oc1c(C[NH+]2CCC3(CCC3)CC2)cccc1OC(F)(F)F ZINC001233737158 1054348208 /nfs/dbraw/zinc/34/82/08/1054348208.db2.gz XWLAGSRIKHQFPG-UHFFFAOYSA-N 1 0 315.335 4.057 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2c3ccccc3CCC[C@@H]2C)c1O ZINC000185084776 1054352914 /nfs/dbraw/zinc/35/29/14/1054352914.db2.gz YZGAITMOWBCPNH-LIRRHRJNSA-N 1 0 311.425 4.204 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(Br)o2)c(O)c1 ZINC001340595878 1054363011 /nfs/dbraw/zinc/36/30/11/1054363011.db2.gz VTGPNSBBUSAVPQ-LLVKDONJSA-N 1 0 324.218 4.215 20 10 DICDRO CC[C@@H](C)c1ccc(NC(=[NH2+])NCc2ccc(N(C)C)cc2)cc1 ZINC000849057043 1054364892 /nfs/dbraw/zinc/36/48/92/1054364892.db2.gz QCYPCDYPQMOWHD-OAHLLOKOSA-N 1 0 324.472 4.403 20 10 DICDRO Cc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccc3ccccc3c2O)cc1 ZINC000185098997 1054365961 /nfs/dbraw/zinc/36/59/61/1054365961.db2.gz JIUBVHDXXLGHSI-QRWLVFNGSA-N 1 0 321.420 4.238 20 10 DICDRO CCN(CC)c1ccc(CNC(=[NH2+])Nc2ccc(C)c(C)c2)cc1 ZINC000849071282 1054374784 /nfs/dbraw/zinc/37/47/84/1054374784.db2.gz CKZHDKBRQIKHON-UHFFFAOYSA-N 1 0 324.472 4.286 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCCOCc2ccccc2)c(O)c1 ZINC000185247094 1054488239 /nfs/dbraw/zinc/48/82/39/1054488239.db2.gz CYTTXJIBCCFUFA-KRWDZBQOSA-N 1 0 313.441 4.348 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)c1 ZINC000185301926 1054512078 /nfs/dbraw/zinc/51/20/78/1054512078.db2.gz JNFUMMDMRDSNRT-AWEZNQCLSA-N 1 0 308.381 4.206 20 10 DICDRO Cc1nccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185346566 1054527260 /nfs/dbraw/zinc/52/72/60/1054527260.db2.gz JUFGAHDENBKBQO-GJZGRUSLSA-N 1 0 323.440 4.037 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](O)c2ccc3ccccc3c2)c1 ZINC000185406546 1054539109 /nfs/dbraw/zinc/53/91/09/1054539109.db2.gz FZWWIUGDONNKGE-VFNWGFHPSA-N 1 0 321.420 4.238 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CC[C@H]4CCC[C@H]4C3)c2c1 ZINC001234525453 1054542559 /nfs/dbraw/zinc/54/25/59/1054542559.db2.gz HZMIQYWCENPMIB-ZBFHGGJFSA-N 1 0 311.425 4.176 20 10 DICDRO COc1ccc2ccc(O)c(C[N@H+]3C[C@@H]4CCCC[C@@H]4C3)c2c1 ZINC001234526074 1054542836 /nfs/dbraw/zinc/54/28/36/1054542836.db2.gz PTIKJZLILOCNQB-IYBDPMFKSA-N 1 0 311.425 4.176 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2OCC2CC2)c1 ZINC000185516471 1054559805 /nfs/dbraw/zinc/55/98/05/1054559805.db2.gz GQGZWBJTHKYZCY-OAHLLOKOSA-N 1 0 311.425 4.340 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185566508 1054582554 /nfs/dbraw/zinc/58/25/54/1054582554.db2.gz PRZLERJAZMZMCO-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO CCC(CC)(CCO)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185620995 1054599856 /nfs/dbraw/zinc/59/98/56/1054599856.db2.gz KJJVWIUHMAJNFL-HNNXBMFYSA-N 1 0 315.457 4.385 20 10 DICDRO Oc1c(C[NH+]2CCC3(CCCO3)CC2)cccc1-c1ccccc1 ZINC001234996443 1054637530 /nfs/dbraw/zinc/63/75/30/1054637530.db2.gz HNQVAHFWZGRZRW-UHFFFAOYSA-N 1 0 323.436 4.204 20 10 DICDRO CCO[C@H]1CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234996203 1054637615 /nfs/dbraw/zinc/63/76/15/1054637615.db2.gz WHAILMFUEBGTOC-SFHVURJKSA-N 1 0 311.425 4.060 20 10 DICDRO C[N@H+](Cc1cccc(-c2ccccc2)c1O)C1CC(F)(F)C1 ZINC001234991405 1054638121 /nfs/dbraw/zinc/63/81/21/1054638121.db2.gz MNWCPQPDGQQCHE-UHFFFAOYSA-N 1 0 303.352 4.289 20 10 DICDRO Oc1c(C[N@@H+]2CCc3ccncc3C2)cccc1-c1ccccc1 ZINC001234996613 1054638655 /nfs/dbraw/zinc/63/86/55/1054638655.db2.gz JNBYWXDEJLANAT-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO C[N@H+](Cc1cccc(O)c1)Cc1cccc(-c2ccccc2)c1O ZINC001234992161 1054638779 /nfs/dbraw/zinc/63/87/79/1054638779.db2.gz NRVGIYUZFHVWEM-UHFFFAOYSA-N 1 0 319.404 4.397 20 10 DICDRO C[C@@]1(F)CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C[C@@H]1F ZINC001234998148 1054640655 /nfs/dbraw/zinc/64/06/55/1054640655.db2.gz GJEFMRBNJRZTPY-PKOBYXMFSA-N 1 0 317.379 4.331 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[N@@H+](CC2CCC2)C(C)C)c1[O-] ZINC001473431051 1054716820 /nfs/dbraw/zinc/71/68/20/1054716820.db2.gz XWKPQNJZAIYPNH-UHFFFAOYSA-N 1 0 309.837 4.259 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)c(O)c1 ZINC001235674258 1054767776 /nfs/dbraw/zinc/76/77/76/1054767776.db2.gz FAGNDKXLCOPWIS-IRXDYDNUSA-N 1 0 315.457 4.023 20 10 DICDRO CC(C)(C)c1ccc(C[NH+]2CCN(c3ccccc3)CC2)c(O)c1 ZINC001235676796 1054770905 /nfs/dbraw/zinc/77/09/05/1054770905.db2.gz VCSXONRNLNRNDQ-UHFFFAOYSA-N 1 0 324.468 4.012 20 10 DICDRO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235685620 1054777293 /nfs/dbraw/zinc/77/72/93/1054777293.db2.gz SWJSSPIBCZWDLX-QGZVFWFLSA-N 1 0 305.462 4.079 20 10 DICDRO COc1ccccc1C[N@H+](C)Cc1ccc(C(C)(C)C)cc1O ZINC001235685597 1054777794 /nfs/dbraw/zinc/77/77/94/1054777794.db2.gz RSNFGHCWLHLSEY-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235685619 1054778628 /nfs/dbraw/zinc/77/86/28/1054778628.db2.gz SWJSSPIBCZWDLX-KRWDZBQOSA-N 1 0 305.462 4.079 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@H](c3ccncc3)C2)c(O)c1 ZINC001235685966 1054779649 /nfs/dbraw/zinc/77/96/49/1054779649.db2.gz WEHPTDMUAFWKIC-INIZCTEOSA-N 1 0 310.441 4.074 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCCO[C@@H]2CC(C)C)cc1C ZINC001474121498 1054784684 /nfs/dbraw/zinc/78/46/84/1054784684.db2.gz XAGKHJCPXGXIMT-AZUAARDMSA-N 1 0 319.489 4.467 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC2(CCCC2)[C@H]1C(C)C ZINC001474575676 1054824506 /nfs/dbraw/zinc/82/45/06/1054824506.db2.gz ARZSVIAXKOEAPJ-LJQANCHMSA-N 1 0 300.490 4.462 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CC(C)(C)c3ccccc32)c1 ZINC000186138677 1054986062 /nfs/dbraw/zinc/98/60/62/1054986062.db2.gz IZCWAXQLOBVICG-FZKQIMNGSA-N 1 0 311.425 4.474 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)CCCN2 ZINC001236281026 1055047209 /nfs/dbraw/zinc/04/72/09/1055047209.db2.gz XWRSSOWXELUJTD-UHFFFAOYSA-N 1 0 323.484 4.133 20 10 DICDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000764140792 1055114967 /nfs/dbraw/zinc/11/49/67/1055114967.db2.gz NFHFTBYWKZJXIO-OAQYLSRUSA-N 1 0 324.468 4.106 20 10 DICDRO CCC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000764437685 1055188292 /nfs/dbraw/zinc/18/82/92/1055188292.db2.gz UUQHIVWIXQZVQW-ZIAGYGMSSA-N 1 0 310.869 4.016 20 10 DICDRO CC(C)CC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000764502553 1055198694 /nfs/dbraw/zinc/19/86/94/1055198694.db2.gz GQUGLASWPFIEPU-HZPDHXFCSA-N 1 0 322.468 4.138 20 10 DICDRO C[C@@H]([NH2+]C1CCCCCC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000764496799 1055200190 /nfs/dbraw/zinc/20/01/90/1055200190.db2.gz BKNOCPKRAPKNJR-OAHLLOKOSA-N 1 0 320.452 4.036 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(Cl)cc(C)n1 ZINC001236650181 1055212009 /nfs/dbraw/zinc/21/20/09/1055212009.db2.gz FYLXFCVBQWZQBN-UHFFFAOYSA-N 1 0 317.864 4.132 20 10 DICDRO Oc1c(CN([C@@H]2CC[NH2+]C2)C2CCCCC2)ccc2ccccc21 ZINC001236652456 1055212484 /nfs/dbraw/zinc/21/24/84/1055212484.db2.gz HXXNZVNRAGNGJT-LJQANCHMSA-N 1 0 324.468 4.042 20 10 DICDRO Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)CCCO2 ZINC000764636692 1055226717 /nfs/dbraw/zinc/22/67/17/1055226717.db2.gz XFDYOQVZHPRCNP-FQEVSTJZSA-N 1 0 324.468 4.373 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(C)c(F)c2)cc1 ZINC000764739945 1055242681 /nfs/dbraw/zinc/24/26/81/1055242681.db2.gz UTIIZHNSLOESMM-HNNXBMFYSA-N 1 0 300.421 4.441 20 10 DICDRO CC(C)(C)C[N@H+](Cc1cccc(Cl)c1[O-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236780962 1055253627 /nfs/dbraw/zinc/25/36/27/1055253627.db2.gz ZMIJNGJFSQAOGG-SHTZXODSSA-N 1 0 324.896 4.164 20 10 DICDRO CCc1ccc(C[NH+]2CCC(c3cccc(O)c3)CC2)c(O)c1 ZINC001236789400 1055257686 /nfs/dbraw/zinc/25/76/86/1055257686.db2.gz WLJLUISGXOXDHJ-UHFFFAOYSA-N 1 0 311.425 4.040 20 10 DICDRO C[N@H+](Cc1cc(OCc2ccccc2)ccc1O)CC(C)(C)C ZINC001236784980 1055258561 /nfs/dbraw/zinc/25/85/61/1055258561.db2.gz JPELDRKWLHUNIK-UHFFFAOYSA-N 1 0 313.441 4.449 20 10 DICDRO C[N@H+](CCC1CC1)Cc1cc(OCc2ccccc2)ccc1O ZINC001236788200 1055258912 /nfs/dbraw/zinc/25/89/12/1055258912.db2.gz HBHBQRLEZOPMIX-UHFFFAOYSA-N 1 0 311.425 4.203 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001236792461 1055263490 /nfs/dbraw/zinc/26/34/90/1055263490.db2.gz MPGBZXOLMPDBAT-ROUUACIJSA-N 1 0 323.436 4.203 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2cccs2)c(Cl)c1 ZINC001236799768 1055265486 /nfs/dbraw/zinc/26/54/86/1055265486.db2.gz QICXDDNFXFBZHB-CQSZACIVSA-N 1 0 323.845 4.453 20 10 DICDRO COc1ccc2c(c1)CC[N@@H+](Cc1cc3ccccc3cc1O)C2 ZINC001236827544 1055281786 /nfs/dbraw/zinc/28/17/86/1055281786.db2.gz UZJQAMJYJAXRCA-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC001236836598 1055282849 /nfs/dbraw/zinc/28/28/49/1055282849.db2.gz LGUQKCZUZLZVRH-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO Oc1cc2ccccc2cc1C[NH+]1CCC(c2cccnc2)CC1 ZINC001236836468 1055285457 /nfs/dbraw/zinc/28/54/57/1055285457.db2.gz JWGZPPRJJYPWPF-UHFFFAOYSA-N 1 0 318.420 4.320 20 10 DICDRO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000764904110 1055290091 /nfs/dbraw/zinc/29/00/91/1055290091.db2.gz XXJHHCFWJBFYSS-QGZVFWFLSA-N 1 0 324.468 4.455 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc2ccccc2cc1O ZINC001236838136 1055290185 /nfs/dbraw/zinc/29/01/85/1055290185.db2.gz VMMFCGOEOBXNEG-UHFFFAOYSA-N 1 0 307.393 4.273 20 10 DICDRO Oc1ccccc1C[N@H+](CCCc1ccncc1)C1CCCC1 ZINC000764961055 1055304704 /nfs/dbraw/zinc/30/47/04/1055304704.db2.gz NWMUJFNAUMQNOH-UHFFFAOYSA-N 1 0 310.441 4.165 20 10 DICDRO CC[C@H]([NH2+]C[C@H](OC)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000765261039 1055346542 /nfs/dbraw/zinc/34/65/42/1055346542.db2.gz LVAOJXWAWYWOJM-PMACEKPBSA-N 1 0 312.457 4.181 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](OC)c2ccccc2)cc1 ZINC000765261831 1055347969 /nfs/dbraw/zinc/34/79/69/1055347969.db2.gz ONWFBGLKMOBZDI-JXFKEZNVSA-N 1 0 312.457 4.181 20 10 DICDRO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(C(C)C)cc2O)no1 ZINC001237045872 1055348644 /nfs/dbraw/zinc/34/86/44/1055348644.db2.gz MCHZHJOFFSTWFZ-QGZVFWFLSA-N 1 0 300.402 4.149 20 10 DICDRO CCOc1ccc(C[N@H+](C)CCc2ccccc2Cl)c(O)c1 ZINC001237044630 1055349276 /nfs/dbraw/zinc/34/92/76/1055349276.db2.gz QOJSQANXLJEVGS-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO Cc1ccccc1N1CC[NH+](Cc2ccc(C(C)C)cc2O)CC1 ZINC001237044321 1055349345 /nfs/dbraw/zinc/34/93/45/1055349345.db2.gz BSLVLRLMZXAFLS-UHFFFAOYSA-N 1 0 324.468 4.146 20 10 DICDRO CCOc1ccc(C[N@H+](C)CCc2cccc(Cl)c2)c(O)c1 ZINC001237045193 1055349787 /nfs/dbraw/zinc/34/97/87/1055349787.db2.gz XWKNYYGYBCEXBX-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC(C(F)(F)F)CC2)c(O)c1 ZINC001237045847 1055350673 /nfs/dbraw/zinc/35/06/73/1055350673.db2.gz LOLMFZKZUZHFCD-UHFFFAOYSA-N 1 0 301.352 4.290 20 10 DICDRO C[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)C1CCCCC1 ZINC001237052395 1055352301 /nfs/dbraw/zinc/35/23/01/1055352301.db2.gz XELHYZLVEZQIRF-UHFFFAOYSA-N 1 0 317.351 4.098 20 10 DICDRO COc1cccc2c1CC[N@H+](Cc1ccc(C(C)C)cc1O)C2 ZINC001237056326 1055353815 /nfs/dbraw/zinc/35/38/15/1055353815.db2.gz YBGZOXUOTMRUPR-UHFFFAOYSA-N 1 0 311.425 4.083 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCOC[C@@H]2C2CCCCC2)c(O)c1 ZINC001237056734 1055354418 /nfs/dbraw/zinc/35/44/18/1055354418.db2.gz ZHGIQTYFVBGJTA-LJQANCHMSA-N 1 0 317.473 4.297 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c(O)c1 ZINC001237052870 1055354809 /nfs/dbraw/zinc/35/48/09/1055354809.db2.gz DXCILQQMCQLZCE-HXUWFJFHSA-N 1 0 311.425 4.089 20 10 DICDRO C[C@@H]([NH2+]CC1CCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000765327795 1055362232 /nfs/dbraw/zinc/36/22/32/1055362232.db2.gz XVTLAMNWNJDLNH-CQSZACIVSA-N 1 0 322.880 4.017 20 10 DICDRO CC(C)=CCC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000765329439 1055362960 /nfs/dbraw/zinc/36/29/60/1055362960.db2.gz JFCWFAMQCGDQKY-ROUUACIJSA-N 1 0 316.489 4.309 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@@H]3CCC[C@H](C)C3)CC2)cc1 ZINC000765306404 1055363134 /nfs/dbraw/zinc/36/31/34/1055363134.db2.gz CYBYJVWUUJSEBO-DLBZAZTESA-N 1 0 316.489 4.080 20 10 DICDRO CC(C)(C)Oc1cccc(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001237106339 1055371984 /nfs/dbraw/zinc/37/19/84/1055371984.db2.gz PEJOODNZIZKVDE-UHFFFAOYSA-N 1 0 311.425 4.128 20 10 DICDRO CCC[N@H+](CCc1ccccn1)Cc1c(O)ccc(F)c1Cl ZINC001237129525 1055378214 /nfs/dbraw/zinc/37/82/14/1055378214.db2.gz IAKZWVWMAANCOL-UHFFFAOYSA-N 1 0 322.811 4.034 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(C)c(OC)c2)cc1 ZINC000765402630 1055378676 /nfs/dbraw/zinc/37/86/76/1055378676.db2.gz KSZPGPCQOURTJC-INIZCTEOSA-N 1 0 312.457 4.311 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC001237138244 1055378679 /nfs/dbraw/zinc/37/86/79/1055378679.db2.gz WCZXPEVYNZZLDC-AWEZNQCLSA-N 1 0 321.342 4.401 20 10 DICDRO CC[C@@H]1CCCC[N@@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237123352 1055378866 /nfs/dbraw/zinc/37/88/66/1055378866.db2.gz PUDHFGXQCICPBW-LLVKDONJSA-N 1 0 303.324 4.055 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c2ccccc2n1 ZINC000765408181 1055380974 /nfs/dbraw/zinc/38/09/74/1055380974.db2.gz JFFQDJDTSAABJT-INIZCTEOSA-N 1 0 319.452 4.460 20 10 DICDRO CC[C@H]1CCCC[N@@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237123353 1055381349 /nfs/dbraw/zinc/38/13/49/1055381349.db2.gz PUDHFGXQCICPBW-NSHDSACASA-N 1 0 303.324 4.055 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)Cc2c(O)ccc(F)c2Cl)cc1 ZINC001237126108 1055381706 /nfs/dbraw/zinc/38/17/06/1055381706.db2.gz JFIHSFLZFFZXBI-LLVKDONJSA-N 1 0 323.795 4.386 20 10 DICDRO C[C@@H]([NH2+]CCOC1CCCC1)c1ccc(N2CCCCC2)cc1 ZINC000765416452 1055383741 /nfs/dbraw/zinc/38/37/41/1055383741.db2.gz HZVBKKLYNIBIII-QGZVFWFLSA-N 1 0 316.489 4.287 20 10 DICDRO Cc1ccccc1C[N@@H+](C)Cc1cc(C(F)(F)F)ccc1O ZINC001237140135 1055384685 /nfs/dbraw/zinc/38/46/85/1055384685.db2.gz VUTMQXHMUMNEGA-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc2ccccc2n1)c1ccc(N(C)C)cc1 ZINC000765455077 1055394328 /nfs/dbraw/zinc/39/43/28/1055394328.db2.gz AMMLPFZQDXJFQC-MRXNPFEDSA-N 1 0 319.452 4.194 20 10 DICDRO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000765474873 1055398729 /nfs/dbraw/zinc/39/87/29/1055398729.db2.gz QZHDICFXDORZST-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cccc(OC)c1Cl ZINC001237195554 1055401977 /nfs/dbraw/zinc/40/19/77/1055401977.db2.gz JVVNPOLUXSGRGE-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccc(OC)c1 ZINC000765485693 1055402836 /nfs/dbraw/zinc/40/28/36/1055402836.db2.gz NGGOEPIYIZSNNF-FQEVSTJZSA-N 1 0 324.468 4.319 20 10 DICDRO CCCCN(CCCC)c1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c(O)c1 ZINC001237215788 1055404783 /nfs/dbraw/zinc/40/47/83/1055404783.db2.gz OMMQNMDIICCMDH-HDICACEKSA-N 1 0 316.489 4.251 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001237487078 1055457988 /nfs/dbraw/zinc/45/79/88/1055457988.db2.gz GCPURTZWTQQZSB-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cccc(O)c1C[N@H+](C)Cc1ccccc1C(F)(F)F ZINC001237487003 1055458959 /nfs/dbraw/zinc/45/89/59/1055458959.db2.gz FGWVNEKPMGJDCK-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO Cc1cccc(O)c1C[N@H+](C)Cc1cccc(Br)c1 ZINC001237486115 1055459696 /nfs/dbraw/zinc/45/96/96/1055459696.db2.gz VWSFHAPMWISSKC-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001237492422 1055461035 /nfs/dbraw/zinc/46/10/35/1055461035.db2.gz PBUABOGTWHOYRH-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO COc1cccc([C@@H]2CCC[N@H+](Cc3c(C)cccc3O)C2)c1 ZINC001237495353 1055462275 /nfs/dbraw/zinc/46/22/75/1055462275.db2.gz QIFNUOGSBOSURQ-QGZVFWFLSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC2(CCc3ccccc3O2)CC1 ZINC001237491149 1055462464 /nfs/dbraw/zinc/46/24/64/1055462464.db2.gz HOQQZGMDZZNLGB-UHFFFAOYSA-N 1 0 323.436 4.060 20 10 DICDRO C[N@H+](C/C=C/c1ccccc1)Cc1cc(Cl)cc(F)c1[O-] ZINC001237622107 1055485531 /nfs/dbraw/zinc/48/55/31/1055485531.db2.gz MBLCDMOYPFAHPT-VMPITWQZSA-N 1 0 305.780 4.330 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1C[C@@H]2C[C@H]1C[C@H]2F ZINC001237643732 1055493731 /nfs/dbraw/zinc/49/37/31/1055493731.db2.gz QOQGEZCAIUDXGZ-JCGIZDLHSA-N 1 0 315.363 4.131 20 10 DICDRO C[N@H+](Cc1ccc(-c2ccc(O)cc2)cc1)Cc1ccccc1O ZINC001237671410 1055500377 /nfs/dbraw/zinc/50/03/77/1055500377.db2.gz UUUHMPIUGCEEAC-UHFFFAOYSA-N 1 0 319.404 4.397 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccc(F)cc1 ZINC001620872979 1055501514 /nfs/dbraw/zinc/50/15/14/1055501514.db2.gz MOAQYHLZQBPQRY-QGZVFWFLSA-N 1 0 322.374 4.411 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CCC3)CC2)cc1Br ZINC001237680618 1055502851 /nfs/dbraw/zinc/50/28/51/1055502851.db2.gz KOGKOUGZEQDMRT-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+](C)Cc2ccc(F)cc2F)c1O ZINC001237687432 1055504129 /nfs/dbraw/zinc/50/41/29/1055504129.db2.gz AWSXMEZJCIDXJP-UHFFFAOYSA-N 1 0 311.759 4.264 20 10 DICDRO CSc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1F ZINC000765608097 1055511058 /nfs/dbraw/zinc/51/10/58/1055511058.db2.gz IFGWCHMOXGZXIQ-LBPRGKRZSA-N 1 0 317.429 4.333 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cnc2ccsc2c1 ZINC000765609415 1055513058 /nfs/dbraw/zinc/51/30/58/1055513058.db2.gz NOBMMNOPCHIXJW-LBPRGKRZSA-N 1 0 310.422 4.082 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](C)c2ncc(C)s2)cc1C ZINC001620896370 1055522034 /nfs/dbraw/zinc/52/20/34/1055522034.db2.gz KGGBIPRXRWRHNB-CQSZACIVSA-N 1 0 318.486 4.442 20 10 DICDRO CC(C)N(C)CC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765623476 1055523293 /nfs/dbraw/zinc/52/32/93/1055523293.db2.gz CBRVENHPPIVNTN-SFHVURJKSA-N 1 0 317.521 4.058 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2c3ccccc3CCC[C@@H]2C)c1 ZINC000765662964 1055537109 /nfs/dbraw/zinc/53/71/09/1055537109.db2.gz PNQCDXZOEJTAIN-VBKZILBWSA-N 1 0 311.425 4.204 20 10 DICDRO CC[C@@H]([NH2+]C1CCN(c2ccc(OC)cc2)CC1)C1CCCC1 ZINC001620936040 1055549319 /nfs/dbraw/zinc/54/93/19/1055549319.db2.gz OTYHOWUGCXWOCB-HXUWFJFHSA-N 1 0 316.489 4.222 20 10 DICDRO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237949463 1055565251 /nfs/dbraw/zinc/56/52/51/1055565251.db2.gz MLNINXHOWKQUGL-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1O ZINC001238062832 1055598166 /nfs/dbraw/zinc/59/81/66/1055598166.db2.gz SLHZVMBOLMGVLT-KRWDZBQOSA-N 1 0 317.429 4.130 20 10 DICDRO CCC[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C1CCCC1 ZINC001620966846 1055700616 /nfs/dbraw/zinc/70/06/16/1055700616.db2.gz MISAUWSKTIILMG-QGZVFWFLSA-N 1 0 310.432 4.479 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cnc(C2CC2)c(C)c1 ZINC001238620708 1055701273 /nfs/dbraw/zinc/70/12/73/1055701273.db2.gz BEBDWVUFEOCBFW-UHFFFAOYSA-N 1 0 323.484 4.356 20 10 DICDRO Cc1cc(OC(C)C)cc(C)c1C[N@H+](C)Cc1ccccc1O ZINC001238665231 1055713866 /nfs/dbraw/zinc/71/38/66/1055713866.db2.gz ZLCKQMUZXGMKDX-UHFFFAOYSA-N 1 0 313.441 4.428 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)c2ccccc2SC)c1 ZINC000282208712 1055807220 /nfs/dbraw/zinc/80/72/20/1055807220.db2.gz DGAXCPOSTVAPMN-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO Oc1ccccc1C[NH+]1CCC2(CCCc3ccccc32)CC1 ZINC001203550195 1055825889 /nfs/dbraw/zinc/82/58/89/1055825889.db2.gz LMVLNEMDYFNEFY-UHFFFAOYSA-N 1 0 307.437 4.262 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2c3ccccc3CC[C@H]2C)c1 ZINC000186196796 1055924460 /nfs/dbraw/zinc/92/44/60/1055924460.db2.gz WWCOYMBTXBVPQA-LAPQFRIASA-N 1 0 311.425 4.375 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@H]2CC=CCC2)c(C(F)(F)F)c1 ZINC001620753924 1055925800 /nfs/dbraw/zinc/92/58/00/1055925800.db2.gz UFSWYJQSVWAZHH-ZDUSSCGKSA-N 1 0 312.379 4.217 20 10 DICDRO CCC[C@H](O)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001620784912 1055959895 /nfs/dbraw/zinc/95/98/95/1055959895.db2.gz CSFNAFDOLREGPT-INIZCTEOSA-N 1 0 321.505 4.238 20 10 DICDRO CCC[C@@H](O)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001620784913 1055960623 /nfs/dbraw/zinc/96/06/23/1055960623.db2.gz CSFNAFDOLREGPT-MRXNPFEDSA-N 1 0 321.505 4.238 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C/C=C\c2ccc(F)cc2F)c1 ZINC001620989580 1055961454 /nfs/dbraw/zinc/96/14/54/1055961454.db2.gz HMUARQQAQSLZII-VSQXVHSFSA-N 1 0 319.351 4.043 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cc(Cl)ccc1F ZINC001620787677 1055962224 /nfs/dbraw/zinc/96/22/24/1055962224.db2.gz HFFYBQLWLWQIKW-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO CCCOc1ccc(C[NH2+]CC[C@H]2CC2(Cl)Cl)cc1C ZINC001621015319 1055981719 /nfs/dbraw/zinc/98/17/19/1055981719.db2.gz VBTGUHLDFKRPKA-AWEZNQCLSA-N 1 0 316.272 4.457 20 10 DICDRO CC(C)[C@@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccccc1 ZINC001620709702 1055984205 /nfs/dbraw/zinc/98/42/05/1055984205.db2.gz UHUGERBLLYOQOM-GOSISDBHSA-N 1 0 314.448 4.421 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCO[C@@H]1CCCC[C@@H]1C ZINC001620721073 1055987264 /nfs/dbraw/zinc/98/72/64/1055987264.db2.gz FUWPNEGDCWXLKK-MGPUTAFESA-N 1 0 314.473 4.172 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CSc2ccccc21 ZINC001620807923 1056002114 /nfs/dbraw/zinc/00/21/14/1056002114.db2.gz TVSCNTAFJBJTQQ-INIZCTEOSA-N 1 0 308.450 4.423 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CCc2ccns2)cc1 ZINC001621048009 1056009280 /nfs/dbraw/zinc/00/92/80/1056009280.db2.gz NZXGLOWWKMRRFC-UHFFFAOYSA-N 1 0 317.502 4.102 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C(C)C)ccc2O)c1 ZINC001621316362 1056020378 /nfs/dbraw/zinc/02/03/78/1056020378.db2.gz FODDEIJRVGPJFZ-ZDUSSCGKSA-N 1 0 315.413 4.081 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000186326649 1056105913 /nfs/dbraw/zinc/10/59/13/1056105913.db2.gz CRGHQOCEIWJYIY-FTRWYGJKSA-N 1 0 312.457 4.043 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)c1 ZINC000765818599 1056182454 /nfs/dbraw/zinc/18/24/54/1056182454.db2.gz FUYYNRONXGCYQR-YOEHRIQHSA-N 1 0 313.445 4.206 20 10 DICDRO C[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)Cc1cccs1 ZINC001620821407 1056223568 /nfs/dbraw/zinc/22/35/68/1056223568.db2.gz VUYQIOYZSGBXQS-NBUZRDOWSA-N 1 0 314.498 4.296 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1nc(C)cs1 ZINC000921699363 1056334056 /nfs/dbraw/zinc/33/40/56/1056334056.db2.gz VVCVRWMGVFLLME-OAHLLOKOSA-N 1 0 302.443 4.017 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@@H]1CC[C@H](C2CC2)O1)C1CCCC1 ZINC001615466347 1056513457 /nfs/dbraw/zinc/51/34/57/1056513457.db2.gz XNCGVSHEYWNKHV-AZUAARDMSA-N 1 0 315.457 4.094 20 10 DICDRO CC[C@H](C)[C@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765943209 1056537568 /nfs/dbraw/zinc/53/75/68/1056537568.db2.gz ACXZSOAKMJKBCV-SQGPQFPESA-N 1 0 318.505 4.125 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(C)cc2O)CCO1 ZINC000186503246 1056563042 /nfs/dbraw/zinc/56/30/42/1056563042.db2.gz MVZNZROZESCWKE-QOKNQOGYSA-N 1 0 305.462 4.335 20 10 DICDRO CCC[N@H+](Cc1nsc2ccccc21)Cc1ccccc1O ZINC001615686538 1056565689 /nfs/dbraw/zinc/56/56/89/1056565689.db2.gz PNDQBMRWZVTPPZ-UHFFFAOYSA-N 1 0 312.438 4.414 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)cc1 ZINC001615960702 1056602506 /nfs/dbraw/zinc/60/25/06/1056602506.db2.gz KDIYIVFWFKNTIE-FQEVSTJZSA-N 1 0 323.484 4.219 20 10 DICDRO COc1cccc2[nH]cc(CC[NH2+][C@@H](C)c3ccc(C)cc3O)c21 ZINC000186507241 1056762096 /nfs/dbraw/zinc/76/20/96/1056762096.db2.gz QDGQTPGKBYOHCV-AWEZNQCLSA-N 1 0 324.424 4.084 20 10 DICDRO C[C@H]([NH2+][C@H]1Cc2cccc(Cl)c2C1)c1ccc(N(C)C)cc1 ZINC001168703637 1056882883 /nfs/dbraw/zinc/88/28/83/1056882883.db2.gz ICSXJLHGJWPGLL-BBRMVZONSA-N 1 0 314.860 4.224 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1O ZINC000922669393 1057047494 /nfs/dbraw/zinc/04/74/94/1057047494.db2.gz BPSYVXUCUCTXJV-ZDUSSCGKSA-N 1 0 303.377 4.089 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)c1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000186568468 1057051536 /nfs/dbraw/zinc/05/15/36/1057051536.db2.gz AWHHJRZPHAHDGL-CXAGYDPISA-N 1 0 317.502 4.362 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1ccc2ccccc2c1O ZINC000282382717 1057064210 /nfs/dbraw/zinc/06/42/10/1057064210.db2.gz JEQCDLSKHDDQSN-UGSOOPFHSA-N 1 0 321.424 4.007 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1nccs1 ZINC000186740298 1057106755 /nfs/dbraw/zinc/10/67/55/1057106755.db2.gz IRYSMMLKDQLZFZ-OLZOCXBDSA-N 1 0 316.470 4.182 20 10 DICDRO COc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(N(C)C)cc1C ZINC000766030993 1057135002 /nfs/dbraw/zinc/13/50/02/1057135002.db2.gz YNFNCNNWFZJBOD-NRFANRHFSA-N 1 0 324.468 4.237 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1O ZINC000186852501 1057135566 /nfs/dbraw/zinc/13/55/66/1057135566.db2.gz OFGFSSSWLXLUEC-DOMZBBRYSA-N 1 0 309.331 4.389 20 10 DICDRO CNc1ccc(-c2[nH+]ccc3c2ccn3Cc2ccccc2)cn1 ZINC001242068951 1057255121 /nfs/dbraw/zinc/25/51/21/1057255121.db2.gz ZBDWPRSEMWCNLT-UHFFFAOYSA-N 1 0 314.392 4.188 20 10 DICDRO c1csc(SCCC[NH2+][C@@H]2CCCc3ccccc32)n1 ZINC000766074197 1057285975 /nfs/dbraw/zinc/28/59/75/1057285975.db2.gz UFZHQFNDNTXICQ-OAHLLOKOSA-N 1 0 304.484 4.293 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766073631 1057286137 /nfs/dbraw/zinc/28/61/37/1057286137.db2.gz RSADJHJFIIMMFH-WDYCEAGBSA-N 1 0 318.505 4.245 20 10 DICDRO COc1cc(C[N@H+](C)Cc2cc(Cl)ccc2F)c(O)cc1C ZINC000766093124 1057323049 /nfs/dbraw/zinc/32/30/49/1057323049.db2.gz SFNWKURWERHXJO-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(Br)cc1O ZINC000756473659 1057360444 /nfs/dbraw/zinc/36/04/44/1057360444.db2.gz DKQUJBQXMAWUNP-RYUDHWBXSA-N 1 0 310.235 4.162 20 10 DICDRO CCc1cc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)on1 ZINC000766137517 1057374382 /nfs/dbraw/zinc/37/43/82/1057374382.db2.gz ZRVPPCDJJMKDLM-HNNXBMFYSA-N 1 0 313.445 4.078 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CCCC[C@@H]2C)ccc1OC ZINC000727468588 1057655640 /nfs/dbraw/zinc/65/56/40/1057655640.db2.gz TWEQFSQLKFOZSK-DOTOQJQBSA-N 1 0 305.462 4.148 20 10 DICDRO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000727643352 1057661623 /nfs/dbraw/zinc/66/16/23/1057661623.db2.gz RSCZMDVTPDFNBU-INIZCTEOSA-N 1 0 324.468 4.319 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC000727645281 1057662440 /nfs/dbraw/zinc/66/24/40/1057662440.db2.gz UWQXBEBLJNUPLD-INIZCTEOSA-N 1 0 324.468 4.319 20 10 DICDRO CCC[N@H+](CCO[C@H]1CCCC[C@@H]1C)Cc1ccccc1O ZINC000727830633 1057676401 /nfs/dbraw/zinc/67/64/01/1057676401.db2.gz FBRGVIPZRXBTLU-LPHOPBHVSA-N 1 0 305.462 4.200 20 10 DICDRO CCC[N@H+](CCO[C@@H]1CCCC[C@@H]1C)Cc1ccccc1O ZINC000727830634 1057676531 /nfs/dbraw/zinc/67/65/31/1057676531.db2.gz FBRGVIPZRXBTLU-QFBILLFUSA-N 1 0 305.462 4.200 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000730453706 1057715407 /nfs/dbraw/zinc/71/54/07/1057715407.db2.gz ACIMLJFRSZWLHR-OAHLLOKOSA-N 1 0 322.383 4.069 20 10 DICDRO CCc1cc(C[N@H+](C)C[C@@H]2CCCOC2)c(O)c(C(C)(C)C)c1 ZINC000730806731 1057726314 /nfs/dbraw/zinc/72/63/14/1057726314.db2.gz KCNUACJNXDSARI-INIZCTEOSA-N 1 0 319.489 4.111 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(F)c(C)c2)cc1F ZINC000731360567 1057742105 /nfs/dbraw/zinc/74/21/05/1057742105.db2.gz IZPSCHYBXCYFDQ-UHFFFAOYSA-N 1 0 318.411 4.409 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(C)c2)cc1F ZINC000731360529 1057742339 /nfs/dbraw/zinc/74/23/39/1057742339.db2.gz HUJOHWGELHJFSJ-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO COc1ccc(C[NH2+]CC2(Sc3ccccc3)CC2)cc1C ZINC000731678093 1057751736 /nfs/dbraw/zinc/75/17/36/1057751736.db2.gz CWRRLBBBGISIKD-UHFFFAOYSA-N 1 0 313.466 4.418 20 10 DICDRO c1ccc2c(c1)CC[C@@H]2C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000732229706 1057771447 /nfs/dbraw/zinc/77/14/47/1057771447.db2.gz BNJILKMFJJKONO-HXUWFJFHSA-N 1 0 320.480 4.497 20 10 DICDRO COc1ccc(C[NH2+]CCOc2ccccc2C(C)C)cc1C ZINC000732232163 1057771734 /nfs/dbraw/zinc/77/17/34/1057771734.db2.gz DJBCXLYGDBHVJQ-UHFFFAOYSA-N 1 0 313.441 4.296 20 10 DICDRO Oc1cc2c(cc1C[N@H+](Cc1ccc(F)cc1)C1CC1)CCC2 ZINC000732492790 1057775672 /nfs/dbraw/zinc/77/56/72/1057775672.db2.gz RIGNBDPZZYBVJN-UHFFFAOYSA-N 1 0 311.400 4.185 20 10 DICDRO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1cc(C)cc(OC)c1O ZINC000732526901 1057777743 /nfs/dbraw/zinc/77/77/43/1057777743.db2.gz WTOMQRAEIGPBGZ-OAHLLOKOSA-N 1 0 317.454 4.280 20 10 DICDRO CC[C@H]1c2ccsc2CC[N@H+]1Cc1cc(C)cc(OC)c1O ZINC000732526900 1057778012 /nfs/dbraw/zinc/77/80/12/1057778012.db2.gz WTOMQRAEIGPBGZ-HNNXBMFYSA-N 1 0 317.454 4.280 20 10 DICDRO COc1ccc(C[NH2+]C2(c3nc(C)cs3)CCCC2)cc1C ZINC000732985694 1057795851 /nfs/dbraw/zinc/79/58/51/1057795851.db2.gz NPOCLNQCYOFPPF-UHFFFAOYSA-N 1 0 316.470 4.328 20 10 DICDRO CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733326955 1057812855 /nfs/dbraw/zinc/81/28/55/1057812855.db2.gz IWYOGFALPSNJNS-KRWDZBQOSA-N 1 0 300.421 4.003 20 10 DICDRO Cc1ccccc1C1(C[NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000733327890 1057813656 /nfs/dbraw/zinc/81/36/56/1057813656.db2.gz ZMANYZUUQDBYPC-UHFFFAOYSA-N 1 0 312.432 4.022 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000733327275 1057813973 /nfs/dbraw/zinc/81/39/73/1057813973.db2.gz QZLCBWXJBJJYGT-UHFFFAOYSA-N 1 0 321.342 4.498 20 10 DICDRO C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]Cc1ccc(N)cc1 ZINC001246173657 1058715942 /nfs/dbraw/zinc/71/59/42/1058715942.db2.gz UWCAXYSQQJPCKN-NSHDSACASA-N 1 0 309.240 4.296 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(F)cc(F)c1 ZINC001559492483 1059268825 /nfs/dbraw/zinc/26/88/25/1059268825.db2.gz RJCJEADXUPDALP-UHFFFAOYSA-N 1 0 318.411 4.441 20 10 DICDRO CC/C=C\CC[N@H+](CC)Cc1cc(Br)ccc1O ZINC001559569444 1059401011 /nfs/dbraw/zinc/40/10/11/1059401011.db2.gz YSPOROSJFGEJSM-WAYWQWQTSA-N 1 0 312.251 4.333 20 10 DICDRO CCS[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N(C)CC)cc1 ZINC001559762910 1059600673 /nfs/dbraw/zinc/60/06/73/1059600673.db2.gz XEEWSMWBOUCNHE-ROUUACIJSA-N 1 0 306.519 4.297 20 10 DICDRO C[NH2+][C@@H](c1nc(-c2ccc(-n3c(C)ccc3C)cc2)no1)C(C)C ZINC001248206721 1059750238 /nfs/dbraw/zinc/75/02/38/1059750238.db2.gz ZSXQCILIUSNLAW-QGZVFWFLSA-N 1 0 324.428 4.061 20 10 DICDRO CC(C)c1ccc2c(c1)C[N@@H+](Cc1ccc(N(C)C)cc1)CC2 ZINC001559979458 1059783007 /nfs/dbraw/zinc/78/30/07/1059783007.db2.gz BAFXWQFQPQSJCL-UHFFFAOYSA-N 1 0 308.469 4.434 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2c3ccoc3ccc2F)cc1 ZINC001248546000 1059876313 /nfs/dbraw/zinc/87/63/13/1059876313.db2.gz XPHPYBCXPSXCDJ-UHFFFAOYSA-N 1 0 312.388 4.270 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCSc3ccccc32)cc1F ZINC001560250539 1060020011 /nfs/dbraw/zinc/02/00/11/1060020011.db2.gz XWDWOVURQDDBHU-INIZCTEOSA-N 1 0 316.445 4.218 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC001560283139 1060061669 /nfs/dbraw/zinc/06/16/69/1060061669.db2.gz ZOMSFRFPUDBUAX-MOEXGYKKSA-N 1 0 310.441 4.125 20 10 DICDRO COc1ccc(C)cc1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001560296884 1060079649 /nfs/dbraw/zinc/07/96/49/1060079649.db2.gz MTKVRTLZRLADNA-UHFFFAOYSA-N 1 0 324.468 4.284 20 10 DICDRO CC(C)[C@H]1CC[C@@H](C)C[C@H]1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001560300907 1060085552 /nfs/dbraw/zinc/08/55/52/1060085552.db2.gz ALVMQMGWMDDSQJ-AYOQOUSVSA-N 1 0 301.474 4.420 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCCc2cccc(F)c2)cc1 ZINC001560313974 1060101463 /nfs/dbraw/zinc/10/14/63/1060101463.db2.gz DMSWMSZBTSULJG-QPJJXVBHSA-N 1 0 312.432 4.127 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001560321959 1060110626 /nfs/dbraw/zinc/11/06/26/1060110626.db2.gz JQOFFFZMMPLVIS-LJQANCHMSA-N 1 0 323.436 4.187 20 10 DICDRO CCCOc1ccc(C[NH2+]CCN2CCCC[C@H]2CC)cc1C ZINC001560326535 1060111573 /nfs/dbraw/zinc/11/15/73/1060111573.db2.gz CHIUAJKTMMZZPY-LJQANCHMSA-N 1 0 318.505 4.138 20 10 DICDRO CCCOc1ccc(C[NH2+]CCN2CCCC[C@@H]2CC)cc1C ZINC001560326534 1060112813 /nfs/dbraw/zinc/11/28/13/1060112813.db2.gz CHIUAJKTMMZZPY-IBGZPJMESA-N 1 0 318.505 4.138 20 10 DICDRO Cc1ccc(C[C@H](C)[NH2+]C/C=C\c2ccc(N(C)C)cc2)s1 ZINC001560342838 1060128520 /nfs/dbraw/zinc/12/85/20/1060128520.db2.gz ITEWTSXMOATRDK-YVACAVLKSA-N 1 0 314.498 4.357 20 10 DICDRO CCS[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001560370129 1060158248 /nfs/dbraw/zinc/15/82/48/1060158248.db2.gz WZEFTZJAHTVDRN-MOPGFXCFSA-N 1 0 318.530 4.441 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[NH+]3C[C@H]4CCCC[C@@H]4C3)ccc2O1 ZINC001249223995 1060192336 /nfs/dbraw/zinc/19/23/36/1060192336.db2.gz QGVLGWAPMDRFRH-HUUCEWRRSA-N 1 0 313.441 4.198 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[NH+]3Cc4ccccc4C3)ccc2O1 ZINC001249224228 1060193700 /nfs/dbraw/zinc/19/37/00/1060193700.db2.gz VPLZEOQZLQIITF-UHFFFAOYSA-N 1 0 307.393 4.092 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CC[C@@H]4CCC[C@@H]4C3)ccc2O1 ZINC001249230505 1060196527 /nfs/dbraw/zinc/19/65/27/1060196527.db2.gz JNQPJRMZROURFC-LSDHHAIUSA-N 1 0 313.441 4.198 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[N@@H+]3CC[C@H]4CCC[C@H]4C3)ccc2O1 ZINC001249230502 1060198521 /nfs/dbraw/zinc/19/85/21/1060198521.db2.gz JNQPJRMZROURFC-CABCVRRESA-N 1 0 313.441 4.198 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCO[C@H](C(C)C)C2)cc1C ZINC001560415959 1060199726 /nfs/dbraw/zinc/19/97/26/1060199726.db2.gz GZGZNMGWALPTSF-HKUYNNGSSA-N 1 0 305.462 4.077 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[NH+]3CC4(C3)CCCCC4)ccc2O1 ZINC001249252194 1060200740 /nfs/dbraw/zinc/20/07/40/1060200740.db2.gz IMBQCORZOYUFPT-UHFFFAOYSA-N 1 0 313.441 4.343 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[NH+]3CC(c4ccccc4)C3)ccc2O1 ZINC001249252907 1060203109 /nfs/dbraw/zinc/20/31/09/1060203109.db2.gz ZZCLIJPNPRJMJN-UHFFFAOYSA-N 1 0 321.420 4.176 20 10 DICDRO COc1cc(C[NH2+]CC2(SC)CCC2)c(O)c(C(C)(C)C)c1 ZINC001560454168 1060244310 /nfs/dbraw/zinc/24/43/10/1060244310.db2.gz MGVVSXWTFVJGLG-UHFFFAOYSA-N 1 0 323.502 4.074 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2C[C@@H](C)O[C@@H]2C)cc1 ZINC001560508000 1060305215 /nfs/dbraw/zinc/30/52/15/1060305215.db2.gz IGHOOXJSOOIYMF-LMMKCTJWSA-N 1 0 318.505 4.216 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC001560515824 1060314749 /nfs/dbraw/zinc/31/47/49/1060314749.db2.gz KSSMRMRMXNUUPG-FPOVZHCZSA-N 1 0 308.469 4.426 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@H]1CCCCO1 ZINC001560518119 1060317294 /nfs/dbraw/zinc/31/72/94/1060317294.db2.gz JBDFHXHUIFQZAQ-WOJBJXKFSA-N 1 0 316.489 4.114 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)cc1F ZINC001560535358 1060341732 /nfs/dbraw/zinc/34/17/32/1060341732.db2.gz QVPHOGFSCOBILQ-IKGGRYGDSA-N 1 0 304.453 4.198 20 10 DICDRO CO[C@@]1(C)C[C@H]1[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001560540492 1060347088 /nfs/dbraw/zinc/34/70/88/1060347088.db2.gz PREOKPSHFQFCBB-UZLBHIALSA-N 1 0 319.489 4.254 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C2CCC2)[C@H]2CCCO2)cc1C ZINC001560547844 1060359147 /nfs/dbraw/zinc/35/91/47/1060359147.db2.gz STNUCPUCBSKVTE-WOJBJXKFSA-N 1 0 317.473 4.221 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)cc1F ZINC001560556781 1060367478 /nfs/dbraw/zinc/36/74/78/1060367478.db2.gz PRIRMBMABQHNSD-QGZVFWFLSA-N 1 0 318.823 4.322 20 10 DICDRO CCOc1ccc(Cl)cc1C[NH2+][C@H](C)c1ccccc1O ZINC001560575209 1060386647 /nfs/dbraw/zinc/38/66/47/1060386647.db2.gz FRVVFNQVTNXFAY-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCC2CC=CC2)c(C(F)(F)F)c1 ZINC001560585801 1060396800 /nfs/dbraw/zinc/39/68/00/1060396800.db2.gz LTNWRTFYGFAVPD-UHFFFAOYSA-N 1 0 312.379 4.217 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CC(C)(C)OC1(C)C ZINC001560600992 1060415538 /nfs/dbraw/zinc/41/55/38/1060415538.db2.gz IZQVIBPPANIZPP-OAHLLOKOSA-N 1 0 314.473 4.170 20 10 DICDRO CC[C@]1(C)CCC[N@H+](Cc2c(O)cccc2Br)C1 ZINC001560644503 1060467618 /nfs/dbraw/zinc/46/76/18/1060467618.db2.gz BJQUWACOKNTSID-OAHLLOKOSA-N 1 0 312.251 4.167 20 10 DICDRO CC1=CCC[C@@H](C)[C@H]1CN(C)c1ccc(OCC[NH+](C)C)cc1 ZINC001560738780 1060606831 /nfs/dbraw/zinc/60/68/31/1060606831.db2.gz WOEVBJHJNLLUBI-XLIONFOSSA-N 1 0 316.489 4.056 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](CC(F)(F)F)C(C)C)cc1Cl ZINC001560764803 1060629604 /nfs/dbraw/zinc/62/96/04/1060629604.db2.gz QLLSQQWSDADRDS-LBPRGKRZSA-N 1 0 309.759 4.421 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCCC2(CC2)C1 ZINC001560777002 1060640983 /nfs/dbraw/zinc/64/09/83/1060640983.db2.gz CNOVGRQFIQWMJZ-UHFFFAOYSA-N 1 0 323.436 4.347 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@H]2C)c1O ZINC001560786826 1060649080 /nfs/dbraw/zinc/64/90/80/1060649080.db2.gz CFBUJOPDMVSYBS-UPJWGTAASA-N 1 0 311.853 4.216 20 10 DICDRO C[N@H+](Cc1c(O)cccc1Br)[C@@H]1CCC(C)(C)C1 ZINC001560803621 1060662939 /nfs/dbraw/zinc/66/29/39/1060662939.db2.gz BESDEIHJXMIFGD-LLVKDONJSA-N 1 0 312.251 4.165 20 10 DICDRO C[N@H+](Cc1c(O)cccc1Br)[C@H]1CCC(C)(C)C1 ZINC001560803622 1060664402 /nfs/dbraw/zinc/66/44/02/1060664402.db2.gz BESDEIHJXMIFGD-NSHDSACASA-N 1 0 312.251 4.165 20 10 DICDRO CCCN(Cc1c(Cl)cncc1Cl)c1ccc(C[NH3+])cc1 ZINC001560808778 1060669546 /nfs/dbraw/zinc/66/95/46/1060669546.db2.gz QFMOACYLHVYMGI-UHFFFAOYSA-N 1 0 324.255 4.264 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)c1 ZINC001560815079 1060674040 /nfs/dbraw/zinc/67/40/40/1060674040.db2.gz QDFKHCUWGWNAGW-XUWVNRHRSA-N 1 0 303.446 4.410 20 10 DICDRO Cc1cc(O)c(C[NH+]2CC(Cc3ccccc3)C2)cc1Cl ZINC001560874464 1060734639 /nfs/dbraw/zinc/73/46/39/1060734639.db2.gz AEOYWSJPQYGQNZ-UHFFFAOYSA-N 1 0 301.817 4.029 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@H](C)Cc2cccc(F)c2)c1O ZINC001560879662 1060741451 /nfs/dbraw/zinc/74/14/51/1060741451.db2.gz HJMXMVLMLVJQSE-CQSZACIVSA-N 1 0 301.405 4.157 20 10 DICDRO CC1(C)CC2(CO1)CCC([NH2+]Cc1cc(Cl)ccc1O)CC2 ZINC001560913197 1060773342 /nfs/dbraw/zinc/77/33/42/1060773342.db2.gz JFDQPQYJAJPVLN-UHFFFAOYSA-N 1 0 323.864 4.263 20 10 DICDRO Cc1ccc(C2CC([NH2+]Cc3cc(Cl)ccc3O)C2)cc1 ZINC001560913371 1060774708 /nfs/dbraw/zinc/77/47/08/1060774708.db2.gz LRCCZAKDFWRSKN-UHFFFAOYSA-N 1 0 301.817 4.390 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)Cc2cccc3ccoc32)cc1 ZINC001560917544 1060778597 /nfs/dbraw/zinc/77/85/97/1060778597.db2.gz RPFUCOPEGZJUIY-UHFFFAOYSA-N 1 0 324.424 4.010 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CCCC[C@H]1Cc1ccccc1F ZINC001560920298 1060782490 /nfs/dbraw/zinc/78/24/90/1060782490.db2.gz AZPAPKGLMHOTBO-KRWDZBQOSA-N 1 0 317.379 4.268 20 10 DICDRO Cc1ccc2c(c1)C[N@@H+](Cc1c(O)cc(C)cc1Cl)CC2 ZINC001560922524 1060785710 /nfs/dbraw/zinc/78/57/10/1060785710.db2.gz YWPYRLOCUJVDKR-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001560927201 1060790845 /nfs/dbraw/zinc/79/08/45/1060790845.db2.gz LDJHPKPQVGQZOT-UHFFFAOYSA-N 1 0 300.160 4.128 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC2([C@@H]3CCCCO3)CCC2)cc1Cl ZINC001560953402 1060820544 /nfs/dbraw/zinc/82/05/44/1060820544.db2.gz LFAAKXHOXISOQI-KRWDZBQOSA-N 1 0 323.864 4.183 20 10 DICDRO Cc1cc(C[NH2+]Cc2cc(F)ccc2O)c(C)n1-c1ccccc1 ZINC001560964296 1060831200 /nfs/dbraw/zinc/83/12/00/1060831200.db2.gz BMIZAMGJZJDFBY-UHFFFAOYSA-N 1 0 324.399 4.229 20 10 DICDRO COc1ccc(C[N@@H+]2Cc3cccc(O)c3C2)cc1C(C)(C)C ZINC001560977536 1060841853 /nfs/dbraw/zinc/84/18/53/1060841853.db2.gz DFKOBEKIFPUCHL-UHFFFAOYSA-N 1 0 311.425 4.214 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@H+](C)Cc2ccc3cc[nH]c3c2)cc1 ZINC001560979712 1060844849 /nfs/dbraw/zinc/84/48/49/1060844849.db2.gz DRGAHEAEFUKAID-SNAWJCMRSA-N 1 0 319.452 4.379 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2cc3cnccc3o2)cc1Cl ZINC001560982169 1060847353 /nfs/dbraw/zinc/84/73/53/1060847353.db2.gz YPYDYGLRNJWPBR-NSHDSACASA-N 1 0 316.788 4.346 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@]12C[C@H]1CCC2 ZINC001561020015 1060877863 /nfs/dbraw/zinc/87/78/63/1060877863.db2.gz UTBQGVLDZJLGMZ-YLJYHZDGSA-N 1 0 309.409 4.003 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@H]2c2ccc(F)cc2)cc1 ZINC001561034947 1060888332 /nfs/dbraw/zinc/88/83/32/1060888332.db2.gz IDBUYAPIYBRMOJ-XQQSMPNESA-N 1 0 310.416 4.352 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)cc1 ZINC001561034946 1060889622 /nfs/dbraw/zinc/88/96/22/1060889622.db2.gz IDBUYAPIYBRMOJ-WUUFJKRQSA-N 1 0 310.416 4.352 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)[C@H](CCOC)c1ccccc1 ZINC001473195555 1060952594 /nfs/dbraw/zinc/95/25/94/1060952594.db2.gz DQOQSYZXVPDARN-LJQANCHMSA-N 1 0 313.441 4.382 20 10 DICDRO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001462172442 1060990447 /nfs/dbraw/zinc/99/04/47/1060990447.db2.gz BEUMFMJFFWULNJ-WSXGPOFGSA-N 1 0 312.379 4.039 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCC[C@@H](C(C)(C)C)CC2)c1O ZINC001462189556 1061011524 /nfs/dbraw/zinc/01/15/24/1061011524.db2.gz CENMTUITQTXLEM-HZPDHXFCSA-N 1 0 305.462 4.485 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCOc3ccccc3[C@H]2C)cc1 ZINC001473249372 1061024082 /nfs/dbraw/zinc/02/40/82/1061024082.db2.gz BJATVQXGNDYLBZ-MRXNPFEDSA-N 1 0 310.441 4.098 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nccc3ccccc32)c1 ZINC001462211056 1061028797 /nfs/dbraw/zinc/02/87/97/1061028797.db2.gz SZTKTJRQHWFYFL-KBPBESRZSA-N 1 0 322.408 4.361 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nccc3ccccc32)c1 ZINC001462211061 1061029784 /nfs/dbraw/zinc/02/97/84/1061029784.db2.gz SZTKTJRQHWFYFL-ZIAGYGMSSA-N 1 0 322.408 4.361 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@H](c3ccccc3F)C2)cc1 ZINC001462272920 1061065873 /nfs/dbraw/zinc/06/58/73/1061065873.db2.gz OJEBCDHWAQICEX-XFHJGTJQSA-N 1 0 324.443 4.394 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]CC2(C3CCC3)CCC2)c1O ZINC001462307867 1061096715 /nfs/dbraw/zinc/09/67/15/1061096715.db2.gz AIWSMKQRAUQYMP-UHFFFAOYSA-N 1 0 309.837 4.114 20 10 DICDRO Oc1c(C[N@@H+]2CCSC3(CCC3)CC2)ccc2ccccc21 ZINC001462345173 1061119289 /nfs/dbraw/zinc/11/92/89/1061119289.db2.gz XBZCMZCTLJSNIF-UHFFFAOYSA-N 1 0 313.466 4.407 20 10 DICDRO COc1cc(O)c(C[NH2+]CC2(C)CCC(C)(C)CC2)cc1OC ZINC001462347127 1061122215 /nfs/dbraw/zinc/12/22/15/1061122215.db2.gz CANFNWPJPMUTCD-UHFFFAOYSA-N 1 0 321.461 4.106 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)c1 ZINC001462388669 1061144670 /nfs/dbraw/zinc/14/46/70/1061144670.db2.gz WEGJXANPOLDFGK-GOSISDBHSA-N 1 0 303.446 4.049 20 10 DICDRO CC(C)[C@H]1[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC12CC=CC2 ZINC001462395344 1061147997 /nfs/dbraw/zinc/14/79/97/1061147997.db2.gz NCNPLQQUMRSUMU-WHXUGTBJSA-N 1 0 310.485 4.442 20 10 DICDRO CO[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)c(C)c1 ZINC001473420649 1061149973 /nfs/dbraw/zinc/14/99/73/1061149973.db2.gz SNUWKSQLKLUUDW-ICSRJNTNSA-N 1 0 316.489 4.033 20 10 DICDRO C[C@@H]([NH2+][C@@H]1C[C@@H](Oc2ccccc2)C1(C)C)c1ccccc1O ZINC001462510338 1061218967 /nfs/dbraw/zinc/21/89/67/1061218967.db2.gz FLQGGBKUJMLRFJ-NIKGAXFTSA-N 1 0 311.425 4.289 20 10 DICDRO CCSc1ccc(C[NH2+]Cc2ccc(Cl)cc2O)cc1 ZINC001462540050 1061247513 /nfs/dbraw/zinc/24/75/13/1061247513.db2.gz XGHYADRHBREBRS-UHFFFAOYSA-N 1 0 307.846 4.447 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@@H]2C[C@H]2Cc2ccccc2)c1 ZINC001462660206 1061321975 /nfs/dbraw/zinc/32/19/75/1061321975.db2.gz IZDLZACAYFMPKP-MOPGFXCFSA-N 1 0 309.453 4.484 20 10 DICDRO C[C@H]([NH2+]Cc1csc(Cc2ccccc2)n1)c1ccccc1O ZINC001473723257 1061372522 /nfs/dbraw/zinc/37/25/22/1061372522.db2.gz COMMTLCALLUPAI-AWEZNQCLSA-N 1 0 324.449 4.290 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)CC2)cc1 ZINC001473888888 1061449884 /nfs/dbraw/zinc/44/98/84/1061449884.db2.gz XUTCHOHJUNOXNC-OAQYLSRUSA-N 1 0 324.468 4.106 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCc2ccc(Cl)cc2)cc1 ZINC001473914642 1061462800 /nfs/dbraw/zinc/46/28/00/1061462800.db2.gz XCICYPGHDVPEDT-ONEGZZNKSA-N 1 0 314.860 4.252 20 10 DICDRO CCOCc1cc(C[NH2+]Cc2ccc(Cl)cc2)ccc1OC ZINC001473918857 1061467821 /nfs/dbraw/zinc/46/78/21/1061467821.db2.gz MEBHDPARZIAPKC-UHFFFAOYSA-N 1 0 319.832 4.175 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1)C1CC1 ZINC001473958186 1061498964 /nfs/dbraw/zinc/49/89/64/1061498964.db2.gz WYCCDMVDTGPFQM-KRWDZBQOSA-N 1 0 320.480 4.385 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C2(c3ccccc3)CCC2)cc1 ZINC001473966288 1061510335 /nfs/dbraw/zinc/51/03/35/1061510335.db2.gz SQOLBONSEROBOL-VURMDHGXSA-N 1 0 306.453 4.435 20 10 DICDRO CCCOc1ccc(C[NH2+]CCc2csc(CC)n2)cc1C ZINC001473973178 1061517476 /nfs/dbraw/zinc/51/74/76/1061517476.db2.gz FJQDZWABWDWHHL-UHFFFAOYSA-N 1 0 318.486 4.135 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2Cc3ccccc32)cc1F ZINC001473986201 1061528416 /nfs/dbraw/zinc/52/84/16/1061528416.db2.gz PSDLWDICVZLAJO-KRWDZBQOSA-N 1 0 312.432 4.101 20 10 DICDRO Cc1ccc(O[C@@H](C)C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001252164882 1061603096 /nfs/dbraw/zinc/60/30/96/1061603096.db2.gz SKCMLLPNOMKICI-SFHVURJKSA-N 1 0 324.468 4.152 20 10 DICDRO Cc1ccc(O[C@H](C)C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001252164881 1061603606 /nfs/dbraw/zinc/60/36/06/1061603606.db2.gz SKCMLLPNOMKICI-GOSISDBHSA-N 1 0 324.468 4.152 20 10 DICDRO Cc1c[nH+]c2ccccc2c1NCc1ccc(N2CCCC2)cc1 ZINC001252419541 1061642479 /nfs/dbraw/zinc/64/24/79/1061642479.db2.gz CHDKLUKBGRHLCK-UHFFFAOYSA-N 1 0 317.436 4.177 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCCc3sccc32)cc1 ZINC001474102763 1061650041 /nfs/dbraw/zinc/65/00/41/1061650041.db2.gz OAXZNEVQJZMNEL-SHCNBLLESA-N 1 0 312.482 4.495 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](C)c2nccs2)cc1C ZINC001474106418 1061655806 /nfs/dbraw/zinc/65/58/06/1061655806.db2.gz TYQNAJLOYMPMIA-AWEZNQCLSA-N 1 0 304.459 4.134 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](CO)CCC(C)(C)C)cc1C ZINC001474126433 1061674381 /nfs/dbraw/zinc/67/43/81/1061674381.db2.gz SMUWVVQBEAUEEE-QGZVFWFLSA-N 1 0 307.478 4.061 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCCSC2)cc1 ZINC001474161129 1061704333 /nfs/dbraw/zinc/70/43/33/1061704333.db2.gz WIZHNXFHKCGHKM-QGZVFWFLSA-N 1 0 306.519 4.298 20 10 DICDRO C[C@@](Cc1ccccc1)([NH2+]Cc1ccc2c(c1)CCO2)C1CC1 ZINC001474182212 1061730637 /nfs/dbraw/zinc/73/06/37/1061730637.db2.gz CXSWMAGTZUUWFC-NRFANRHFSA-N 1 0 307.437 4.123 20 10 DICDRO Cc1ccc(CC(C)(C)[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC001474183619 1061731938 /nfs/dbraw/zinc/73/19/38/1061731938.db2.gz GVSNYCZDSMKISL-UHFFFAOYSA-N 1 0 314.448 4.311 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)cs1 ZINC001474185402 1061734384 /nfs/dbraw/zinc/73/43/84/1061734384.db2.gz RCMFVWZGIJHZJT-AWEZNQCLSA-N 1 0 302.487 4.152 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](c2ccccc2)C(C)C)c1 ZINC001474196248 1061747449 /nfs/dbraw/zinc/74/74/49/1061747449.db2.gz PNCYFSCJHQUOJZ-BEFAXECRSA-N 1 0 313.441 4.491 20 10 DICDRO CO[C@H]1C[C@H]([NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC001474226700 1061789375 /nfs/dbraw/zinc/78/93/75/1061789375.db2.gz YBHQHHQBUAWVJK-WKILWMFISA-N 1 0 319.489 4.254 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)[C@@H]2CCCCO2)cc1F ZINC001474240997 1061806306 /nfs/dbraw/zinc/80/63/06/1061806306.db2.gz FWGWYSYKAWKZAM-SFHVURJKSA-N 1 0 322.468 4.109 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CC(Nc3ccccc3)C2)c(Cl)c1 ZINC001474257918 1061825504 /nfs/dbraw/zinc/82/55/04/1061825504.db2.gz TUUXWOSCTQSMBD-UHFFFAOYSA-N 1 0 316.832 4.087 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C(C)(C)c2ccc(F)cc2)cc1 ZINC001474268194 1061836849 /nfs/dbraw/zinc/83/68/49/1061836849.db2.gz HLSFFBJEMWJUTR-AATRIKPKSA-N 1 0 312.432 4.430 20 10 DICDRO CCCOc1ccc(C[NH2+]CC[C@@H]2CCC(C)(C)CO2)cc1C ZINC001474283383 1061853012 /nfs/dbraw/zinc/85/30/12/1061853012.db2.gz PBMXSGVFMPZFFZ-SFHVURJKSA-N 1 0 319.489 4.469 20 10 DICDRO CC[C@@H](C)[C@H](C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)OC ZINC001474307586 1061873088 /nfs/dbraw/zinc/87/30/88/1061873088.db2.gz ORFOAAOGSABXQU-XLIONFOSSA-N 1 0 318.505 4.170 20 10 DICDRO CCC[N@H+](Cc1cccc(CC)c1O)[C@H]1C[C@H](OCC)C1(C)C ZINC001474316374 1061886452 /nfs/dbraw/zinc/88/64/52/1061886452.db2.gz AGZLHRLAJGFCPH-ROUUACIJSA-N 1 0 319.489 4.370 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@@H](C)Cc2ccc(C)cc2)c1O ZINC001474324162 1061905505 /nfs/dbraw/zinc/90/55/05/1061905505.db2.gz MZKUJCNMAPSVDQ-INIZCTEOSA-N 1 0 313.441 4.081 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H]2Cc2ccc(F)cc2)c1O ZINC001474329169 1061919192 /nfs/dbraw/zinc/91/91/92/1061919192.db2.gz BGRGEIMXOQSIDB-LJQANCHMSA-N 1 0 313.416 4.301 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@H](C)CC2)c(O)c(C(C)(C)C)c1 ZINC001474338848 1061935031 /nfs/dbraw/zinc/93/50/31/1061935031.db2.gz GMVLRMQVPYGYQR-AWEZNQCLSA-N 1 0 305.462 4.320 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)Cc2cccs2)cc1)C1CC1 ZINC001474382019 1062028977 /nfs/dbraw/zinc/02/89/77/1062028977.db2.gz ZMPPDMYAJPKBAU-UHFFFAOYSA-N 1 0 300.471 4.369 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cc3cccnc3o2)cc1 ZINC001474398609 1062054697 /nfs/dbraw/zinc/05/46/97/1062054697.db2.gz WOSSELAQPCPMJP-UHFFFAOYSA-N 1 0 323.440 4.306 20 10 DICDRO COc1cc(C[N@H+](C)[C@H](C)c2ccco2)c(O)c(C(C)(C)C)c1 ZINC001474400922 1062055850 /nfs/dbraw/zinc/05/58/50/1062055850.db2.gz BTJPOPHSCPNACQ-CYBMUJFWSA-N 1 0 317.429 4.484 20 10 DICDRO Cc1cc(Br)cc(C[N@H+](C2CC2)C2CCCC2)c1O ZINC001474414382 1062085824 /nfs/dbraw/zinc/08/58/24/1062085824.db2.gz BEBXVJSQQBQRFW-UHFFFAOYSA-N 1 0 324.262 4.370 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cccc3cc[nH]c32)c(Cl)c1 ZINC001474445671 1062123571 /nfs/dbraw/zinc/12/35/71/1062123571.db2.gz ISPZIAYTQNBOKA-UHFFFAOYSA-N 1 0 300.789 4.125 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@H](C)CCC2CC2)c1O ZINC001474466854 1062145206 /nfs/dbraw/zinc/14/52/06/1062145206.db2.gz MXOVCLAGYJXAQF-LLVKDONJSA-N 1 0 312.251 4.131 20 10 DICDRO CCC[C@@]1(COC)CCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001474476800 1062155482 /nfs/dbraw/zinc/15/54/82/1062155482.db2.gz IKPSPAICTOBPCS-IEJURRBGSA-N 1 0 316.489 4.047 20 10 DICDRO CCC[C@]1(COC)CCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001474476798 1062155534 /nfs/dbraw/zinc/15/55/34/1062155534.db2.gz IKPSPAICTOBPCS-CPSHHHPTSA-N 1 0 316.489 4.047 20 10 DICDRO CCCN(Cc1ccc(Cl)cc1F)c1ccc(C[NH3+])cc1 ZINC001474496674 1062176271 /nfs/dbraw/zinc/17/62/71/1062176271.db2.gz VFWTZISYFUIRTJ-UHFFFAOYSA-N 1 0 306.812 4.354 20 10 DICDRO CCCOC1(C[NH2+]Cc2ccc(N(C)C)cc2C)CCCCC1 ZINC001474503234 1062184007 /nfs/dbraw/zinc/18/40/07/1062184007.db2.gz IWXDZMKPCMXHDN-UHFFFAOYSA-N 1 0 318.505 4.280 20 10 DICDRO CCC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1C[C@H](OCC)C1(C)C ZINC001459528408 1062185909 /nfs/dbraw/zinc/18/59/09/1062185909.db2.gz IROJBJQLAQUWNP-MOPGFXCFSA-N 1 0 318.505 4.168 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCC(=C3CCC3)CC2)c1 ZINC001474505471 1062189168 /nfs/dbraw/zinc/18/91/68/1062189168.db2.gz SYEOHLIRKDJNPO-CYBMUJFWSA-N 1 0 301.430 4.475 20 10 DICDRO COc1cc(C)c(C[NH2+]Cc2cc3ccccc3s2)c(O)c1 ZINC001474541889 1062231272 /nfs/dbraw/zinc/23/12/72/1062231272.db2.gz MZGOHOHLGHBWEC-UHFFFAOYSA-N 1 0 313.422 4.214 20 10 DICDRO COC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C)c1ccc(C)o1 ZINC001254721950 1062243264 /nfs/dbraw/zinc/24/32/64/1062243264.db2.gz XBRISWFGCYHALY-SNPRPXQTSA-N 1 0 315.413 4.128 20 10 DICDRO Oc1cc(Br)ccc1C[NH+]1CC(C2CCCCC2)C1 ZINC001474568747 1062274760 /nfs/dbraw/zinc/27/47/60/1062274760.db2.gz KTPYNBLNMMEYFT-UHFFFAOYSA-N 1 0 324.262 4.167 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C2CC(C)(C)C2)c(C(F)(F)F)c1 ZINC001474570773 1062276924 /nfs/dbraw/zinc/27/69/24/1062276924.db2.gz KECRQCKVJLDTNW-UHFFFAOYSA-N 1 0 314.395 4.392 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CC3(CCCC3)[C@H]2C(C)C)c(O)c1 ZINC001474578335 1062287440 /nfs/dbraw/zinc/28/74/40/1062287440.db2.gz TXEPGNVLYOOAHC-GOSISDBHSA-N 1 0 303.446 4.110 20 10 DICDRO COc1cc(C[N@@H+]2C[C@H](C)[C@H](C)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001474588821 1062301031 /nfs/dbraw/zinc/30/10/31/1062301031.db2.gz MWRJRNUFYSARHB-IHRRRGAJSA-N 1 0 305.462 4.175 20 10 DICDRO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC001474592953 1062304604 /nfs/dbraw/zinc/30/46/04/1062304604.db2.gz YFVMUZDZCHLMJN-RCCFBDPRSA-N 1 0 318.505 4.326 20 10 DICDRO CCC(C)(C)[C@H](C)[NH2+]Cc1cc(Br)cc(C)c1O ZINC001474627018 1062346612 /nfs/dbraw/zinc/34/66/12/1062346612.db2.gz YNSQZDJBNOTXQJ-NSHDSACASA-N 1 0 314.267 4.377 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2CC(c3ccc(Cl)cc3)C2)c1 ZINC001474634924 1062356445 /nfs/dbraw/zinc/35/64/45/1062356445.db2.gz JHUIRRUNVFWJRV-UHFFFAOYSA-N 1 0 301.817 4.390 20 10 DICDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1(CC)CC ZINC001459756246 1062365730 /nfs/dbraw/zinc/36/57/30/1062365730.db2.gz VKDYPLXKCPFWCN-OALUTQOASA-N 1 0 318.505 4.168 20 10 DICDRO CC1(C)C[C@@]1([NH2+]Cc1ccc(Cl)cc1O)c1ccccc1 ZINC001474647601 1062373570 /nfs/dbraw/zinc/37/35/70/1062373570.db2.gz QUWWQQYTHUAALZ-GOSISDBHSA-N 1 0 301.817 4.461 20 10 DICDRO Oc1c(C[NH+]2CC(Cc3cccs3)C2)ccc2ccccc21 ZINC001474655899 1062385873 /nfs/dbraw/zinc/38/58/73/1062385873.db2.gz YTLFKDNCHMLBTN-UHFFFAOYSA-N 1 0 309.434 4.281 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H]2CCCC[C@@H]2C(C)(C)C)c1O ZINC001459790405 1062402252 /nfs/dbraw/zinc/40/22/52/1062402252.db2.gz DNENQBFYKHLYKV-DLBZAZTESA-N 1 0 321.436 4.428 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC001474707018 1062434892 /nfs/dbraw/zinc/43/48/92/1062434892.db2.gz VWYAHOHHSGSBKJ-ZDUSSCGKSA-N 1 0 314.385 4.275 20 10 DICDRO CSCC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC001474732628 1062453195 /nfs/dbraw/zinc/45/31/95/1062453195.db2.gz BQBMTSSDVGXIEK-UHFFFAOYSA-N 1 0 301.455 4.120 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCO[C@@H](C(C)(C)C)CC2)c1 ZINC001474754891 1062465421 /nfs/dbraw/zinc/46/54/21/1062465421.db2.gz DPZJPXPGLABAAR-GOSISDBHSA-N 1 0 305.462 4.153 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Cl)cc1O)c1cc(F)ccc1N(C)C ZINC001474760124 1062469803 /nfs/dbraw/zinc/46/98/03/1062469803.db2.gz HHZOWZURNHHOCG-LLVKDONJSA-N 1 0 322.811 4.102 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)c(O)c1 ZINC001255697692 1062524118 /nfs/dbraw/zinc/52/41/18/1062524118.db2.gz SEDWOGHKDWELJA-STQMWFEESA-N 1 0 301.352 4.220 20 10 DICDRO Cc1cccc(C[NH2+][C@H](C)CSc2ccc(F)cc2)c1O ZINC001255736319 1062560400 /nfs/dbraw/zinc/56/04/00/1062560400.db2.gz WGSQBLGUGFVLDK-CYBMUJFWSA-N 1 0 305.418 4.110 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H]2CCO[C@@H](c3ccccc3)C2)c(O)c1 ZINC001256798236 1062984910 /nfs/dbraw/zinc/98/49/10/1062984910.db2.gz OJLWBVXMNIIXCB-FXAWDEMLSA-N 1 0 311.425 4.019 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCO[C@@H](c3ccccc3)C2)cc1C ZINC001256800111 1062988730 /nfs/dbraw/zinc/98/87/30/1062988730.db2.gz YURJGYUMLWFWFI-UYAOXDASSA-N 1 0 311.425 4.014 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCO[C@H](c2ccccc2)C1 ZINC001256819612 1062998397 /nfs/dbraw/zinc/99/83/97/1062998397.db2.gz DOKLIQCILTYKCC-ICSRJNTNSA-N 1 0 311.425 4.134 20 10 DICDRO CCCOc1ccc(C[NH2+]CCc2ccccc2OC)cc1C ZINC001460990095 1063168564 /nfs/dbraw/zinc/16/85/64/1063168564.db2.gz UXXOYRNNNQWVGW-UHFFFAOYSA-N 1 0 313.441 4.125 20 10 DICDRO c1ccc2c(c1)CCC[C@H]2C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001461018145 1063192253 /nfs/dbraw/zinc/19/22/53/1063192253.db2.gz BTWRCHFDDOVLEH-IBGZPJMESA-N 1 0 307.437 4.221 20 10 DICDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC001461051908 1063218547 /nfs/dbraw/zinc/21/85/47/1063218547.db2.gz BNZGCSZUWBNOPR-FUHWJXTLSA-N 1 0 318.530 4.156 20 10 DICDRO CCCCCC[C@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001257369168 1063232855 /nfs/dbraw/zinc/23/28/55/1063232855.db2.gz OOBPDIVFTKPDJL-SFHVURJKSA-N 1 0 318.505 4.314 20 10 DICDRO COc1ccc(C[NH2+]CCOc2ccc3ccccc3c2)cc1C ZINC001461077907 1063236539 /nfs/dbraw/zinc/23/65/39/1063236539.db2.gz CGIZJCJBPRJPOG-UHFFFAOYSA-N 1 0 321.420 4.325 20 10 DICDRO C/C(=C/c1ccccc1)C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001461111804 1063261590 /nfs/dbraw/zinc/26/15/90/1063261590.db2.gz IGFSVTXPHPLPKS-LGMDPLHJSA-N 1 0 306.453 4.262 20 10 DICDRO CCC[C@H](C)CC[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001257463766 1063287692 /nfs/dbraw/zinc/28/76/92/1063287692.db2.gz PXIYGBJPHBPTQB-ZWKOTPCHSA-N 1 0 318.505 4.218 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)cc1F ZINC001461180986 1063313124 /nfs/dbraw/zinc/31/31/24/1063313124.db2.gz IVSMJGHYTKYTKM-QLPKVWCKSA-N 1 0 304.453 4.340 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccc(C)cc2)cc1F ZINC001461209446 1063336126 /nfs/dbraw/zinc/33/61/26/1063336126.db2.gz WUFSFNDWWOQFNU-UHFFFAOYSA-N 1 0 314.448 4.313 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC2(c3cccc(F)c3)CC2)cc1 ZINC001461227515 1063349566 /nfs/dbraw/zinc/34/95/66/1063349566.db2.gz SLPMAOXDDVZZBB-SNAWJCMRSA-N 1 0 324.443 4.226 20 10 DICDRO CCO[C@@H](CC[NH2+]Cc1c(C)c2ccccc2n1C)C(C)C ZINC001461269482 1063379870 /nfs/dbraw/zinc/37/98/70/1063379870.db2.gz SFOBKIWKTJBTRZ-IBGZPJMESA-N 1 0 302.462 4.028 20 10 DICDRO Cc1cccc(C)c1CC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001461285622 1063391920 /nfs/dbraw/zinc/39/19/20/1063391920.db2.gz GVAVQTAVGVMBEL-RMKNXTFCSA-N 1 0 308.469 4.215 20 10 DICDRO CC[C@@H](CC(F)F)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001473114363 1063416481 /nfs/dbraw/zinc/41/64/81/1063416481.db2.gz CLOPRDZMTFEBFV-AWEZNQCLSA-N 1 0 310.432 4.398 20 10 DICDRO CC(C)CSCCC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001461354187 1063438286 /nfs/dbraw/zinc/43/82/86/1063438286.db2.gz LNHPJCXGIMXLHC-ALCCZGGFSA-N 1 0 306.519 4.135 20 10 DICDRO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001473150530 1063455126 /nfs/dbraw/zinc/45/51/26/1063455126.db2.gz OCKPUGWEOJHOEJ-HXUWFJFHSA-N 1 0 324.468 4.488 20 10 DICDRO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC001461399051 1063471264 /nfs/dbraw/zinc/47/12/64/1063471264.db2.gz DRLXZZZTOYJWAZ-CQSZACIVSA-N 1 0 318.411 4.498 20 10 DICDRO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@@H](C)CO1 ZINC001473174192 1063480120 /nfs/dbraw/zinc/48/01/20/1063480120.db2.gz VHKLOAHHVLFPBZ-UWJYYQICSA-N 1 0 324.468 4.023 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)C[C@@H](O)c1ccccc1 ZINC001461416495 1063486371 /nfs/dbraw/zinc/48/63/71/1063486371.db2.gz XFGDDFDEZFUWLH-QVKFZJNVSA-N 1 0 322.452 4.089 20 10 DICDRO CCOCc1cc(C[NH2+]CC(C(C)C)C(C)C)ccc1OC ZINC001461431275 1063496399 /nfs/dbraw/zinc/49/63/99/1063496399.db2.gz BNRNPDBTRUURCF-UHFFFAOYSA-N 1 0 307.478 4.250 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC001461460320 1063519372 /nfs/dbraw/zinc/51/93/72/1063519372.db2.gz GSTYKUDRBFZITB-SCAQPMJSSA-N 1 0 314.473 4.170 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C2CC(c3ccccc3)C2)cc1 ZINC001461466327 1063525225 /nfs/dbraw/zinc/52/52/25/1063525225.db2.gz XAVWNRBFXCWPLD-SREVYHEPSA-N 1 0 306.453 4.302 20 10 DICDRO CCCOc1ccc(C[NH2+]CC(C)(C)c2cccnc2)cc1C ZINC001461574874 1063587878 /nfs/dbraw/zinc/58/78/78/1063587878.db2.gz AZVOUXGUBCOTKM-UHFFFAOYSA-N 1 0 312.457 4.246 20 10 DICDRO Clc1ccccc1C1([NH2+]Cc2ccc3c(c2)CCO3)CCC1 ZINC001461616489 1063614565 /nfs/dbraw/zinc/61/45/65/1063614565.db2.gz LVJASQOHVHWMBI-UHFFFAOYSA-N 1 0 313.828 4.444 20 10 DICDRO Cc1cc[nH+]c(NCc2cc(F)c(N(C)C)cc2F)c1C1CC1 ZINC001461615478 1063615517 /nfs/dbraw/zinc/61/55/17/1063615517.db2.gz MSHHHYXZKKCGJJ-UHFFFAOYSA-N 1 0 317.383 4.224 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)cc1C ZINC001461628768 1063622791 /nfs/dbraw/zinc/62/27/91/1063622791.db2.gz HBEFENYYTCTXLJ-OAGGEKHMSA-N 1 0 309.400 4.307 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC(C)(C)C(O)(CC)CC)cc1 ZINC001461630143 1063624735 /nfs/dbraw/zinc/62/47/35/1063624735.db2.gz OZXSLKBVAIZYIT-UHFFFAOYSA-N 1 0 320.521 4.200 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2cc(C)n(-c3ccccc3)c2C)o1 ZINC001461682782 1063654550 /nfs/dbraw/zinc/65/45/50/1063654550.db2.gz IGMNPTUYRLIMBQ-UHFFFAOYSA-N 1 0 324.424 4.376 20 10 DICDRO CCCCC[C@@H](CC)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258446764 1063659112 /nfs/dbraw/zinc/65/91/12/1063659112.db2.gz UNRAYJVYMBPLKH-LJQANCHMSA-N 1 0 318.505 4.314 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2C[C@@H]2C2CCCC2)ccc1OC ZINC001461830702 1063740435 /nfs/dbraw/zinc/74/04/35/1063740435.db2.gz NEGHVQRQJKQVMK-PKOBYXMFSA-N 1 0 317.473 4.148 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2C[C@@H]2C2CCCC2)ccc1OC ZINC001461830700 1063741366 /nfs/dbraw/zinc/74/13/66/1063741366.db2.gz NEGHVQRQJKQVMK-IEBWSBKVSA-N 1 0 317.473 4.148 20 10 DICDRO CCC1(CC)[C@@H](OC)C[C@@H]1[N@H+](C)Cc1ccc(N(C)C)cc1C ZINC001461861192 1063753154 /nfs/dbraw/zinc/75/31/54/1063753154.db2.gz KHJSBGCAZMLPKC-OALUTQOASA-N 1 0 318.505 4.087 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)CC2CCCC2)c(C(F)(F)F)c1 ZINC001461890450 1063779684 /nfs/dbraw/zinc/77/96/84/1063779684.db2.gz ZZHXLTIOYIGLMF-UHFFFAOYSA-N 1 0 314.395 4.393 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H](C)Cc2cccc(Cl)c2)c(O)c1 ZINC001258741013 1063790385 /nfs/dbraw/zinc/79/03/85/1063790385.db2.gz FESHEGHVVPMTJQ-AWEZNQCLSA-N 1 0 303.833 4.383 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H](C)Cc2cccc(Cl)c2)c(O)c1 ZINC001258741017 1063790626 /nfs/dbraw/zinc/79/06/26/1063790626.db2.gz FESHEGHVVPMTJQ-CQSZACIVSA-N 1 0 303.833 4.383 20 10 DICDRO CC(C)C[C@H]1CCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001461917031 1063798533 /nfs/dbraw/zinc/79/85/33/1063798533.db2.gz RQRVCGYJSBYXST-OAHLLOKOSA-N 1 0 310.432 4.431 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1F ZINC001461919137 1063800888 /nfs/dbraw/zinc/80/08/88/1063800888.db2.gz JKHPNPYQDQZKJZ-HNNXBMFYSA-N 1 0 316.395 4.020 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](C3CC3)C2)c(C(F)(F)F)c1 ZINC001461922751 1063803951 /nfs/dbraw/zinc/80/39/51/1063803951.db2.gz ZSRUYMJNNVVDOU-CYBMUJFWSA-N 1 0 312.379 4.003 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H]2C2CCCC2)cc1F ZINC001461938359 1063822138 /nfs/dbraw/zinc/82/21/38/1063822138.db2.gz XVLPYHPTMMCWPR-KRWDZBQOSA-N 1 0 308.416 4.185 20 10 DICDRO CC[C@H](C)C[C@H](CC)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258795492 1063830539 /nfs/dbraw/zinc/83/05/39/1063830539.db2.gz RSFCWHKWFITGLS-HKUYNNGSSA-N 1 0 318.505 4.170 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@H](C)Cc2ccccc2OC)c1O ZINC001461949447 1063833509 /nfs/dbraw/zinc/83/35/09/1063833509.db2.gz MCJCKWOWWTYARV-OAHLLOKOSA-N 1 0 313.441 4.026 20 10 DICDRO Cc1csc(CCC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)n1 ZINC001261137958 1063910180 /nfs/dbraw/zinc/91/01/80/1063910180.db2.gz BLHHIGOPWKKFIZ-LBPRGKRZSA-N 1 0 324.877 4.402 20 10 DICDRO CO[C@@](C)([C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C)C1CC1 ZINC001261366005 1063920676 /nfs/dbraw/zinc/92/06/76/1063920676.db2.gz FLECSEGAIVCTQN-CFLYGVGMSA-N 1 0 303.446 4.042 20 10 DICDRO CSCc1cccc(C[NH2+]Cc2ccc(Cl)cc2O)c1 ZINC001462118612 1063938594 /nfs/dbraw/zinc/93/85/94/1063938594.db2.gz RTHXBRLGGKBICP-UHFFFAOYSA-N 1 0 307.846 4.198 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1noc2ccccc12 ZINC001262033861 1063955031 /nfs/dbraw/zinc/95/50/31/1063955031.db2.gz KYXGZNHAUZIKOD-OCCSQVGLSA-N 1 0 308.381 4.180 20 10 DICDRO Cc1cnc([C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)s1 ZINC001262192544 1063959016 /nfs/dbraw/zinc/95/90/16/1063959016.db2.gz JFMQYKKKVZBNNP-QGZVFWFLSA-N 1 0 314.454 4.017 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](C1CC1)[C@H]1CCCOC1 ZINC001262207196 1063960969 /nfs/dbraw/zinc/96/09/69/1063960969.db2.gz VVUAOCSWHJDVBB-WJCADGGCSA-N 1 0 315.457 4.044 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H]2CC3CCC2CC3)c1O ZINC000381984363 1063996866 /nfs/dbraw/zinc/99/68/66/1063996866.db2.gz WWJUNTPQFKILPF-OCLKLICZSA-N 1 0 323.864 4.359 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000390214605 1064151098 /nfs/dbraw/zinc/15/10/98/1064151098.db2.gz FVOZVYPNNGZPKA-MRXNPFEDSA-N 1 0 308.469 4.482 20 10 DICDRO COCc1cccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC000390964350 1064176194 /nfs/dbraw/zinc/17/61/94/1064176194.db2.gz MBTBMQWHXFYCPA-RHSMWYFYSA-N 1 0 311.425 4.185 20 10 DICDRO COCc1ccccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000390973535 1064177010 /nfs/dbraw/zinc/17/70/10/1064177010.db2.gz PWNSFPITLTZMCY-YOEHRIQHSA-N 1 0 311.425 4.185 20 10 DICDRO CCCC[C@H]1CCC[C@H]1[NH2+]Cc1cc(F)cc(C(C)=O)c1O ZINC001307657301 1065546767 /nfs/dbraw/zinc/54/67/67/1065546767.db2.gz MGQQOAKFDKWUKO-SUMWQHHRSA-N 1 0 307.409 4.182 20 10 DICDRO CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1cc(F)cc(C(C)=O)c1O ZINC001307657298 1065546955 /nfs/dbraw/zinc/54/69/55/1065546955.db2.gz MGQQOAKFDKWUKO-CXAGYDPISA-N 1 0 307.409 4.182 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2O)c(Br)c1 ZINC001308009941 1065723689 /nfs/dbraw/zinc/72/36/89/1065723689.db2.gz IEEMLWHSSHDIQA-GFCCVEGCSA-N 1 0 320.230 4.314 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)Cc2cccnc2)ccc1N1CCCCC1 ZINC001308149653 1065782441 /nfs/dbraw/zinc/78/24/41/1065782441.db2.gz QJKGOKPSTJZRAJ-SFHVURJKSA-N 1 0 323.484 4.101 20 10 DICDRO CCCOc1ccc(C[NH2+]CCOc2cccc(C)c2)cc1C ZINC001308183707 1065795087 /nfs/dbraw/zinc/79/50/87/1065795087.db2.gz NUOVHBWNCXPHLR-UHFFFAOYSA-N 1 0 313.441 4.261 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c(Cl)c1 ZINC001308207963 1065814131 /nfs/dbraw/zinc/81/41/31/1065814131.db2.gz JLMLONHOCOFCPX-YPMHNXCESA-N 1 0 305.805 4.360 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c(Cl)c1 ZINC001308207962 1065815436 /nfs/dbraw/zinc/81/54/36/1065815436.db2.gz JLMLONHOCOFCPX-WCQYABFASA-N 1 0 305.805 4.360 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](C)Cc2cccs2)ccc1OC ZINC001308258171 1065860667 /nfs/dbraw/zinc/86/06/67/1065860667.db2.gz YKTRYQBCRAKCGS-CQSZACIVSA-N 1 0 319.470 4.014 20 10 DICDRO C[C@H]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC001308258597 1065860887 /nfs/dbraw/zinc/86/08/87/1065860887.db2.gz LUSOEWRKXPMOCC-MQMHXKEQSA-N 1 0 314.395 4.440 20 10 DICDRO c1ccc2c(c1)CC[C@@H]2C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001308266648 1065865758 /nfs/dbraw/zinc/86/57/58/1065865758.db2.gz RCHLXFQCBATLLQ-LJQANCHMSA-N 1 0 306.453 4.106 20 10 DICDRO c1ccc2c(c1)CC[C@H]2C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001308266646 1065866169 /nfs/dbraw/zinc/86/61/69/1065866169.db2.gz RCHLXFQCBATLLQ-IBGZPJMESA-N 1 0 306.453 4.106 20 10 DICDRO Cc1cccc(O[C@H](C)C[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC001308275330 1065875343 /nfs/dbraw/zinc/87/53/43/1065875343.db2.gz QXYRALMPASUGOC-JHTBKMLMSA-N 1 0 324.468 4.131 20 10 DICDRO Cc1ccc(O[C@H](C)C[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001308287208 1065884310 /nfs/dbraw/zinc/88/43/10/1065884310.db2.gz SPLYETLCHJFJSP-OOFWQKGWSA-N 1 0 324.468 4.131 20 10 DICDRO CCCCO[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1(C)C ZINC001308303372 1065898550 /nfs/dbraw/zinc/89/85/50/1065898550.db2.gz OGDUFBRBFMIYIK-RTBURBONSA-N 1 0 317.473 4.085 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCC2Cc3ccccc3C2)c(Cl)c1 ZINC001308371627 1065947230 /nfs/dbraw/zinc/94/72/30/1065947230.db2.gz ISUWXBQVILGXLT-UHFFFAOYSA-N 1 0 315.844 4.249 20 10 DICDRO COc1cc(C[NH2+]C[C@H]2CCC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308382290 1065953914 /nfs/dbraw/zinc/95/39/14/1065953914.db2.gz DRXQNFHQDUKMCC-ZIAGYGMSSA-N 1 0 305.462 4.224 20 10 DICDRO Fc1cccc([C@H]2C[C@H]([NH2+]Cc3ccc4c(c3)CCCO4)C2)c1 ZINC001308385091 1065955453 /nfs/dbraw/zinc/95/54/53/1065955453.db2.gz LAIOHKGAIPTZQE-UAPYVXQJSA-N 1 0 311.400 4.187 20 10 DICDRO CC1(c2ccccc2)CC([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001308388239 1065956083 /nfs/dbraw/zinc/95/60/83/1065956083.db2.gz HNXYNJQCIDIFJT-UHFFFAOYSA-N 1 0 307.437 4.222 20 10 DICDRO Cc1ccccc1[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001308388725 1065956464 /nfs/dbraw/zinc/95/64/64/1065956464.db2.gz QDTCDBBWXQAIMC-WGSAOQKQSA-N 1 0 307.437 4.356 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC3CCC2CC3)cc1F ZINC001308413856 1065972071 /nfs/dbraw/zinc/97/20/71/1065972071.db2.gz HLCHDBZXMIPYDI-JFUPDXTOSA-N 1 0 304.453 4.340 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2C[C@@H](OC(C)C)C2)cc1 ZINC001308432706 1065984395 /nfs/dbraw/zinc/98/43/95/1065984395.db2.gz MPMKBTXODIQBCU-PUZFROQSSA-N 1 0 318.505 4.359 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C/C=C/c2ccc(F)c(F)c2)c1 ZINC001308451092 1065997285 /nfs/dbraw/zinc/99/72/85/1065997285.db2.gz UYBOBOXGASULCO-AAOUONPWSA-N 1 0 319.351 4.043 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCc3ccc(O)cc32)cc1C ZINC001308470716 1066011174 /nfs/dbraw/zinc/01/11/74/1066011174.db2.gz HRIMPYUWFYAWOD-IBGZPJMESA-N 1 0 311.425 4.267 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cc(OC)ccc2F)cc1C ZINC001308472255 1066012716 /nfs/dbraw/zinc/01/27/16/1066012716.db2.gz ONXGUHWRXQXYRY-UHFFFAOYSA-N 1 0 317.404 4.221 20 10 DICDRO C[C@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccccc1O ZINC001308506968 1066033799 /nfs/dbraw/zinc/03/37/99/1066033799.db2.gz WBNYVCSZVNABNE-NSHDSACASA-N 1 0 316.451 4.428 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H]1[C@@H](c2ccccc2)C1(F)F ZINC001308512314 1066039812 /nfs/dbraw/zinc/03/98/12/1066039812.db2.gz INVLJRNBVKVYTH-CZUORRHYSA-N 1 0 323.770 4.184 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCCc3ccccc3C2)cc1 ZINC001308538734 1066056046 /nfs/dbraw/zinc/05/60/46/1066056046.db2.gz YUMSLPACBKDVSL-IRUYWQDXSA-N 1 0 320.480 4.303 20 10 DICDRO CCC[N@@H+](Cc1cc(OC)cc(C(C)(C)C)c1O)CC1CC1 ZINC001308559352 1066069181 /nfs/dbraw/zinc/06/91/81/1066069181.db2.gz CGZNCCDQILGWGH-UHFFFAOYSA-N 1 0 305.462 4.320 20 10 DICDRO CCS[C@@H]1CCCC[N@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC001308566987 1066074527 /nfs/dbraw/zinc/07/45/27/1066074527.db2.gz HGSXVSKXFJXMCT-CYBMUJFWSA-N 1 0 313.894 4.462 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)cc1Cl ZINC001308594818 1066106763 /nfs/dbraw/zinc/10/67/63/1066106763.db2.gz RPOUIBFOZCCBNG-ZBFHGGJFSA-N 1 0 311.878 4.214 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)cc1Cl ZINC001308594813 1066107245 /nfs/dbraw/zinc/10/72/45/1066107245.db2.gz RPOUIBFOZCCBNG-GDBMZVCRSA-N 1 0 311.878 4.214 20 10 DICDRO CSC1(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)CCC1 ZINC001308597119 1066108335 /nfs/dbraw/zinc/10/83/35/1066108335.db2.gz NUSDCMKXEICPDK-UHFFFAOYSA-N 1 0 306.519 4.249 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CCC[C@H]2C2CCC2)c1O ZINC001308599143 1066110782 /nfs/dbraw/zinc/11/07/82/1066110782.db2.gz KZDBAGAWYFCMBG-HNNXBMFYSA-N 1 0 324.262 4.228 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCOCc2ccccc2)cc1Cl ZINC001308602634 1066111877 /nfs/dbraw/zinc/11/18/77/1066111877.db2.gz FHXGTDQXDFXCHZ-UHFFFAOYSA-N 1 0 319.832 4.003 20 10 DICDRO COc1cc(Cl)cc(C[N@H+]2CC=C(C(C)(C)C)CC2)c1O ZINC001308604093 1066113567 /nfs/dbraw/zinc/11/35/67/1066113567.db2.gz SXFOXKOZMMYJCI-UHFFFAOYSA-N 1 0 309.837 4.232 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC001308607513 1066114936 /nfs/dbraw/zinc/11/49/36/1066114936.db2.gz NBDFOQYRDNNWRU-GOSISDBHSA-N 1 0 300.471 4.460 20 10 DICDRO Cc1ccc(C[N@@H+]2CCCC[C@H]2Cc2ccc(F)cc2)c(O)c1 ZINC001308615469 1066119474 /nfs/dbraw/zinc/11/94/74/1066119474.db2.gz NEJNWIFWRVPSEW-IBGZPJMESA-N 1 0 313.416 4.437 20 10 DICDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1c(O)cccc1Br ZINC001308619183 1066121730 /nfs/dbraw/zinc/12/17/30/1066121730.db2.gz JYFVXSCSJRLWAQ-NWDGAFQWSA-N 1 0 312.251 4.165 20 10 DICDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2c(O)cccc2Br)C1 ZINC001308619182 1066122247 /nfs/dbraw/zinc/12/22/47/1066122247.db2.gz JYFVXSCSJRLWAQ-NEPJUHHUSA-N 1 0 312.251 4.165 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2cccc(F)c2[C@@H]1C ZINC001308624381 1066123858 /nfs/dbraw/zinc/12/38/58/1066123858.db2.gz MBISIFOTCZOSRL-HNNXBMFYSA-N 1 0 312.432 4.319 20 10 DICDRO CCC[C@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001308630322 1066125885 /nfs/dbraw/zinc/12/58/85/1066125885.db2.gz CYQDHFAQEWSVNY-LBPRGKRZSA-N 1 0 302.384 4.392 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)[C@H](C)Cc2ccc(O)cc2)c1 ZINC001308629110 1066126031 /nfs/dbraw/zinc/12/60/31/1066126031.db2.gz JFOCTFHIFXDZSS-OAHLLOKOSA-N 1 0 313.441 4.284 20 10 DICDRO Oc1ccccc1C[N@H+](CC1CCSCC1)C1CCCC1 ZINC001308634147 1066128732 /nfs/dbraw/zinc/12/87/32/1066128732.db2.gz NPRQSYXEESHSFX-UHFFFAOYSA-N 1 0 305.487 4.280 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H](OC)C2CCCC2)cc1 ZINC001308645104 1066135055 /nfs/dbraw/zinc/13/50/55/1066135055.db2.gz IMIKOYAZRFVOIS-FQEVSTJZSA-N 1 0 318.505 4.170 20 10 DICDRO CC[C@H]1CC[N@H+](Cc2cc(Br)cc(C)c2O)[C@@H]1C ZINC001308704185 1066188496 /nfs/dbraw/zinc/18/84/96/1066188496.db2.gz NIIPFUJIJDENOP-NEPJUHHUSA-N 1 0 312.251 4.084 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCc2cccc(C)c2)c1 ZINC001308748909 1066223109 /nfs/dbraw/zinc/22/31/09/1066223109.db2.gz XAPLGHRARJGVAG-HZPDHXFCSA-N 1 0 313.441 4.381 20 10 DICDRO Cc1ccc(C[NH2+]C2(Cc3cccc(Cl)c3)CC2)c(O)c1 ZINC001308767346 1066240318 /nfs/dbraw/zinc/24/03/18/1066240318.db2.gz PLOUZBVPKSMNBY-UHFFFAOYSA-N 1 0 301.817 4.219 20 10 DICDRO C=Cc1ccc(CC[NH2+]Cc2cc(Cl)c(C)cc2O)cc1 ZINC001308775974 1066247234 /nfs/dbraw/zinc/24/72/34/1066247234.db2.gz CDAQXHDITXAAQZ-UHFFFAOYSA-N 1 0 301.817 4.329 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]C[C@H]1CSc2ccccc21 ZINC001308781080 1066254966 /nfs/dbraw/zinc/25/49/66/1066254966.db2.gz YYDXATFHVUGMDU-LBPRGKRZSA-N 1 0 305.830 4.025 20 10 DICDRO CC1(C2CC2)CC[NH+](Cc2c(O)cccc2Br)CC1 ZINC001308791299 1066265772 /nfs/dbraw/zinc/26/57/72/1066265772.db2.gz CURKPBYRHXIZPM-UHFFFAOYSA-N 1 0 324.262 4.167 20 10 DICDRO Oc1cccc(Br)c1C[NH+](C1CCC1)C1CCC1 ZINC001308791319 1066266170 /nfs/dbraw/zinc/26/61/70/1066266170.db2.gz CYRVSXNVJMADKC-UHFFFAOYSA-N 1 0 310.235 4.062 20 10 DICDRO CC(C)[C@@H]1[N@H+](Cc2c(O)cccc2Br)CC12CCC2 ZINC001308791490 1066266277 /nfs/dbraw/zinc/26/62/77/1066266277.db2.gz OPNUUHAHOWPDMQ-HNNXBMFYSA-N 1 0 324.262 4.165 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2ccc(C)cc2O)c2ccco2)cc1 ZINC001308820846 1066296541 /nfs/dbraw/zinc/29/65/41/1066296541.db2.gz OUSCUOFOCGFISA-FQEVSTJZSA-N 1 0 323.392 4.181 20 10 DICDRO Cc1ccc2c(c1)CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)C2 ZINC001308823589 1066297960 /nfs/dbraw/zinc/29/79/60/1066297960.db2.gz ALOOKGQGLWVKIT-PLNGDYQASA-N 1 0 306.453 4.133 20 10 DICDRO Oc1cccc(Br)c1C[NH+]1CCC(C2CCC2)CC1 ZINC001308854327 1066334677 /nfs/dbraw/zinc/33/46/77/1066334677.db2.gz GCVJTOUAPHUMPR-UHFFFAOYSA-N 1 0 324.262 4.167 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H]3CC(C)(C)CC[C@H]3C)C2)cc1 ZINC001308861488 1066341410 /nfs/dbraw/zinc/34/14/10/1066341410.db2.gz YKGFZWRNOIYMPD-GJYPPUQNSA-N 1 0 316.489 4.078 20 10 DICDRO CCOC(=O)C(C)(C)CCC[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC001308903082 1066381617 /nfs/dbraw/zinc/38/16/17/1066381617.db2.gz VFQHZZZDIDDCQA-GJZGRUSLSA-N 1 0 321.461 4.191 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC001308908663 1066384994 /nfs/dbraw/zinc/38/49/94/1066384994.db2.gz IBKXGNJSLJNVDB-QGZVFWFLSA-N 1 0 305.368 4.455 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)c1 ZINC001308905858 1066385480 /nfs/dbraw/zinc/38/54/80/1066385480.db2.gz MLRHTOKYRIELQT-LJQANCHMSA-N 1 0 317.473 4.439 20 10 DICDRO Oc1cccc2c1CN(Cc1ccccc1CC(F)(F)F)C2 ZINC001308910306 1066388270 /nfs/dbraw/zinc/38/82/70/1066388270.db2.gz NHSPYEOLFZVGJW-UHFFFAOYSA-N 1 0 307.315 4.013 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]Cc2cccc3ncccc23)c1 ZINC001308933165 1066407488 /nfs/dbraw/zinc/40/74/88/1066407488.db2.gz WDEVPIDYPSCZLQ-UHFFFAOYSA-N 1 0 306.409 4.354 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC(OC3CCCCC3)CC2)c1 ZINC000092736176 185337609 /nfs/dbraw/zinc/33/76/09/185337609.db2.gz CRJQGNQYJFXOBJ-UHFFFAOYSA-N 1 0 303.446 4.014 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](CC)c2ccc(OC)cc2)c1O ZINC000236963027 202097384 /nfs/dbraw/zinc/09/73/84/202097384.db2.gz IASXWLYTDNGKFF-QGZVFWFLSA-N 1 0 315.413 4.040 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCC(C(F)(F)F)CC2)c1 ZINC000273385015 130114886 /nfs/dbraw/zinc/11/48/86/130114886.db2.gz JHYHNAFMTWYXIK-UNXYVOJBSA-N 1 0 317.351 4.173 20 10 DICDRO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000273430399 130120740 /nfs/dbraw/zinc/12/07/40/130120740.db2.gz VLHPDOJSFDSIII-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(O)c1C ZINC000273445461 130122814 /nfs/dbraw/zinc/12/28/14/130122814.db2.gz DZXNODCREOPLES-GFCCVEGCSA-N 1 0 302.443 4.194 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)c(O)c1C ZINC000273485553 130127550 /nfs/dbraw/zinc/12/75/50/130127550.db2.gz NEUQFQHMQCAYCD-ZOBUZTSGSA-N 1 0 305.462 4.253 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(O)c1C ZINC000273521620 130132499 /nfs/dbraw/zinc/13/24/99/130132499.db2.gz UNZIYUMWSHKMGC-KBPBESRZSA-N 1 0 314.385 4.329 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273571640 130138326 /nfs/dbraw/zinc/13/83/26/130138326.db2.gz KURFXLBNLLALMD-OLZOCXBDSA-N 1 0 304.459 4.440 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1 ZINC000273590489 130141575 /nfs/dbraw/zinc/14/15/75/130141575.db2.gz PAGVHYANKQXSBR-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1cc(Cl)ccc1O ZINC000273621754 130146902 /nfs/dbraw/zinc/14/69/02/130146902.db2.gz ZGNLQHCSTOEAER-BONVTDFDSA-N 1 0 303.789 4.089 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1cc(Cl)ccc1O ZINC000273621751 130146939 /nfs/dbraw/zinc/14/69/39/130146939.db2.gz ZGNLQHCSTOEAER-BMIGLBTASA-N 1 0 303.789 4.089 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3ncccc3c2)c(O)c1C ZINC000280128304 130785258 /nfs/dbraw/zinc/78/52/58/130785258.db2.gz OUTFATBSECPRPZ-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)cc(Cl)n1)c1ccc(C)cc1O ZINC000282410732 130919840 /nfs/dbraw/zinc/91/98/40/130919840.db2.gz CFXLHBPEGNEDBE-HNNXBMFYSA-N 1 0 304.821 4.298 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H](CCCO)c2ccccc2)c(O)c1 ZINC000283912720 131032967 /nfs/dbraw/zinc/03/29/67/131032967.db2.gz DIEALVLXLNNHMT-FUHWJXTLSA-N 1 0 313.441 4.173 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)c1cn[nH]c1 ZINC000283979215 131037856 /nfs/dbraw/zinc/03/78/56/131037856.db2.gz GWKNUZQDXLRZMC-OAHLLOKOSA-N 1 0 312.461 4.029 20 10 DICDRO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)n1 ZINC000284946594 131125306 /nfs/dbraw/zinc/12/53/06/131125306.db2.gz DZLHDAVYSIERAM-JSGCOSHPSA-N 1 0 304.459 4.228 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cc1F ZINC000285462697 131170238 /nfs/dbraw/zinc/17/02/38/131170238.db2.gz ZYJWAEJBSQPOEC-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)c(C)c1OC ZINC000287190807 131268458 /nfs/dbraw/zinc/26/84/58/131268458.db2.gz VUUSNFDBSGKRBD-KGLIPLIRSA-N 1 0 315.413 4.130 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c1 ZINC000287239773 131270551 /nfs/dbraw/zinc/27/05/51/131270551.db2.gz YRZMJAOWMQLQSC-GUYCJALGSA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)C[C@H](C)O)c1cc(Cl)cc(Cl)c1[O-] ZINC000287712686 131296972 /nfs/dbraw/zinc/29/69/72/131296972.db2.gz OEIHBBQBIKONFF-BFVZDQMLSA-N 1 0 320.260 4.147 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(OC(F)(F)F)cc1)CC2 ZINC000295797224 131920547 /nfs/dbraw/zinc/92/05/47/131920547.db2.gz BWKCXKUDLKWPAK-AWEZNQCLSA-N 1 0 323.314 4.068 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(OC(F)(F)F)cc1)CC2 ZINC000295797228 131921123 /nfs/dbraw/zinc/92/11/23/131921123.db2.gz BWKCXKUDLKWPAK-CQSZACIVSA-N 1 0 323.314 4.068 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1)CC2 ZINC000296933143 131993026 /nfs/dbraw/zinc/99/30/26/131993026.db2.gz QBRJCKLIUUQUPW-KFKAGJAMSA-N 1 0 323.436 4.137 20 10 DICDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297144923 132001569 /nfs/dbraw/zinc/00/15/69/132001569.db2.gz ZRTPFEPZIVKPHI-SJORKVTESA-N 1 0 309.409 4.055 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297394554 132013221 /nfs/dbraw/zinc/01/32/21/132013221.db2.gz SBFQYHHJSIAESU-AWEZNQCLSA-N 1 0 303.402 4.030 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCCc3sccc32)c1O ZINC000185206696 333368889 /nfs/dbraw/zinc/36/88/89/333368889.db2.gz YVWNZPQPLVOSKQ-ZDUSSCGKSA-N 1 0 323.845 4.283 20 10 DICDRO CCc1cnc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)s1 ZINC000185584482 333370551 /nfs/dbraw/zinc/37/05/51/333370551.db2.gz XCEJVVGIZONBEJ-GFCCVEGCSA-N 1 0 312.438 4.415 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)n1 ZINC000273409362 334046371 /nfs/dbraw/zinc/04/63/71/334046371.db2.gz HPYCXTKODXCNJS-RISCZKNCSA-N 1 0 304.459 4.228 20 10 DICDRO CC[C@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1O ZINC000368415111 336844311 /nfs/dbraw/zinc/84/43/11/336844311.db2.gz YJZXKBNNXVSVMU-KRWDZBQOSA-N 1 0 303.446 4.172 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccccc1O ZINC000375345464 337008701 /nfs/dbraw/zinc/00/87/01/337008701.db2.gz ROOIOHGLZDVDHO-HZPDHXFCSA-N 1 0 301.361 4.096 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(O)c1 ZINC000193903017 337079996 /nfs/dbraw/zinc/07/99/96/337079996.db2.gz HWBQQVPKURBHOF-CHWSQXEVSA-N 1 0 300.358 4.021 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccccc1O ZINC000183450671 337191736 /nfs/dbraw/zinc/19/17/36/337191736.db2.gz NATYWRNDXBSRIU-YWZLYKJASA-N 1 0 304.393 4.227 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1ccccc1O ZINC000183716655 337193148 /nfs/dbraw/zinc/19/31/48/337193148.db2.gz VERSURXQKHGBJM-MLGOLLRUSA-N 1 0 301.361 4.096 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccccc2-n2cccn2)c1 ZINC000185741649 337250941 /nfs/dbraw/zinc/25/09/41/337250941.db2.gz FFSBCVPXPOYACN-HOTGVXAUSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCOc3cc(F)ccc32)c(O)c1 ZINC000186374452 337256925 /nfs/dbraw/zinc/25/69/25/337256925.db2.gz AGXGASAAVBYJKV-SUMWQHHRSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](c1cncc(F)c1)C1CC1 ZINC000467366871 339234462 /nfs/dbraw/zinc/23/44/62/339234462.db2.gz BKGWPCWZLISALG-FQEVSTJZSA-N 1 0 323.415 4.262 20 10 DICDRO Cc1ccc2c(c1)[nH]cc2C1=CCN(c2cc[nH+]c(C)c2)CC1 ZINC000478286710 339512632 /nfs/dbraw/zinc/51/26/32/339512632.db2.gz SMGGVQSYGDMMTD-UHFFFAOYSA-N 1 0 303.409 4.473 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(N(C)C)cc1 ZINC000297465757 533976619 /nfs/dbraw/zinc/97/66/19/533976619.db2.gz YEYLPKBFFNFMOG-KBPBESRZSA-N 1 0 313.401 4.073 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCc3c2cccc3O)cc1 ZINC000130313102 520289255 /nfs/dbraw/zinc/28/92/55/520289255.db2.gz ZDSFRSXYRKRQKK-IFXJQAMLSA-N 1 0 310.441 4.186 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1O ZINC000156696836 522696075 /nfs/dbraw/zinc/69/60/75/522696075.db2.gz SVEXUPZZNGJBIW-BBRMVZONSA-N 1 0 314.385 4.411 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccccc1O ZINC000156768287 522719471 /nfs/dbraw/zinc/71/94/71/522719471.db2.gz IYUQCBFBCXYOTR-WBVHZDCISA-N 1 0 303.446 4.315 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccccc1-n1cccn1)c1ccccc1O ZINC000156350870 522740685 /nfs/dbraw/zinc/74/06/85/522740685.db2.gz XPHQVQGPEZVBIR-QAPCUYQASA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1ccccc1O ZINC000157899596 522750974 /nfs/dbraw/zinc/75/09/74/522750974.db2.gz URFFMCYJHUXOLV-IRXDYDNUSA-N 1 0 315.388 4.486 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccc(F)cc1F ZINC000182391914 522912083 /nfs/dbraw/zinc/91/20/83/522912083.db2.gz UWLGWTBHLDSWIT-APPDUMDISA-N 1 0 321.367 4.481 20 10 DICDRO CC[C@@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccc(N(C)C)cc1 ZINC000156447802 522945188 /nfs/dbraw/zinc/94/51/88/522945188.db2.gz FXBPAFLISDMQES-QZTJIDSGSA-N 1 0 316.445 4.082 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(F)cccc2Cl)c1 ZINC000182442656 524773090 /nfs/dbraw/zinc/77/30/90/524773090.db2.gz RIDNGXLIBJUNLC-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(Cl)nc1 ZINC000181380261 525444268 /nfs/dbraw/zinc/44/42/68/525444268.db2.gz HYTZHUZUCXPEFA-AWEZNQCLSA-N 1 0 315.848 4.186 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1ccncc1 ZINC000156636900 525525497 /nfs/dbraw/zinc/52/54/97/525525497.db2.gz ZXIOPNOUUWVFGX-QGZVFWFLSA-N 1 0 309.457 4.169 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccc(N(C)C)cc1 ZINC000188052583 525627598 /nfs/dbraw/zinc/62/75/98/525627598.db2.gz MYKFDLUTNVIZFX-UGSOOPFHSA-N 1 0 314.404 4.066 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)c(O)c1 ZINC000188060619 525946472 /nfs/dbraw/zinc/94/64/72/525946472.db2.gz HNCJMPGWGAVHPV-LRDDRELGSA-N 1 0 301.361 4.014 20 10 DICDRO Cc1csc(C2([NH2+]Cc3cccc(C)c3O)CCCC2)n1 ZINC000182217341 526326375 /nfs/dbraw/zinc/32/63/75/526326375.db2.gz PUYCFEOABAKIHC-UHFFFAOYSA-N 1 0 302.443 4.025 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)CCC2 ZINC000364962686 527108810 /nfs/dbraw/zinc/10/88/10/527108810.db2.gz OPRQYGUWDHECDV-RNCFNFMXSA-N 1 0 306.406 4.024 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](CCOC)c2ccco2)cc1 ZINC000272485732 535765233 /nfs/dbraw/zinc/76/52/33/535765233.db2.gz BPXNCJMGIKXYGV-YJBOKZPZSA-N 1 0 316.445 4.164 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1ccc(C)o1 ZINC000273507674 536807378 /nfs/dbraw/zinc/80/73/78/536807378.db2.gz ZWMFGYTUJURBNQ-DOTOQJQBSA-N 1 0 317.429 4.339 20 10 DICDRO CC(C)CCOC1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000121614150 1035509115 /nfs/dbraw/zinc/50/91/15/1035509115.db2.gz YXFJBFALVRXWLM-UHFFFAOYSA-N 1 0 311.853 4.073 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(O)c1)c1ccc(N2CCCCC2)cc1 ZINC000154391428 1035890486 /nfs/dbraw/zinc/89/04/86/1035890486.db2.gz VCXXNFIVRXWUMF-INIZCTEOSA-N 1 0 310.441 4.233 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1OC(F)F ZINC000120565572 1035929556 /nfs/dbraw/zinc/92/95/56/1035929556.db2.gz XCBFYXGMTIBWJE-CYBMUJFWSA-N 1 0 320.383 4.205 20 10 DICDRO c1cc2c(o1)CCC[C@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000120781176 1036122919 /nfs/dbraw/zinc/12/29/19/1036122919.db2.gz DDMRGJVDDVSNRT-LJQANCHMSA-N 1 0 310.441 4.437 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccc(OC)cc3)C2)cc1 ZINC001167287956 1036443895 /nfs/dbraw/zinc/44/38/95/1036443895.db2.gz WDFYUYLYFPNYQJ-LJQANCHMSA-N 1 0 324.468 4.141 20 10 DICDRO C[C@@H](Cc1ccccc1Cl)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001648816862 1036576202 /nfs/dbraw/zinc/57/62/02/1036576202.db2.gz KKOXAQCEZWVAGM-AWEZNQCLSA-N 1 0 315.844 4.386 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000074230515 1036698043 /nfs/dbraw/zinc/69/80/43/1036698043.db2.gz BFPKWVBPPMJCSE-ZDUSSCGKSA-N 1 0 320.383 4.205 20 10 DICDRO Oc1ccccc1C[N@@H+](C[C@H](O)CC1CCCC1)C1CCCC1 ZINC001167353939 1036950638 /nfs/dbraw/zinc/95/06/38/1036950638.db2.gz SQFQSTYRUZDWQM-LJQANCHMSA-N 1 0 317.473 4.078 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N(C)C)cc1)CCCO2 ZINC000160543722 1037197773 /nfs/dbraw/zinc/19/77/73/1037197773.db2.gz MHTBXEOGIOPPGD-LJQANCHMSA-N 1 0 310.441 4.065 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc2c(s1)CCC2 ZINC000160544826 1037201667 /nfs/dbraw/zinc/20/16/67/1037201667.db2.gz OOBPKYJMRYYADO-ZDUSSCGKSA-N 1 0 300.471 4.154 20 10 DICDRO CC[N@H+](Cc1cc(Br)cc(C)c1O)[C@@H](C)C(C)C ZINC000706654005 1037238348 /nfs/dbraw/zinc/23/83/48/1037238348.db2.gz SNLYMUZSLCKMFE-LBPRGKRZSA-N 1 0 314.267 4.330 20 10 DICDRO CC(C)CCC[C@@H](C)[NH2+]Cc1c(O)cccc1Br ZINC000706804369 1037450259 /nfs/dbraw/zinc/45/02/59/1037450259.db2.gz JJUFKNLADPZSCL-GFCCVEGCSA-N 1 0 314.267 4.459 20 10 DICDRO COCC[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000840835809 1037463257 /nfs/dbraw/zinc/46/32/57/1037463257.db2.gz AQIXUQBSEPYBDX-ZWKOTPCHSA-N 1 0 318.505 4.390 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C1CCC2(CCCO2)CC1 ZINC000684409121 1037957130 /nfs/dbraw/zinc/95/71/30/1037957130.db2.gz KICBCCADNSUVFA-UHFFFAOYSA-N 1 0 312.457 4.068 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cnc2ccsc2c1 ZINC000126461570 1038104684 /nfs/dbraw/zinc/10/46/84/1038104684.db2.gz ONUHJTPZSPIBCZ-ZDUSSCGKSA-N 1 0 311.454 4.213 20 10 DICDRO COc1ccccc1[C@H](NCc1cc(C)ccc1O)c1ccco1 ZINC000151129975 1038433080 /nfs/dbraw/zinc/43/30/80/1038433080.db2.gz VHHVJEIULDZOFV-FQEVSTJZSA-N 1 0 323.392 4.181 20 10 DICDRO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)[nH]1 ZINC000277247834 1038467927 /nfs/dbraw/zinc/46/79/27/1038467927.db2.gz NTJZHQPWPNHFAG-ZLKJLUDKSA-N 1 0 316.449 4.052 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2cncs2)ccc1N1CCCCC1 ZINC000934194424 1038508674 /nfs/dbraw/zinc/50/86/74/1038508674.db2.gz XCXWINRHFTYODF-OAHLLOKOSA-N 1 0 315.486 4.293 20 10 DICDRO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001167533712 1038552495 /nfs/dbraw/zinc/55/24/95/1038552495.db2.gz KKILVVCOWYIKPS-FOIQADDNSA-N 1 0 312.432 4.475 20 10 DICDRO C[C@@H]([NH2+]CCSC(F)(F)F)c1ccc2ccccc2c1O ZINC000230659033 1038621557 /nfs/dbraw/zinc/62/15/57/1038621557.db2.gz MPRIIOUDZNZTFT-SNVBAGLBSA-N 1 0 315.360 4.449 20 10 DICDRO CS[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000230698900 1038621600 /nfs/dbraw/zinc/62/16/00/1038621600.db2.gz XJPFTYIZTXFYMW-AEFFLSMTSA-N 1 0 304.503 4.051 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(Cl)c2)cc1 ZINC000048241766 1038666042 /nfs/dbraw/zinc/66/60/42/1038666042.db2.gz GVNJPLYJWUAHEV-UHFFFAOYSA-N 1 0 302.849 4.476 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000112536838 1038685929 /nfs/dbraw/zinc/68/59/29/1038685929.db2.gz OGXLDOLMQOIFGF-DYESRHJHSA-N 1 0 324.468 4.325 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)c1cnccn1 ZINC000119347939 1038917863 /nfs/dbraw/zinc/91/78/63/1038917863.db2.gz GOTSDGXXJPIYLU-INIZCTEOSA-N 1 0 324.472 4.096 20 10 DICDRO COc1cc(C)c(N2C(C)(C)CC([NH3+])CC2(C)C)cc1Cl ZINC001167624774 1038967650 /nfs/dbraw/zinc/96/76/50/1038967650.db2.gz GAYPCZWRKLWIEH-UHFFFAOYSA-N 1 0 310.869 4.142 20 10 DICDRO CC(C)(C)OC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000120636491 1039004910 /nfs/dbraw/zinc/00/49/10/1039004910.db2.gz CRNLFSMNEWOPII-UHFFFAOYSA-N 1 0 313.441 4.325 20 10 DICDRO CCC[C@H]1CCC[N@H+](Cc2ccc(Br)cc2O)C1 ZINC000708481336 1039654742 /nfs/dbraw/zinc/65/47/42/1039654742.db2.gz CGKNXBPYXCOEIC-LBPRGKRZSA-N 1 0 312.251 4.167 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2OC)cc1 ZINC000187592886 1039999568 /nfs/dbraw/zinc/99/95/68/1039999568.db2.gz LHOKUIIBOQMYAV-AWEZNQCLSA-N 1 0 316.420 4.141 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2OC)cc1 ZINC000187592866 1039999930 /nfs/dbraw/zinc/99/99/30/1039999930.db2.gz LHOKUIIBOQMYAV-CQSZACIVSA-N 1 0 316.420 4.141 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2c(C)noc2C)cc1F ZINC000152254664 1040006633 /nfs/dbraw/zinc/00/66/33/1040006633.db2.gz MWQDFRNGTOSQKT-LBPRGKRZSA-N 1 0 319.424 4.128 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(C(F)F)c(F)c2)cc1 ZINC000892475108 1040518789 /nfs/dbraw/zinc/51/87/89/1040518789.db2.gz DJQFFSKLYAKUKB-UHFFFAOYSA-N 1 0 308.347 4.119 20 10 DICDRO COCCCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000178108846 1040923779 /nfs/dbraw/zinc/92/37/79/1040923779.db2.gz JHWDLZALYNLJIW-KRWDZBQOSA-N 1 0 304.478 4.144 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1cccc(Cl)c1 ZINC000808732363 1041020658 /nfs/dbraw/zinc/02/06/58/1041020658.db2.gz JYUBMZYOACSUEH-GUYCJALGSA-N 1 0 319.832 4.392 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c1 ZINC000809693777 1041216672 /nfs/dbraw/zinc/21/66/72/1041216672.db2.gz BTAQOILCOVZZDL-VAMGGRTRSA-N 1 0 323.436 4.169 20 10 DICDRO CCCC[N@H+](CCCc1cnccc1C)Cc1ccccc1O ZINC000809663488 1041220186 /nfs/dbraw/zinc/22/01/86/1041220186.db2.gz QBHVDMCOHLBXCQ-UHFFFAOYSA-N 1 0 312.457 4.331 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2c2ccncc2)c1O ZINC000809729747 1041227506 /nfs/dbraw/zinc/22/75/06/1041227506.db2.gz YJNLGHFPFSMOQX-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CC[C@@](C)(c3ccccc3)C2)c1O ZINC000809739637 1041239990 /nfs/dbraw/zinc/23/99/90/1041239990.db2.gz ADJDJGNETWSMOX-YLJYHZDGSA-N 1 0 311.425 4.001 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H]2c2ccsc2)c1O ZINC000164075874 1041248151 /nfs/dbraw/zinc/24/81/51/1041248151.db2.gz UXOWSVCRXZZQKG-HNNXBMFYSA-N 1 0 303.427 4.108 20 10 DICDRO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1cc(F)ccc1O ZINC000809780772 1041255339 /nfs/dbraw/zinc/25/53/39/1041255339.db2.gz JBRAUHWFWHRJHS-INIZCTEOSA-N 1 0 303.377 4.123 20 10 DICDRO CSc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)s1 ZINC000810146745 1041323497 /nfs/dbraw/zinc/32/34/97/1041323497.db2.gz WSGNBLAOLWDJNZ-UHFFFAOYSA-N 1 0 306.500 4.134 20 10 DICDRO CC[C@@H]([NH2+]Cc1cscn1)c1ccc(C(F)(F)F)cc1O ZINC000810215145 1041337172 /nfs/dbraw/zinc/33/71/72/1041337172.db2.gz RWEPVAKIFFPGJN-GFCCVEGCSA-N 1 0 316.348 4.108 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCCO1)c1ccc(C(F)(F)F)cc1O ZINC000810212224 1041337906 /nfs/dbraw/zinc/33/79/06/1041337906.db2.gz OGINIIXMSPRVER-OCCSQVGLSA-N 1 0 317.351 4.021 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CSC)c1ccc(C(F)(F)F)cc1O ZINC000810217784 1041338635 /nfs/dbraw/zinc/33/86/35/1041338635.db2.gz BHHAFWHYEBKPQO-SKDRFNHKSA-N 1 0 307.381 4.203 20 10 DICDRO CC[C@@H]([NH2+]CCOC(C)(C)C)c1ccc(C(F)(F)F)cc1O ZINC000810229978 1041343221 /nfs/dbraw/zinc/34/32/21/1041343221.db2.gz AKNDPEYZOHGZSH-CYBMUJFWSA-N 1 0 319.367 4.267 20 10 DICDRO CC[C@H]([NH2+]Cc1cccnc1)c1ccc(C(F)(F)F)cc1O ZINC000810207805 1041346948 /nfs/dbraw/zinc/34/69/48/1041346948.db2.gz OGUHITHQBLVYGT-AWEZNQCLSA-N 1 0 310.319 4.047 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccnc1)c1ccc(C(F)(F)F)cc1O ZINC000810207808 1041347808 /nfs/dbraw/zinc/34/78/08/1041347808.db2.gz OGUHITHQBLVYGT-CQSZACIVSA-N 1 0 310.319 4.047 20 10 DICDRO CO[C@@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000810257723 1041349421 /nfs/dbraw/zinc/34/94/21/1041349421.db2.gz UVNVINYQIHGRHP-IKGGRYGDSA-N 1 0 304.478 4.141 20 10 DICDRO CC[C@@H]([NH2+]CC1(SC)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810237828 1041353689 /nfs/dbraw/zinc/35/36/89/1041353689.db2.gz KMKPYFPZIANECV-GFCCVEGCSA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCC=CO1)c1ccc(C(F)(F)F)cc1O ZINC000810239053 1041353915 /nfs/dbraw/zinc/35/39/15/1041353915.db2.gz RCRYCBXDVUMROT-GXTWGEPZSA-N 1 0 315.335 4.144 20 10 DICDRO COc1cccc(C2(C[NH2+][C@@H](C)c3cc(C)ccc3O)CC2)c1 ZINC000810242630 1041354807 /nfs/dbraw/zinc/35/48/07/1041354807.db2.gz SDZGPUXLQXGYDE-HNNXBMFYSA-N 1 0 311.425 4.092 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3sccc3c2)c1 ZINC000810242898 1041354936 /nfs/dbraw/zinc/35/49/36/1041354936.db2.gz IYQNWIKNDQMVDD-GFCCVEGCSA-N 1 0 313.422 4.466 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1cc(F)ccc1O ZINC000810250969 1041357043 /nfs/dbraw/zinc/35/70/43/1041357043.db2.gz QZYFMDCWIHSGJV-NRXGSXMXSA-N 1 0 315.388 4.102 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccccc2OC(F)F)cc1C ZINC000378883316 1041398037 /nfs/dbraw/zinc/39/80/37/1041398037.db2.gz GIFRZPZIAVFOAW-ZDUSSCGKSA-N 1 0 321.367 4.456 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2cccc(F)c2)cc1 ZINC000314381563 1041451090 /nfs/dbraw/zinc/45/10/90/1041451090.db2.gz UEGLFZMIMIILCD-UHFFFAOYSA-N 1 0 300.421 4.004 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2C)c1 ZINC000926896592 1041472542 /nfs/dbraw/zinc/47/25/42/1041472542.db2.gz BAEWXIPZMVAVKC-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO C[C@H]([NH2+]CCSCc1ccccc1)c1cc(F)ccc1O ZINC000756356097 1041513944 /nfs/dbraw/zinc/51/39/44/1041513944.db2.gz XPBLCBCGXBCUEA-ZDUSSCGKSA-N 1 0 305.418 4.115 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000811518289 1041530924 /nfs/dbraw/zinc/53/09/24/1041530924.db2.gz JAEFZVKYNHDBOI-VQTJNVASSA-N 1 0 323.436 4.079 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2cccs2)N(C)C)c(O)c1C ZINC000756374183 1041532487 /nfs/dbraw/zinc/53/24/87/1041532487.db2.gz YSIMCXNXJPPWJU-GDBMZVCRSA-N 1 0 318.486 4.024 20 10 DICDRO COCc1ccccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756373754 1041533945 /nfs/dbraw/zinc/53/39/45/1041533945.db2.gz YODMCIFXKMVYBE-BLLLJJGKSA-N 1 0 315.388 4.016 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3ccccc3c2)c1 ZINC000182337943 1041566752 /nfs/dbraw/zinc/56/67/52/1041566752.db2.gz HZWYVTZQSFWVMI-AWEZNQCLSA-N 1 0 307.393 4.405 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)cc1C(C)C ZINC000811781197 1041567093 /nfs/dbraw/zinc/56/70/93/1041567093.db2.gz ZTTBZELGLPIOED-RTBURBONSA-N 1 0 317.473 4.213 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Oc2ccccc2)nc1)c1ccccc1O ZINC000183475160 1041583926 /nfs/dbraw/zinc/58/39/26/1041583926.db2.gz BIYNWUMMLDSCKS-HNNXBMFYSA-N 1 0 320.392 4.430 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000184919510 1041601365 /nfs/dbraw/zinc/60/13/65/1041601365.db2.gz ZQWYPLGOTLRQDQ-PXNSSMCTSA-N 1 0 324.468 4.188 20 10 DICDRO CCC[C@H]([NH2+]CCCSc1nccs1)c1cccnc1 ZINC000185489759 1041615058 /nfs/dbraw/zinc/61/50/58/1041615058.db2.gz MVXBLCWFJYZBJP-AWEZNQCLSA-N 1 0 307.488 4.151 20 10 DICDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185501468 1041615654 /nfs/dbraw/zinc/61/56/54/1041615654.db2.gz YRLNNBWXNDJLSU-OLZOCXBDSA-N 1 0 324.424 4.432 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC2CC2)c(O)c1 ZINC000185516639 1041615698 /nfs/dbraw/zinc/61/56/98/1041615698.db2.gz NBTCXTQHLZCKLM-OAHLLOKOSA-N 1 0 311.425 4.340 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CCCC1 ZINC000185749077 1041620778 /nfs/dbraw/zinc/62/07/78/1041620778.db2.gz IAMOOIIFNOGCPO-CQSZACIVSA-N 1 0 309.425 4.169 20 10 DICDRO CC(C)[N@H+](Cc1cc(-c2ccccc2)ccc1O)[C@H]1CCOC1 ZINC000812776123 1041645848 /nfs/dbraw/zinc/64/58/48/1041645848.db2.gz IVIFOTQATWVTED-IBGZPJMESA-N 1 0 311.425 4.059 20 10 DICDRO COc1ccc(N2CCC([NH2+]C3C[C@@H](C)C[C@H](C)C3)CC2)cc1 ZINC000812835017 1041654464 /nfs/dbraw/zinc/65/44/64/1041654464.db2.gz ZIRIFZKDGPQMBZ-HOTGVXAUSA-N 1 0 316.489 4.078 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCCC(C)(C)C3)CC2)cc1 ZINC000812844922 1041655261 /nfs/dbraw/zinc/65/52/61/1041655261.db2.gz SBIOOLAUCNWZPH-QGZVFWFLSA-N 1 0 316.489 4.222 20 10 DICDRO CCCC1(C[NH2+]C2CCN(c3ccc(OC)cc3)CC2)CCC1 ZINC000812837188 1041655305 /nfs/dbraw/zinc/65/53/05/1041655305.db2.gz AITQWLRUNPKGFT-UHFFFAOYSA-N 1 0 316.489 4.224 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)cc1 ZINC000812841631 1041655478 /nfs/dbraw/zinc/65/54/78/1041655478.db2.gz GBKBKHLOAISYQW-XYJFISCASA-N 1 0 316.489 4.078 20 10 DICDRO CCCOc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000728775121 1041671775 /nfs/dbraw/zinc/67/17/75/1041671775.db2.gz KIXDPHHNLOYMJC-UHFFFAOYSA-N 1 0 305.805 4.124 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(SC)s2)c1 ZINC000813331427 1041698985 /nfs/dbraw/zinc/69/89/85/1041698985.db2.gz OPCXSCSOFXZNCQ-SNVBAGLBSA-N 1 0 309.456 4.035 20 10 DICDRO Cc1cc(Br)c([O-])c(C[N@@H+](CC2CC2)C(C)C)c1 ZINC000781898540 1041705772 /nfs/dbraw/zinc/70/57/72/1041705772.db2.gz YYMRLJMPDZCQIH-UHFFFAOYSA-N 1 0 312.251 4.084 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2F)c2c1c(F)ccc2O ZINC000756547865 1041709325 /nfs/dbraw/zinc/70/93/25/1041709325.db2.gz IBXSWDOQOWSSSN-YMTOWFKASA-N 1 0 307.315 4.148 20 10 DICDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2c(O)cccc2Cl)s1 ZINC000123171893 1041733656 /nfs/dbraw/zinc/73/36/56/1041733656.db2.gz RXCWCPXCIDCWOP-JTQLQIEISA-N 1 0 310.850 4.312 20 10 DICDRO CC[C@@H]([NH2+]CC1CC(F)(F)C1)c1ccc(C(F)(F)F)cc1O ZINC000813872614 1041740537 /nfs/dbraw/zinc/74/05/37/1041740537.db2.gz IEKPWTUALWZLQY-GFCCVEGCSA-N 1 0 323.305 4.497 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1 ZINC000813872476 1041740612 /nfs/dbraw/zinc/74/06/12/1041740612.db2.gz HCEABOOPYZKIGM-CHWSQXEVSA-N 1 0 313.388 4.267 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)COC)c1ccc(C(F)(F)F)cc1O ZINC000813882756 1041742267 /nfs/dbraw/zinc/74/22/67/1041742267.db2.gz JNZZOPJUTWVDNF-CYBMUJFWSA-N 1 0 319.367 4.124 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(Cc3ccccc3)CC2)c(O)c1 ZINC000192902796 1041756708 /nfs/dbraw/zinc/75/67/08/1041756708.db2.gz PETBQTKTQDGOCR-QGZVFWFLSA-N 1 0 324.468 4.016 20 10 DICDRO COc1ccc(O)c(C[NH2+]Cc2cc(Cl)sc2Cl)c1 ZINC000312740777 1041779501 /nfs/dbraw/zinc/77/95/01/1041779501.db2.gz CXASSYOLDQDRIP-UHFFFAOYSA-N 1 0 318.225 4.059 20 10 DICDRO C[C@@]12CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]1C2(F)F ZINC000814169297 1041783044 /nfs/dbraw/zinc/78/30/44/1041783044.db2.gz GCIWSOXDNAVGFS-ZWKOTPCHSA-N 1 0 320.427 4.154 20 10 DICDRO CCOc1cccc(C[NH2+]C[C@@H](c2ccccc2)C2CC2)c1O ZINC000814298091 1041806943 /nfs/dbraw/zinc/80/69/43/1041806943.db2.gz OGZGIIIRNSDBRV-SFHVURJKSA-N 1 0 311.425 4.074 20 10 DICDRO CCOc1ccc(C[NH2+]C[C@H](c2ccccc2)C2CC2)c(O)c1 ZINC000814297667 1041807725 /nfs/dbraw/zinc/80/77/25/1041807725.db2.gz KGGLBDROYHWVNV-LJQANCHMSA-N 1 0 311.425 4.074 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)CC1 ZINC000775523821 1041827562 /nfs/dbraw/zinc/82/75/62/1041827562.db2.gz NVTMGNSUWQSWHJ-HNNXBMFYSA-N 1 0 311.853 4.293 20 10 DICDRO CC(C)COC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000124294507 1041831690 /nfs/dbraw/zinc/83/16/90/1041831690.db2.gz OTAFLHKVUSGELM-UHFFFAOYSA-N 1 0 313.441 4.182 20 10 DICDRO Cc1cc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)ccc1N(C)C ZINC000815092926 1041909917 /nfs/dbraw/zinc/90/99/17/1041909917.db2.gz VXLAODYMHVMGBT-MGPUTAFESA-N 1 0 309.457 4.039 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)cc1C ZINC000815141649 1041924996 /nfs/dbraw/zinc/92/49/96/1041924996.db2.gz FBXBGTADDZONEN-UHFFFAOYSA-N 1 0 305.368 4.405 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc(C(C)(F)F)cc2)cc1C ZINC000815142357 1041925795 /nfs/dbraw/zinc/92/57/95/1041925795.db2.gz RAKKSFWNBKJEBW-UHFFFAOYSA-N 1 0 305.368 4.411 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)c1cccc(Cl)c1 ZINC000756734773 1041950548 /nfs/dbraw/zinc/95/05/48/1041950548.db2.gz ZOJSZGADQMZIKK-FZKQIMNGSA-N 1 0 319.832 4.392 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]Cc1cccnc1 ZINC000815553273 1041961650 /nfs/dbraw/zinc/96/16/50/1041961650.db2.gz WAAAJZKYYUULTN-FQEVSTJZSA-N 1 0 318.420 4.251 20 10 DICDRO CCOCCC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815552986 1041961818 /nfs/dbraw/zinc/96/18/18/1041961818.db2.gz OYNKVJFJUQQZAS-LJQANCHMSA-N 1 0 313.441 4.082 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCSc2ccccc2)c(O)c1 ZINC000815554809 1041962074 /nfs/dbraw/zinc/96/20/74/1041962074.db2.gz JKHOHNJWHWJXML-HNNXBMFYSA-N 1 0 301.455 4.452 20 10 DICDRO CSCCC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815581467 1041965836 /nfs/dbraw/zinc/96/58/36/1041965836.db2.gz HFASVQXWJGBKMI-GOSISDBHSA-N 1 0 315.482 4.409 20 10 DICDRO CSC[C@@H](C)[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815582001 1041967516 /nfs/dbraw/zinc/96/75/16/1041967516.db2.gz VHGIPCFIWIHRPK-QAPCUYQASA-N 1 0 315.482 4.407 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@@H]1CCSC1 ZINC000815595244 1041969020 /nfs/dbraw/zinc/96/90/20/1041969020.db2.gz LNCBGRCUZHWNDT-SJLPKXTDSA-N 1 0 313.466 4.161 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)C[C@@H](O)c2ccccc2)c(O)c1 ZINC000815589637 1041969148 /nfs/dbraw/zinc/96/91/48/1041969148.db2.gz YVLFSOBGUDGVNB-XYJFISCASA-N 1 0 313.441 4.172 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccccc2)c(O)c1 ZINC000815589634 1041969192 /nfs/dbraw/zinc/96/91/92/1041969192.db2.gz YVLFSOBGUDGVNB-BQFCYCMXSA-N 1 0 313.441 4.172 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](O)c2ccccc2Cl)c(O)c1 ZINC000815594055 1041969659 /nfs/dbraw/zinc/96/96/59/1041969659.db2.gz DTIWOOPAVSGDTI-SUMWQHHRSA-N 1 0 319.832 4.047 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CC(C)(C)[C@@H]2CCCCO2)c(O)c1 ZINC000815596222 1041970089 /nfs/dbraw/zinc/97/00/89/1041970089.db2.gz NUQZZKGZJLYRHD-RDJZCZTQSA-N 1 0 305.462 4.255 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ccc(F)c(F)c2F)c(O)c1 ZINC000815615476 1041974432 /nfs/dbraw/zinc/97/44/32/1041974432.db2.gz QHOIUMBHQPGLBB-GFCCVEGCSA-N 1 0 323.358 4.320 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ccc(F)c(F)c2)c(O)c1 ZINC000815619299 1041975097 /nfs/dbraw/zinc/97/50/97/1041975097.db2.gz JFFDMSAFARLOOO-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)c(O)c1 ZINC000815623881 1041977248 /nfs/dbraw/zinc/97/72/48/1041977248.db2.gz JUMWIDFAPJUATO-JYJNAYRXSA-N 1 0 305.462 4.253 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@H]1C[C@@H]1C(F)F ZINC000815626080 1041977539 /nfs/dbraw/zinc/97/75/39/1041977539.db2.gz VFDBYYXOAPTHRL-BBWFWOEESA-N 1 0 317.379 4.309 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c(O)c1 ZINC000815623883 1041977810 /nfs/dbraw/zinc/97/78/10/1041977810.db2.gz JUMWIDFAPJUATO-YVSFHVDLSA-N 1 0 305.462 4.253 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 ZINC000815632594 1041978880 /nfs/dbraw/zinc/97/88/80/1041978880.db2.gz RVZPOETUAWQCMA-FNHZYXHNSA-N 1 0 312.432 4.489 20 10 DICDRO C[C@H](F)CC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815645360 1041983045 /nfs/dbraw/zinc/98/30/45/1041983045.db2.gz CQSVWCQGAHGVBD-MAUKXSAKSA-N 1 0 301.405 4.404 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc2ccccc2c1O ZINC000815642990 1041983109 /nfs/dbraw/zinc/98/31/09/1041983109.db2.gz QJUIXCOOBXGCSS-QWHCGFSZSA-N 1 0 308.381 4.058 20 10 DICDRO CCOC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000815644593 1041983307 /nfs/dbraw/zinc/98/33/07/1041983307.db2.gz GTWUTPINIRHZPI-JSGCOSHPSA-N 1 0 307.409 4.019 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC2(COC)CCC2)cc1 ZINC000815642225 1041983359 /nfs/dbraw/zinc/98/33/59/1041983359.db2.gz WCFMKHBYDITLHG-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1cc(Cl)ccc1O ZINC000815648645 1041984818 /nfs/dbraw/zinc/98/48/18/1041984818.db2.gz SOXRQYPLNBZUFW-JDFRZJQESA-N 1 0 301.817 4.500 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)C(C)(C)O ZINC000815652351 1041986107 /nfs/dbraw/zinc/98/61/07/1041986107.db2.gz YXPSXWICKPBEGI-VQIMIIECSA-N 1 0 318.505 4.267 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3SCCS[C@@H]23)c(O)c1C ZINC000756777674 1042015716 /nfs/dbraw/zinc/01/57/16/1042015716.db2.gz KPNCIEVASCBOAD-CRNXPOROSA-N 1 0 323.527 4.039 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc(OC(C)C)c1 ZINC000236764282 1042027377 /nfs/dbraw/zinc/02/73/77/1042027377.db2.gz ZNRAIVLVNHWFKV-UHFFFAOYSA-N 1 0 312.457 4.138 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2ccccc2)c1O ZINC000748050995 1042030719 /nfs/dbraw/zinc/03/07/19/1042030719.db2.gz LVZJDWKPHVFJOD-GOSISDBHSA-N 1 0 313.372 4.071 20 10 DICDRO C[N@H+](CCOc1ccccc1)Cc1ccc2ccccc2c1O ZINC000816478203 1042055529 /nfs/dbraw/zinc/05/55/29/1042055529.db2.gz YFMWZOKCNADRBK-UHFFFAOYSA-N 1 0 307.393 4.056 20 10 DICDRO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816482684 1042055572 /nfs/dbraw/zinc/05/55/72/1042055572.db2.gz OYLKIAGLRPNKOY-IBGZPJMESA-N 1 0 306.409 4.221 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc3ccccc3c2O)cc1 ZINC000816481155 1042056186 /nfs/dbraw/zinc/05/61/86/1042056186.db2.gz KSGGDRKONGDXTA-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO C[N@H+](Cc1ccc(F)c(F)c1)Cc1ccc2ccccc2c1O ZINC000816485470 1042057795 /nfs/dbraw/zinc/05/77/95/1042057795.db2.gz OCANWKSOUYERRU-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO CO[C@H](C[NH2+]Cc1ccc2ccccc2c1O)c1ccccc1 ZINC000816537517 1042063457 /nfs/dbraw/zinc/06/34/57/1042063457.db2.gz IANJEHADOORIGW-LJQANCHMSA-N 1 0 307.393 4.023 20 10 DICDRO C[NH+](C)Cc1ccc(NCc2ccc3ccccc3c2O)cc1 ZINC000816522823 1042065269 /nfs/dbraw/zinc/06/52/69/1042065269.db2.gz PQAXURJSVRDACI-UHFFFAOYSA-N 1 0 306.409 4.219 20 10 DICDRO Oc1c(C[NH2+][C@H]2CCOc3c(F)cccc32)ccc2ccccc21 ZINC000816586130 1042066108 /nfs/dbraw/zinc/06/61/08/1042066108.db2.gz ASSNCPZLHUMMLV-SFHVURJKSA-N 1 0 323.367 4.298 20 10 DICDRO CC(C)[C@H]1OCCC[C@@H]1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816555263 1042066991 /nfs/dbraw/zinc/06/69/91/1042066991.db2.gz YQCORIOIEAHRKP-YLJYHZDGSA-N 1 0 313.441 4.086 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+]Cc1ccc2ccccc2c1O ZINC000816557864 1042067140 /nfs/dbraw/zinc/06/71/40/1042067140.db2.gz DZKJSGAQPQDTKV-LBPRGKRZSA-N 1 0 310.397 4.044 20 10 DICDRO CCO[C@H](CC[NH2+]Cc1ccc2ccccc2c1O)C(C)C ZINC000816555798 1042067221 /nfs/dbraw/zinc/06/72/21/1042067221.db2.gz QDSLAEYFYOQSBU-GOSISDBHSA-N 1 0 301.430 4.086 20 10 DICDRO CCOCCC1(C[NH2+]Cc2ccc3ccccc3c2O)CCC1 ZINC000816558008 1042067839 /nfs/dbraw/zinc/06/78/39/1042067839.db2.gz JHVBVUCQRGQYBT-UHFFFAOYSA-N 1 0 313.441 4.232 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)ccc2ccccc21 ZINC000816592161 1042068001 /nfs/dbraw/zinc/06/80/01/1042068001.db2.gz AXTQWBUSQNWATO-LBPRGKRZSA-N 1 0 309.331 4.320 20 10 DICDRO [O-]c1c(Cl)cccc1C[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000816625084 1042070219 /nfs/dbraw/zinc/07/02/19/1042070219.db2.gz QTISICLFDFKZNW-CTYIDZIISA-N 1 0 305.780 4.221 20 10 DICDRO C[C@H]1CC(CC[NH2+]Cc2ccc3ccccc3c2O)C[C@H](C)O1 ZINC000816601018 1042072248 /nfs/dbraw/zinc/07/22/48/1042072248.db2.gz ORAIEUIJSPVSSG-GJZGRUSLSA-N 1 0 313.441 4.229 20 10 DICDRO Oc1c(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)ccc2ccccc21 ZINC000816616161 1042073819 /nfs/dbraw/zinc/07/38/19/1042073819.db2.gz PPXSSQPJLSBYPT-AZUAARDMSA-N 1 0 323.436 4.079 20 10 DICDRO Oc1c(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)ccc2ccccc21 ZINC000816616163 1042073973 /nfs/dbraw/zinc/07/39/73/1042073973.db2.gz PPXSSQPJLSBYPT-QUCCMNQESA-N 1 0 323.436 4.079 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC23CCSCC3)c2c1c(F)ccc2O ZINC000817588266 1042118632 /nfs/dbraw/zinc/11/86/32/1042118632.db2.gz DFEIEPSYCMIGDI-YRGRVCCFSA-N 1 0 321.461 4.203 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)cc(C)n1 ZINC000817590068 1042119647 /nfs/dbraw/zinc/11/96/47/1042119647.db2.gz SXNPNXLOQGEWBU-HNNXBMFYSA-N 1 0 310.441 4.134 20 10 DICDRO C[C@H]([NH2+]C[C@H](N)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000817955316 1042131235 /nfs/dbraw/zinc/13/12/35/1042131235.db2.gz VOFSAURISWUSDN-UWJYYQICSA-N 1 0 323.484 4.028 20 10 DICDRO Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955765 1042131339 /nfs/dbraw/zinc/13/13/39/1042131339.db2.gz HHUHIENEVIMWRA-LBPRGKRZSA-N 1 0 303.475 4.050 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1OC(F)(F)F ZINC000817955495 1042131783 /nfs/dbraw/zinc/13/17/83/1042131783.db2.gz CDBJRWJASQUBKG-LBPRGKRZSA-N 1 0 324.346 4.061 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1cccc(Cl)c1[O-] ZINC000817963110 1042132501 /nfs/dbraw/zinc/13/25/01/1042132501.db2.gz NKXJSGJSNUHZFR-SJKOYZFVSA-N 1 0 318.848 4.306 20 10 DICDRO Nc1ccc(CC[NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000817957154 1042132923 /nfs/dbraw/zinc/13/29/23/1042132923.db2.gz JRGGIRUBBACSHA-APWZRJJASA-N 1 0 314.860 4.391 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)c(O)c1 ZINC000817967188 1042134047 /nfs/dbraw/zinc/13/40/47/1042134047.db2.gz DRLDUHGLAFBYBN-RDTXWAMCSA-N 1 0 310.441 4.319 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)c(O)c1C ZINC000817967432 1042134119 /nfs/dbraw/zinc/13/41/19/1042134119.db2.gz IJDARYDUKRJKBM-KUHUBIRLSA-N 1 0 310.441 4.319 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000817968615 1042134578 /nfs/dbraw/zinc/13/45/78/1042134578.db2.gz UUEBLDBIHLOTTC-VLIAUNLRSA-N 1 0 309.457 4.063 20 10 DICDRO Cc1cc(N)cc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000817979430 1042135727 /nfs/dbraw/zinc/13/57/27/1042135727.db2.gz AYTDUWYBTJIYPJ-KRWDZBQOSA-N 1 0 323.484 4.418 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)c(O)c1C ZINC000817977397 1042136259 /nfs/dbraw/zinc/13/62/59/1042136259.db2.gz JGVHHWNZRBXZHD-HNNXBMFYSA-N 1 0 310.441 4.218 20 10 DICDRO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1ccccc1O ZINC000818230431 1042145124 /nfs/dbraw/zinc/14/51/24/1042145124.db2.gz BMQFAOSCLVCBBL-UHFFFAOYSA-N 1 0 305.805 4.079 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000818615158 1042157715 /nfs/dbraw/zinc/15/77/15/1042157715.db2.gz MNXMEBBEHBGDQP-FRRDWIJNSA-N 1 0 317.260 4.010 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+](Cc2cccs2)C(C)C)c1O ZINC000314964315 1042182314 /nfs/dbraw/zinc/18/23/14/1042182314.db2.gz BAFDCIQVKYDUDO-UHFFFAOYSA-N 1 0 321.417 4.206 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(C)c(OC)c2)cc1C ZINC001648935626 1042221907 /nfs/dbraw/zinc/22/19/07/1042221907.db2.gz XGMNEDFSWYVLPV-UHFFFAOYSA-N 1 0 313.441 4.391 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccc(N(C)C)cc1 ZINC000178530372 1042240641 /nfs/dbraw/zinc/24/06/41/1042240641.db2.gz OEOUHOHTRLNMBZ-SFHVURJKSA-N 1 0 316.420 4.141 20 10 DICDRO C[C@H]([NH2+]CCOc1ccccc1)c1ccc2ccccc2c1O ZINC000390886598 1042244343 /nfs/dbraw/zinc/24/43/43/1042244343.db2.gz XEQNUPYIMKMGPA-HNNXBMFYSA-N 1 0 307.393 4.275 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cccc(F)c2C1)c1ccc(N(C)C)cc1 ZINC001170963352 1042249247 /nfs/dbraw/zinc/24/92/47/1042249247.db2.gz WJBGRJGTVLUOFO-YOEHRIQHSA-N 1 0 312.432 4.100 20 10 DICDRO Cc1cccc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1O ZINC000278999865 1042258586 /nfs/dbraw/zinc/25/85/86/1042258586.db2.gz KKPDNNMAOJLRNE-VIFPVBQESA-N 1 0 316.348 4.027 20 10 DICDRO CC(C)n1cncc1CN1CCCc2cc(OC(F)F)ccc21 ZINC000822470725 1042287934 /nfs/dbraw/zinc/28/79/34/1042287934.db2.gz XWPBVVLFRZVKOM-UHFFFAOYSA-N 1 0 321.371 4.018 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(Cl)cc2F)cc1 ZINC001137662569 1042323069 /nfs/dbraw/zinc/32/30/69/1042323069.db2.gz XXZFQKYTVWURHJ-UHFFFAOYSA-N 1 0 306.812 4.177 20 10 DICDRO CC(C)[N@H+](Cc1cc2cccnc2o1)Cc1ccc(N(C)C)cc1 ZINC000823403961 1042324166 /nfs/dbraw/zinc/32/41/66/1042324166.db2.gz HTLUMZRHXDAAIS-UHFFFAOYSA-N 1 0 323.440 4.304 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1nc(C(F)(F)F)cs1 ZINC000279599318 1042324514 /nfs/dbraw/zinc/32/45/14/1042324514.db2.gz WBHGBGXGUIERAQ-IUCAKERBSA-N 1 0 316.348 4.279 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3c(Cl)cccc3C2)cc1 ZINC001171021474 1042333039 /nfs/dbraw/zinc/33/30/39/1042333039.db2.gz FFUYSGSHEITHHP-MRXNPFEDSA-N 1 0 314.860 4.053 20 10 DICDRO CCC[C@@H](CCc1ccccc1)[NH2+]Cc1cccc(OC)c1O ZINC000236882335 1042361966 /nfs/dbraw/zinc/36/19/66/1042361966.db2.gz ZJQXXAKHFNKXNJ-SFHVURJKSA-N 1 0 313.441 4.292 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCc3occc32)cc1F ZINC000236977021 1042443155 /nfs/dbraw/zinc/44/31/55/1042443155.db2.gz VQRDPLDCGYGIHC-KRWDZBQOSA-N 1 0 316.420 4.432 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccc(C)cc1O ZINC000279961635 1042466233 /nfs/dbraw/zinc/46/62/33/1042466233.db2.gz CHKGTUMFEYRJKL-OALUTQOASA-N 1 0 313.441 4.255 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000237092100 1042523158 /nfs/dbraw/zinc/52/31/58/1042523158.db2.gz LCLGGPXFYDAXAW-UHFFFAOYSA-N 1 0 322.374 4.370 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccc(C)cc1O ZINC000280103662 1042564340 /nfs/dbraw/zinc/56/43/40/1042564340.db2.gz NGAWNJSHSKHPDX-INIZCTEOSA-N 1 0 303.377 4.089 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)C[C@H](O)c1cccs1)c1ccc(C)cc1O ZINC000280099153 1042564455 /nfs/dbraw/zinc/56/44/55/1042564455.db2.gz MYLKAULFSQTSQE-QRTARXTBSA-N 1 0 319.470 4.315 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccc(C)cc1O ZINC000280156279 1042566346 /nfs/dbraw/zinc/56/63/46/1042566346.db2.gz QLDYBWQHZROMOQ-SJORKVTESA-N 1 0 315.388 4.404 20 10 DICDRO c1cncc([C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C2CCC2)c1 ZINC000280185201 1042567312 /nfs/dbraw/zinc/56/73/12/1042567312.db2.gz COZJQBFTBUVVFQ-NRFANRHFSA-N 1 0 321.468 4.313 20 10 DICDRO COc1ccc(O)c(C[NH2+]Cc2cc(C)cc3c(C)c(C)[nH]c32)c1 ZINC000271897462 1042672371 /nfs/dbraw/zinc/67/23/71/1042672371.db2.gz UMSBPZGORZLARX-UHFFFAOYSA-N 1 0 324.424 4.097 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccccc1OC ZINC000319682375 1042678379 /nfs/dbraw/zinc/67/83/79/1042678379.db2.gz VQMXEXDEBJEEEN-SUMWQHHRSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2c(F)cccc2Cl)c1O ZINC000894323220 1042844906 /nfs/dbraw/zinc/84/49/06/1042844906.db2.gz LELWCNRLSKDYNU-LLVKDONJSA-N 1 0 323.795 4.353 20 10 DICDRO Cc1ccc2oc(C[NH2+]Cc3ccc4c(c3)CCCO4)cc2c1 ZINC001203144922 1042932429 /nfs/dbraw/zinc/93/24/29/1042932429.db2.gz UQBSPYRGSFOZOO-UHFFFAOYSA-N 1 0 307.393 4.356 20 10 DICDRO Cc1cccc2c1CC[N@H+](Cc1c(O)ccc3ccccc31)C2 ZINC000729467216 1042973915 /nfs/dbraw/zinc/97/39/15/1042973915.db2.gz TVCVOGCCXUJGCE-UHFFFAOYSA-N 1 0 303.405 4.412 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2CCCc3c(F)cccc32)c1O ZINC000894868199 1042993895 /nfs/dbraw/zinc/99/38/95/1042993895.db2.gz POIKZDYQMYRISP-KRWDZBQOSA-N 1 0 315.388 4.016 20 10 DICDRO CC[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccc(C)cc1O ZINC000794807197 1043050860 /nfs/dbraw/zinc/05/08/60/1043050860.db2.gz WJMVSUYHNOHNNQ-IBGZPJMESA-N 1 0 321.424 4.127 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(C)cc1O ZINC000794807285 1043050993 /nfs/dbraw/zinc/05/09/93/1043050993.db2.gz XFZFLYPXANSWMW-IBGZPJMESA-N 1 0 324.468 4.324 20 10 DICDRO CC[C@@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccc(C)cc1O ZINC000794803194 1043051016 /nfs/dbraw/zinc/05/10/16/1043051016.db2.gz PWVSPUZLAIOILH-HXUWFJFHSA-N 1 0 324.468 4.410 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1N(C)CC)c1ccc(C)cc1O ZINC000794803624 1043051043 /nfs/dbraw/zinc/05/10/43/1043051043.db2.gz BRUFVFRGDIZLSZ-SFHVURJKSA-N 1 0 312.457 4.398 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1ccc(C)cc1O ZINC000794811518 1043056589 /nfs/dbraw/zinc/05/65/89/1043056589.db2.gz FHDBTINHDFYWSR-JFRXWTBNSA-N 1 0 315.457 4.089 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)Cc1cccc(OC)c1)c1ccc(C)cc1O ZINC000794810901 1043057055 /nfs/dbraw/zinc/05/70/55/1043057055.db2.gz NPQCTNUVSUVYDC-KXBFYZLASA-N 1 0 313.441 4.381 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)Cc1cccc(OC)c1)c1ccc(C)cc1O ZINC000794810899 1043057120 /nfs/dbraw/zinc/05/71/20/1043057120.db2.gz NPQCTNUVSUVYDC-DNVCBOLYSA-N 1 0 313.441 4.381 20 10 DICDRO CC[C@H]([NH2+]CC[C@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000794814578 1043058884 /nfs/dbraw/zinc/05/88/84/1043058884.db2.gz LVOWCAXMXMMPCD-ICSRJNTNSA-N 1 0 313.441 4.039 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccc(C)cc1O ZINC000794812425 1043060399 /nfs/dbraw/zinc/06/03/99/1043060399.db2.gz WQOYGJQWJDQEPK-UYAOXDASSA-N 1 0 311.425 4.055 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccc(C)cc1O ZINC000794812421 1043060695 /nfs/dbraw/zinc/06/06/95/1043060695.db2.gz WQOYGJQWJDQEPK-ICSRJNTNSA-N 1 0 311.425 4.055 20 10 DICDRO CC[C@@H]([NH2+]CCSCC(F)(F)F)c1ccc(C)cc1O ZINC000794817230 1043062273 /nfs/dbraw/zinc/06/22/73/1043062273.db2.gz NYTUKLANLCIKGE-GFCCVEGCSA-N 1 0 307.381 4.037 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1ccc(C)cc1O ZINC000794817088 1043062437 /nfs/dbraw/zinc/06/24/37/1043062437.db2.gz OVPNXYCDRRMGKP-HFTRVMKXSA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)C)c1ccc(C)cc1O ZINC000794820239 1043064195 /nfs/dbraw/zinc/06/41/95/1043064195.db2.gz ZKZOCGUKDNVRBG-VDZJLULYSA-N 1 0 305.462 4.193 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3ncccc3c2)c2c1c(F)ccc2O ZINC000794827071 1043066076 /nfs/dbraw/zinc/06/60/76/1043066076.db2.gz FRBKUKNOAGPBOX-SJCJKPOMSA-N 1 0 322.383 4.418 20 10 DICDRO C[C@@H]([NH2+]Cc1cnc2c(F)cccc2c1)c1ccc(N(C)C)cc1 ZINC000865531749 1043111399 /nfs/dbraw/zinc/11/13/99/1043111399.db2.gz NJTJQTDLBFCKHS-CQSZACIVSA-N 1 0 323.415 4.291 20 10 DICDRO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cc2cnccc2o1 ZINC000865854560 1043142280 /nfs/dbraw/zinc/14/22/80/1043142280.db2.gz QEMZNOZTBAXGQW-FOSCPCJNSA-N 1 0 321.424 4.258 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccc1N(C)C ZINC000179400942 1043144812 /nfs/dbraw/zinc/14/48/12/1043144812.db2.gz GLFQCOOJPUTXAE-QGZVFWFLSA-N 1 0 323.484 4.204 20 10 DICDRO C[C@H](c1ccccc1)[N@H+](CCCCCO)Cc1ccccc1O ZINC000179645209 1043148574 /nfs/dbraw/zinc/14/85/74/1043148574.db2.gz QGZGLXASTLYQEM-QGZVFWFLSA-N 1 0 313.441 4.118 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCOCC1)c1ccc(N2CCCCCC2)cc1 ZINC000183339155 1043160905 /nfs/dbraw/zinc/16/09/05/1043160905.db2.gz DHDDVMKXABJCLR-HKUYNNGSSA-N 1 0 316.489 4.287 20 10 DICDRO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccccc1O ZINC000183332196 1043161066 /nfs/dbraw/zinc/16/10/66/1043161066.db2.gz XPQZAFYAEBXZQG-ZDUSSCGKSA-N 1 0 304.459 4.387 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCc3ncccc32)cc1 ZINC000866237599 1043163689 /nfs/dbraw/zinc/16/36/89/1043163689.db2.gz IEAUBHNQIVIVBM-HXUWFJFHSA-N 1 0 309.457 4.095 20 10 DICDRO C[C@@H]([NH2+]CCc1nc(C(C)(C)C)cs1)c1ccccc1O ZINC000183497818 1043164266 /nfs/dbraw/zinc/16/42/66/1043164266.db2.gz KSTSNFJFNKRESZ-GFCCVEGCSA-N 1 0 304.459 4.040 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1O ZINC000183446623 1043164785 /nfs/dbraw/zinc/16/47/85/1043164785.db2.gz YOSLVCMMLXRJLR-RIFZZMRRSA-N 1 0 311.425 4.211 20 10 DICDRO Cc1cc(C)n(-c2ccccc2C[NH2+][C@H](C)c2ccccc2O)n1 ZINC000183561978 1043167086 /nfs/dbraw/zinc/16/70/86/1043167086.db2.gz PCHTYWFGBOUENO-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO CCS[C@@H]1CCCC[N@H+](Cc2ccc(N(C)CC)cc2)C1 ZINC001307465296 1043178692 /nfs/dbraw/zinc/17/86/92/1043178692.db2.gz RIAJKOVZUOWJNI-GOSISDBHSA-N 1 0 306.519 4.250 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000185230032 1043195835 /nfs/dbraw/zinc/19/58/35/1043195835.db2.gz VZNIHOMCKJCHCX-STQMWFEESA-N 1 0 303.377 4.342 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](c2ccccc2)[C@@H]2CCCO2)c1 ZINC000185225067 1043197375 /nfs/dbraw/zinc/19/73/75/1043197375.db2.gz YIXOXGJQDNUQJK-UIAACRFSSA-N 1 0 311.425 4.272 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(O)c1 ZINC000185374325 1043200388 /nfs/dbraw/zinc/20/03/88/1043200388.db2.gz ZPYVMUWEBZVSOO-GFCCVEGCSA-N 1 0 304.459 4.305 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(-n3cccn3)c2)c(O)c1 ZINC000185616854 1043205412 /nfs/dbraw/zinc/20/54/12/1043205412.db2.gz NKSMUCYJCNFQGT-JKSUJKDBSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)s1 ZINC000866454617 1043205807 /nfs/dbraw/zinc/20/58/07/1043205807.db2.gz FILBYDIEJHEEOH-PTRXPTGYSA-N 1 0 306.406 4.195 20 10 DICDRO CC(C)[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1cccnc1 ZINC000185661310 1043206552 /nfs/dbraw/zinc/20/65/52/1043206552.db2.gz LCTVWFBEDQMJDW-CXAGYDPISA-N 1 0 302.393 4.017 20 10 DICDRO CC(C)c1csc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)n1 ZINC000185807792 1043208268 /nfs/dbraw/zinc/20/82/68/1043208268.db2.gz ZTNHMWSHFRXLML-SNVBAGLBSA-N 1 0 310.850 4.476 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc2[nH]c(=O)oc2c1)c1ccccc1O ZINC000866486002 1043209313 /nfs/dbraw/zinc/20/93/13/1043209313.db2.gz VKMBKJCAQIDBPX-FZMZJTMJSA-N 1 0 312.369 4.041 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(OCC(F)F)c2)c(O)c1 ZINC000185982645 1043210898 /nfs/dbraw/zinc/21/08/98/1043210898.db2.gz MJGCHVCGTHLQGX-ZDUSSCGKSA-N 1 0 321.367 4.195 20 10 DICDRO CCC(CC)(C[NH2+][C@@H](C)c1cccc(OC)c1O)C(F)(F)F ZINC000866506173 1043212189 /nfs/dbraw/zinc/21/21/89/1043212189.db2.gz DXKCULCTSMVWIL-NSHDSACASA-N 1 0 319.367 4.420 20 10 DICDRO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000186057467 1043212706 /nfs/dbraw/zinc/21/27/06/1043212706.db2.gz LVPKTKMSXUZIRD-LSDHHAIUSA-N 1 0 323.440 4.482 20 10 DICDRO CC[C@H]([NH2+]Cc1noc2ccc(F)cc21)c1ccc(C)cc1O ZINC000866510526 1043213795 /nfs/dbraw/zinc/21/37/95/1043213795.db2.gz DRRABPNXHOMPLV-HNNXBMFYSA-N 1 0 314.360 4.222 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc2ccccc2c1)c1ccccc1O ZINC000121090265 1043214665 /nfs/dbraw/zinc/21/46/65/1043214665.db2.gz GOYAPIFCTAVKAF-CTNGQTDRSA-N 1 0 321.420 4.320 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccc1O ZINC000186106298 1043215338 /nfs/dbraw/zinc/21/53/38/1043215338.db2.gz FBWWXYDVRVRZKO-IBGZPJMESA-N 1 0 310.441 4.233 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccc(F)c2F)c1 ZINC000186207927 1043217562 /nfs/dbraw/zinc/21/75/62/1043217562.db2.gz PESKDXUAAIWQGL-MNOVXSKESA-N 1 0 307.340 4.091 20 10 DICDRO CC[C@@H]([NH2+]CCSCCC(F)(F)F)c1ccccc1O ZINC000866543477 1043222117 /nfs/dbraw/zinc/22/21/17/1043222117.db2.gz RENGFSKJDFPRHB-GFCCVEGCSA-N 1 0 307.381 4.119 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCOc3c(F)cccc32)c1 ZINC000186506565 1043224958 /nfs/dbraw/zinc/22/49/58/1043224958.db2.gz LFHMYMQQAPBQJG-GUYCJALGSA-N 1 0 315.388 4.404 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(OC)ccc2O)CCO1 ZINC000186502359 1043224968 /nfs/dbraw/zinc/22/49/68/1043224968.db2.gz WXZLKIUCLBTDCI-OHNRDTAOSA-N 1 0 321.461 4.035 20 10 DICDRO CCSc1cc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)ccn1 ZINC000187787721 1043251439 /nfs/dbraw/zinc/25/14/39/1043251439.db2.gz RALSMSZWXZOUIJ-LLVKDONJSA-N 1 0 322.861 4.403 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2ccc(OC)c(C)c2)C(C)C)cc1 ZINC000237220447 1043256285 /nfs/dbraw/zinc/25/62/85/1043256285.db2.gz GYWAFYAIDYDLTM-FQEVSTJZSA-N 1 0 313.441 4.499 20 10 DICDRO c1ccc2c(c1)NCCC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000192661787 1043273638 /nfs/dbraw/zinc/27/36/38/1043273638.db2.gz HTTVHNZGTNTEPQ-OAQYLSRUSA-N 1 0 321.468 4.323 20 10 DICDRO COc1cccc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)c1O ZINC000237231736 1043274618 /nfs/dbraw/zinc/27/46/18/1043274618.db2.gz IMQFGNPPPYTYBE-SFHVURJKSA-N 1 0 317.404 4.417 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@@H]3CCCNc4ccccc43)ccc21 ZINC000192780887 1043275691 /nfs/dbraw/zinc/27/56/91/1043275691.db2.gz XHVICOQIPBBRRM-HXUWFJFHSA-N 1 0 321.468 4.106 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc3ncccc3c2)c(O)c1 ZINC000192975453 1043277861 /nfs/dbraw/zinc/27/78/61/1043277861.db2.gz MABAXOAWGFIITJ-UHFFFAOYSA-N 1 0 322.408 4.019 20 10 DICDRO CCc1nc(C)c([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC000122417962 1043303992 /nfs/dbraw/zinc/30/39/92/1043303992.db2.gz OLANKAWIBLIALE-NSHDSACASA-N 1 0 321.465 4.070 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCSc2ccccc21 ZINC000122686509 1043321593 /nfs/dbraw/zinc/32/15/93/1043321593.db2.gz RVBNBUJUFVVPIJ-GOSISDBHSA-N 1 0 312.482 4.388 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1ccc(N2CCCCC2)cc1 ZINC000271527180 1043431903 /nfs/dbraw/zinc/43/19/03/1043431903.db2.gz QIROGHJPWYCCAN-DNVCBOLYSA-N 1 0 324.472 4.128 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCO[C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000271582253 1043439354 /nfs/dbraw/zinc/43/93/54/1043439354.db2.gz WZZRRLNYAXHJCM-LMMKCTJWSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2cccc3ncccc23)c2c1c(F)ccc2O ZINC000872124301 1043469514 /nfs/dbraw/zinc/46/95/14/1043469514.db2.gz JDFPVAPJTHZGOY-SJCJKPOMSA-N 1 0 322.383 4.418 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCOc3c(F)cccc32)cc1Cl ZINC000825633579 1043510008 /nfs/dbraw/zinc/51/00/08/1043510008.db2.gz BEZDLDLPFZZNGE-HNNXBMFYSA-N 1 0 321.779 4.107 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOc3c(F)cccc32)cc1Cl ZINC000825633580 1043510594 /nfs/dbraw/zinc/51/05/94/1043510594.db2.gz BEZDLDLPFZZNGE-OAHLLOKOSA-N 1 0 321.779 4.107 20 10 DICDRO Cc1[nH]c2ccccc2c1C1=CCN(c2cc[nH+]cc2C)CC1 ZINC000521947953 1043510969 /nfs/dbraw/zinc/51/09/69/1043510969.db2.gz OPIZXTADBTVOFI-UHFFFAOYSA-N 1 0 303.409 4.473 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(Cl)nc2)cc1C ZINC000873016341 1043513992 /nfs/dbraw/zinc/51/39/92/1043513992.db2.gz KLLUMSQQAJLNGX-UHFFFAOYSA-N 1 0 304.821 4.122 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](CCO)c2cccs2)cc1C ZINC000873059337 1043514197 /nfs/dbraw/zinc/51/41/97/1043514197.db2.gz PQXFAPOXYBVSQU-MRXNPFEDSA-N 1 0 319.470 4.059 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccc(C(F)(F)F)nc2)cc1C ZINC000873185163 1043524044 /nfs/dbraw/zinc/52/40/44/1043524044.db2.gz QRJLNIXNBJLYSM-GFCCVEGCSA-N 1 0 324.346 4.274 20 10 DICDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000124472057 1043530859 /nfs/dbraw/zinc/53/08/59/1043530859.db2.gz VWAXXGBMLKQDGU-HZPDHXFCSA-N 1 0 312.457 4.481 20 10 DICDRO CCC[N@H+](CCC(=O)c1ccc(F)cc1)Cc1ccccc1O ZINC000777593207 1043554069 /nfs/dbraw/zinc/55/40/69/1043554069.db2.gz AIPBGXHDHZJZCQ-UHFFFAOYSA-N 1 0 315.388 4.016 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+]Cc2cc(Cl)c(C)cc2O)c1 ZINC000825773190 1043618764 /nfs/dbraw/zinc/61/87/64/1043618764.db2.gz AKQZNSMONMWRMR-UHFFFAOYSA-N 1 0 311.212 4.001 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccc2ccccc2c1O ZINC000926949883 1043661123 /nfs/dbraw/zinc/66/11/23/1043661123.db2.gz OTMXRMGOULKHBY-ITDIGPHOSA-N 1 0 309.331 4.394 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCCc3cccnc32)c1O ZINC000927061724 1043676041 /nfs/dbraw/zinc/67/60/41/1043676041.db2.gz RDNQVUAKKMVOPX-BLLLJJGKSA-N 1 0 316.832 4.477 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3cccnc32)c2c1c(F)ccc2O ZINC000927064017 1043676927 /nfs/dbraw/zinc/67/69/27/1043676927.db2.gz OAUCJDLOWKJBHR-BYCMXARLSA-N 1 0 312.388 4.142 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)CCc2cccs2)cc1 ZINC000729542380 1043691470 /nfs/dbraw/zinc/69/14/70/1043691470.db2.gz BELFNTUDYPSYNH-UHFFFAOYSA-N 1 0 302.487 4.269 20 10 DICDRO CCSc1ccc(C[NH2+]Cc2cc(C)cc(OC)c2O)cc1 ZINC000895527346 1043700789 /nfs/dbraw/zinc/70/07/89/1043700789.db2.gz YPSGCCCRKPLSBB-UHFFFAOYSA-N 1 0 317.454 4.111 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2CCSc3ccc(F)cc32)c(O)c1 ZINC000876909371 1043723429 /nfs/dbraw/zinc/72/34/29/1043723429.db2.gz ZGMYPUQMKRQHSN-HNNXBMFYSA-N 1 0 303.402 4.166 20 10 DICDRO Oc1c(C[NH+]2CCC3(CCCCO3)CC2)ccc2ccccc21 ZINC000895653647 1043726928 /nfs/dbraw/zinc/72/69/28/1043726928.db2.gz KEUHQPVCLYPUAV-UHFFFAOYSA-N 1 0 311.425 4.081 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc3ccc(C)cc3[nH]2)c1 ZINC000825933616 1043739992 /nfs/dbraw/zinc/73/99/92/1043739992.db2.gz BLIMBMOSPBLOHQ-CYBMUJFWSA-N 1 0 310.397 4.041 20 10 DICDRO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC000825935333 1043747874 /nfs/dbraw/zinc/74/78/74/1043747874.db2.gz QKBZEPUVMYPVJZ-OAHLLOKOSA-N 1 0 319.836 4.031 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c(O)c1 ZINC000877482420 1043765950 /nfs/dbraw/zinc/76/59/50/1043765950.db2.gz IOOJUTUSEYCCHE-SECBINFHSA-N 1 0 316.348 4.027 20 10 DICDRO COc1cc(C)cc(C[NH2+]C(C)(C)c2ccc(F)cc2F)c1O ZINC000895855244 1043768287 /nfs/dbraw/zinc/76/82/87/1043768287.db2.gz QDVVQQKAJZDKBJ-UHFFFAOYSA-N 1 0 321.367 4.012 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000877589551 1043778650 /nfs/dbraw/zinc/77/86/50/1043778650.db2.gz QCAPKTRAWLUMJF-FQEVSTJZSA-N 1 0 323.436 4.054 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000877589553 1043779379 /nfs/dbraw/zinc/77/93/79/1043779379.db2.gz QCAPKTRAWLUMJF-HXUWFJFHSA-N 1 0 323.436 4.054 20 10 DICDRO CCCn1c(C[NH2+][C@H](C)c2ccccc2O)nc2ccccc21 ZINC000877756355 1043792839 /nfs/dbraw/zinc/79/28/39/1043792839.db2.gz IHDSSOXLTOZWDV-CQSZACIVSA-N 1 0 309.413 4.003 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+][C@H](C)c1ccccc1O)CC3 ZINC000783533717 1043850305 /nfs/dbraw/zinc/85/03/05/1043850305.db2.gz WBFMDEOSSIBPRN-CABCVRRESA-N 1 0 320.436 4.390 20 10 DICDRO CC[C@@H]([NH2+]CCCn1ccc2ccccc21)c1ccccc1O ZINC000320273467 1043853685 /nfs/dbraw/zinc/85/36/85/1043853685.db2.gz FMOFKRNLALQXNS-GOSISDBHSA-N 1 0 308.425 4.478 20 10 DICDRO Oc1ccccc1C[N@H+](CCCc1cccnc1)Cc1ccco1 ZINC000929969307 1043862424 /nfs/dbraw/zinc/86/24/24/1043862424.db2.gz LNOQHIYCNRPWCN-UHFFFAOYSA-N 1 0 322.408 4.015 20 10 DICDRO Oc1c(C[NH2+]Cc2nccc3c2CCCC3)ccc2ccccc21 ZINC000896281239 1043877625 /nfs/dbraw/zinc/87/76/25/1043877625.db2.gz MSCHRADKFVEXOQ-UHFFFAOYSA-N 1 0 318.420 4.109 20 10 DICDRO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H](C)c3ccccc3O)cc2)n1 ZINC000879651498 1043978981 /nfs/dbraw/zinc/97/89/81/1043978981.db2.gz YJGZYFWMPZJPRK-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO C[C@@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccccc1O ZINC000879649274 1043979140 /nfs/dbraw/zinc/97/91/40/1043979140.db2.gz OTTYKDAPKLOJFQ-GFCCVEGCSA-N 1 0 302.443 4.357 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(C)c1O)c1cc(F)ccc1OC ZINC000896688150 1043980495 /nfs/dbraw/zinc/98/04/95/1043980495.db2.gz HPQYHNSWYJYIFC-INIZCTEOSA-N 1 0 303.377 4.089 20 10 DICDRO Oc1c(C[NH2+]Cc2nc3c(s2)CCCC3)ccc2ccccc21 ZINC000896822966 1044023763 /nfs/dbraw/zinc/02/37/63/1044023763.db2.gz AZJNEECCWONVKV-UHFFFAOYSA-N 1 0 324.449 4.171 20 10 DICDRO Cc1nc(C[NH2+][C@H](C)c2ccccc2O)sc1C(C)(C)C ZINC000931554031 1044044580 /nfs/dbraw/zinc/04/45/80/1044044580.db2.gz KGOSSKFCRLFOGX-LLVKDONJSA-N 1 0 304.459 4.305 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)s1 ZINC000728048319 1044075270 /nfs/dbraw/zinc/07/52/70/1044075270.db2.gz KICJSAWUERVXIN-UHFFFAOYSA-N 1 0 319.470 4.397 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@@H](c3cccnc3)C3CCC3)ccc21 ZINC000280984833 1044088589 /nfs/dbraw/zinc/08/85/89/1044088589.db2.gz WLXAVNPXESDVNT-OAQYLSRUSA-N 1 0 321.468 4.095 20 10 DICDRO FC(F)(F)[C@@H]1CCC[C@H]([NH2+]CCCSc2nccs2)C1 ZINC000129977264 1044188044 /nfs/dbraw/zinc/18/80/44/1044188044.db2.gz RNMVXFFUCDDVDT-MNOVXSKESA-N 1 0 324.437 4.336 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](C)c2ccccc2SC)c1 ZINC000281881297 1044206963 /nfs/dbraw/zinc/20/69/63/1044206963.db2.gz DGAXCPOSTVAPMN-CYBMUJFWSA-N 1 0 317.454 4.364 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cccc2cccnc21 ZINC000130732407 1044212704 /nfs/dbraw/zinc/21/27/04/1044212704.db2.gz QOBFXWMEWZFIRO-UHFFFAOYSA-N 1 0 306.409 4.353 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1Cl)c1ccc(C)cc1O ZINC000883302483 1044263600 /nfs/dbraw/zinc/26/36/00/1044263600.db2.gz ZHJFXUHAMVQDJG-OAHLLOKOSA-N 1 0 304.821 4.298 20 10 DICDRO CC[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccccc1O ZINC000293577539 1044300829 /nfs/dbraw/zinc/30/08/29/1044300829.db2.gz BUDDFWPPSRCADG-HNNXBMFYSA-N 1 0 324.346 4.089 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)c1 ZINC000293607840 1044304904 /nfs/dbraw/zinc/30/49/04/1044304904.db2.gz DWJZNSKYVRZNNE-LBPRGKRZSA-N 1 0 321.367 4.363 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2nsc3ccccc23)c(O)c1C ZINC000883403057 1044305107 /nfs/dbraw/zinc/30/51/07/1044305107.db2.gz JCGUQALTEZWNHT-ZDUSSCGKSA-N 1 0 312.438 4.470 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)c1 ZINC000192744591 1044307135 /nfs/dbraw/zinc/30/71/35/1044307135.db2.gz MXIMNUHZWVPMAK-LBPRGKRZSA-N 1 0 307.340 4.153 20 10 DICDRO C[C@H](CSC(C)(C)C)[NH2+]CCCSc1nccs1 ZINC000132229163 1044318188 /nfs/dbraw/zinc/31/81/88/1044318188.db2.gz JRFNIVCGPRJPIA-LLVKDONJSA-N 1 0 304.550 4.135 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccc(F)cc1F ZINC000132191520 1044318377 /nfs/dbraw/zinc/31/83/77/1044318377.db2.gz OFFRGWUWFIXCSJ-SNVBAGLBSA-N 1 0 314.426 4.254 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2cc(C(F)(F)F)ccn2)c1 ZINC000293723982 1044320987 /nfs/dbraw/zinc/32/09/87/1044320987.db2.gz NWTVWBSKIDLWSI-GFCCVEGCSA-N 1 0 324.346 4.008 20 10 DICDRO Cc1cc(C[NH2+]C2(c3nccs3)CCCC2)ccc1N(C)C ZINC000293924261 1044353149 /nfs/dbraw/zinc/35/31/49/1044353149.db2.gz YFGJROYSDRRAOE-UHFFFAOYSA-N 1 0 315.486 4.077 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(OC(C)C)nc2)c(O)c1 ZINC000293948945 1044356201 /nfs/dbraw/zinc/35/62/01/1044356201.db2.gz ZDPFAYLIZBCFDJ-HNNXBMFYSA-N 1 0 314.429 4.042 20 10 DICDRO CO[C@@](C)([C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O)C1CC1 ZINC000840858847 1044397243 /nfs/dbraw/zinc/39/72/43/1044397243.db2.gz HBQXUMSLFJBKMJ-YRVVQQKDSA-N 1 0 313.441 4.400 20 10 DICDRO CC(C)(C)c1cc(C[NH2+][C@@H]2CCCOC2)c(O)c(C(C)(C)C)c1 ZINC001202655807 1044445457 /nfs/dbraw/zinc/44/54/57/1044445457.db2.gz PGZPOAIUBVNBIK-MRXNPFEDSA-N 1 0 319.489 4.256 20 10 DICDRO CCn1cc([C@@H](C)[NH2+]Cc2cc(-c3ccccc3)ccc2O)cn1 ZINC000294773171 1044459851 /nfs/dbraw/zinc/45/98/51/1044459851.db2.gz GDFDPGPEDXMWDG-OAHLLOKOSA-N 1 0 321.424 4.126 20 10 DICDRO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000237313092 1044518531 /nfs/dbraw/zinc/51/85/31/1044518531.db2.gz FAFHXKBVDRRKEG-HOTGVXAUSA-N 1 0 312.457 4.130 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)on1 ZINC000121146632 1044521162 /nfs/dbraw/zinc/52/11/62/1044521162.db2.gz BOVOPWZAFDUGFH-CQSZACIVSA-N 1 0 315.461 4.495 20 10 DICDRO CCOCc1cc(C[NH2+]C2CCCCCCC2)ccc1OC ZINC000215919840 1044539977 /nfs/dbraw/zinc/53/99/77/1044539977.db2.gz NEWLSYOPINRDEP-UHFFFAOYSA-N 1 0 305.462 4.434 20 10 DICDRO CC(C)[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1nc2ccccc2[nH]1 ZINC000295787936 1044559418 /nfs/dbraw/zinc/55/94/18/1044559418.db2.gz BJDMDBASNNTURR-QFBILLFUSA-N 1 0 321.424 4.243 20 10 DICDRO CCCOCc1ccccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295802429 1044561638 /nfs/dbraw/zinc/56/16/38/1044561638.db2.gz CEJUZURTGSTMTM-GOSISDBHSA-N 1 0 311.425 4.096 20 10 DICDRO CC(F)(F)CC[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000296115109 1044591537 /nfs/dbraw/zinc/59/15/37/1044591537.db2.gz SPNLFTQGRMDJLY-UHFFFAOYSA-N 1 0 321.367 4.106 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(C(F)(F)F)n1)c1ccc(C)cc1O ZINC000296605427 1044633391 /nfs/dbraw/zinc/63/33/91/1044633391.db2.gz VXCULLJZKVXQEZ-AWEZNQCLSA-N 1 0 324.346 4.355 20 10 DICDRO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297002789 1044654697 /nfs/dbraw/zinc/65/46/97/1044654697.db2.gz SWHZMMMSOYJBJX-CJNGLKHVSA-N 1 0 321.424 4.100 20 10 DICDRO Cc1ccc(C[NH+](C)C)cc1N[C@H](C)c1c(O)cccc1F ZINC000886586018 1044664460 /nfs/dbraw/zinc/66/44/60/1044664460.db2.gz JDJYLZPZJKDKRN-CYBMUJFWSA-N 1 0 302.393 4.074 20 10 DICDRO Oc1ccccc1C[NH2+][C@H]1CCOc2c(Cl)c(Cl)ccc21 ZINC000364457167 1044664765 /nfs/dbraw/zinc/66/47/65/1044664765.db2.gz IWJJBZYETKRGTG-ZDUSSCGKSA-N 1 0 324.207 4.312 20 10 DICDRO Cc1ncccc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000155248018 1044690792 /nfs/dbraw/zinc/69/07/92/1044690792.db2.gz QUJPZIFRGKLLNH-UHFFFAOYSA-N 1 0 309.457 4.012 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000090763046 1044748890 /nfs/dbraw/zinc/74/88/90/1044748890.db2.gz FCBXTJWNYGELOC-SCLBCKFNSA-N 1 0 315.461 4.202 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1COC)c1ccc(N(C)C)cc1 ZINC000122067194 1044769917 /nfs/dbraw/zinc/76/99/17/1044769917.db2.gz NPNQDAGHWVIPDZ-FQEVSTJZSA-N 1 0 312.457 4.140 20 10 DICDRO Cc1ccc([C@H]([NH2+]Cc2cc(C)ccc2O)c2ccccn2)cc1 ZINC000369546450 1044806750 /nfs/dbraw/zinc/80/67/50/1044806750.db2.gz ORLQSYKLFCYWRS-NRFANRHFSA-N 1 0 318.420 4.283 20 10 DICDRO C[C@@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)C1CCC1 ZINC000370636068 1044845644 /nfs/dbraw/zinc/84/56/44/1044845644.db2.gz FEEISBOIQDVNSX-CYBMUJFWSA-N 1 0 324.415 4.035 20 10 DICDRO CCN(CC)c1ccc(CNc2ccc([C@@H](C)[NH3+])cc2)cc1F ZINC000841029110 1044871422 /nfs/dbraw/zinc/87/14/22/1044871422.db2.gz SMKWDUJFOMCRAB-CQSZACIVSA-N 1 0 315.436 4.304 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000373164909 1044945979 /nfs/dbraw/zinc/94/59/79/1044945979.db2.gz ORCCXKNIPAUHSD-LRQRDZAKSA-N 1 0 324.468 4.181 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)Cc1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000152131827 1045036309 /nfs/dbraw/zinc/03/63/09/1045036309.db2.gz QPGSTQBLWSJROL-BFUOFWGJSA-N 1 0 315.461 4.029 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000778999639 1045112503 /nfs/dbraw/zinc/11/25/03/1045112503.db2.gz JAWFQFSBTWFORJ-OAHLLOKOSA-N 1 0 324.399 4.392 20 10 DICDRO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)Cc1cc(F)ccc1O ZINC000778997021 1045113562 /nfs/dbraw/zinc/11/35/62/1045113562.db2.gz ZHDGRWLTFDEHPU-GOSISDBHSA-N 1 0 315.388 4.049 20 10 DICDRO Oc1ccccc1C[N@H+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1 ZINC000778999492 1045113645 /nfs/dbraw/zinc/11/36/45/1045113645.db2.gz FYWZEAKUYIMECO-UHFFFAOYSA-N 1 0 322.383 4.302 20 10 DICDRO C[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1cc(F)ccc1O ZINC000779000488 1045114702 /nfs/dbraw/zinc/11/47/02/1045114702.db2.gz YGDCLEAIZAKIAB-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)s1 ZINC000048068723 1045130740 /nfs/dbraw/zinc/13/07/40/1045130740.db2.gz XNAIKCNUUFZCFC-UHFFFAOYSA-N 1 0 300.471 4.337 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000779035360 1045185916 /nfs/dbraw/zinc/18/59/16/1045185916.db2.gz ZBLWGCZYSILBHU-KRWDZBQOSA-N 1 0 303.352 4.398 20 10 DICDRO C[C@@H](CCCCO)[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000779039762 1045188379 /nfs/dbraw/zinc/18/83/79/1045188379.db2.gz SVZDKZRKZVEQOU-KRWDZBQOSA-N 1 0 318.505 4.096 20 10 DICDRO Cc1ccnc(N[C@H](C)c2cc(Br)cc(C)c2O)c1 ZINC000779040783 1045191595 /nfs/dbraw/zinc/19/15/95/1045191595.db2.gz LZJAAJVLCKKCSZ-LLVKDONJSA-N 1 0 321.218 4.340 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1O)c1csc(C(F)(F)F)c1 ZINC000924902650 1045209217 /nfs/dbraw/zinc/20/92/17/1045209217.db2.gz PYLGTYMJTLOFPD-SECBINFHSA-N 1 0 301.333 4.323 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccc(N(C)C)cc1 ZINC000779053887 1045220146 /nfs/dbraw/zinc/22/01/46/1045220146.db2.gz MSQLGIUWQFNTFL-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)Cc2ccsc2)cc1 ZINC000048557329 1045240319 /nfs/dbraw/zinc/24/03/19/1045240319.db2.gz XMZCRKDZKAUUBY-OAHLLOKOSA-N 1 0 302.487 4.315 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CCc3cc(Cl)ccc32)c1O ZINC000527991111 1045291088 /nfs/dbraw/zinc/29/10/88/1045291088.db2.gz HBRGEQICBLQMMC-ZBEGNZNMSA-N 1 0 317.816 4.392 20 10 DICDRO CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cccc(C)c1O ZINC000779150257 1045324526 /nfs/dbraw/zinc/32/45/26/1045324526.db2.gz SKQRQMIHVBIOFK-UGSOOPFHSA-N 1 0 319.832 4.220 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C(F)(F)F)cc2C)c1 ZINC000188914116 1045340465 /nfs/dbraw/zinc/34/04/65/1045340465.db2.gz NBFVNMHLOHNYFD-UHFFFAOYSA-N 1 0 309.331 4.318 20 10 DICDRO CCOC1CC(CC[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000189255223 1045344841 /nfs/dbraw/zinc/34/48/41/1045344841.db2.gz JCMKUOZFTHZSNE-SYJJWHGVSA-N 1 0 317.473 4.127 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCc3ccc(C(C)C)cc32)c1O ZINC000189616199 1045358993 /nfs/dbraw/zinc/35/89/93/1045358993.db2.gz PGCBTAQKKOVKNR-GOSISDBHSA-N 1 0 311.425 4.301 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](CC)[C@@H](C)Cc2ccsc2)c1 ZINC000779215664 1045372224 /nfs/dbraw/zinc/37/22/24/1045372224.db2.gz NTRFSZHUQTXZGX-AWEZNQCLSA-N 1 0 319.470 4.306 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2CCc3ccc(C(C)C)cc32)c1 ZINC000190235898 1045516001 /nfs/dbraw/zinc/51/60/01/1045516001.db2.gz RWENXDIOPZEEKO-LJQANCHMSA-N 1 0 311.425 4.301 20 10 DICDRO COc1ccc2ccc(O)c(C[N@H+](C)C(C3CC3)C3CC3)c2c1 ZINC000750604558 1045537982 /nfs/dbraw/zinc/53/79/82/1045537982.db2.gz VNYZQILRDPSDCP-UHFFFAOYSA-N 1 0 311.425 4.174 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)c2c1c(F)ccc2O ZINC000800494525 1045632582 /nfs/dbraw/zinc/63/25/82/1045632582.db2.gz XETVRVPVUXPUMG-MDZLAQPJSA-N 1 0 313.363 4.495 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](C)c2ccsc2)ccc1OC ZINC000800888877 1045662782 /nfs/dbraw/zinc/66/27/82/1045662782.db2.gz FEQVZDLUFNLJRM-ZDUSSCGKSA-N 1 0 305.443 4.144 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1C ZINC000752266441 1045669245 /nfs/dbraw/zinc/66/92/45/1045669245.db2.gz QMYLZGQRJUSVER-DZGCQCFKSA-N 1 0 315.379 4.467 20 10 DICDRO FC(F)(F)[C@@H]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000752265664 1045669698 /nfs/dbraw/zinc/66/96/98/1045669698.db2.gz LDHLLZCNZKPEBF-IUODEOHRSA-N 1 0 313.363 4.080 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1C ZINC000752266994 1045669758 /nfs/dbraw/zinc/66/97/58/1045669758.db2.gz UPKBWVAGFNEWSR-UKRRQHHQSA-N 1 0 315.379 4.462 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)c(O)c1C ZINC000800987446 1045677639 /nfs/dbraw/zinc/67/76/39/1045677639.db2.gz XVQCBLHWTWSDQJ-NVXWUHKLSA-N 1 0 311.425 4.053 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2ccccc2OC1)c1ccc(C)cc1O ZINC000800986613 1045678719 /nfs/dbraw/zinc/67/87/19/1045678719.db2.gz JRXIYTLFWVHQDB-FUHWJXTLSA-N 1 0 311.425 4.135 20 10 DICDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@H](C)c1cc(C)ccc1O ZINC000800994863 1045680452 /nfs/dbraw/zinc/68/04/52/1045680452.db2.gz YEMQWKPCQACEAH-SJKOYZFVSA-N 1 0 315.388 4.186 20 10 DICDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000800994864 1045680472 /nfs/dbraw/zinc/68/04/72/1045680472.db2.gz YEMQWKPCQACEAH-YVEFUNNKSA-N 1 0 315.388 4.186 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC000752986760 1045718092 /nfs/dbraw/zinc/71/80/92/1045718092.db2.gz MHAAFONWEUHBPH-IAGOWNOFSA-N 1 0 311.425 4.217 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC000752986768 1045720278 /nfs/dbraw/zinc/72/02/78/1045720278.db2.gz MHAAFONWEUHBPH-SJORKVTESA-N 1 0 311.425 4.217 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@H]1CCC[C@H](c2ccccc2)C1 ZINC000752986764 1045720590 /nfs/dbraw/zinc/72/05/90/1045720590.db2.gz MHAAFONWEUHBPH-IRXDYDNUSA-N 1 0 311.425 4.217 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Cl)nc1Cl)c1ccc(N(C)C)cc1 ZINC000801544231 1045735220 /nfs/dbraw/zinc/73/52/20/1045735220.db2.gz DNPJGNHDOIRCHL-LLVKDONJSA-N 1 0 324.255 4.305 20 10 DICDRO Cc1cccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2C)c1O ZINC000191670855 1045745154 /nfs/dbraw/zinc/74/51/54/1045745154.db2.gz CBAGYSOCFBGLSN-UHFFFAOYSA-N 1 0 309.331 4.318 20 10 DICDRO CCCC[N@H+](Cc1ccc(Cl)cn1)Cc1ccccc1O ZINC000801599416 1045752109 /nfs/dbraw/zinc/75/21/09/1045752109.db2.gz NEOYFHVUKUZDMD-UHFFFAOYSA-N 1 0 304.821 4.243 20 10 DICDRO CCCC[N@H+](Cc1cnc(Cl)s1)Cc1ccccc1O ZINC000801599281 1045752974 /nfs/dbraw/zinc/75/29/74/1045752974.db2.gz IURXUSHZLUYKDU-UHFFFAOYSA-N 1 0 310.850 4.304 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]C12CCC(CC1)C2 ZINC000753588214 1045770670 /nfs/dbraw/zinc/77/06/70/1045770670.db2.gz ZVXVJEHVTWYXFW-UHFFFAOYSA-N 1 0 323.436 4.394 20 10 DICDRO CCC(CC)(CC)[NH2+]Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000828345111 1045902930 /nfs/dbraw/zinc/90/29/30/1045902930.db2.gz NGVUSABIOSSFPQ-UHFFFAOYSA-N 1 0 318.505 4.360 20 10 DICDRO COc1cc(C)cc(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)c1O ZINC000754720933 1045918331 /nfs/dbraw/zinc/91/83/31/1045918331.db2.gz WNLBXENEQVPFCB-HNNXBMFYSA-N 1 0 311.425 4.435 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)c1O ZINC000754740537 1045923444 /nfs/dbraw/zinc/92/34/44/1045923444.db2.gz UVJNTBNVCHOIMF-MAUKXSAKSA-N 1 0 311.425 4.087 20 10 DICDRO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1c(O)ccc2ccncc21 ZINC000754857316 1045933495 /nfs/dbraw/zinc/93/34/95/1045933495.db2.gz OYTSTVLEJDTDGR-VBKFSLOCSA-N 1 0 318.420 4.476 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)cc1F ZINC000192795692 1045934808 /nfs/dbraw/zinc/93/48/08/1045934808.db2.gz XQHIRBLVWAULGG-STQMWFEESA-N 1 0 303.377 4.260 20 10 DICDRO COc1cc(C[N@@H+]2CCS[C@H](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000754870659 1045936334 /nfs/dbraw/zinc/93/63/34/1045936334.db2.gz BESVMEALOTUMLW-CYBMUJFWSA-N 1 0 323.502 4.026 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1OC1CC1)c1ccc(N(C)C)cc1 ZINC000828960053 1045946291 /nfs/dbraw/zinc/94/62/91/1045946291.db2.gz SVOBKUJLQSNVTG-OAHLLOKOSA-N 1 0 310.441 4.145 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)cc1 ZINC000192870744 1045946759 /nfs/dbraw/zinc/94/67/59/1045946759.db2.gz KJKWJYLYRIQOCE-CQSZACIVSA-N 1 0 307.393 4.405 20 10 DICDRO CC[C@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C)cc1O ZINC000802309299 1045949951 /nfs/dbraw/zinc/94/99/51/1045949951.db2.gz QQEOAPJNNKIWTA-DFGXFYAUSA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@H]([NH2+]CCC1C[C@H](C)O[C@@H](C)C1)c1ccc(C)cc1O ZINC000802309304 1045950319 /nfs/dbraw/zinc/95/03/19/1045950319.db2.gz QQEOAPJNNKIWTA-MPGHIAIKSA-N 1 0 305.462 4.335 20 10 DICDRO CC[C@@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C)cc1O ZINC000802309302 1045950568 /nfs/dbraw/zinc/95/05/68/1045950568.db2.gz QQEOAPJNNKIWTA-KYHPRHEASA-N 1 0 305.462 4.335 20 10 DICDRO C[C@@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000802308907 1045952298 /nfs/dbraw/zinc/95/22/98/1045952298.db2.gz KPOMXRWSKWYYQZ-XJFOESAGSA-N 1 0 311.853 4.290 20 10 DICDRO CC(C)N1CCC([NH2+][C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000192950412 1045956972 /nfs/dbraw/zinc/95/69/72/1045956972.db2.gz WWOMAZGOIIJXHM-OAHLLOKOSA-N 1 0 312.457 4.069 20 10 DICDRO CCCC[N@H+](CCCc1cc(CC)no1)Cc1ccccc1O ZINC000829516185 1045983453 /nfs/dbraw/zinc/98/34/53/1045983453.db2.gz RNLJPBIMPITHQN-UHFFFAOYSA-N 1 0 316.445 4.178 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c(C)n1-c1ccccc1 ZINC001137857419 1045987913 /nfs/dbraw/zinc/98/79/13/1045987913.db2.gz GVRMRBWXQAXTCA-SFHVURJKSA-N 1 0 316.395 4.325 20 10 DICDRO CCCNc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000193360947 1045996254 /nfs/dbraw/zinc/99/62/54/1045996254.db2.gz KIHYLIAYTMSMDX-MRXNPFEDSA-N 1 0 311.473 4.425 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2ccc(C)s2)c1 ZINC000080241001 1046011604 /nfs/dbraw/zinc/01/16/04/1046011604.db2.gz VUHPUALNOLTXBC-AAEUAGOBSA-N 1 0 305.443 4.053 20 10 DICDRO C[N@H+](Cc1cc2oc3ccccc3c2cc1O)[C@@H]1CCSC1 ZINC000755794890 1046016246 /nfs/dbraw/zinc/01/62/46/1046016246.db2.gz RUHPBHKROWSQSO-CYBMUJFWSA-N 1 0 313.422 4.229 20 10 DICDRO Cc1nc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)sc1C ZINC000756036746 1046041484 /nfs/dbraw/zinc/04/14/84/1046041484.db2.gz YTMWECZSMPNZIM-UHFFFAOYSA-N 1 0 317.502 4.237 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cc3ccccc3nc1Cl)CC2 ZINC001137978264 1046042593 /nfs/dbraw/zinc/04/25/93/1046042593.db2.gz ADSNKLNVEGMIHM-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)c1 ZINC000193703478 1046062898 /nfs/dbraw/zinc/06/28/98/1046062898.db2.gz FOWXMXZENZEUHK-CQSZACIVSA-N 1 0 307.393 4.405 20 10 DICDRO C[C@H]([NH2+]CCSCc1ccccc1F)c1cc(F)ccc1O ZINC000756355499 1046068525 /nfs/dbraw/zinc/06/85/25/1046068525.db2.gz PFYUDUFCRPYNEQ-LBPRGKRZSA-N 1 0 323.408 4.254 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCOCc2ccccc2)c(O)c1C ZINC000756359265 1046068798 /nfs/dbraw/zinc/06/87/98/1046068798.db2.gz OUMMLCGBCWABCG-KRWDZBQOSA-N 1 0 313.441 4.267 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCc2ccccc2F)c2c1c(F)ccc2O ZINC000756358308 1046068972 /nfs/dbraw/zinc/06/89/72/1046068972.db2.gz WFKSJFWPEQGLGG-IAQYHMDHSA-N 1 0 303.352 4.051 20 10 DICDRO Cc1ccc(SCC[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756361953 1046069393 /nfs/dbraw/zinc/06/93/93/1046069393.db2.gz LWKNJYOHRQPBBW-ZDUSSCGKSA-N 1 0 305.418 4.283 20 10 DICDRO Cc1nc2ccccc2n1CC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000756361970 1046069999 /nfs/dbraw/zinc/06/99/99/1046069999.db2.gz MBKGDYPQMYBGEL-HNNXBMFYSA-N 1 0 323.440 4.018 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)c(O)c1C ZINC000756358127 1046070490 /nfs/dbraw/zinc/07/04/90/1046070490.db2.gz RNHVEQRCMCOCHM-ZDUSSCGKSA-N 1 0 321.367 4.461 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCn2cnc3ccccc32)c(O)c1C ZINC000756362817 1046070740 /nfs/dbraw/zinc/07/07/40/1046070740.db2.gz NOAHHMZIZSOOSS-INIZCTEOSA-N 1 0 323.440 4.100 20 10 DICDRO C[C@@H]([NH2+]CCc1cccs1)c1cc2c(cc1O)CCCC2 ZINC000756373084 1046071351 /nfs/dbraw/zinc/07/13/51/1046071351.db2.gz SJCAGAZCSRHPKI-CYBMUJFWSA-N 1 0 301.455 4.226 20 10 DICDRO C[C@H]([NH2+]CCCSc1ccccc1)c1cc(F)ccc1O ZINC000756369956 1046072046 /nfs/dbraw/zinc/07/20/46/1046072046.db2.gz FMOQMZCCWSDPQN-ZDUSSCGKSA-N 1 0 305.418 4.364 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(OC(C)C)cc2)c(O)c1 ZINC000756382887 1046074487 /nfs/dbraw/zinc/07/44/87/1046074487.db2.gz FXQOCCZVYKJINN-MRXNPFEDSA-N 1 0 313.441 4.381 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3occc32)c2c1c(F)ccc2O ZINC000756402543 1046075418 /nfs/dbraw/zinc/07/54/18/1046075418.db2.gz UVOROPHXCPRZBO-HONMWMINSA-N 1 0 301.361 4.340 20 10 DICDRO CC[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)N1CCCC1 ZINC000756399254 1046075477 /nfs/dbraw/zinc/07/54/77/1046075477.db2.gz AGRKYPKFOCRVCV-RDJZCZTQSA-N 1 0 312.457 4.070 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCCOc2ccc(F)cc2)c1 ZINC000756402537 1046075784 /nfs/dbraw/zinc/07/57/84/1046075784.db2.gz UOYKNXWEZOEJQV-HNNXBMFYSA-N 1 0 317.404 4.350 20 10 DICDRO CCc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)s1 ZINC000756413975 1046078274 /nfs/dbraw/zinc/07/82/74/1046078274.db2.gz HFIAGNONNSSDOI-HZMBPMFUSA-N 1 0 305.418 4.493 20 10 DICDRO CC(C)Oc1ncccc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756419287 1046079169 /nfs/dbraw/zinc/07/91/69/1046079169.db2.gz DXUFCJIZQPNZMV-LBPRGKRZSA-N 1 0 320.820 4.079 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756435233 1046080555 /nfs/dbraw/zinc/08/05/55/1046080555.db2.gz YDFIDUIJCKSLOI-MKBNYLNASA-N 1 0 315.388 4.439 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C2CCN(c3ccccc3)CC2)c(O)c1C ZINC000756445261 1046081657 /nfs/dbraw/zinc/08/16/57/1046081657.db2.gz MKTJQJOAOYNIDX-KRWDZBQOSA-N 1 0 324.468 4.329 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756434885 1046082523 /nfs/dbraw/zinc/08/25/23/1046082523.db2.gz VEPXYHWVCWUVTM-BLLLJJGKSA-N 1 0 315.388 4.268 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3n2)c2c1c(F)ccc2O ZINC000756453980 1046082764 /nfs/dbraw/zinc/08/27/64/1046082764.db2.gz BUJWYUOHRDDVDA-SJKOYZFVSA-N 1 0 322.383 4.418 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCCc2nc3ccccc3[nH]2)c(O)c1C ZINC000756454528 1046085233 /nfs/dbraw/zinc/08/52/33/1046085233.db2.gz FZYQIMAIGUFECZ-HNNXBMFYSA-N 1 0 323.440 4.169 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)CCC3)c1 ZINC000756454975 1046085419 /nfs/dbraw/zinc/08/54/19/1046085419.db2.gz GWPPAKYGXNKHOD-UONOGXRCSA-N 1 0 311.425 4.301 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(Br)cc1O ZINC000756473681 1046086840 /nfs/dbraw/zinc/08/68/40/1046086840.db2.gz DKQUJBQXMAWUNP-VXGBXAGGSA-N 1 0 310.235 4.162 20 10 DICDRO C[C@H]([NH2+]Cc1cc2c(s1)CCCC2)c1cc(F)ccc1O ZINC000756483462 1046089399 /nfs/dbraw/zinc/08/93/99/1046089399.db2.gz OBKFWRKXQAFOOG-NSHDSACASA-N 1 0 305.418 4.322 20 10 DICDRO COc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756503071 1046090731 /nfs/dbraw/zinc/09/07/31/1046090731.db2.gz JJKIJIFVAXNGCK-KGLIPLIRSA-N 1 0 317.404 4.212 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2F)c2c1c(F)ccc2O ZINC000756496071 1046091185 /nfs/dbraw/zinc/09/11/85/1046091185.db2.gz MYOFCKRSHDMKDM-LKFCYVNXSA-N 1 0 307.315 4.148 20 10 DICDRO COc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000756503815 1046091755 /nfs/dbraw/zinc/09/17/55/1046091755.db2.gz NAZNCDVKOZIEPK-HZPDHXFCSA-N 1 0 313.441 4.381 20 10 DICDRO COc1ccc(CC[C@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000756503816 1046091788 /nfs/dbraw/zinc/09/17/88/1046091788.db2.gz NAZNCDVKOZIEPK-JKSUJKDBSA-N 1 0 313.441 4.381 20 10 DICDRO COc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000756503814 1046092351 /nfs/dbraw/zinc/09/23/51/1046092351.db2.gz NAZNCDVKOZIEPK-HOTGVXAUSA-N 1 0 313.441 4.381 20 10 DICDRO Cc1ccc([C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C2CCC2)o1 ZINC000756496584 1046092402 /nfs/dbraw/zinc/09/24/02/1046092402.db2.gz PFHCKFWPFRZTLZ-IBGZPJMESA-N 1 0 316.420 4.424 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2c[nH]c3cc(F)ccc23)c(O)c1 ZINC000756507744 1046094279 /nfs/dbraw/zinc/09/42/79/1046094279.db2.gz DRGWFGPNMVMXLU-ZDUSSCGKSA-N 1 0 312.388 4.214 20 10 DICDRO COc1ccccc1C1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CC1 ZINC000756516026 1046094856 /nfs/dbraw/zinc/09/48/56/1046094856.db2.gz HMJSMBFLTFEWAS-HNNXBMFYSA-N 1 0 311.425 4.092 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(Cl)cc1 ZINC000194257456 1046096682 /nfs/dbraw/zinc/09/66/82/1046096682.db2.gz POACJERWKACJGF-DYVFJYSZSA-N 1 0 319.832 4.392 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)c(O)c1C ZINC000756528570 1046097011 /nfs/dbraw/zinc/09/70/11/1046097011.db2.gz NQUKKJAISFQSTL-CQSZACIVSA-N 1 0 321.424 4.111 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2cc(F)ccc2F)c2c1c(F)ccc2O ZINC000756547859 1046098282 /nfs/dbraw/zinc/09/82/82/1046098282.db2.gz IBXSWDOQOWSSSN-OTYXRUKQSA-N 1 0 307.315 4.148 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000756554768 1046100070 /nfs/dbraw/zinc/10/00/70/1046100070.db2.gz PRTXHDOMOMQJBL-MRXNPFEDSA-N 1 0 312.457 4.316 20 10 DICDRO CCc1nc([C@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)cs1 ZINC000756568384 1046100289 /nfs/dbraw/zinc/10/02/89/1046100289.db2.gz DQSOVGFZHJTYIK-JFGNBEQYSA-N 1 0 320.433 4.449 20 10 DICDRO C[C@@H]([NH2+]CC1CCSCC1)c1cc2c(cc1O)CCCC2 ZINC000756571803 1046101947 /nfs/dbraw/zinc/10/19/47/1046101947.db2.gz FTIGENIMNFBYNR-CYBMUJFWSA-N 1 0 305.487 4.065 20 10 DICDRO COc1ccc2[nH]cc(CC[NH2+][C@H](C)c3cc(C)ccc3O)c2c1 ZINC000756573419 1046102001 /nfs/dbraw/zinc/10/20/01/1046102001.db2.gz JRNQNCLACLQXGB-CQSZACIVSA-N 1 0 324.424 4.084 20 10 DICDRO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cn1 ZINC000756572564 1046102576 /nfs/dbraw/zinc/10/25/76/1046102576.db2.gz GPHVHWBQWUOETD-VXGBXAGGSA-N 1 0 307.825 4.235 20 10 DICDRO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756571940 1046103115 /nfs/dbraw/zinc/10/31/15/1046103115.db2.gz HPVKADLEQWWHLG-RYUDHWBXSA-N 1 0 314.429 4.288 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCN(c3ccccc3)C2)c(O)c1C ZINC000756582377 1046104231 /nfs/dbraw/zinc/10/42/31/1046104231.db2.gz HYMJWGBKEHZDKW-ROUUACIJSA-N 1 0 324.468 4.329 20 10 DICDRO CCCC[C@@H](COC)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756584985 1046104976 /nfs/dbraw/zinc/10/49/76/1046104976.db2.gz IAKPTPFBOOYCFH-ZBFHGGJFSA-N 1 0 301.430 4.401 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)c2cccc(F)c2)c1 ZINC000756592011 1046106457 /nfs/dbraw/zinc/10/64/57/1046106457.db2.gz RNXFKRPCQNLUIW-CYBMUJFWSA-N 1 0 317.404 4.168 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1ccc(Cl)cc1 ZINC000756608479 1046107675 /nfs/dbraw/zinc/10/76/75/1046107675.db2.gz CLQRARWRMAQHTL-PIGZYNQJSA-N 1 0 323.795 4.223 20 10 DICDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756608828 1046108031 /nfs/dbraw/zinc/10/80/31/1046108031.db2.gz DULWYKJKDHENPZ-KGLIPLIRSA-N 1 0 305.462 4.125 20 10 DICDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756608824 1046108970 /nfs/dbraw/zinc/10/89/70/1046108970.db2.gz DULWYKJKDHENPZ-KBPBESRZSA-N 1 0 305.462 4.125 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2O)C12CCC2 ZINC000756613730 1046110487 /nfs/dbraw/zinc/11/04/87/1046110487.db2.gz QKRAGFLAXAYNCU-USXIJHARSA-N 1 0 303.446 4.007 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756625307 1046111497 /nfs/dbraw/zinc/11/14/97/1046111497.db2.gz JFHQOIUFAQHGIJ-SNVBAGLBSA-N 1 0 309.381 4.243 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)C1CCOCC1 ZINC000756628498 1046112044 /nfs/dbraw/zinc/11/20/44/1046112044.db2.gz MRVJCHLUDVKMDY-IFXJQAMLSA-N 1 0 313.441 4.401 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3ccc(C)c(C)c3O)nc2c1 ZINC000756629578 1046112138 /nfs/dbraw/zinc/11/21/38/1046112138.db2.gz PZMOYQFYNRXYOA-AWEZNQCLSA-N 1 0 309.413 4.045 20 10 DICDRO Cc1ccccc1[C@H](CO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756635030 1046114187 /nfs/dbraw/zinc/11/41/87/1046114187.db2.gz DFMBPPDIDCEPPF-QRWLVFNGSA-N 1 0 321.420 4.238 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CCCC[C@@H]1O)c1ccc2ccccc2c1O ZINC000756639034 1046114286 /nfs/dbraw/zinc/11/42/86/1046114286.db2.gz VQJRQYMZGRTSCN-DCPHZVHLSA-N 1 0 313.441 4.137 20 10 DICDRO CCO[C@@H](CC[NH2+][C@@H](C)c1cc(F)ccc1O)C1CCCC1 ZINC000756638095 1046114452 /nfs/dbraw/zinc/11/44/52/1046114452.db2.gz RNNFNSRUESHHAB-UGSOOPFHSA-N 1 0 309.425 4.167 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)c1ccncc1 ZINC000756637020 1046114830 /nfs/dbraw/zinc/11/48/30/1046114830.db2.gz YVQVACSLPUSPOB-GJZGRUSLSA-N 1 0 306.409 4.395 20 10 DICDRO COc1ccc(CC[NH2+][C@H](C)c2ccc(C)cc2O)c(Cl)c1 ZINC000756645882 1046116139 /nfs/dbraw/zinc/11/61/39/1046116139.db2.gz KJCSGTOCQHEDHS-CYBMUJFWSA-N 1 0 319.832 4.256 20 10 DICDRO C[C@@H]([NH2+]C[C@]1(C)CCCS1)c1cc2c(cc1O)CCCC2 ZINC000756646345 1046116657 /nfs/dbraw/zinc/11/66/57/1046116657.db2.gz LTJNTKYJOMNDKF-ACJLOTCBSA-N 1 0 305.487 4.207 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2cccnc2)C(C)C)c(O)c1C ZINC000756649223 1046117827 /nfs/dbraw/zinc/11/78/27/1046117827.db2.gz MQPBGYPFXDLADZ-QFBILLFUSA-N 1 0 312.457 4.494 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756647571 1046118824 /nfs/dbraw/zinc/11/88/24/1046118824.db2.gz PRGQLXKQYLJEEL-WFASDCNBSA-N 1 0 315.388 4.186 20 10 DICDRO C[C@@]1(F)CCCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138215884 1046120563 /nfs/dbraw/zinc/12/05/63/1046120563.db2.gz ZWVXAQGNTLPLBQ-LJQANCHMSA-N 1 0 304.453 4.391 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cccnc1 ZINC001138219498 1046120710 /nfs/dbraw/zinc/12/07/10/1046120710.db2.gz DLHPKBZOTFPJKS-UHFFFAOYSA-N 1 0 309.457 4.094 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756678349 1046120727 /nfs/dbraw/zinc/12/07/27/1046120727.db2.gz WBIAKZDLOMGHBG-CABCVRRESA-N 1 0 310.441 4.386 20 10 DICDRO FC1(F)C[C@H]2C[N@@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]2C1 ZINC001138215400 1046120856 /nfs/dbraw/zinc/12/08/56/1046120856.db2.gz CYUOFMQCVFRPCE-CALCHBBNSA-N 1 0 320.427 4.154 20 10 DICDRO C[C@H](C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)Oc1ccccc1 ZINC000756706508 1046121584 /nfs/dbraw/zinc/12/15/84/1046121584.db2.gz SNRLYDCKGBRNFY-WOSRLPQWSA-N 1 0 315.388 4.137 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1OCCc2ccccc21)c1cc(Cl)ccc1O ZINC000756706105 1046121937 /nfs/dbraw/zinc/12/19/37/1046121937.db2.gz GWOBWLRESDWVNI-KZULUSFZSA-N 1 0 317.816 4.010 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(F)cc32)c2c1c(F)ccc2O ZINC000756709058 1046122214 /nfs/dbraw/zinc/12/22/14/1046122214.db2.gz VXMWATHXSKVUCP-GTTSAUCSSA-N 1 0 315.363 4.496 20 10 DICDRO COc1cccc(C[C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000756706907 1046122710 /nfs/dbraw/zinc/12/27/10/1046122710.db2.gz ITUWPQGAMXZFLY-OLZOCXBDSA-N 1 0 319.832 4.336 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1N(C)C)c1ccc2ccccc2c1O ZINC000756731146 1046123961 /nfs/dbraw/zinc/12/39/61/1046123961.db2.gz YBIINPOLIKEWIB-HNNXBMFYSA-N 1 0 320.436 4.462 20 10 DICDRO C[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Oc1ccccc1Cl ZINC000756734717 1046124313 /nfs/dbraw/zinc/12/43/13/1046124313.db2.gz YUQGVOGNNAQGGO-RYUDHWBXSA-N 1 0 323.795 4.303 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](Cc2ccccc2)C2CC2)c1 ZINC000756739708 1046126346 /nfs/dbraw/zinc/12/63/46/1046126346.db2.gz WZHOSAZDISEHQS-LIRRHRJNSA-N 1 0 311.425 4.073 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](Cc2ccccc2)C2CC2)c1 ZINC000756739705 1046126457 /nfs/dbraw/zinc/12/64/57/1046126457.db2.gz WZHOSAZDISEHQS-AUUYWEPGSA-N 1 0 311.425 4.073 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@H]2C)c1 ZINC000756744680 1046126629 /nfs/dbraw/zinc/12/66/29/1046126629.db2.gz BMUSGZOWCIRPEY-ODCFSMADSA-N 1 0 311.425 4.304 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccc2ccccc2c1O ZINC000756759533 1046127793 /nfs/dbraw/zinc/12/77/93/1046127793.db2.gz MFVNBPSQNNEGMX-CQSZACIVSA-N 1 0 319.404 4.426 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCC[C@H]2CCCC[C@H]2O)c2c1c(F)ccc2O ZINC000756761777 1046128364 /nfs/dbraw/zinc/12/83/64/1046128364.db2.gz VCTCJFBVYKHAMF-LUYZLQTOSA-N 1 0 321.436 4.001 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)COC2)c1cc2c(cc1O)CCCC2 ZINC000756759520 1046128375 /nfs/dbraw/zinc/12/83/75/1046128375.db2.gz MAKDQRFXBQUYLT-CQSZACIVSA-N 1 0 323.436 4.152 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c(F)c1 ZINC000756759706 1046128632 /nfs/dbraw/zinc/12/86/32/1046128632.db2.gz XMJKIISWNYBTQV-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCOC3(CCCC3)C2)c2c1c(F)ccc2O ZINC000756764395 1046129952 /nfs/dbraw/zinc/12/99/52/1046129952.db2.gz IJOUSZHYCPRPRL-UMVBOHGHSA-N 1 0 319.420 4.161 20 10 DICDRO CC(C)OC1CCC([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756770347 1046130525 /nfs/dbraw/zinc/13/05/25/1046130525.db2.gz TZIGKPNUJSMOCR-WOICTCIZSA-N 1 0 321.436 4.405 20 10 DICDRO CC(C)OC1CCC([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756770345 1046130731 /nfs/dbraw/zinc/13/07/31/1046130731.db2.gz TZIGKPNUJSMOCR-UWLZSVRSSA-N 1 0 321.436 4.405 20 10 DICDRO Cc1c(C[N@H+](C)Cc2ccc(Cl)nc2)c2ccccc2n1C ZINC001138258089 1046131334 /nfs/dbraw/zinc/13/13/34/1046131334.db2.gz LGBVSOPEQXPWCP-UHFFFAOYSA-N 1 0 313.832 4.167 20 10 DICDRO CCCCCn1cc(C[NH2+][C@H](C)c2cc(C)ccc2O)c(C)n1 ZINC000756776513 1046131578 /nfs/dbraw/zinc/13/15/78/1046131578.db2.gz ZYKPXPDDDREZIN-MRXNPFEDSA-N 1 0 315.461 4.247 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c2ccccc2n1C ZINC001138257196 1046131822 /nfs/dbraw/zinc/13/18/22/1046131822.db2.gz ZZRJXAQLKNMXOQ-QGZVFWFLSA-N 1 0 319.452 4.261 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)c1c(C)noc1C ZINC000756774316 1046132054 /nfs/dbraw/zinc/13/20/54/1046132054.db2.gz BPKLDAQZCXPUBQ-QCZZGDTMSA-N 1 0 318.392 4.425 20 10 DICDRO Cc1c(C[N@H+]2CCC(=O)[C@@H](C)C23CCCC3)c2ccccc2n1C ZINC001138260181 1046132121 /nfs/dbraw/zinc/13/21/21/1046132121.db2.gz YCCFLPALQMWBER-OAHLLOKOSA-N 1 0 324.468 4.210 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2c3ccccc3n(C)c2C)c1 ZINC001138257127 1046132285 /nfs/dbraw/zinc/13/22/85/1046132285.db2.gz XKXZNOYRGFAFKL-UHFFFAOYSA-N 1 0 308.425 4.127 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)c1c(C)noc1C ZINC000756774308 1046132381 /nfs/dbraw/zinc/13/23/81/1046132381.db2.gz BPKLDAQZCXPUBQ-HERUPUMHSA-N 1 0 318.392 4.425 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000756779028 1046132403 /nfs/dbraw/zinc/13/24/03/1046132403.db2.gz IHENGSTUWBPXMT-BONVTDFDSA-N 1 0 319.351 4.017 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756782442 1046133584 /nfs/dbraw/zinc/13/35/84/1046133584.db2.gz RBHBOXPYWLYMOO-IUUKEHGRSA-N 1 0 321.367 4.097 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000756783337 1046134060 /nfs/dbraw/zinc/13/40/60/1046134060.db2.gz XTELJTWHIWWWBF-TYILLQQXSA-N 1 0 317.404 4.267 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H](c2cccnc2)C2CC2)c2c1c(F)ccc2O ZINC000756784006 1046134184 /nfs/dbraw/zinc/13/41/84/1046134184.db2.gz JUHTVLQEZBWLIC-PRIMNGNOSA-N 1 0 312.388 4.216 20 10 DICDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000756790345 1046135633 /nfs/dbraw/zinc/13/56/33/1046135633.db2.gz MTPOCXSHKRPMHE-TYILLQQXSA-N 1 0 317.404 4.267 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1O ZINC000193901175 1046136422 /nfs/dbraw/zinc/13/64/22/1046136422.db2.gz RZZJKBHRXHHCAO-BLLLJJGKSA-N 1 0 300.358 4.102 20 10 DICDRO C[C@@H]([NH2+]C1(c2ccc(F)cc2)CCC1)c1cc(F)ccc1O ZINC000756818478 1046138532 /nfs/dbraw/zinc/13/85/32/1046138532.db2.gz NWCYBSDCHGUGFR-GFCCVEGCSA-N 1 0 303.352 4.400 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]C2(c3ccc(F)cc3)CC2)c2c1c(F)ccc2O ZINC000756827379 1046140394 /nfs/dbraw/zinc/14/03/94/1046140394.db2.gz SHBXLCLZNHEQKX-XHDPSFHLSA-N 1 0 315.363 4.498 20 10 DICDRO COc1ccc(C2([NH2+][C@@H](C)c3cc(Cl)ccc3O)CC2)cc1 ZINC000756821079 1046140769 /nfs/dbraw/zinc/14/07/69/1046140769.db2.gz LHRDHNRUBHBQOS-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C2(c3ccc(F)cc3)CC2)c2c1c(F)ccc2O ZINC000756827376 1046140905 /nfs/dbraw/zinc/14/09/05/1046140905.db2.gz SHBXLCLZNHEQKX-IAQYHMDHSA-N 1 0 315.363 4.498 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C2(c3ccccc3F)CC2)c2c1c(F)ccc2O ZINC000756833172 1046141904 /nfs/dbraw/zinc/14/19/04/1046141904.db2.gz JTPGDCWPRDMUML-IAQYHMDHSA-N 1 0 315.363 4.498 20 10 DICDRO C[C@H]1C[C@H]([NH2+]C2(c3ccccc3F)CC2)c2c1c(F)ccc2O ZINC000756833173 1046142458 /nfs/dbraw/zinc/14/24/58/1046142458.db2.gz JTPGDCWPRDMUML-NHYWBVRUSA-N 1 0 315.363 4.498 20 10 DICDRO CCC(CC)[N@H+](CC)Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001138339285 1046155201 /nfs/dbraw/zinc/15/52/01/1046155201.db2.gz CEKBAINYRANRHA-UHFFFAOYSA-N 1 0 316.489 4.102 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2nccc3c2CCCC3)c(O)c1 ZINC000903182846 1046184874 /nfs/dbraw/zinc/18/48/74/1046184874.db2.gz VTNHCWMQGNMSFO-HNNXBMFYSA-N 1 0 310.441 4.134 20 10 DICDRO C[C@@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1cc(F)cc(F)c1O ZINC000757613675 1046193909 /nfs/dbraw/zinc/19/39/09/1046193909.db2.gz NMUKVEOJFDEEJK-SNVBAGLBSA-N 1 0 324.346 4.044 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccco1 ZINC000757640272 1046196298 /nfs/dbraw/zinc/19/62/98/1046196298.db2.gz XEOSNPDDMKSZOM-BXUZGUMPSA-N 1 0 309.793 4.067 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cc(F)c(F)c(F)c2)c(O)c1C ZINC000757639718 1046197543 /nfs/dbraw/zinc/19/75/43/1046197543.db2.gz SGEKQDAYKZMFGI-LBPRGKRZSA-N 1 0 323.358 4.320 20 10 DICDRO C[C@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1ccc2ccccc2c1O ZINC000757654320 1046198120 /nfs/dbraw/zinc/19/81/20/1046198120.db2.gz ABUAPYAXUNAFNP-PMPSAXMXSA-N 1 0 313.441 4.401 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(F)c(F)c2F)c(O)c1C ZINC000757659741 1046199597 /nfs/dbraw/zinc/19/95/97/1046199597.db2.gz ZVNSICCTPSSDOV-GFCCVEGCSA-N 1 0 323.358 4.320 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC2CCC(OC)CC2)cc1 ZINC000757683443 1046201436 /nfs/dbraw/zinc/20/14/36/1046201436.db2.gz XBUULHRPNOWAQH-ZRZPHAQCSA-N 1 0 318.505 4.389 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1C ZINC000903234929 1046202045 /nfs/dbraw/zinc/20/20/45/1046202045.db2.gz SKICYXWSHXVMBI-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2c[nH]c(=O)c3ccccc23)c(O)c1 ZINC000903235068 1046202687 /nfs/dbraw/zinc/20/26/87/1046202687.db2.gz MVGZLMOBXQUGHM-AWEZNQCLSA-N 1 0 322.408 4.114 20 10 DICDRO COc1c(Cl)cccc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000903248049 1046209337 /nfs/dbraw/zinc/20/93/37/1046209337.db2.gz ZXHXHLWZBLABMW-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO CC[C@@H]([NH2+]C1CC2(C1)CO[C@H](C)C2)c1cc(Cl)ccc1O ZINC000903283636 1046222461 /nfs/dbraw/zinc/22/24/61/1046222461.db2.gz RZTOSNRYBZKWOA-UKBVEQLASA-N 1 0 309.837 4.044 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc(C(C)(C)C)s2)cc1 ZINC000149712025 1046231865 /nfs/dbraw/zinc/23/18/65/1046231865.db2.gz CWOKMGHCSFHBOO-UHFFFAOYSA-N 1 0 302.487 4.401 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1cncs1 ZINC000903310469 1046233345 /nfs/dbraw/zinc/23/33/45/1046233345.db2.gz JOBMRUNGUAHSHQ-NWDGAFQWSA-N 1 0 302.443 4.139 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](c2ccccn2)C2CC2)cc1 ZINC000903338206 1046251934 /nfs/dbraw/zinc/25/19/34/1046251934.db2.gz GXIDBYVPFLPGOI-YWZLYKJASA-N 1 0 309.457 4.340 20 10 DICDRO C[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccc(Cl)cc1O ZINC000903427839 1046276848 /nfs/dbraw/zinc/27/68/48/1046276848.db2.gz AAZAKQQPDVKYEV-PIGZYNQJSA-N 1 0 302.805 4.243 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)cc1 ZINC000903427689 1046278128 /nfs/dbraw/zinc/27/81/28/1046278128.db2.gz IQMFQOIIYBSIRH-FOIQADDNSA-N 1 0 309.457 4.340 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccncc2)C2CC2)c2c1c(F)ccc2O ZINC000903429225 1046279309 /nfs/dbraw/zinc/27/93/09/1046279309.db2.gz TYRBTWOQOXGPPI-PRIMNGNOSA-N 1 0 312.388 4.216 20 10 DICDRO Cc1cc([C@H]([NH2+]Cc2ccc(N(C)C)cc2)C2CC2)ccc1F ZINC000758638866 1046282669 /nfs/dbraw/zinc/28/26/69/1046282669.db2.gz IRCBXLIGDNDLPK-HXUWFJFHSA-N 1 0 312.432 4.441 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]Cc2csc(C)c2C)c1O ZINC000399908831 1046347520 /nfs/dbraw/zinc/34/75/20/1046347520.db2.gz GRQHGUJUASZBPA-UHFFFAOYSA-N 1 0 311.834 4.022 20 10 DICDRO C[C@@H]([NH2+]CCSc1ccccc1)c1ccc(N(C)C)cc1 ZINC000037904202 1046368815 /nfs/dbraw/zinc/36/88/15/1046368815.db2.gz FTDVXMZCFIGQQC-OAHLLOKOSA-N 1 0 300.471 4.196 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccc(OC)c2)cc1 ZINC000759643820 1046368778 /nfs/dbraw/zinc/36/87/78/1046368778.db2.gz OUSVJFBRXCFZDA-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO C[N@H+](Cc1ccc(F)cc1)Cc1ccc(N2CCCCC2)cc1 ZINC000759688401 1046373078 /nfs/dbraw/zinc/37/30/78/1046373078.db2.gz GYQNOHIGFWLVQY-UHFFFAOYSA-N 1 0 312.432 4.448 20 10 DICDRO CCn1ccc2c1cccc2C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001139155442 1046398530 /nfs/dbraw/zinc/39/85/30/1046398530.db2.gz QBHQANLPPBITIX-UHFFFAOYSA-N 1 0 321.468 4.359 20 10 DICDRO COC1(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)CCC1 ZINC000780740675 1046402085 /nfs/dbraw/zinc/40/20/85/1046402085.db2.gz RPNBFIPZKQNMRW-KRWDZBQOSA-N 1 0 316.489 4.287 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)c1 ZINC000780791731 1046405982 /nfs/dbraw/zinc/40/59/82/1046405982.db2.gz PFBXQRIMTAGRHB-BBVFFXRHSA-N 1 0 309.409 4.079 20 10 DICDRO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000780793432 1046406850 /nfs/dbraw/zinc/40/68/50/1046406850.db2.gz NPFKZNQKRRQSDD-AAEUAGOBSA-N 1 0 318.358 4.055 20 10 DICDRO C[N@H+](Cc1cccnc1)Cc1cc(-c2ccccc2)ccc1O ZINC000780891549 1046410664 /nfs/dbraw/zinc/41/06/64/1046410664.db2.gz VIVVWZSIRLZQDB-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO C[C@@H]([NH2+][C@H](C)C1CCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000749130100 1046431693 /nfs/dbraw/zinc/43/16/93/1046431693.db2.gz OZBZAOKKVWHVIY-IAGOWNOFSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)cc(OC)c1)c1ccc(N(C)C)cc1 ZINC000090972281 1046433732 /nfs/dbraw/zinc/43/37/32/1046433732.db2.gz PYJOEBDKPLGIEC-LJQANCHMSA-N 1 0 316.420 4.141 20 10 DICDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCCO1)c1ccc(N(C)C)cc1 ZINC000247078658 1046457491 /nfs/dbraw/zinc/45/74/91/1046457491.db2.gz QSBZTIWDOJPKLW-ZLGUVYLKSA-N 1 0 324.468 4.324 20 10 DICDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)c(C)c2)c1 ZINC001139672976 1046496986 /nfs/dbraw/zinc/49/69/86/1046496986.db2.gz MFEOQRDCRCCYMM-OAQYLSRUSA-N 1 0 324.468 4.407 20 10 DICDRO Cc1cc(C[NH+]2CCC(c3cccc(O)c3)CC2)ccc1N(C)C ZINC001139673387 1046497157 /nfs/dbraw/zinc/49/71/57/1046497157.db2.gz GDCXELLCAYEQDW-UHFFFAOYSA-N 1 0 324.468 4.146 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](Cc3ccncc3)C2)cc1C(C)C ZINC000782288548 1046514151 /nfs/dbraw/zinc/51/41/51/1046514151.db2.gz FYARJMYYFNGICG-GOSISDBHSA-N 1 0 324.468 4.284 20 10 DICDRO COc1cccc2c1CC[N@H+](Cc1c(O)ccc3ccccc31)C2 ZINC000782291761 1046514470 /nfs/dbraw/zinc/51/44/70/1046514470.db2.gz JUBMZDJWONCIND-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO CCOc1ccc(O)c(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1 ZINC000092484129 1046520744 /nfs/dbraw/zinc/52/07/44/1046520744.db2.gz BOCPFKHCDSHEAN-ZDUSSCGKSA-N 1 0 301.386 4.110 20 10 DICDRO COc1ccc(CC(C)(C)[NH2+]Cc2cc(C)c(C)cc2O)cc1 ZINC000782535579 1046533589 /nfs/dbraw/zinc/53/35/89/1046533589.db2.gz KTYHFIQRKUVRBD-UHFFFAOYSA-N 1 0 313.441 4.129 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000782529679 1046534221 /nfs/dbraw/zinc/53/42/21/1046534221.db2.gz SIOGPRBYXLVDII-GJZGRUSLSA-N 1 0 314.395 4.272 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC=C(c2ccco2)C1 ZINC000795651282 1046565840 /nfs/dbraw/zinc/56/58/40/1046565840.db2.gz QZILRPMKTQBMLT-UHFFFAOYSA-N 1 0 305.377 4.428 20 10 DICDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000783309812 1046579075 /nfs/dbraw/zinc/57/90/75/1046579075.db2.gz MYXJKVONHXGSEC-KFWWJZLASA-N 1 0 322.880 4.016 20 10 DICDRO Cc1ccccc1C[N@@H+](C)Cc1c(O)cccc1Br ZINC001140101152 1046588250 /nfs/dbraw/zinc/58/82/50/1046588250.db2.gz LBOGRIRURFNRKV-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2c(O)cccc2Br)cc1 ZINC001140101356 1046588901 /nfs/dbraw/zinc/58/89/01/1046588901.db2.gz PPCUCMAHHSCRJV-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Cc1ccc([C@H](C[NH2+][C@H](C)c2ccccc2O)N2CCCC2)cc1 ZINC000783507316 1046601780 /nfs/dbraw/zinc/60/17/80/1046601780.db2.gz CBAZYAONTXMGBM-XLIONFOSSA-N 1 0 324.468 4.188 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOc2ccc(F)cc21)c1ccccc1O ZINC000783502441 1046602034 /nfs/dbraw/zinc/60/20/34/1046602034.db2.gz SQXUSPQPMUCFOP-MLGOLLRUSA-N 1 0 301.361 4.096 20 10 DICDRO C[C@H]([NH2+]CCc1c[nH]c2cc(Cl)ccc12)c1ccccc1O ZINC000783504706 1046602066 /nfs/dbraw/zinc/60/20/66/1046602066.db2.gz JMNNCWQIQBTBOG-LBPRGKRZSA-N 1 0 314.816 4.420 20 10 DICDRO C[C@@H]([NH2+]CC1(c2ccc(Cl)cc2)CC1)c1ccccc1O ZINC000783506327 1046602567 /nfs/dbraw/zinc/60/25/67/1046602567.db2.gz PWJBEKBONLTGNZ-CYBMUJFWSA-N 1 0 301.817 4.428 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccc(Cl)cc1 ZINC000783515805 1046603350 /nfs/dbraw/zinc/60/33/50/1046603350.db2.gz BRJDBXWYDCNVCN-OLZOCXBDSA-N 1 0 305.805 4.164 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2O)C12CCCCC2 ZINC000783519107 1046604229 /nfs/dbraw/zinc/60/42/29/1046604229.db2.gz VVRZIUPZCUEEHI-FHLIZLRMSA-N 1 0 303.446 4.171 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2O)C12CCCCC2 ZINC000783519105 1046604247 /nfs/dbraw/zinc/60/42/47/1046604247.db2.gz VVRZIUPZCUEEHI-BMGDILEWSA-N 1 0 303.446 4.171 20 10 DICDRO CC(C)Oc1ncccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841746277 1046605938 /nfs/dbraw/zinc/60/59/38/1046605938.db2.gz XGSLAZAWRNFVLX-GFCCVEGCSA-N 1 0 320.820 4.079 20 10 DICDRO Cc1ccc(C)c(C[NH+]2CCC(c3cccc(O)c3)CC2)c1O ZINC001140184988 1046609110 /nfs/dbraw/zinc/60/91/10/1046609110.db2.gz NFPLQNZYEFNQQM-UHFFFAOYSA-N 1 0 311.425 4.094 20 10 DICDRO Cc1ccc(C)c(C[NH+]2CCC(c3ccc(O)cc3)CC2)c1O ZINC001140184573 1046609314 /nfs/dbraw/zinc/60/93/14/1046609314.db2.gz ZXKXYFWLROVSEA-UHFFFAOYSA-N 1 0 311.425 4.094 20 10 DICDRO COc1ccc(C2=CC[N@H+](Cc3c(C)ccc(C)c3O)CC2)cc1 ZINC001140184772 1046610228 /nfs/dbraw/zinc/61/02/28/1046610228.db2.gz HSCXSIUOTXCMHE-UHFFFAOYSA-N 1 0 323.436 4.307 20 10 DICDRO Cc1ccc(C2CC[NH+](Cc3c(O)cccc3Cl)CC2)cn1 ZINC000783603294 1046613092 /nfs/dbraw/zinc/61/30/92/1046613092.db2.gz PROABVVAPCYYEU-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO CCS[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cc(OC)ccc2O)C1 ZINC000248496918 1046618414 /nfs/dbraw/zinc/61/84/14/1046618414.db2.gz LNFBVQYWVZTRJP-VNHYZAJKSA-N 1 0 309.475 4.116 20 10 DICDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(C)c(C)cc2O)s1 ZINC000093275117 1046620820 /nfs/dbraw/zinc/62/08/20/1046620820.db2.gz DTCUEMLKGIJABU-ZDUSSCGKSA-N 1 0 304.459 4.275 20 10 DICDRO Cc1cc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)cs1 ZINC000834549113 1046628402 /nfs/dbraw/zinc/62/84/02/1046628402.db2.gz VNESBHULLQQEDX-AWEZNQCLSA-N 1 0 300.471 4.290 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)n1 ZINC000093453361 1046629626 /nfs/dbraw/zinc/62/96/26/1046629626.db2.gz ODTXTDCXIINXPP-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)cc1C(C)C ZINC000795671479 1046631494 /nfs/dbraw/zinc/63/14/94/1046631494.db2.gz VSINBSDNWRVXOE-SFHVURJKSA-N 1 0 313.445 4.274 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(F)cc1F ZINC000834594143 1046635312 /nfs/dbraw/zinc/63/53/12/1046635312.db2.gz PXADERPNAFUSNF-JKSUJKDBSA-N 1 0 303.352 4.399 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@H]2CCc3cccc(O)c32)on1 ZINC000834602099 1046635638 /nfs/dbraw/zinc/63/56/38/1046635638.db2.gz JIJDBYJRURVCFA-HNNXBMFYSA-N 1 0 300.402 4.061 20 10 DICDRO CO[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(Cl)cc1 ZINC000834602009 1046636183 /nfs/dbraw/zinc/63/61/83/1046636183.db2.gz HHGNWOBGHUGVBI-NVXWUHKLSA-N 1 0 317.816 4.010 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccccc1N(C)C ZINC000093945476 1046645077 /nfs/dbraw/zinc/64/50/77/1046645077.db2.gz RVVOTMIBOOEZLD-CYBMUJFWSA-N 1 0 321.515 4.042 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC[C@H]2CCCCO2)cc1 ZINC000248886350 1046645163 /nfs/dbraw/zinc/64/51/63/1046645163.db2.gz QGZPPLMWBSDOTK-VQIMIIECSA-N 1 0 304.478 4.143 20 10 DICDRO CO[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(Cl)c1 ZINC000834673054 1046648479 /nfs/dbraw/zinc/64/84/79/1046648479.db2.gz MARWVERIRGXHAJ-WBVHZDCISA-N 1 0 317.816 4.010 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@H](c3cccc(C)c3)C2)c1O ZINC000784025079 1046652928 /nfs/dbraw/zinc/65/29/28/1046652928.db2.gz FDIJBXHMABKINM-KRWDZBQOSA-N 1 0 311.425 4.007 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]C1(c3ccc(F)cc3F)CCC1)CC2 ZINC000834733298 1046658741 /nfs/dbraw/zinc/65/87/41/1046658741.db2.gz CWSCKPXLLJXKHV-INIZCTEOSA-N 1 0 315.363 4.327 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001140341247 1046665677 /nfs/dbraw/zinc/66/56/77/1046665677.db2.gz GJFHOQPKCVQYQK-CYBMUJFWSA-N 1 0 305.780 4.174 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001140344217 1046667831 /nfs/dbraw/zinc/66/78/31/1046667831.db2.gz GGJROULGFGMKCQ-OAHLLOKOSA-N 1 0 301.817 4.110 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001140344454 1046667876 /nfs/dbraw/zinc/66/78/76/1046667876.db2.gz KHCWYHHOALPUEL-INIZCTEOSA-N 1 0 302.805 4.168 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)cc1 ZINC001140344739 1046668142 /nfs/dbraw/zinc/66/81/42/1046668142.db2.gz LIRCHCFXRJASQI-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO C[N@H+](Cc1c(O)cccc1Cl)C12CC3CC(CC(C3)C1)C2 ZINC001140345315 1046668797 /nfs/dbraw/zinc/66/87/97/1046668797.db2.gz RPJIOXSKMCWMON-UHFFFAOYSA-N 1 0 305.849 4.446 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H](c1ccccc1)C(F)(F)F)CC2 ZINC000834774436 1046668823 /nfs/dbraw/zinc/66/88/23/1046668823.db2.gz PCFHFHMKAJKPDH-GJZGRUSLSA-N 1 0 321.342 4.315 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cc(Cl)ccc1O ZINC000834815303 1046673876 /nfs/dbraw/zinc/67/38/76/1046673876.db2.gz UOGZCACXKDEXDQ-WDEREUQCSA-N 1 0 320.776 4.366 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCCc2ccccc2Cl)c1 ZINC000784264998 1046677523 /nfs/dbraw/zinc/67/75/23/1046677523.db2.gz GSLKDZRMLVANEU-ZDUSSCGKSA-N 1 0 319.832 4.338 20 10 DICDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000834843806 1046685089 /nfs/dbraw/zinc/68/50/89/1046685089.db2.gz MCVKLMJTUPTRMH-STQMWFEESA-N 1 0 319.367 4.017 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC(C)(C)c2ccccn2)cc1 ZINC000834856218 1046688301 /nfs/dbraw/zinc/68/83/01/1046688301.db2.gz MSPOPWBBNXZVOG-MRXNPFEDSA-N 1 0 311.473 4.166 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](C)CCCO)c1ccc(N2CCCCCC2)cc1 ZINC000834870187 1046690651 /nfs/dbraw/zinc/69/06/51/1046690651.db2.gz GZIPHCSRVUQVCT-ZWKOTPCHSA-N 1 0 318.505 4.126 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834885303 1046698492 /nfs/dbraw/zinc/69/84/92/1046698492.db2.gz VGYSPPUWJFDKHB-SMDDNHRTSA-N 1 0 302.245 4.244 20 10 DICDRO CO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000834885858 1046700680 /nfs/dbraw/zinc/70/06/80/1046700680.db2.gz FRUBKYDIRMQVBX-POZUXBRTSA-N 1 0 320.452 4.034 20 10 DICDRO C[C@H]([NH2+]CC[C@@]1(C)CC1(Cl)Cl)c1cc(F)ccc1O ZINC000834894378 1046705142 /nfs/dbraw/zinc/70/51/42/1046705142.db2.gz RRMBTDIAWHGCIP-ZANVPECISA-N 1 0 306.208 4.156 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000834897601 1046707947 /nfs/dbraw/zinc/70/79/47/1046707947.db2.gz UYCNPDNFTWVPSM-YGRLFVJLSA-N 1 0 321.342 4.456 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCN(C)c3ccccc32)c(O)c1 ZINC000834902625 1046711017 /nfs/dbraw/zinc/71/10/17/1046711017.db2.gz HRNSVMWZPGTPOB-CRAIPNDOSA-N 1 0 310.441 4.323 20 10 DICDRO CC[C@H]([NH2+]Cc1cnc(C)cc1C)c1cc(Cl)ccc1O ZINC000834904453 1046714762 /nfs/dbraw/zinc/71/47/62/1046714762.db2.gz YJZDPHQEOIQPTK-INIZCTEOSA-N 1 0 304.821 4.298 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+][C@H](C)c3cc(C)ccc3O)C2)c1 ZINC000834905746 1046715356 /nfs/dbraw/zinc/71/53/56/1046715356.db2.gz VVBZPBDPUGUCTO-DJIMGWMZSA-N 1 0 311.425 4.306 20 10 DICDRO CC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1[O-] ZINC000796696743 1046717490 /nfs/dbraw/zinc/71/74/90/1046717490.db2.gz UFWIVOMTTKXWJR-CRAIPNDOSA-N 1 0 322.468 4.084 20 10 DICDRO CC[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(F)cc1[O-] ZINC000796694363 1046718016 /nfs/dbraw/zinc/71/80/16/1046718016.db2.gz IOXRLQVLRGBGGD-CRAIPNDOSA-N 1 0 322.468 4.227 20 10 DICDRO Oc1cc(Cl)ccc1C[NH+]1CCC(c2cccs2)CC1 ZINC001140466431 1046737738 /nfs/dbraw/zinc/73/77/38/1046737738.db2.gz FNAAKNXURZEMPT-UHFFFAOYSA-N 1 0 307.846 4.487 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001140466453 1046738746 /nfs/dbraw/zinc/73/87/46/1046738746.db2.gz GDRPVYLFESUPIH-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2cccc3cccnc32)c1 ZINC000321863736 1046741653 /nfs/dbraw/zinc/74/16/53/1046741653.db2.gz YRVFRNVVILVNQP-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO CCCO[C@H]1CCC[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835028512 1046745405 /nfs/dbraw/zinc/74/54/05/1046745405.db2.gz KXYZGBKJPRLSFV-BPJPHKDRSA-N 1 0 316.489 4.047 20 10 DICDRO CCCO[C@H]1CCC[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835028513 1046745438 /nfs/dbraw/zinc/74/54/38/1046745438.db2.gz KXYZGBKJPRLSFV-CYXJOQHWSA-N 1 0 316.489 4.047 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C2(C)CCC(F)(F)CC2)cc1 ZINC000835047872 1046749097 /nfs/dbraw/zinc/74/90/97/1046749097.db2.gz LXDGZVBXZBQWKN-PLNGDYQASA-N 1 0 308.416 4.323 20 10 DICDRO C[C@@H]1C[C@H](c2cccnc2)[N@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835048153 1046749166 /nfs/dbraw/zinc/74/91/66/1046749166.db2.gz MJVQUZSGYFMBMF-QNIGJGFBSA-N 1 0 321.468 4.244 20 10 DICDRO CC[C@@H]([NH2+]CCCc1cccc(C)n1)c1cc(Cl)ccc1O ZINC000797017024 1046772139 /nfs/dbraw/zinc/77/21/39/1046772139.db2.gz NDYOJYYRIOIDPV-QGZVFWFLSA-N 1 0 318.848 4.423 20 10 DICDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1 ZINC000797058474 1046781379 /nfs/dbraw/zinc/78/13/79/1046781379.db2.gz FMEPOAPFWDXSLS-VEVIJQCQSA-N 1 0 319.832 4.127 20 10 DICDRO C[C@H]([NH2+][C@H]1CSC[C@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000797066229 1046785125 /nfs/dbraw/zinc/78/51/25/1046785125.db2.gz QCNOHCNTAKDFIW-KEYYUXOJSA-N 1 0 322.493 4.218 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CC2(C(F)(F)F)CC2)c2c1c(F)ccc2O ZINC000797072140 1046786199 /nfs/dbraw/zinc/78/61/99/1046786199.db2.gz WYXZMGIXFAETFH-WPRPVWTQSA-N 1 0 303.299 4.012 20 10 DICDRO C[C@H]([NH2+]CC1(c2ccccn2)CCC1)c1cc(Cl)ccc1O ZINC000797100241 1046790187 /nfs/dbraw/zinc/79/01/87/1046790187.db2.gz OVFUGGKLDGWETB-ZDUSSCGKSA-N 1 0 316.832 4.213 20 10 DICDRO CC[N@H+](Cc1cc(C)ccc1O)[C@@H](C)Cc1ccc(OC)cc1 ZINC001140617319 1046811241 /nfs/dbraw/zinc/81/12/41/1046811241.db2.gz MRZPIEQCHQRHFT-INIZCTEOSA-N 1 0 313.441 4.162 20 10 DICDRO Cc1ccc(Br)cc1C[N@@H+](C)Cc1ccccc1O ZINC001140650383 1046834721 /nfs/dbraw/zinc/83/47/21/1046834721.db2.gz KOXCTVXBWTYOGU-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)nc(Cl)c2)cc1 ZINC000797596262 1046863893 /nfs/dbraw/zinc/86/38/93/1046863893.db2.gz UFCPGQOJOZZNFQ-UHFFFAOYSA-N 1 0 317.864 4.179 20 10 DICDRO Cc1cc(F)ccc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001140782101 1046895435 /nfs/dbraw/zinc/89/54/35/1046895435.db2.gz GJASOZLPFVTLQZ-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO Cc1ccc(Br)c(C[N@H+](C)Cc2ccccc2O)c1 ZINC001137386136 1046896149 /nfs/dbraw/zinc/89/61/49/1046896149.db2.gz QWSSRGWMCUIJFG-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1C[C@H](c2ccccc2F)C1 ZINC000797877034 1046899400 /nfs/dbraw/zinc/89/94/00/1046899400.db2.gz TXDJNAXYHBIRME-HAQNSBGRSA-N 1 0 305.780 4.221 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(SC)cc2)c1 ZINC000797999048 1046917486 /nfs/dbraw/zinc/91/74/86/1046917486.db2.gz OKOLMLZTGWKLSQ-ZDUSSCGKSA-N 1 0 317.454 4.016 20 10 DICDRO CSc1ccc(CC[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000797998751 1046918181 /nfs/dbraw/zinc/91/81/81/1046918181.db2.gz IHSTUSHKWUVPOF-LBPRGKRZSA-N 1 0 305.418 4.147 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCN1C1CCCCC1)c1ccccc1O ZINC000798002301 1046919653 /nfs/dbraw/zinc/91/96/53/1046919653.db2.gz CVKWPZYNQOQGJG-HKUYNNGSSA-N 1 0 316.489 4.230 20 10 DICDRO CC[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000827354885 1046928834 /nfs/dbraw/zinc/92/88/34/1046928834.db2.gz UUCHLYLPVBQSFJ-GOSISDBHSA-N 1 0 316.489 4.066 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c(O)c1 ZINC001140855520 1046930517 /nfs/dbraw/zinc/93/05/17/1046930517.db2.gz CYPANBNAQUFZRQ-MAUKXSAKSA-N 1 0 302.462 4.003 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2C3CCCC2CCC3)c(O)c1 ZINC001140856518 1046932314 /nfs/dbraw/zinc/93/23/14/1046932314.db2.gz DGORKFTULAJQNT-UHFFFAOYSA-N 1 0 302.462 4.145 20 10 DICDRO Oc1cc2c(cc1C[N@H+]1CC=C(c3ccc(F)cc3)CC1)CCC2 ZINC000798190376 1046933451 /nfs/dbraw/zinc/93/34/51/1046933451.db2.gz TWTZAJUPSYMHST-UHFFFAOYSA-N 1 0 323.411 4.309 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c(Cl)c1 ZINC001140922590 1046950119 /nfs/dbraw/zinc/95/01/19/1046950119.db2.gz VOYDOJYIMKWPTB-UHFFFAOYSA-N 1 0 316.823 4.273 20 10 DICDRO CN(C)c1ccc(CN(C)Cc2ccccc2F)c(Cl)c1 ZINC001140923885 1046951031 /nfs/dbraw/zinc/95/10/31/1046951031.db2.gz KTECAEFDAGKCLQ-UHFFFAOYSA-N 1 0 306.812 4.177 20 10 DICDRO Cc1ccc(C[NH+]2CCC(c3ccc(F)cc3F)CC2)c(O)c1 ZINC001140953475 1046960231 /nfs/dbraw/zinc/96/02/31/1046960231.db2.gz BCDIPKCTHMBYNE-UHFFFAOYSA-N 1 0 317.379 4.358 20 10 DICDRO COc1cccc([C@@H]2CCC[N@H+](Cc3ccc(C)cc3O)C2)c1 ZINC001140953611 1046960592 /nfs/dbraw/zinc/96/05/92/1046960592.db2.gz DMUHODZWSOPRAW-QGZVFWFLSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)c(O)c1 ZINC001140950335 1046960903 /nfs/dbraw/zinc/96/09/03/1046960903.db2.gz YYTSETTXZQNAHM-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c(O)c1 ZINC001140950775 1046961033 /nfs/dbraw/zinc/96/10/33/1046961033.db2.gz HWLXEXACUYRBLN-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2ccc(F)cc2)c(O)c1 ZINC001140950955 1046961158 /nfs/dbraw/zinc/96/11/58/1046961158.db2.gz QMNRBZOWKQQDDO-KRWDZBQOSA-N 1 0 317.429 4.130 20 10 DICDRO Cc1ccc(C[NH+]2CCC(n3ccc4ccccc43)CC2)c(O)c1 ZINC001140958135 1046961723 /nfs/dbraw/zinc/96/17/23/1046961723.db2.gz SANDGKUQGCTJDZ-UHFFFAOYSA-N 1 0 320.436 4.492 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c(O)c1 ZINC001140958207 1046961762 /nfs/dbraw/zinc/96/17/62/1046961762.db2.gz TYUYUKZDQRSYBV-INIZCTEOSA-N 1 0 303.352 4.316 20 10 DICDRO C[N@H+](Cc1ccc(-c2ccccn2)s1)Cc1ccccc1O ZINC001141006705 1046976423 /nfs/dbraw/zinc/97/64/23/1046976423.db2.gz GOFYFYZSKRUZNB-UHFFFAOYSA-N 1 0 310.422 4.148 20 10 DICDRO Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000798925379 1046986724 /nfs/dbraw/zinc/98/67/24/1046986724.db2.gz ACPLOQWNWBBMNR-RBUKOAKNSA-N 1 0 323.484 4.272 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](c3ccccn3)C2)cc1C(C)C ZINC000799158310 1047007379 /nfs/dbraw/zinc/00/73/79/1047007379.db2.gz ITFLXOSEJDILKQ-MRXNPFEDSA-N 1 0 310.441 4.209 20 10 DICDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC001141158445 1047028839 /nfs/dbraw/zinc/02/88/39/1047028839.db2.gz AAWUXQCUWYCHBL-INIZCTEOSA-N 1 0 303.789 4.088 20 10 DICDRO FC(F)C1CCC([NH2+]CCCSc2nccs2)CC1 ZINC000799718982 1047055048 /nfs/dbraw/zinc/05/50/48/1047055048.db2.gz QPKCXRIZCMVFAB-UHFFFAOYSA-N 1 0 306.447 4.039 20 10 DICDRO COc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc(N(C)C)cc1C ZINC000799719158 1047056029 /nfs/dbraw/zinc/05/60/29/1047056029.db2.gz UJYHHQHDOQATFT-HXUWFJFHSA-N 1 0 324.468 4.237 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1CO)c1ccc(N2CCCCC2)cc1 ZINC000305134903 1047100296 /nfs/dbraw/zinc/10/02/96/1047100296.db2.gz ODDCISSNSKGDDB-QGZVFWFLSA-N 1 0 324.468 4.020 20 10 DICDRO Clc1cccc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001116012495 1047100641 /nfs/dbraw/zinc/10/06/41/1047100641.db2.gz BJGAZPPEDGRYDC-UHFFFAOYSA-N 1 0 314.860 4.273 20 10 DICDRO C[N@H+](CCc1cccs1)Cc1ccc(N2CCCC2)cc1 ZINC001116444906 1047141798 /nfs/dbraw/zinc/14/17/98/1047141798.db2.gz DJUSFNHUTVLYBZ-UHFFFAOYSA-N 1 0 300.471 4.023 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1ccccc1N1CCCC1 ZINC001116443694 1047142215 /nfs/dbraw/zinc/14/22/15/1047142215.db2.gz CGNWCLPLCKTIMC-UHFFFAOYSA-N 1 0 324.468 4.405 20 10 DICDRO Cc1cnccc1CC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000827719202 1047150854 /nfs/dbraw/zinc/15/08/54/1047150854.db2.gz GQSCBERFDHIGJO-UHFFFAOYSA-N 1 0 323.484 4.055 20 10 DICDRO C[C@H]([NH2+]CCCCOc1ccccc1)c1cc(F)ccc1O ZINC001116584246 1047159875 /nfs/dbraw/zinc/15/98/75/1047159875.db2.gz BNSYABMOEHSMBG-AWEZNQCLSA-N 1 0 303.377 4.041 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c(C)c1 ZINC001116589115 1047160637 /nfs/dbraw/zinc/16/06/37/1047160637.db2.gz QCMIIZFRGPAAJS-RHSMWYFYSA-N 1 0 311.425 4.356 20 10 DICDRO C[C@H](CCCc1cccnc1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000839150975 1047198558 /nfs/dbraw/zinc/19/85/58/1047198558.db2.gz PLAXYAIGESEUNL-OTIVFRFGSA-N 1 0 323.484 4.162 20 10 DICDRO Cc1cc(NCc2cc(Cl)cc(F)c2O)ccc1C[NH+](C)C ZINC000839188367 1047203291 /nfs/dbraw/zinc/20/32/91/1047203291.db2.gz FRUICXISLAPUSK-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2)c(O)c1 ZINC000839194435 1047204772 /nfs/dbraw/zinc/20/47/72/1047204772.db2.gz PMRVXXJIRXYQIB-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cnc3ccc(C)cc3c2)c1 ZINC000839540799 1047245663 /nfs/dbraw/zinc/24/56/63/1047245663.db2.gz WFWNIBPHJKOZRL-CQSZACIVSA-N 1 0 322.408 4.108 20 10 DICDRO CC(=O)c1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC001117795103 1047246648 /nfs/dbraw/zinc/24/66/48/1047246648.db2.gz PQOPUNMYEFQTNE-UHFFFAOYSA-N 1 0 322.452 4.120 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](C)c1cncc(F)c1 ZINC001117945116 1047251154 /nfs/dbraw/zinc/25/11/54/1047251154.db2.gz OUNFYJDSVKCDPH-TYNCELHUSA-N 1 0 300.377 4.134 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCn2ccc3ccccc32)c1 ZINC000390218390 1047295402 /nfs/dbraw/zinc/29/54/02/1047295402.db2.gz GXWIZGBNCCRAMA-MRXNPFEDSA-N 1 0 308.425 4.396 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2coc3ccc(F)cc23)cc1 ZINC001141856861 1047300429 /nfs/dbraw/zinc/30/04/29/1047300429.db2.gz UZFVEULFMCJHJE-UHFFFAOYSA-N 1 0 312.388 4.270 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCN2Cc2ccccc2)c(O)c1 ZINC000390577312 1047300338 /nfs/dbraw/zinc/30/03/38/1047300338.db2.gz XFZZFTJJTBOSIJ-MJGOQNOKSA-N 1 0 324.468 4.016 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)c1O ZINC001118489836 1047300777 /nfs/dbraw/zinc/30/07/77/1047300777.db2.gz WHGQWCVQLTZEID-FRJFDASCSA-N 1 0 315.791 4.438 20 10 DICDRO CC(C)[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000393396330 1047309670 /nfs/dbraw/zinc/30/96/70/1047309670.db2.gz USCDPBJFLKJGEZ-IBGZPJMESA-N 1 0 300.421 4.379 20 10 DICDRO [O-]c1cc(F)c(F)cc1C[N@@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC001142534506 1047320448 /nfs/dbraw/zinc/32/04/48/1047320448.db2.gz LXRIEBCJDMDKCZ-HNNXBMFYSA-N 1 0 321.342 4.017 20 10 DICDRO Cc1nc(-c2ccc(C[NH2+]Cc3ccccc3O)cc2)cs1 ZINC000725848559 1047320682 /nfs/dbraw/zinc/32/06/82/1047320682.db2.gz XVZDSVFYHTYQII-UHFFFAOYSA-N 1 0 310.422 4.114 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCCOc2ccc(F)cc21 ZINC000725848995 1047320899 /nfs/dbraw/zinc/32/08/99/1047320899.db2.gz OZWRKIIMAKUIJK-HNNXBMFYSA-N 1 0 321.779 4.188 20 10 DICDRO COc1ccc([C@H](C)[NH2+]CCCSc2nccs2)c(C)c1 ZINC000840722806 1047321222 /nfs/dbraw/zinc/32/12/22/1047321222.db2.gz LHALAIZTFQJLGC-ZDUSSCGKSA-N 1 0 322.499 4.293 20 10 DICDRO Cc1ccc(-c2ccc(C[NH2+]Cc3ccc4c(c3)CCO4)o2)cc1 ZINC000725852480 1047321950 /nfs/dbraw/zinc/32/19/50/1047321950.db2.gz AHUOHHICABNFCT-UHFFFAOYSA-N 1 0 319.404 4.480 20 10 DICDRO Oc1cccc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)c1 ZINC000725851168 1047322263 /nfs/dbraw/zinc/32/22/63/1047322263.db2.gz JCWDHFMLHBEEME-UHFFFAOYSA-N 1 0 305.377 4.055 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)CC(F)(F)F ZINC000396953221 1047324676 /nfs/dbraw/zinc/32/46/76/1047324676.db2.gz DIYCVHPJOMYYND-AWEZNQCLSA-N 1 0 314.395 4.355 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)CC(F)(F)F ZINC000396953222 1047325328 /nfs/dbraw/zinc/32/53/28/1047325328.db2.gz DIYCVHPJOMYYND-CQSZACIVSA-N 1 0 314.395 4.355 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cn1 ZINC000397104083 1047325495 /nfs/dbraw/zinc/32/54/95/1047325495.db2.gz QOMBLBLYZQSVSP-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cnn(CC2CCC2)c1)c1ccccc1O ZINC000898181547 1047325845 /nfs/dbraw/zinc/32/58/45/1047325845.db2.gz JQQPNAPGYYZMEG-KSSFIOAISA-N 1 0 313.445 4.191 20 10 DICDRO C[C@@H]([NH2+]C[C@]1(C)CCCN1Cc1ccccc1)c1ccccc1O ZINC000398011079 1047327395 /nfs/dbraw/zinc/32/73/95/1047327395.db2.gz LSPNQGSMROYKMU-UTKZUKDTSA-N 1 0 324.468 4.098 20 10 DICDRO C[C@H]([NH2+]C[C@]1(C)CCCN1Cc1ccccc1)c1ccccc1O ZINC000398011082 1047327940 /nfs/dbraw/zinc/32/79/40/1047327940.db2.gz LSPNQGSMROYKMU-UWJYYQICSA-N 1 0 324.468 4.098 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)CCCc2cccnc2)c(O)c1C ZINC000840771113 1047330424 /nfs/dbraw/zinc/33/04/24/1047330424.db2.gz ARYRLTOAUWEYJU-NVXWUHKLSA-N 1 0 312.457 4.466 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)CCCc2cccnc2)c(O)c1C ZINC000840771115 1047330631 /nfs/dbraw/zinc/33/06/31/1047330631.db2.gz ARYRLTOAUWEYJU-RDJZCZTQSA-N 1 0 312.457 4.466 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CC1(C(F)(F)F)CC1 ZINC000796488310 1047334072 /nfs/dbraw/zinc/33/40/72/1047334072.db2.gz FXHGGBDJSNOAPQ-UHFFFAOYSA-N 1 0 321.342 4.491 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](c2ccncc2)C2CC2)cc1C ZINC000898318196 1047339442 /nfs/dbraw/zinc/33/94/42/1047339442.db2.gz OZGBVFMIGTXWML-HXUWFJFHSA-N 1 0 310.441 4.420 20 10 DICDRO C[C@H]([NH2+][C@@H]1CS[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000840854996 1047346574 /nfs/dbraw/zinc/34/65/74/1047346574.db2.gz ILJHSYWZKWFJDA-VYDXJSESSA-N 1 0 304.503 4.222 20 10 DICDRO CO[C@@](C)([C@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O)C1CC1 ZINC000840858844 1047348278 /nfs/dbraw/zinc/34/82/78/1047348278.db2.gz HBQXUMSLFJBKMJ-CKNLXJGOSA-N 1 0 313.441 4.400 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2cccnc2)c2c1c(F)ccc2O ZINC000840890567 1047355135 /nfs/dbraw/zinc/35/51/35/1047355135.db2.gz ATPJWKYBAVPPJQ-IUODEOHRSA-N 1 0 314.404 4.042 20 10 DICDRO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C ZINC000840894722 1047356386 /nfs/dbraw/zinc/35/63/86/1047356386.db2.gz SDEKRFAWORJPAP-IRXDYDNUSA-N 1 0 311.473 4.046 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)CCC(F)(F)F ZINC000840895478 1047356657 /nfs/dbraw/zinc/35/66/57/1047356657.db2.gz YNSZRRGDRQYWRI-KBPBESRZSA-N 1 0 316.411 4.313 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000840892623 1047357518 /nfs/dbraw/zinc/35/75/18/1047357518.db2.gz WCJWNYAFXMLGKX-LJQANCHMSA-N 1 0 311.473 4.166 20 10 DICDRO Cc1csc([C@@H]([NH2+]Cc2ccc(N(C)C)cc2C)C2CC2)n1 ZINC000840935078 1047360306 /nfs/dbraw/zinc/36/03/06/1047360306.db2.gz DPJGTVRWYAIXKG-KRWDZBQOSA-N 1 0 315.486 4.067 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1 ZINC000840929977 1047360953 /nfs/dbraw/zinc/36/09/53/1047360953.db2.gz DZWPJGMAXSOKKZ-SFTDATJTSA-N 1 0 324.468 4.071 20 10 DICDRO C[C@H]([NH3+])c1ccc(NCc2ccc(N3CCCCC3)cc2)cc1 ZINC000841029657 1047372761 /nfs/dbraw/zinc/37/27/61/1047372761.db2.gz XYNCJYSTPNVOKG-INIZCTEOSA-N 1 0 309.457 4.309 20 10 DICDRO C[NH2+]Cc1cccc(NCc2ccc(N3CCCCC3)cc2)c1 ZINC000841042427 1047375034 /nfs/dbraw/zinc/37/50/34/1047375034.db2.gz HJLZFMOTGAANOH-UHFFFAOYSA-N 1 0 309.457 4.008 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCCc3cc(N)ccc32)c1O ZINC000841057444 1047376144 /nfs/dbraw/zinc/37/61/44/1047376144.db2.gz HNHYSDFRTSXFHQ-QGZVFWFLSA-N 1 0 316.832 4.103 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCCc3cc(N)ccc32)c1O ZINC000841057421 1047376445 /nfs/dbraw/zinc/37/64/45/1047376445.db2.gz HNHYSDFRTSXFHQ-KRWDZBQOSA-N 1 0 316.832 4.103 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000841058684 1047376684 /nfs/dbraw/zinc/37/66/84/1047376684.db2.gz QUBQOZFMCSNEPA-NRFANRHFSA-N 1 0 323.484 4.282 20 10 DICDRO Cc1cc2cc(C[NH2+]Cc3c(O)cccc3Cl)ccc2[nH]1 ZINC000796527774 1047378140 /nfs/dbraw/zinc/37/81/40/1047378140.db2.gz LJLIEVFUPSMIEG-UHFFFAOYSA-N 1 0 300.789 4.125 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CCCSCC1)oc1ccccc12 ZINC000726962394 1047394442 /nfs/dbraw/zinc/39/44/42/1047394442.db2.gz WRCOKZLGKUVYBK-UHFFFAOYSA-N 1 0 313.422 4.231 20 10 DICDRO C[C@H](CC(F)(F)F)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001255659432 1047399974 /nfs/dbraw/zinc/39/99/74/1047399974.db2.gz YHBQNOONXXZGNU-CYBMUJFWSA-N 1 0 300.368 4.060 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2cc(F)c(F)c(F)c2)c1 ZINC000757637431 1047420925 /nfs/dbraw/zinc/42/09/25/1047420925.db2.gz HWLPNKSTPJCBTR-LLVKDONJSA-N 1 0 309.331 4.011 20 10 DICDRO C[C@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1ccc(Cl)cc1O ZINC000841743644 1047447109 /nfs/dbraw/zinc/44/71/09/1047447109.db2.gz JDSQLVUAKXYRLX-FZMZJTMJSA-N 1 0 324.877 4.061 20 10 DICDRO CC(C)OC1CCC([NH2+][C@H](C)c2ccc(Cl)cc2[O-])CC1 ZINC000841747491 1047448226 /nfs/dbraw/zinc/44/82/26/1047448226.db2.gz BQVBBDWHBXLBAY-LRVUVFPRSA-N 1 0 311.853 4.432 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000841744254 1047448352 /nfs/dbraw/zinc/44/83/52/1047448352.db2.gz GNDLQHCFWOBNGZ-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccc2c(c1)OCO2 ZINC000841745489 1047448876 /nfs/dbraw/zinc/44/88/76/1047448876.db2.gz YYPKYHQUYSYTJI-MNOVXSKESA-N 1 0 319.788 4.186 20 10 DICDRO CCCOc1ncccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841743795 1047448953 /nfs/dbraw/zinc/44/89/53/1047448953.db2.gz CEKFQKFZKRNDGJ-GFCCVEGCSA-N 1 0 320.820 4.080 20 10 DICDRO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(Cl)cc1O ZINC000841751135 1047450812 /nfs/dbraw/zinc/45/08/12/1047450812.db2.gz LFMDUKHPVFNFBK-LBPRGKRZSA-N 1 0 319.836 4.208 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccco1 ZINC000841753150 1047452589 /nfs/dbraw/zinc/45/25/89/1047452589.db2.gz JTCRCCMVRRFZBN-SMDDNHRTSA-N 1 0 309.793 4.067 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccc([N+](=O)[O-])cc1 ZINC000841758002 1047453254 /nfs/dbraw/zinc/45/32/54/1047453254.db2.gz QXHOGJHTYPQFHN-QWRGUYRKSA-N 1 0 320.776 4.366 20 10 DICDRO C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1ccc(Cl)cc1O ZINC000841758027 1047453411 /nfs/dbraw/zinc/45/34/11/1047453411.db2.gz RDMXPUHQTOQBHV-QPUJVOFHSA-N 1 0 308.636 4.280 20 10 DICDRO COc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841761259 1047455560 /nfs/dbraw/zinc/45/55/60/1047455560.db2.gz XSVANTXREVREIM-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH2+]C2(c3ccccc3)CC2)c1O ZINC000750043925 1047455716 /nfs/dbraw/zinc/45/57/16/1047455716.db2.gz OOINTVSJBDWLMD-UHFFFAOYSA-N 1 0 315.800 4.027 20 10 DICDRO c1ccc2c(c1)COC[C@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841889995 1047462118 /nfs/dbraw/zinc/46/21/18/1047462118.db2.gz FLGDTVGFZPOVQY-OAQYLSRUSA-N 1 0 322.452 4.038 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CCC(OC3CCC3)CC2)cc1 ZINC000841888519 1047462266 /nfs/dbraw/zinc/46/22/66/1047462266.db2.gz KRSNNXQIVFOKNA-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO Oc1c(C[NH+]2CCC(OC3CCC3)CC2)ccc2ccccc21 ZINC000841888545 1047462317 /nfs/dbraw/zinc/46/23/17/1047462317.db2.gz LGNZWFDJYLIJTC-UHFFFAOYSA-N 1 0 311.425 4.079 20 10 DICDRO CC(C)C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccncc1 ZINC000842836014 1047506613 /nfs/dbraw/zinc/50/66/13/1047506613.db2.gz LHBMQTRWXYWSKX-FQEVSTJZSA-N 1 0 323.484 4.341 20 10 DICDRO CC[C@@H]([NH2+]C1(c2ccccc2OC)CC1)c1ccc(N(C)C)cc1 ZINC000842901743 1047512657 /nfs/dbraw/zinc/51/26/57/1047512657.db2.gz KMAPBAAJRRWSKL-LJQANCHMSA-N 1 0 324.468 4.491 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CCN(c3ccccc3)CC2)c1O ZINC001143101679 1047530690 /nfs/dbraw/zinc/53/06/90/1047530690.db2.gz KIPOCRYZEHBXKA-UHFFFAOYSA-N 1 0 324.468 4.012 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)c1O ZINC001143104567 1047531878 /nfs/dbraw/zinc/53/18/78/1047531878.db2.gz VITIUMWNHVSIGI-NVXWUHKLSA-N 1 0 315.457 4.023 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1O ZINC001143110278 1047532537 /nfs/dbraw/zinc/53/25/37/1047532537.db2.gz BCOXQVOPDHZUKX-GOSISDBHSA-N 1 0 310.441 4.422 20 10 DICDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2cccc(C(C)(C)C)c2O)no1 ZINC001143104645 1047532806 /nfs/dbraw/zinc/53/28/06/1047532806.db2.gz WTCKXULNLBWZDP-QGZVFWFLSA-N 1 0 314.429 4.323 20 10 DICDRO CCC(O)(CC)C(C)(C)C[NH2+]Cc1cc(C(C)C)ccc1O ZINC001206661476 1047739228 /nfs/dbraw/zinc/73/92/28/1047739228.db2.gz XUMYSQZLHVODEM-UHFFFAOYSA-N 1 0 307.478 4.183 20 10 DICDRO Cc1ccc(NCc2cc(Cl)c3cccnc3c2O)[nH+]c1C ZINC001157723748 1047751020 /nfs/dbraw/zinc/75/10/20/1047751020.db2.gz BNTHGDPSHSYPFH-UHFFFAOYSA-N 1 0 313.788 4.218 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]CC(C1CCC1)C1CCC1 ZINC001183046094 1047878413 /nfs/dbraw/zinc/87/84/13/1047878413.db2.gz UHWLMDIMHRXPKS-UHFFFAOYSA-N 1 0 300.490 4.367 20 10 DICDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1c(C)c3ccccc3n1C)CC2 ZINC000479440216 1047890431 /nfs/dbraw/zinc/89/04/31/1047890431.db2.gz SINIBKDBVLHNQK-IBGZPJMESA-N 1 0 320.436 4.272 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+]Cc1c(C)c2ccccc2n1C ZINC000479453682 1047897015 /nfs/dbraw/zinc/89/70/15/1047897015.db2.gz KJBCICNYRIXNJX-GOSISDBHSA-N 1 0 320.436 4.272 20 10 DICDRO CCOC(=O)C(C)(C)CCC[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC001183355797 1047919130 /nfs/dbraw/zinc/91/91/30/1047919130.db2.gz VFQHZZZDIDDCQA-HUUCEWRRSA-N 1 0 321.461 4.191 20 10 DICDRO CCOC(=O)C(C)(C)CCC[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC001183355798 1047919958 /nfs/dbraw/zinc/91/99/58/1047919958.db2.gz VFQHZZZDIDDCQA-LSDHHAIUSA-N 1 0 321.461 4.191 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C/C=C/c2ccc(F)cc2F)cc1 ZINC001204145951 1047936961 /nfs/dbraw/zinc/93/69/61/1047936961.db2.gz PRFMDISBDXAPED-SNAWJCMRSA-N 1 0 316.395 4.176 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc3ccccc3c2O)c(Cl)n1 ZINC001183550151 1047942259 /nfs/dbraw/zinc/94/22/59/1047942259.db2.gz GZPMGOXYFCMBFF-UHFFFAOYSA-N 1 0 312.800 4.192 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000775834567 1047943478 /nfs/dbraw/zinc/94/34/78/1047943478.db2.gz VAGQPZDIHRYCKA-OXJNMPFZSA-N 1 0 312.457 4.181 20 10 DICDRO COCC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000775834569 1047943523 /nfs/dbraw/zinc/94/35/23/1047943523.db2.gz VAGQPZDIHRYCKA-UZLBHIALSA-N 1 0 312.457 4.181 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2C[C@@H]3C[C@]3(c3ccccc3)C2)c1 ZINC001183799028 1047966004 /nfs/dbraw/zinc/96/60/04/1047966004.db2.gz IXKSQHPSUQPDGG-PZJWPPBQSA-N 1 0 307.437 4.289 20 10 DICDRO Cc1cc(C[N@H+]2CCCSC[C@@H]2C)ccc1N1CCCCC1 ZINC001198516924 1047970478 /nfs/dbraw/zinc/97/04/78/1047970478.db2.gz GAUZPMSOZICGIK-KRWDZBQOSA-N 1 0 318.530 4.313 20 10 DICDRO COC1(C[NH2+]Cc2cc(C(C)C)ccc2O)CCCCCC1 ZINC001184218676 1048009938 /nfs/dbraw/zinc/00/99/38/1048009938.db2.gz OGEQGWMIDIRRJZ-UHFFFAOYSA-N 1 0 305.462 4.345 20 10 DICDRO CCC(CC)(CC)C[NH2+]C[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC001184218556 1048010820 /nfs/dbraw/zinc/01/08/20/1048010820.db2.gz NDMBWLGGHIZUBB-LJQANCHMSA-N 1 0 319.537 4.161 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000773427353 1048033713 /nfs/dbraw/zinc/03/37/13/1048033713.db2.gz KRLHGKYTOOBBJU-KRWDZBQOSA-N 1 0 323.484 4.485 20 10 DICDRO CC(C)(C)n1c2ccccc2nc1NCc1cc(F)ccc1O ZINC001184451705 1048041488 /nfs/dbraw/zinc/04/14/88/1048041488.db2.gz NHRXUXKKDRTEPS-UHFFFAOYSA-N 1 0 313.376 4.248 20 10 DICDRO CCOCc1ccc(C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001199188797 1048042618 /nfs/dbraw/zinc/04/26/18/1048042618.db2.gz FVBHJSVNHFATCJ-UHFFFAOYSA-N 1 0 324.468 4.113 20 10 DICDRO CCc1onc(C)c1C[NH2+][C@@H](CC)c1cccc(Cl)c1[O-] ZINC000927134118 1048054553 /nfs/dbraw/zinc/05/45/53/1048054553.db2.gz HMZGXNUKTMJPGF-AWEZNQCLSA-N 1 0 308.809 4.145 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)c1 ZINC000775961712 1048064740 /nfs/dbraw/zinc/06/47/40/1048064740.db2.gz RHCAMUKNMRJRKX-UHFFFAOYSA-N 1 0 311.356 4.390 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)cc1C ZINC000776012194 1048086130 /nfs/dbraw/zinc/08/61/30/1048086130.db2.gz FHUNQRSBQUMMNJ-TZMCWYRMSA-N 1 0 301.352 4.172 20 10 DICDRO CC[C@@H](CSC)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000774831134 1048136696 /nfs/dbraw/zinc/13/66/96/1048136696.db2.gz VBCLZRACIPNCHE-KRWDZBQOSA-N 1 0 301.455 4.290 20 10 DICDRO CCS[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001200921055 1048156777 /nfs/dbraw/zinc/15/67/77/1048156777.db2.gz CJLMOBNHIDJAPI-DLBZAZTESA-N 1 0 305.487 4.166 20 10 DICDRO CCCOc1ccc(C[NH2+]CCCc2c(C)noc2C)cc1C ZINC001201373185 1048241992 /nfs/dbraw/zinc/24/19/92/1048241992.db2.gz UMCWXOUOWRJPBG-UHFFFAOYSA-N 1 0 316.445 4.111 20 10 DICDRO COc1ccc(C[NH+](C)C)cc1NCc1cccc(Cl)c1C ZINC001201346933 1048246576 /nfs/dbraw/zinc/24/65/76/1048246576.db2.gz GKALVRRBZAEBJJ-UHFFFAOYSA-N 1 0 318.848 4.331 20 10 DICDRO COc1ccc(C2([NH2+]Cc3cc(Cl)cc(C)c3O)CC2)cc1 ZINC000776169758 1048267154 /nfs/dbraw/zinc/26/71/54/1048267154.db2.gz PRLFQXKNBKHSRH-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO COc1ccc(O)c(C[NH2+]C(C)(C)Cc2ccccc2Cl)c1 ZINC000776173680 1048267388 /nfs/dbraw/zinc/26/73/88/1048267388.db2.gz FLFHYIANTYBDEC-UHFFFAOYSA-N 1 0 319.832 4.165 20 10 DICDRO C[C@H]([NH2+][C@@H]1CSC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000797065909 1048280271 /nfs/dbraw/zinc/28/02/71/1048280271.db2.gz NUKXYWURRCARFI-RVKKMQEKSA-N 1 0 304.503 4.079 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1Oc1cccnc1)c1ccccc1O ZINC001175418114 1048299229 /nfs/dbraw/zinc/29/92/29/1048299229.db2.gz FECQLMYVVINZNF-OAHLLOKOSA-N 1 0 320.392 4.430 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC2(Cc3ccccc3)CC2)cc1F ZINC001201548902 1048304559 /nfs/dbraw/zinc/30/45/59/1048304559.db2.gz CGKBOGVKODBSSO-UHFFFAOYSA-N 1 0 312.432 4.004 20 10 DICDRO CCN(CC)c1ccc(CNc2cc(C)cc(C)[nH+]2)cc1F ZINC001201549743 1048305361 /nfs/dbraw/zinc/30/53/61/1048305361.db2.gz QYCVXBAAFUMNMC-UHFFFAOYSA-N 1 0 301.409 4.296 20 10 DICDRO C[N@H+](CCCc1ccccc1)Cc1ccc(N2CCCC2)cc1 ZINC001201664103 1048347949 /nfs/dbraw/zinc/34/79/49/1048347949.db2.gz UWXIYXMMNQGGHA-UHFFFAOYSA-N 1 0 308.469 4.351 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2CCC[C@H]2OC)cc1 ZINC001201715059 1048352942 /nfs/dbraw/zinc/35/29/42/1048352942.db2.gz UUOVTUALZOKRDL-AZUAARDMSA-N 1 0 318.505 4.218 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCc3ccccc3C2)cc1 ZINC001201733812 1048372391 /nfs/dbraw/zinc/37/23/91/1048372391.db2.gz BZLSNNCJATUCAG-UEKDZROGSA-N 1 0 320.480 4.161 20 10 DICDRO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC001201803600 1048375508 /nfs/dbraw/zinc/37/55/08/1048375508.db2.gz XQHMIYCWLYRMTQ-CQSZACIVSA-N 1 0 300.421 4.305 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C2C[C@@H](C)O[C@H](C)C2)cc1 ZINC001201842552 1048386897 /nfs/dbraw/zinc/38/68/97/1048386897.db2.gz MPXVWTCCVMBZIA-IAGOWNOFSA-N 1 0 318.505 4.359 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@H](C3CCC3)CC2)c1O ZINC001175610140 1048394095 /nfs/dbraw/zinc/39/40/95/1048394095.db2.gz FSAQOJCBIPGRPM-HNNXBMFYSA-N 1 0 319.420 4.136 20 10 DICDRO C[C@@H]([NH2+]CCOc1cccc2ccccc21)c1ccccc1O ZINC000775128399 1048404063 /nfs/dbraw/zinc/40/40/63/1048404063.db2.gz AUKKCFCSPMCZKC-OAHLLOKOSA-N 1 0 307.393 4.275 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cc1 ZINC000775134069 1048417340 /nfs/dbraw/zinc/41/73/40/1048417340.db2.gz BPEPTUQOCFUWTO-OAHLLOKOSA-N 1 0 314.395 4.307 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H](C)c2ccc(F)cc2F)c1O ZINC000776232697 1048432191 /nfs/dbraw/zinc/43/21/91/1048432191.db2.gz VLNHYUPUSGIUIF-SNVBAGLBSA-N 1 0 311.759 4.483 20 10 DICDRO CSc1ccc(C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001202058702 1048433683 /nfs/dbraw/zinc/43/36/83/1048433683.db2.gz QNVFOQLCHDPPSV-UHFFFAOYSA-N 1 0 312.482 4.299 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)c1O ZINC000776251415 1048465000 /nfs/dbraw/zinc/46/50/00/1048465000.db2.gz WMRBXABFZURNCI-KRWDZBQOSA-N 1 0 309.409 4.237 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2COc3c2cccc3Cl)c1O ZINC000776251069 1048465446 /nfs/dbraw/zinc/46/54/46/1048465446.db2.gz PHHYEOPYSLLWPA-CQSZACIVSA-N 1 0 324.207 4.231 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000776256972 1048486433 /nfs/dbraw/zinc/48/64/33/1048486433.db2.gz UUWNGUPATFSFAC-GFCCVEGCSA-N 1 0 304.821 4.162 20 10 DICDRO CCc1cnccc1[C@H](C)[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000776256975 1048486442 /nfs/dbraw/zinc/48/64/42/1048486442.db2.gz UUWNGUPATFSFAC-LBPRGKRZSA-N 1 0 304.821 4.162 20 10 DICDRO [NH3+]Cc1ccc(Nc2ccccc2C(=O)c2ccccc2)cc1 ZINC001175969578 1048509164 /nfs/dbraw/zinc/50/91/64/1048509164.db2.gz WCYBOLGWTOCTNH-UHFFFAOYSA-N 1 0 302.377 4.120 20 10 DICDRO COc1cc(C[NH2+]Cc2cccs2)c(O)c(C(C)(C)C)c1 ZINC000850008872 1048610596 /nfs/dbraw/zinc/61/05/96/1048610596.db2.gz DPHXZCAZEYLZHI-UHFFFAOYSA-N 1 0 305.443 4.050 20 10 DICDRO COc1cc(C[NH2+]Cc2ccsc2)c(O)c(C(C)(C)C)c1 ZINC000850031787 1048612698 /nfs/dbraw/zinc/61/26/98/1048612698.db2.gz VWYGETYFAVGXGQ-UHFFFAOYSA-N 1 0 305.443 4.050 20 10 DICDRO Cc1cccc2[nH]c(C[NH2+]CCCSc3nccs3)cc21 ZINC000850144054 1048620623 /nfs/dbraw/zinc/62/06/23/1048620623.db2.gz HRMSQZSLIVHPOQ-UHFFFAOYSA-N 1 0 317.483 4.205 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(Br)c1)c1ccccc1O ZINC000042418765 1048625229 /nfs/dbraw/zinc/62/52/29/1048625229.db2.gz DNLDJDJAYPCZSE-LLVKDONJSA-N 1 0 306.203 4.006 20 10 DICDRO COc1cc(C[NH2+]Cc2cc(C)cs2)c(O)c(C(C)(C)C)c1 ZINC000850315920 1048632118 /nfs/dbraw/zinc/63/21/18/1048632118.db2.gz SWMQOGYKPXDOGX-UHFFFAOYSA-N 1 0 319.470 4.358 20 10 DICDRO CNc1ccccc1N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC001164499604 1048636697 /nfs/dbraw/zinc/63/66/97/1048636697.db2.gz SQUHFZJWYUYXOO-GUDVDZBRSA-N 1 0 321.468 4.051 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](c2ccccc2F)C(C)C)c1O ZINC000850361920 1048638371 /nfs/dbraw/zinc/63/83/71/1048638371.db2.gz GJJXPFABMOKUSH-GOSISDBHSA-N 1 0 317.404 4.417 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](c2ccccc2F)C(C)C)c(O)c1 ZINC000850361833 1048638593 /nfs/dbraw/zinc/63/85/93/1048638593.db2.gz FRIYEHBPJWHIJV-LJQANCHMSA-N 1 0 317.404 4.417 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCc3ccccc32)ccc1OC ZINC000850374208 1048642556 /nfs/dbraw/zinc/64/25/56/1048642556.db2.gz ZBWLRCRQXUWZOU-LJQANCHMSA-N 1 0 311.425 4.009 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](C)C2CCC(F)CC2)ccc1OC ZINC000850395115 1048646254 /nfs/dbraw/zinc/64/62/54/1048646254.db2.gz AJHVMHSMLRNSBM-NXVRBGIVSA-N 1 0 323.452 4.238 20 10 DICDRO COc1cccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)c1C ZINC000850416696 1048652189 /nfs/dbraw/zinc/65/21/89/1048652189.db2.gz OKXLQFACVCACRA-UHFFFAOYSA-N 1 0 324.468 4.284 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1cc2cnccc2o1 ZINC000850462735 1048665566 /nfs/dbraw/zinc/66/55/66/1048665566.db2.gz QCBZNFYSQKWXLN-ZIAGYGMSSA-N 1 0 309.413 4.306 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](C)Cc2ccc(F)cc2C)c1O ZINC000850495193 1048671402 /nfs/dbraw/zinc/67/14/02/1048671402.db2.gz YEEFIZNXVMXQQX-KBPBESRZSA-N 1 0 317.404 4.130 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccnc3ccccc23)c1 ZINC000850505909 1048672806 /nfs/dbraw/zinc/67/28/06/1048672806.db2.gz CVJKWFGYJFTRAW-OAHLLOKOSA-N 1 0 306.409 4.142 20 10 DICDRO C[C@@H]([NH2+]CCc1ccnc2ccccc12)c1ccc(N(C)C)cc1 ZINC000850507792 1048673302 /nfs/dbraw/zinc/67/33/02/1048673302.db2.gz QFVQJJINIKDDNK-MRXNPFEDSA-N 1 0 319.452 4.194 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cc(F)ccc1O ZINC000850521641 1048676314 /nfs/dbraw/zinc/67/63/14/1048676314.db2.gz ZVLWZYXSDMVQKF-LLVKDONJSA-N 1 0 319.351 4.062 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)COc1c(F)cccc1F)c1ccccc1O ZINC000850522878 1048676334 /nfs/dbraw/zinc/67/63/34/1048676334.db2.gz QFBVEIVAQGUCDX-MLGOLLRUSA-N 1 0 321.367 4.179 20 10 DICDRO C[C@@H]([NH2+]CCCOC(C)(C)C)c1ccc2ccccc2c1O ZINC000850526627 1048680573 /nfs/dbraw/zinc/68/05/73/1048680573.db2.gz RFLCHJGHMLSOBD-CQSZACIVSA-N 1 0 301.430 4.401 20 10 DICDRO COCc1csc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000850531179 1048682235 /nfs/dbraw/zinc/68/22/35/1048682235.db2.gz CNOPJLDYEISFAV-ZDUSSCGKSA-N 1 0 305.443 4.068 20 10 DICDRO C[C@H]([NH2+]Cc1c(C2CC2)cnn1C)c1ccc2ccccc2c1O ZINC000850535294 1048684175 /nfs/dbraw/zinc/68/41/75/1048684175.db2.gz ULPRHACUNMJUSQ-ZDUSSCGKSA-N 1 0 321.424 4.007 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2cc3cc(C)ccc3o2)c1O ZINC000850531832 1048684780 /nfs/dbraw/zinc/68/47/80/1048684780.db2.gz OGOJNBLDQPDILS-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(COC)cs2)cc1 ZINC000850533156 1048685378 /nfs/dbraw/zinc/68/53/78/1048685378.db2.gz RIPKEQYJEZADCT-CQSZACIVSA-N 1 0 318.486 4.201 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)c1O ZINC000850542107 1048686502 /nfs/dbraw/zinc/68/65/02/1048686502.db2.gz HTTHMIMWCXXDEL-GTNSWQLSSA-N 1 0 317.816 4.398 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cc2c(cc1O)CCCC2 ZINC000850543387 1048686558 /nfs/dbraw/zinc/68/65/58/1048686558.db2.gz ILRJIWMIZSZCCC-ZUOKHONESA-N 1 0 323.436 4.315 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl)C1CC1 ZINC000850540418 1048687316 /nfs/dbraw/zinc/68/73/16/1048687316.db2.gz MNYLMZIKCUXTBA-SCLBCKFNSA-N 1 0 322.880 4.016 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc(N(C)C)cc1 ZINC000850544445 1048688559 /nfs/dbraw/zinc/68/85/59/1048688559.db2.gz XDPGEQAPIALTAB-UXHICEINSA-N 1 0 310.441 4.186 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@H](C)O)c1cc(Cl)ccc1O ZINC000850585525 1048701567 /nfs/dbraw/zinc/70/15/67/1048701567.db2.gz YXQMBXPQORTMNW-ULFGMLNVSA-N 1 0 319.832 4.208 20 10 DICDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1C ZINC000850579761 1048701624 /nfs/dbraw/zinc/70/16/24/1048701624.db2.gz ZWENSTQQACTYLW-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@H]([NH2+]Cc1cnc(C(C)(C)C)s1)c1ccc(N(C)C)cc1 ZINC000775363897 1048704069 /nfs/dbraw/zinc/70/40/69/1048704069.db2.gz NGWLXJWGHYIYQQ-ZDUSSCGKSA-N 1 0 317.502 4.357 20 10 DICDRO CO[C@@H](c1ccccc1F)[C@@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000776497751 1048718977 /nfs/dbraw/zinc/71/89/77/1048718977.db2.gz FBWAQQBOGUIWCB-AUUYWEPGSA-N 1 0 317.404 4.014 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(C)c1C ZINC001203723231 1048738300 /nfs/dbraw/zinc/73/83/00/1048738300.db2.gz GFDVFWYKDUKEJB-UHFFFAOYSA-N 1 0 312.457 4.010 20 10 DICDRO Fc1ccc2c(c1)CCC[C@@H]2[NH2+]CCCSc1nccs1 ZINC000775392247 1048748447 /nfs/dbraw/zinc/74/84/47/1048748447.db2.gz GGZKJVQXFKJNAB-HNNXBMFYSA-N 1 0 322.474 4.432 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCc2cc(F)ccc21 ZINC000775393053 1048749296 /nfs/dbraw/zinc/74/92/96/1048749296.db2.gz KJSOTDWXMMYHCM-FQEVSTJZSA-N 1 0 312.432 4.367 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1O ZINC000775412784 1048785305 /nfs/dbraw/zinc/78/53/05/1048785305.db2.gz QLGBLNRVZNZABH-IUODEOHRSA-N 1 0 300.358 4.102 20 10 DICDRO CO[C@@H]1CCC[C@@H]1C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000775417520 1048794871 /nfs/dbraw/zinc/79/48/71/1048794871.db2.gz MTOYMPLZUGFXDF-YVWKXTFCSA-N 1 0 316.489 4.143 20 10 DICDRO CC[C@@H](CSC)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000775424164 1048809124 /nfs/dbraw/zinc/80/91/24/1048809124.db2.gz UYJFCWYZKUCBRA-RDJZCZTQSA-N 1 0 306.519 4.469 20 10 DICDRO C[C@@H]([NH2+]Cc1nsc2ccccc12)c1ccc(N(C)C)cc1 ZINC000851951161 1048817174 /nfs/dbraw/zinc/81/71/74/1048817174.db2.gz VKPQPONJJSZRAJ-CYBMUJFWSA-N 1 0 311.454 4.213 20 10 DICDRO CCCC[N@H+](Cc1cnc2ccccc2n1)Cc1ccccc1O ZINC000852019467 1048820286 /nfs/dbraw/zinc/82/02/86/1048820286.db2.gz ZLRCGKQCHYULDP-UHFFFAOYSA-N 1 0 321.424 4.138 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccccc2COC)cc1C ZINC001177175913 1048846310 /nfs/dbraw/zinc/84/63/10/1048846310.db2.gz RLKBQIGEIFGJEF-UHFFFAOYSA-N 1 0 313.441 4.220 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)Cc2ccco2)c(O)c(C(C)(C)C)c1 ZINC001177235281 1048852944 /nfs/dbraw/zinc/85/29/44/1048852944.db2.gz BMNYNPGPFMBTIF-ZDUSSCGKSA-N 1 0 317.429 4.012 20 10 DICDRO CC(C)Oc1cccc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC001177323312 1048868612 /nfs/dbraw/zinc/86/86/12/1048868612.db2.gz NEXVNFQFICWYBE-VURMDHGXSA-N 1 0 324.468 4.343 20 10 DICDRO CC(C)Oc1cccc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC001177323311 1048869772 /nfs/dbraw/zinc/86/97/72/1048869772.db2.gz NEXVNFQFICWYBE-SOFGYWHQSA-N 1 0 324.468 4.343 20 10 DICDRO CCCOc1ccc(C[NH2+]CCc2c(F)cccc2F)cc1C ZINC001177328062 1048870086 /nfs/dbraw/zinc/87/00/86/1048870086.db2.gz FONCVIFBNYETHI-UHFFFAOYSA-N 1 0 319.395 4.394 20 10 DICDRO C[C@@H](c1ccc(OC(F)F)cc1)[N@H+](C)Cc1ccccc1O ZINC000111235779 1048899165 /nfs/dbraw/zinc/89/91/65/1048899165.db2.gz RHEMCNXJKYGUOR-LBPRGKRZSA-N 1 0 307.340 4.187 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccncc2)c1 ZINC000853628916 1048910386 /nfs/dbraw/zinc/91/03/86/1048910386.db2.gz FPHAVTZHXPGYDW-IBGZPJMESA-N 1 0 308.425 4.131 20 10 DICDRO CC[C@@H]1C[C@H](C[N@H+](C)Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000780755540 1048913900 /nfs/dbraw/zinc/91/39/00/1048913900.db2.gz WQRCIGGGLHOMQA-UYAOXDASSA-N 1 0 318.505 4.170 20 10 DICDRO C[C@@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccccc1O ZINC001203536495 1048924195 /nfs/dbraw/zinc/92/41/95/1048924195.db2.gz WBNYVCSZVNABNE-LLVKDONJSA-N 1 0 316.451 4.428 20 10 DICDRO Oc1ccccc1C[N@@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001203556204 1048926573 /nfs/dbraw/zinc/92/65/73/1048926573.db2.gz OCICEYGHHMRFIM-INIZCTEOSA-N 1 0 319.857 4.336 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccccc2O)CCc2ccc(Cl)cc21 ZINC001203558618 1048929543 /nfs/dbraw/zinc/92/95/43/1048929543.db2.gz PUYFTAVGHRRSIC-ZDUSSCGKSA-N 1 0 301.817 4.207 20 10 DICDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001177646825 1048930059 /nfs/dbraw/zinc/93/00/59/1048930059.db2.gz QCFNAQPQWVZVDF-FNEOHHHZSA-N 1 0 306.453 4.351 20 10 DICDRO Clc1cccc2c1CC[C@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177651096 1048930554 /nfs/dbraw/zinc/93/05/54/1048930554.db2.gz ULBSSPBUKBJWPD-GOSISDBHSA-N 1 0 313.828 4.442 20 10 DICDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001177646830 1048930669 /nfs/dbraw/zinc/93/06/69/1048930669.db2.gz QCFNAQPQWVZVDF-OLEQZPESSA-N 1 0 306.453 4.351 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c1O ZINC001203600202 1048940398 /nfs/dbraw/zinc/94/03/98/1048940398.db2.gz XAPFEMFLRINQOY-INIZCTEOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cc1C ZINC001203603737 1048940557 /nfs/dbraw/zinc/94/05/57/1048940557.db2.gz VJGMQRXMIQQPTM-HNNXBMFYSA-N 1 0 311.425 4.179 20 10 DICDRO CCOc1cccc(C[N@H+](CC)Cc2ccc(C)c(C)c2)c1O ZINC001203614666 1048941623 /nfs/dbraw/zinc/94/16/23/1048941623.db2.gz DLYWBRSIIHKRRK-UHFFFAOYSA-N 1 0 313.441 4.430 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c(O)c1 ZINC001203627788 1048943351 /nfs/dbraw/zinc/94/33/51/1048943351.db2.gz PDUFEPGCANLXOF-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2cc(C)cc(C)c2)c(O)c1 ZINC001203634692 1048944142 /nfs/dbraw/zinc/94/41/42/1048944142.db2.gz RCHJNLLLADXBFH-IBGZPJMESA-N 1 0 311.425 4.355 20 10 DICDRO Oc1ccc(Br)cc1C[N@@H+]1CCC12CCCCC2 ZINC001203636100 1048944658 /nfs/dbraw/zinc/94/46/58/1048944658.db2.gz OJOIIWXOHFOFES-UHFFFAOYSA-N 1 0 310.235 4.063 20 10 DICDRO COc1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)c(O)c1 ZINC001203630334 1048945207 /nfs/dbraw/zinc/94/52/07/1048945207.db2.gz QFVHYIRFTMMNOF-SFHVURJKSA-N 1 0 315.388 4.267 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCOC2CCCCCC2)cc1 ZINC001177875577 1048949339 /nfs/dbraw/zinc/94/93/39/1048949339.db2.gz MSLMQOWLNRURJO-UHFFFAOYSA-N 1 0 318.505 4.362 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCSc2ccccc2C1 ZINC001203664539 1048952695 /nfs/dbraw/zinc/95/26/95/1048952695.db2.gz JNKVUMSGYXJEAG-UHFFFAOYSA-N 1 0 305.830 4.154 20 10 DICDRO CC[N@H+](CCc1ccc(OC)cc1)Cc1cc(Cl)ccc1O ZINC001203664476 1048953048 /nfs/dbraw/zinc/95/30/48/1048953048.db2.gz GMJYLTLIWVSAGJ-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCc3ccccc32)cc1 ZINC001177855083 1048954124 /nfs/dbraw/zinc/95/41/24/1048954124.db2.gz KKMSGGRBJGEPQP-VOFKWLDRSA-N 1 0 306.453 4.085 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001203664219 1048954539 /nfs/dbraw/zinc/95/45/39/1048954539.db2.gz RFQGFAFUMNIISM-ZDUSSCGKSA-N 1 0 305.780 4.174 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1cccc(Cl)c1[O-] ZINC000854227461 1048954779 /nfs/dbraw/zinc/95/47/79/1048954779.db2.gz STBIKAFVSJVOOD-IRXDYDNUSA-N 1 0 316.832 4.356 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H](c1cccnc1)C(C)C ZINC001177943421 1048965976 /nfs/dbraw/zinc/96/59/76/1048965976.db2.gz QXZDERAIIOVKLE-IBGZPJMESA-N 1 0 321.468 4.411 20 10 DICDRO CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177971925 1048967220 /nfs/dbraw/zinc/96/72/20/1048967220.db2.gz AODLUZQAFCDPRG-SJLPKXTDSA-N 1 0 305.487 4.166 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCc3c2cccc3F)cc1 ZINC001203706985 1048971347 /nfs/dbraw/zinc/97/13/47/1048971347.db2.gz WJBPSDPTMYZLJL-FBQMEGEOSA-N 1 0 310.416 4.182 20 10 DICDRO CC[C@@H]1C[C@H](C[N@H+](Cc2ccccc2O)C2CCCC2)CCO1 ZINC000780758445 1048990991 /nfs/dbraw/zinc/99/09/91/1048990991.db2.gz RVVVWIPNLPGNQJ-VQIMIIECSA-N 1 0 317.473 4.342 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]CC2(C)COC2)c(O)c(C(C)(C)C)c1 ZINC000112711936 1048995333 /nfs/dbraw/zinc/99/53/33/1048995333.db2.gz RBOGVXZRNDKQHW-UHFFFAOYSA-N 1 0 319.489 4.113 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(OC(C)C)cc1)c1ccccc1O ZINC000775486213 1049004434 /nfs/dbraw/zinc/00/44/34/1049004434.db2.gz CLFFGMDCOUQRBM-IBGZPJMESA-N 1 0 313.441 4.463 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)cc1C ZINC000776775751 1049008805 /nfs/dbraw/zinc/00/88/05/1049008805.db2.gz KYTMAQWOLWVPDV-UHFFFAOYSA-N 1 0 309.331 4.058 20 10 DICDRO Cc1ncc(C[N@H+](Cc2ccccc2O)C2CCCCC2)s1 ZINC000112980001 1049011524 /nfs/dbraw/zinc/01/15/24/1049011524.db2.gz LPSDCMPEKFSUOW-UHFFFAOYSA-N 1 0 316.470 4.492 20 10 DICDRO Oc1ccc(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)cc1O ZINC001203875316 1049021735 /nfs/dbraw/zinc/02/17/35/1049021735.db2.gz LHDZUOSQPXLNFQ-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](OC)c1ccccc1)c1cc(Cl)ccc1O ZINC000775493878 1049025731 /nfs/dbraw/zinc/02/57/31/1049025731.db2.gz VYLIAEZCUZAJLJ-FUHWJXTLSA-N 1 0 319.832 4.474 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc3ncsc3c2)cc1C ZINC000776806638 1049026195 /nfs/dbraw/zinc/02/61/95/1049026195.db2.gz CZWGZVGAUDPUKK-ZDUSSCGKSA-N 1 0 312.438 4.464 20 10 DICDRO CC[C@H]([NH2+]CCCCOc1ccc(F)cc1)c1ccccc1O ZINC000775493376 1049027600 /nfs/dbraw/zinc/02/76/00/1049027600.db2.gz ZEMPDOMPPJZVQE-SFHVURJKSA-N 1 0 317.404 4.431 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc2ccccc2n1)c1ccccc1O ZINC000775495851 1049027693 /nfs/dbraw/zinc/02/76/93/1049027693.db2.gz DGPILLZHSBUSOX-SFHVURJKSA-N 1 0 306.409 4.224 20 10 DICDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000775496593 1049031238 /nfs/dbraw/zinc/03/12/38/1049031238.db2.gz JVVVETUZTCMUBI-CYBMUJFWSA-N 1 0 314.395 4.280 20 10 DICDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000775497846 1049031279 /nfs/dbraw/zinc/03/12/79/1049031279.db2.gz WMKHFWACKGOJSS-NSHDSACASA-N 1 0 306.347 4.102 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)ccc1OC ZINC001178448720 1049033118 /nfs/dbraw/zinc/03/31/18/1049033118.db2.gz ACUUITIEVSMLTA-HDMKZQKVSA-N 1 0 305.462 4.146 20 10 DICDRO COc1cccc([C@@H]2CCC[N@H+](Cc3ccc(N(C)C)cc3)C2)c1 ZINC001203937154 1049034564 /nfs/dbraw/zinc/03/45/64/1049034564.db2.gz NOQNKHBMDRAHPA-LJQANCHMSA-N 1 0 324.468 4.141 20 10 DICDRO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)cc1 ZINC001203934377 1049034891 /nfs/dbraw/zinc/03/48/91/1049034891.db2.gz SUBYJYXEWZDXCY-NRFANRHFSA-N 1 0 324.468 4.488 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC001203936312 1049035195 /nfs/dbraw/zinc/03/51/95/1049035195.db2.gz DHCHDAYIEDAPIZ-UHFFFAOYSA-N 1 0 322.374 4.403 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)CCc2cccc(Cl)c2)cc1 ZINC001203934031 1049035873 /nfs/dbraw/zinc/03/58/73/1049035873.db2.gz KFIHXXMSKFUQHI-UHFFFAOYSA-N 1 0 302.849 4.081 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC001203939838 1049035897 /nfs/dbraw/zinc/03/58/97/1049035897.db2.gz WRVNCWHOEFVLDO-HNNXBMFYSA-N 1 0 314.395 4.307 20 10 DICDRO Cc1ccccc1OC1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC001203930472 1049035984 /nfs/dbraw/zinc/03/59/84/1049035984.db2.gz UXTFMXVAZCYRMH-UHFFFAOYSA-N 1 0 324.468 4.104 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)cc1 ZINC001203939615 1049036013 /nfs/dbraw/zinc/03/60/13/1049036013.db2.gz RPMURBUKJOLJHB-NRFANRHFSA-N 1 0 324.468 4.106 20 10 DICDRO CCc1nc(C[NH2+][C@H](CC)c2cc(Cl)ccc2O)cs1 ZINC000775500913 1049040388 /nfs/dbraw/zinc/04/03/88/1049040388.db2.gz AVRUXXRFDYMKDD-CYBMUJFWSA-N 1 0 310.850 4.305 20 10 DICDRO CC[C@@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1ccccc1O ZINC000775500676 1049043014 /nfs/dbraw/zinc/04/30/14/1049043014.db2.gz WTUBOQTXSCLUPZ-QGZVFWFLSA-N 1 0 312.388 4.296 20 10 DICDRO CN(C)c1ccc(C[NH2+]C[C@H](c2ccccc2)C(F)(F)F)cc1 ZINC000776817368 1049043451 /nfs/dbraw/zinc/04/34/51/1049043451.db2.gz VEYYEHMMVSOSQT-QGZVFWFLSA-N 1 0 322.374 4.188 20 10 DICDRO COc1ccc(C[NH2+]C[C@H](c2ccccc2)C(F)(F)F)cc1C ZINC000776816755 1049044170 /nfs/dbraw/zinc/04/41/70/1049044170.db2.gz RAZWCDVSSRXJCM-MRXNPFEDSA-N 1 0 323.358 4.439 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000775506528 1049046974 /nfs/dbraw/zinc/04/69/74/1049046974.db2.gz AJMPYEOSNIZDAL-ZDUSSCGKSA-N 1 0 302.384 4.272 20 10 DICDRO CC[C@H]([NH2+]CCc1c[nH]c2ccc(OC)cc12)c1ccccc1O ZINC000775504059 1049048151 /nfs/dbraw/zinc/04/81/51/1049048151.db2.gz RLMGUNLHULMJKE-SFHVURJKSA-N 1 0 324.424 4.166 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(C)nc1)c1cc(Cl)ccc1O ZINC000775503428 1049048360 /nfs/dbraw/zinc/04/83/60/1049048360.db2.gz IKBKAEBSQNTSBP-INIZCTEOSA-N 1 0 304.821 4.032 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]2OCC[C@H]21)c1cc(Cl)ccc1O ZINC000775513536 1049050436 /nfs/dbraw/zinc/05/04/36/1049050436.db2.gz LACQCIHVUZCOFU-FAYQHZLMSA-N 1 0 309.837 4.044 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)c1cc(Cl)ccc1O ZINC000775509624 1049052623 /nfs/dbraw/zinc/05/26/23/1049052623.db2.gz SYCVNZQQPURUOT-GUDXXQAFSA-N 1 0 323.864 4.290 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1SC)c1ccccc1O ZINC000775512495 1049057321 /nfs/dbraw/zinc/05/73/21/1049057321.db2.gz LHPIKUSYGSRSRL-OAHLLOKOSA-N 1 0 305.418 4.494 20 10 DICDRO Cc1cc(C[NH2+][C@H]2CC[C@@H](C)SC2)c(C)n1-c1ccccc1 ZINC001203357250 1049073781 /nfs/dbraw/zinc/07/37/81/1049073781.db2.gz INOQBWIZUQLKMR-QAPCUYQASA-N 1 0 314.498 4.468 20 10 DICDRO Cc1cc(C[NH2+][C@H]2CC[C@H](C)SC2)c(C)n1-c1ccccc1 ZINC001203357251 1049074083 /nfs/dbraw/zinc/07/40/83/1049074083.db2.gz INOQBWIZUQLKMR-YJBOKZPZSA-N 1 0 314.498 4.468 20 10 DICDRO CC[C@H]([NH2+]Cc1ccnc(SC)c1)c1cc(Cl)ccc1O ZINC000775520135 1049076661 /nfs/dbraw/zinc/07/66/61/1049076661.db2.gz QALLXEXFQGEQRC-AWEZNQCLSA-N 1 0 322.861 4.403 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)cc1 ZINC000773764603 1049076609 /nfs/dbraw/zinc/07/66/09/1049076609.db2.gz ABSLBGZOMCNMCR-HXUWFJFHSA-N 1 0 309.457 4.183 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000775521806 1049077816 /nfs/dbraw/zinc/07/78/16/1049077816.db2.gz BCGNBGSHQCYHNW-ZFWWWQNUSA-N 1 0 309.837 4.188 20 10 DICDRO COc1cc(C[NH2+][C@H](C)C2CCCC2)c(O)c(C(C)(C)C)c1 ZINC001178713145 1049079536 /nfs/dbraw/zinc/07/95/36/1049079536.db2.gz JSZMDZGGNOESAH-CYBMUJFWSA-N 1 0 305.462 4.367 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)COC2)c1cc(Cl)ccc1O ZINC000775522648 1049081399 /nfs/dbraw/zinc/08/13/99/1049081399.db2.gz WMAOZRGUEIFRTO-QGZVFWFLSA-N 1 0 317.816 4.317 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](OC)c1ccccc1Cl)c1ccccc1O ZINC000775522544 1049081847 /nfs/dbraw/zinc/08/18/47/1049081847.db2.gz SZDHPZHKAAUJTG-AEFFLSMTSA-N 1 0 319.832 4.474 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCCc2ccsc2)cc1F ZINC001204090395 1049083694 /nfs/dbraw/zinc/08/36/94/1049083694.db2.gz WQPDHBMASHGQBI-UHFFFAOYSA-N 1 0 320.477 4.456 20 10 DICDRO CC[C@H]([NH2+]CC1(c2ccc(F)cc2F)CC1)c1ccccc1O ZINC000775526676 1049095963 /nfs/dbraw/zinc/09/59/63/1049095963.db2.gz SUKMLGQVLOEMCY-KRWDZBQOSA-N 1 0 317.379 4.443 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)CCCc2ccc(F)c(F)c2)cc1 ZINC001204145949 1049097142 /nfs/dbraw/zinc/09/71/42/1049097142.db2.gz PQWCEVXJKQTLCN-UHFFFAOYSA-N 1 0 318.411 4.095 20 10 DICDRO Cc1cc(NC/C=C/c2ccc(N(C)C)cc2)ccc1C[NH+](C)C ZINC001178927438 1049105960 /nfs/dbraw/zinc/10/59/60/1049105960.db2.gz ZWNWBMTULPYHKH-VOTSOKGWSA-N 1 0 323.484 4.248 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@H]2CCC[C@@H]2C(C)(C)C)cc1F ZINC001178931998 1049108250 /nfs/dbraw/zinc/10/82/50/1049108250.db2.gz VDJHGHMRXYDPFT-BBRMVZONSA-N 1 0 310.432 4.335 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCC[C@H]2C(C)(C)C)cc1F ZINC001178932000 1049108359 /nfs/dbraw/zinc/10/83/59/1049108359.db2.gz VDJHGHMRXYDPFT-CZUORRHYSA-N 1 0 310.432 4.335 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(F)cc1F ZINC001204213560 1049112235 /nfs/dbraw/zinc/11/22/35/1049112235.db2.gz QRTVXAXGXGFXRN-UHFFFAOYSA-N 1 0 304.384 4.053 20 10 DICDRO CCCOc1ccc(C[NH2+]C2CCC(COC)CC2)cc1C ZINC001178945778 1049112434 /nfs/dbraw/zinc/11/24/34/1049112434.db2.gz ZBRZCUQRZABNSD-UHFFFAOYSA-N 1 0 305.462 4.079 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)ccc1F ZINC001178972413 1049115932 /nfs/dbraw/zinc/11/59/32/1049115932.db2.gz TVCUCNBAMQQEKV-INIZCTEOSA-N 1 0 314.448 4.229 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)c2ccccc21 ZINC001204233154 1049115966 /nfs/dbraw/zinc/11/59/66/1049115966.db2.gz OLGVYMBEBPWBLG-RTBURBONSA-N 1 0 318.411 4.178 20 10 DICDRO CC[C@@H](C[NH2+]Cc1ccc2c(c1)CCCO2)CC(F)(F)F ZINC001178966677 1049116126 /nfs/dbraw/zinc/11/61/26/1049116126.db2.gz KJMDTAVZOGREIP-GFCCVEGCSA-N 1 0 301.352 4.080 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1cccc2cc[nH]c21 ZINC001178972431 1049116155 /nfs/dbraw/zinc/11/61/55/1049116155.db2.gz UECCUPJRUTYXNF-MRXNPFEDSA-N 1 0 321.468 4.263 20 10 DICDRO CC[C@H](C[NH2+]Cc1ccc2c(c1)CCCO2)CC(F)(F)F ZINC001178966678 1049116285 /nfs/dbraw/zinc/11/62/85/1049116285.db2.gz KJMDTAVZOGREIP-LBPRGKRZSA-N 1 0 301.352 4.080 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)c3ccccc23)cn1 ZINC001204240197 1049118266 /nfs/dbraw/zinc/11/82/66/1049118266.db2.gz LDCOBXWMQJBIQO-UHFFFAOYSA-N 1 0 319.452 4.241 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1C[C@@]1(F)c1ccccc1 ZINC001178998381 1049120783 /nfs/dbraw/zinc/12/07/83/1049120783.db2.gz LPXCBEJDFKLPJR-VQTJNVASSA-N 1 0 308.400 4.214 20 10 DICDRO C[C@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1cc(Cl)ccc1O ZINC000857082562 1049127150 /nfs/dbraw/zinc/12/71/50/1049127150.db2.gz OMRWDRQHJIVUST-IUCAKERBSA-N 1 0 308.636 4.280 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c1 ZINC000857080059 1049125370 /nfs/dbraw/zinc/12/53/70/1049125370.db2.gz CKXXGFDIPPFSOS-BONVTDFDSA-N 1 0 319.351 4.017 20 10 DICDRO C[N@H+](Cc1ccc(O)cc1O)Cc1ccc(Cl)cc1Cl ZINC001204272278 1049125598 /nfs/dbraw/zinc/12/55/98/1049125598.db2.gz LUYJNQXAYKNXLC-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO C[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(N2CCCCC2)cc1 ZINC000857081505 1049126138 /nfs/dbraw/zinc/12/61/38/1049126138.db2.gz POIRJHMYNQUKTR-GOEBONIOSA-N 1 0 308.416 4.373 20 10 DICDRO C[N@H+](Cc1ccc(O)cc1O)Cc1cccc(Cl)c1Cl ZINC001204278675 1049126216 /nfs/dbraw/zinc/12/62/16/1049126216.db2.gz HVEVATZLKUDLJS-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO FC(F)(F)C1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204323198 1049142770 /nfs/dbraw/zinc/14/27/70/1049142770.db2.gz FSEZGGXEDKMQNM-UHFFFAOYSA-N 1 0 312.379 4.061 20 10 DICDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(N3CCCC3)cc2)cn1 ZINC001204328324 1049142839 /nfs/dbraw/zinc/14/28/39/1049142839.db2.gz HDASZFOLRWSUSM-OAQYLSRUSA-N 1 0 321.468 4.327 20 10 DICDRO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204325631 1049143049 /nfs/dbraw/zinc/14/30/49/1049143049.db2.gz RRAWKHRLYQTETK-KRWDZBQOSA-N 1 0 306.453 4.406 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](OC)C2CCCC2)cc1C ZINC001179243868 1049147101 /nfs/dbraw/zinc/14/71/01/1049147101.db2.gz UXPVHDXHNWAFLS-IBGZPJMESA-N 1 0 305.462 4.079 20 10 DICDRO CC[C@H]([NH2+]C[C@]1(C)CCO[C@H]1C1CC1)c1cc(Cl)ccc1O ZINC000775553397 1049149246 /nfs/dbraw/zinc/14/92/46/1049149246.db2.gz BKILLFFXJOXXIF-SZMVWBNQSA-N 1 0 323.864 4.292 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)cc1 ZINC001179348151 1049154084 /nfs/dbraw/zinc/15/40/84/1049154084.db2.gz POVHKSBEOPFTPO-YLAKUSLOSA-N 1 0 318.505 4.215 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C(C)(C)c2cccc(F)c2)cc1 ZINC000773813464 1049156513 /nfs/dbraw/zinc/15/65/13/1049156513.db2.gz UFHWSVNPIKMQHA-UHFFFAOYSA-N 1 0 300.421 4.307 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+](Cc1cccc(O)c1)CC1CC1 ZINC001204431183 1049162308 /nfs/dbraw/zinc/16/23/08/1049162308.db2.gz NWIVMEVDRVDZEJ-UHFFFAOYSA-N 1 0 324.468 4.179 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C2CCC2)[C@@H]2CCOC2)cc1C ZINC001179390615 1049162842 /nfs/dbraw/zinc/16/28/42/1049162842.db2.gz KVNSFPSWKPMGRC-QUCCMNQESA-N 1 0 317.473 4.079 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2ccc(F)cc2F)cc1 ZINC000773813843 1049170646 /nfs/dbraw/zinc/17/06/46/1049170646.db2.gz WLDOCHRQGKBVLD-CYBMUJFWSA-N 1 0 304.384 4.272 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2ccc(F)c(F)c2n1)c1ccccc1O ZINC001179489963 1049172738 /nfs/dbraw/zinc/17/27/38/1049172738.db2.gz YJNGERFMPJPRQD-LLVKDONJSA-N 1 0 314.335 4.069 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC001204543431 1049187323 /nfs/dbraw/zinc/18/73/23/1049187323.db2.gz QMISVHIBLJUJIX-DYESRHJHSA-N 1 0 308.469 4.439 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)cc1 ZINC000776953539 1049189642 /nfs/dbraw/zinc/18/96/42/1049189642.db2.gz NYNAUCXFQLUDQS-UYAOXDASSA-N 1 0 318.505 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DICDRO Cc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c1O ZINC000775696490 1049630156 /nfs/dbraw/zinc/63/01/56/1049630156.db2.gz MQFVTLAZGKZXAE-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@H]1CCc2ccccc21 ZINC001206048030 1049639534 /nfs/dbraw/zinc/63/95/34/1049639534.db2.gz OGOYBYIJXRBCKK-GOSISDBHSA-N 1 0 308.469 4.271 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC001182423717 1049642818 /nfs/dbraw/zinc/64/28/18/1049642818.db2.gz IGSRLQWFWBAYGC-RYGJVYDSSA-N 1 0 300.490 4.160 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC001182423716 1049642919 /nfs/dbraw/zinc/64/29/19/1049642919.db2.gz IGSRLQWFWBAYGC-CWFSZBLJSA-N 1 0 300.490 4.160 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CC(C)(C)C[C@H]1C ZINC001182423745 1049643019 /nfs/dbraw/zinc/64/30/19/1049643019.db2.gz INPVTMMSLWFRGR-GJYPPUQNSA-N 1 0 302.506 4.406 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCCN1C1CC1)c1ccc2ccccc2c1O ZINC000774380801 1049653728 /nfs/dbraw/zinc/65/37/28/1049653728.db2.gz UJISLVFGITVKBW-QAPCUYQASA-N 1 0 324.468 4.213 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@H](c3ccc(F)cc3)C3CC3)ccc21 ZINC000774407597 1049660047 /nfs/dbraw/zinc/66/00/47/1049660047.db2.gz XFERIRPECJNPMJ-NRFANRHFSA-N 1 0 324.443 4.449 20 10 DICDRO Cc1cc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)ccc1N(C)C ZINC001196458086 1049662618 /nfs/dbraw/zinc/66/26/18/1049662618.db2.gz IDAVAWLASGHUDD-NRFANRHFSA-N 1 0 308.469 4.476 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc(C)cc1)c1cc(Cl)ccc1O ZINC000774485620 1049675179 /nfs/dbraw/zinc/67/51/79/1049675179.db2.gz QDOVNCPJKLMTOS-AEFFLSMTSA-N 1 0 319.832 4.128 20 10 DICDRO CCC(CC)[N@@H+](Cc1cc(OC)c(OC)cc1O)CC(C)C ZINC000775730388 1049678444 /nfs/dbraw/zinc/67/84/44/1049678444.db2.gz AMUIRMZZZRZBKW-UHFFFAOYSA-N 1 0 309.450 4.056 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1ccc2c(c1)OCO2)c1ccc(C)cc1O ZINC000794789935 1049694177 /nfs/dbraw/zinc/69/41/77/1049694177.db2.gz BBPINIJVQXYCBO-CJNGLKHVSA-N 1 0 313.397 4.231 20 10 DICDRO 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PHTIIVDJMXKWIU-KRWDZBQOSA-N 1 0 315.457 4.229 20 10 DICDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000760647745 1049904935 /nfs/dbraw/zinc/90/49/35/1049904935.db2.gz CDSQTXVUZUEROW-HNNXBMFYSA-N 1 0 314.395 4.498 20 10 DICDRO CCOCCC1(C[NH2+][C@H](CC)c2ccccc2O)CCCC1 ZINC000156355636 1049919724 /nfs/dbraw/zinc/91/97/24/1049919724.db2.gz PZNDPLFTIVCMED-QGZVFWFLSA-N 1 0 305.462 4.420 20 10 DICDRO C[C@H](CCCC(C)(C)O)CC[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001207683284 1049927363 /nfs/dbraw/zinc/92/73/63/1049927363.db2.gz OZLNZIVMZUXFLY-QGZVFWFLSA-N 1 0 320.521 4.152 20 10 DICDRO CCCC[C@H](C)[C@H](C)[NH2+]C[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC001207748663 1049934029 /nfs/dbraw/zinc/93/40/29/1049934029.db2.gz NOGRNQYZDXXTMI-ABSDTBQOSA-N 1 0 319.537 4.160 20 10 DICDRO CCc1nc(CC[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)cs1 ZINC000157099394 1050044137 /nfs/dbraw/zinc/04/41/37/1050044137.db2.gz PCPZWHXXELJMEG-KRWDZBQOSA-N 1 0 317.502 4.055 20 10 DICDRO Cc1cccc2c(C[N@@H+](C)Cc3ccc(N(C)C)cc3)c[nH]c21 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LORUPLXLSUPXFS-GOSISDBHSA-N 1 0 316.395 4.325 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@H]2COCC[C@H]21 ZINC000770285133 1050147659 /nfs/dbraw/zinc/14/76/59/1050147659.db2.gz AOVPLZTXUGYRMZ-AZUAARDMSA-N 1 0 323.436 4.060 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)Oc1ccccc1 ZINC000733797902 1050156707 /nfs/dbraw/zinc/15/67/07/1050156707.db2.gz DELMOAQPKTXTGM-SFHVURJKSA-N 1 0 324.468 4.234 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCC12CCOCC2)c1cc(Cl)ccc1O ZINC000282652428 1050171213 /nfs/dbraw/zinc/17/12/13/1050171213.db2.gz ICQLYUUNTWNFCB-MLGOLLRUSA-N 1 0 309.837 4.046 20 10 DICDRO CC(C)[C@H](CCO)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766194203 1050186358 /nfs/dbraw/zinc/18/63/58/1050186358.db2.gz UANWQMBBRSWQLP-PXNSSMCTSA-N 1 0 318.505 4.125 20 10 DICDRO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000378895294 1050190508 /nfs/dbraw/zinc/19/05/08/1050190508.db2.gz NCEOQBLEUYDDFF-MRXNPFEDSA-N 1 0 312.457 4.391 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2OC)cc1C ZINC000378876997 1050191910 /nfs/dbraw/zinc/19/19/10/1050191910.db2.gz ATZSGKXDEPEKGA-CYBMUJFWSA-N 1 0 303.377 4.002 20 10 DICDRO CO[C@@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000770744683 1050192926 /nfs/dbraw/zinc/19/29/26/1050192926.db2.gz BDISGDHAEHBPCB-PIGZYNQJSA-N 1 0 323.795 4.051 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000824468397 1050214781 /nfs/dbraw/zinc/21/47/81/1050214781.db2.gz HLFIEQYHJNMJIS-QGZVFWFLSA-N 1 0 303.352 4.146 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000824468396 1050216010 /nfs/dbraw/zinc/21/60/10/1050216010.db2.gz HLFIEQYHJNMJIS-KRWDZBQOSA-N 1 0 303.352 4.146 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c(O)c1 ZINC000824548338 1050224585 /nfs/dbraw/zinc/22/45/85/1050224585.db2.gz GBABIZJUZGQXQU-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO Cc1cc(O)c(C[N@@H+](Cc2ccccn2)C(C)C)cc1Cl ZINC000824602036 1050227757 /nfs/dbraw/zinc/22/77/57/1050227757.db2.gz PXYOSQYELIBKCD-UHFFFAOYSA-N 1 0 304.821 4.160 20 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/nfs/dbraw/zinc/27/26/40/1050272640.db2.gz JPIZKANOCYOIPX-UHFFFAOYSA-N 1 0 311.404 4.005 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825127649 1050278700 /nfs/dbraw/zinc/27/87/00/1050278700.db2.gz ZCYVXHWPMXLCRZ-NSHDSACASA-N 1 0 323.795 4.353 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CSCc3ccccc32)cc1Cl ZINC000825151412 1050280944 /nfs/dbraw/zinc/28/09/44/1050280944.db2.gz XQOHTKXANDIAAQ-MRXNPFEDSA-N 1 0 319.857 4.432 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@]3(CCSC3)C2)ccc2ccccc21 ZINC000825215261 1050285249 /nfs/dbraw/zinc/28/52/49/1050285249.db2.gz JPNWZNNNSASWHD-IBGZPJMESA-N 1 0 313.466 4.265 20 10 DICDRO CC[C@](C)([NH2+]Cc1cc(Cl)c(C)cc1O)c1nccs1 ZINC000825291006 1050290350 /nfs/dbraw/zinc/29/03/50/1050290350.db2.gz BVMMMKYJZXOXMN-HNNXBMFYSA-N 1 0 310.850 4.226 20 10 DICDRO Cc1csc(C(C)(C)[NH2+]Cc2cc(Cl)c(C)cc2O)n1 ZINC000825277474 1050291212 /nfs/dbraw/zinc/29/12/12/1050291212.db2.gz ARRDEXRLESYSKZ-UHFFFAOYSA-N 1 0 310.850 4.144 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CSc3ccccc32)cc1Cl ZINC000825292035 1050291270 /nfs/dbraw/zinc/29/12/70/1050291270.db2.gz STWUBIZOOMUDEA-CQSZACIVSA-N 1 0 305.830 4.291 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cnc(C(C)(C)C)s2)cc1 ZINC000771935481 1050300562 /nfs/dbraw/zinc/30/05/62/1050300562.db2.gz VQSZOFNGMXVUAN-UHFFFAOYSA-N 1 0 317.502 4.139 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1Cl ZINC000825391567 1050302878 /nfs/dbraw/zinc/30/28/78/1050302878.db2.gz YEMGBWHQXOHOEN-CZUORRHYSA-N 1 0 311.853 4.037 20 10 DICDRO COCC[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1ccc(C)o1 ZINC000825447288 1050306882 /nfs/dbraw/zinc/30/68/82/1050306882.db2.gz SNUWNSQRSSNHGT-HNNXBMFYSA-N 1 0 323.820 4.123 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)C[C@H](C)c2nccs2)cc1Cl ZINC000825500865 1050309031 /nfs/dbraw/zinc/30/90/31/1050309031.db2.gz JBHGBEJULMWQCT-NSHDSACASA-N 1 0 310.850 4.046 20 10 DICDRO C[C@]1([NH2+]Cc2cc(Cl)ccc2O)CCCc2ccccc21 ZINC000734843497 1050324972 /nfs/dbraw/zinc/32/49/72/1050324972.db2.gz LXWSHXASDIZTDH-SFHVURJKSA-N 1 0 301.817 4.387 20 10 DICDRO CC[C@H](Cc1ccc(Cl)cc1)[NH2+]Cc1cc(C)ccc1O ZINC000734850132 1050326966 /nfs/dbraw/zinc/32/69/66/1050326966.db2.gz QMOIUJOSOPFDKL-QGZVFWFLSA-N 1 0 303.833 4.465 20 10 DICDRO COc1ccc(N2CCC[N@H+](C[C@@H](C)c3ccccc3)CC2)cc1 ZINC000735078072 1050343982 /nfs/dbraw/zinc/34/39/82/1050343982.db2.gz DNBDLOHSAZHWRO-GOSISDBHSA-N 1 0 324.468 4.011 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cc(Cl)ccc2C1)c1ccccc1O ZINC001171099500 1050351378 /nfs/dbraw/zinc/35/13/78/1050351378.db2.gz JGNGOIBKRDJKGA-MLGOLLRUSA-N 1 0 301.817 4.254 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccnc(SC)c1)c1ccc(N(C)C)cc1 ZINC000772467604 1050363258 /nfs/dbraw/zinc/36/32/58/1050363258.db2.gz ANZHVCOXVXXLCZ-QGZVFWFLSA-N 1 0 315.486 4.110 20 10 DICDRO c1ccc2c(c1)CC(C[NH2+]Cc1ccc(N3CCCCC3)cc1)C2 ZINC000735323993 1050371152 /nfs/dbraw/zinc/37/11/52/1050371152.db2.gz KSOMLJHACGTNOH-UHFFFAOYSA-N 1 0 320.480 4.182 20 10 DICDRO Cc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000766213310 1050393826 /nfs/dbraw/zinc/39/38/26/1050393826.db2.gz WYXZMWLBAZFNHD-GDBMZVCRSA-N 1 0 300.446 4.326 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)ccc1N1CCCCC1 ZINC000844469026 1050435238 /nfs/dbraw/zinc/43/52/38/1050435238.db2.gz UAINWVAHSVYURN-GOSISDBHSA-N 1 0 320.427 4.216 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccncc1OC)c1cc(Cl)ccc1O ZINC000783328390 1050485394 /nfs/dbraw/zinc/48/53/94/1050485394.db2.gz AHWTWXBYEXWXDC-NHYWBVRUSA-N 1 0 320.820 4.251 20 10 DICDRO C[NH2+]Cc1ccc(Nc2ccc(Cc3ccc(N)cc3)cc2)cc1 ZINC001211131093 1050490233 /nfs/dbraw/zinc/49/02/33/1050490233.db2.gz LTFTZZRMJWFQTB-UHFFFAOYSA-N 1 0 317.436 4.323 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2cccc3cc[nH]c32)c1O ZINC000786579829 1050498227 /nfs/dbraw/zinc/49/82/27/1050498227.db2.gz TYXCWHAIAGPWGS-UHFFFAOYSA-N 1 0 300.789 4.125 20 10 DICDRO CC(C)CCC[C@@H](C)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001170063882 1050515049 /nfs/dbraw/zinc/51/50/49/1050515049.db2.gz IRYBHXYVDXXJCC-QGZVFWFLSA-N 1 0 318.505 4.161 20 10 DICDRO CCS[C@H]1CCCC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000738217892 1050523820 /nfs/dbraw/zinc/52/38/20/1050523820.db2.gz CHNGFTSGJJAFGU-HNNXBMFYSA-N 1 0 316.470 4.048 20 10 DICDRO Cn1c[nH+]cc1Nc1ccccc1C(=O)c1ccc(Cl)cc1 ZINC001211251229 1050527354 /nfs/dbraw/zinc/52/73/54/1050527354.db2.gz WCVSFWQXIDWIFU-UHFFFAOYSA-N 1 0 311.772 4.048 20 10 DICDRO Cc1nc(F)ccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000787090536 1050550333 /nfs/dbraw/zinc/55/03/33/1050550333.db2.gz DQIHOMIZTUURGO-UHFFFAOYSA-N 1 0 315.436 4.006 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCC1 ZINC000766237147 1050554774 /nfs/dbraw/zinc/55/47/74/1050554774.db2.gz JETPTTPKOZOVMU-UKRRQHHQSA-N 1 0 324.415 4.035 20 10 DICDRO CCC[C@@H](C)[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766238710 1050561264 /nfs/dbraw/zinc/56/12/64/1050561264.db2.gz XRUJCDVNUKSUGZ-ZIAGYGMSSA-N 1 0 312.404 4.035 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCc3c(Cl)cccc3C2)cc1C ZINC000739863614 1050590215 /nfs/dbraw/zinc/59/02/15/1050590215.db2.gz QLGVXMJLJSAOSL-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCc1cc2ccccc2o1 ZINC000740011432 1050595372 /nfs/dbraw/zinc/59/53/72/1050595372.db2.gz NSDDBNNIKSYYLQ-UHFFFAOYSA-N 1 0 301.773 4.124 20 10 DICDRO CCOCc1cc(C[NH2+]C2C[C@H](C)C[C@@H](C)C2)ccc1OC ZINC000740017903 1050598031 /nfs/dbraw/zinc/59/80/31/1050598031.db2.gz FSNOJKSENFQPND-HUUCEWRRSA-N 1 0 305.462 4.146 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCS1)c1ccc(N2CCCCC2)cc1 ZINC000168653791 1050619115 /nfs/dbraw/zinc/61/91/15/1050619115.db2.gz QNZCWFDGUHISCU-MAUKXSAKSA-N 1 0 304.503 4.223 20 10 DICDRO CC[C@@H](Cc1cccs1)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000845970853 1050640269 /nfs/dbraw/zinc/64/02/69/1050640269.db2.gz DHKUABNBDCQBER-OLZOCXBDSA-N 1 0 305.443 4.134 20 10 DICDRO CCOc1ccc(C[NH2+]C2(c3ccccc3C)CCC2)c(O)c1 ZINC000845994483 1050647860 /nfs/dbraw/zinc/64/78/60/1050647860.db2.gz DVEJHTSRYMYQIV-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@H](SC)C2)cc1 ZINC000227378486 1050665138 /nfs/dbraw/zinc/66/51/38/1050665138.db2.gz USCVCQVTWDQJEU-AEFFLSMTSA-N 1 0 306.519 4.297 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000846116135 1050666067 /nfs/dbraw/zinc/66/60/67/1050666067.db2.gz FQRQIEUPHWBVJB-SFHVURJKSA-N 1 0 315.363 4.290 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCCC3(CCOCC3)C2)cc1C(C)C ZINC000742158715 1050672045 /nfs/dbraw/zinc/67/20/45/1050672045.db2.gz HBPIYYNDKAMXFD-UHFFFAOYSA-N 1 0 317.473 4.217 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c1 ZINC000846108024 1050672049 /nfs/dbraw/zinc/67/20/49/1050672049.db2.gz BHQOAHBPLUGOEV-QWRGUYRKSA-N 1 0 318.244 4.025 20 10 DICDRO CCS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cccc(OC)c2O)C1 ZINC000846149879 1050672113 /nfs/dbraw/zinc/67/21/13/1050672113.db2.gz NMPOUNZOAALWSH-BFHYXJOUSA-N 1 0 309.475 4.116 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2cccc(OC)c2O)CCCC1 ZINC000846149564 1050672695 /nfs/dbraw/zinc/67/26/95/1050672695.db2.gz JMHKKXUZGXFIOB-OAHLLOKOSA-N 1 0 321.461 4.038 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CC(C)(C)c3ccccc32)c1O ZINC000846157739 1050674679 /nfs/dbraw/zinc/67/46/79/1050674679.db2.gz WNSZGURFUIAILI-CXAGYDPISA-N 1 0 311.425 4.474 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC2(Cc3ccccc3)CC2)c1O ZINC000846157782 1050674710 /nfs/dbraw/zinc/67/47/10/1050674710.db2.gz XEZSTWOLNIBAEO-OAHLLOKOSA-N 1 0 311.425 4.074 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CC(C)(C)c3ccccc32)c1O ZINC000846157743 1050675266 /nfs/dbraw/zinc/67/52/66/1050675266.db2.gz WNSZGURFUIAILI-GUYCJALGSA-N 1 0 311.425 4.474 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCc3ccc(F)cc32)c1O ZINC000846167332 1050678186 /nfs/dbraw/zinc/67/81/86/1050678186.db2.gz IMZKQTQVKHUZIT-SJKOYZFVSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCc3ccc(F)cc32)c1O ZINC000846167328 1050678842 /nfs/dbraw/zinc/67/88/42/1050678842.db2.gz IMZKQTQVKHUZIT-PXAZEXFGSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(Cl)cc2F)c1O ZINC000846165837 1050678884 /nfs/dbraw/zinc/67/88/84/1050678884.db2.gz ZPJZYADNJGZORG-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc(OC)c2O)CCO1 ZINC000846163927 1050678932 /nfs/dbraw/zinc/67/89/32/1050678932.db2.gz SYRISSYLMHTFCH-JOQOYGCGSA-N 1 0 321.461 4.035 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCc3c(F)cccc32)c1O ZINC000846171769 1050679948 /nfs/dbraw/zinc/67/99/48/1050679948.db2.gz WDCRJWBHIIPAEN-SJCJKPOMSA-N 1 0 315.388 4.268 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C(C)(F)F)cc2)c1O ZINC000846171796 1050680733 /nfs/dbraw/zinc/68/07/33/1050680733.db2.gz WGTVWFKMDFMTHK-GFCCVEGCSA-N 1 0 321.367 4.363 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC2CC(c3ccccc3)C2)c1O ZINC000846168969 1050680842 /nfs/dbraw/zinc/68/08/42/1050680842.db2.gz WOWYOIAJOMSOLI-UQPPLGOBSA-N 1 0 311.425 4.245 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccc(OC)cc1 ZINC000846138585 1050681639 /nfs/dbraw/zinc/68/16/39/1050681639.db2.gz WLGHXOIJWITGDF-SUMWQHHRSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c1O ZINC000846138194 1050681815 /nfs/dbraw/zinc/68/18/15/1050681815.db2.gz UWPWBKYJLCZENK-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H](c2cccs2)C2CC2)c1O ZINC000846136974 1050682322 /nfs/dbraw/zinc/68/23/22/1050682322.db2.gz PBSCHSLQFXMDOQ-MEDUHNTESA-N 1 0 303.427 4.264 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2cc(C)sc2C)c1O ZINC000846135505 1050682643 /nfs/dbraw/zinc/68/26/43/1050682643.db2.gz DLTZUEYACPMKOJ-VXGBXAGGSA-N 1 0 305.443 4.491 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2c(F)cccc2Cl)c1O ZINC000846142857 1050683744 /nfs/dbraw/zinc/68/37/44/1050683744.db2.gz WPQJUCMNOOMMJM-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)c2ccc(F)cc2F)c1O ZINC000846145512 1050684109 /nfs/dbraw/zinc/68/41/09/1050684109.db2.gz LBADKYPHDZZWJE-VXGBXAGGSA-N 1 0 321.367 4.133 20 10 DICDRO CCS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846143973 1050684327 /nfs/dbraw/zinc/68/43/27/1050684327.db2.gz BSVNXBDKDXPEQV-XNRPHZJLSA-N 1 0 309.475 4.116 20 10 DICDRO CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846143971 1050684666 /nfs/dbraw/zinc/68/46/66/1050684666.db2.gz BSVNXBDKDXPEQV-IVMMDQJWSA-N 1 0 309.475 4.116 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](c2ncccc2C)C(C)C)c1O ZINC000846145169 1050685355 /nfs/dbraw/zinc/68/53/55/1050685355.db2.gz NDNLDHFVVHLTQI-PBHICJAKSA-N 1 0 314.429 4.152 20 10 DICDRO CC[C@H]([NH2+][C@@H](c1ccccc1F)[C@H](C)O)c1ccc(C)cc1O ZINC000846182409 1050688858 /nfs/dbraw/zinc/68/88/58/1050688858.db2.gz JOWFPCSUOYCTSM-SOVGHPHASA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@H]([NH2+][C@@H](C1CC1)C1CCOCC1)c1cc(Cl)ccc1O ZINC000846189888 1050690981 /nfs/dbraw/zinc/69/09/81/1050690981.db2.gz VQFFPDFIXGUSNB-WMZOPIPTSA-N 1 0 323.864 4.292 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)c(O)c1 ZINC000788500949 1050693066 /nfs/dbraw/zinc/69/30/66/1050693066.db2.gz FGNVUDGQJBAKLD-ZDUSSCGKSA-N 1 0 321.367 4.461 20 10 DICDRO C[C@H]([NH2+]CCC[C@@H]1CC1(Cl)Cl)c1cc(F)ccc1O ZINC000846215731 1050696220 /nfs/dbraw/zinc/69/62/20/1050696220.db2.gz OLPAUNPHYBRQLO-VHSXEESVSA-N 1 0 306.208 4.156 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c(O)c1 ZINC000846216536 1050696898 /nfs/dbraw/zinc/69/68/98/1050696898.db2.gz SQJBBNLZGCZNAY-NWDGAFQWSA-N 1 0 302.245 4.325 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCN(c3ccccc3)C2)cc1C ZINC000788531973 1050703185 /nfs/dbraw/zinc/70/31/85/1050703185.db2.gz JNLRCTCVBJMWGQ-GOSISDBHSA-N 1 0 324.468 4.015 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCN(c3ccccc3)C2)c(O)c1 ZINC000788527593 1050703636 /nfs/dbraw/zinc/70/36/36/1050703636.db2.gz WZLHNAYBDAZMLC-ZWKOTPCHSA-N 1 0 324.468 4.186 20 10 DICDRO COc1ccc(C[NH2+]C[C@H]2CCCN(c3ccccc3)C2)cc1C ZINC000788532725 1050706550 /nfs/dbraw/zinc/70/65/50/1050706550.db2.gz SZGWUOQDAZJMIH-LJQANCHMSA-N 1 0 324.468 4.010 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c(O)c1 ZINC000788585419 1050711459 /nfs/dbraw/zinc/71/14/59/1050711459.db2.gz VABQATAXWBQAPE-INIZCTEOSA-N 1 0 324.468 4.242 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2O)C12CCC2 ZINC000788615103 1050716326 /nfs/dbraw/zinc/71/63/26/1050716326.db2.gz UZRLHXILQICNQR-USXIJHARSA-N 1 0 303.446 4.007 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)c(O)c1 ZINC000788687555 1050725522 /nfs/dbraw/zinc/72/55/22/1050725522.db2.gz RDAPDKOWNTUSKE-ZMSDIMECSA-N 1 0 305.462 4.253 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)c(O)c1 ZINC000788687552 1050726032 /nfs/dbraw/zinc/72/60/32/1050726032.db2.gz RDAPDKOWNTUSKE-YQQAZPJKSA-N 1 0 305.462 4.253 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCC1 ZINC000788666406 1050727018 /nfs/dbraw/zinc/72/70/18/1050727018.db2.gz BYNQYCWVGJZOHT-INIZCTEOSA-N 1 0 305.462 4.257 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccn(C3CCCC3)n2)c(O)c1 ZINC000788672209 1050729792 /nfs/dbraw/zinc/72/97/92/1050729792.db2.gz PEYOOTAZWPUEPQ-HNNXBMFYSA-N 1 0 313.445 4.171 20 10 DICDRO CCO[C@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)c1ccccc1 ZINC000788778895 1050752796 /nfs/dbraw/zinc/75/27/96/1050752796.db2.gz ZRRZGEJWWFMIFN-VQIMIIECSA-N 1 0 313.441 4.437 20 10 DICDRO COc1c2ccccc2oc1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC000788969745 1050766667 /nfs/dbraw/zinc/76/66/67/1050766667.db2.gz NGDBWOQWDNZUHZ-UHFFFAOYSA-N 1 0 311.381 4.048 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c1O ZINC000761198544 1050773697 /nfs/dbraw/zinc/77/36/97/1050773697.db2.gz QGLAXXHTIJXAPD-QMTHXVAHSA-N 1 0 321.804 4.060 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCCc3sccc3C2)c1O ZINC000761199624 1050774646 /nfs/dbraw/zinc/77/46/46/1050774646.db2.gz QJCFEVGFVBXOGE-UHFFFAOYSA-N 1 0 323.845 4.064 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@H](c2cccs2)C2CC2)c1O ZINC000761198450 1050774860 /nfs/dbraw/zinc/77/48/60/1050774860.db2.gz OYRBHOBEUMJZEY-HNNXBMFYSA-N 1 0 323.845 4.357 20 10 DICDRO CC1(C)[C@@H]2C[N@@H+](Cc3cc4oc5ccccc5c4cc3O)C[C@@H]21 ZINC000742165369 1050806994 /nfs/dbraw/zinc/80/69/94/1050806994.db2.gz IFLLUJOQLXFVAJ-IYBDPMFKSA-N 1 0 307.393 4.379 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000742152570 1050807975 /nfs/dbraw/zinc/80/79/75/1050807975.db2.gz IWZZLDCJVAHPSR-KRWDZBQOSA-N 1 0 318.420 4.005 20 10 DICDRO CCOCc1cc(C[NH2+][C@H](C)C2CCCCC2)ccc1OC ZINC000742373964 1050835442 /nfs/dbraw/zinc/83/54/42/1050835442.db2.gz XEIMFZINHWGNHI-OAHLLOKOSA-N 1 0 305.462 4.290 20 10 DICDRO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c1 ZINC000789481967 1050837431 /nfs/dbraw/zinc/83/74/31/1050837431.db2.gz ALXUIMJUHFBXIN-DZGCQCFKSA-N 1 0 314.256 4.025 20 10 DICDRO COc1cccc(C[C@@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000772977360 1050841217 /nfs/dbraw/zinc/84/12/17/1050841217.db2.gz MRKMBVRFXXPIPG-HZPDHXFCSA-N 1 0 312.457 4.043 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CCOCC3)CC2)cc1C(C)C ZINC000789528319 1050844288 /nfs/dbraw/zinc/84/42/88/1050844288.db2.gz DSTZYPMRGLXESJ-UHFFFAOYSA-N 1 0 317.473 4.217 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c(O)c(C(C)(C)C)c1 ZINC000789565104 1050850914 /nfs/dbraw/zinc/85/09/14/1050850914.db2.gz JXBLPIXCZIWSRR-HXUWFJFHSA-N 1 0 317.473 4.001 20 10 DICDRO Cc1ccncc1C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC000746893975 1050945773 /nfs/dbraw/zinc/94/57/73/1050945773.db2.gz AOUYJUKGAILYNW-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO Fc1cc(-c2ccco2)ccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000790483619 1050961961 /nfs/dbraw/zinc/96/19/61/1050961961.db2.gz JQGLBQJDAAQGSN-UHFFFAOYSA-N 1 0 323.367 4.310 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2F)ccc1N(C)C ZINC000772994790 1050966643 /nfs/dbraw/zinc/96/66/43/1050966643.db2.gz BKRZBDORHVQRDL-ZDUSSCGKSA-N 1 0 304.384 4.190 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC3(CCCCC3)O2)c(O)c1 ZINC000790716637 1050988376 /nfs/dbraw/zinc/98/83/76/1050988376.db2.gz WUJKTSXPPMRLSS-HOTGVXAUSA-N 1 0 303.446 4.233 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC3(CCCCC3)O2)c1 ZINC000790716575 1050989145 /nfs/dbraw/zinc/98/91/45/1050989145.db2.gz WGCQOLFDLIBXEH-HOTGVXAUSA-N 1 0 303.446 4.233 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC3(CCCCC3)O2)c1 ZINC000790716579 1050989197 /nfs/dbraw/zinc/98/91/97/1050989197.db2.gz WGCQOLFDLIBXEH-JKSUJKDBSA-N 1 0 303.446 4.233 20 10 DICDRO Clc1sccc1C[NH2+]CCCSc1nccs1 ZINC000790968277 1051010412 /nfs/dbraw/zinc/01/04/12/1051010412.db2.gz XVWANDWEHPSYOG-UHFFFAOYSA-N 1 0 304.893 4.130 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2cc(F)ccc2F)ccc1N(C)C ZINC000772999600 1051013716 /nfs/dbraw/zinc/01/37/16/1051013716.db2.gz NFIPWEBJBCVZKW-CYBMUJFWSA-N 1 0 304.384 4.190 20 10 DICDRO CC(C)=CCC[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000790991224 1051013916 /nfs/dbraw/zinc/01/39/16/1051013916.db2.gz NUGFBAITVGTGKE-UHFFFAOYSA-N 1 0 317.433 4.031 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1N(C)C)c1ccc(N(C)C)cc1 ZINC000773005883 1051017050 /nfs/dbraw/zinc/01/70/50/1051017050.db2.gz UYLAJHOOKYBVEP-IBGZPJMESA-N 1 0 311.473 4.060 20 10 DICDRO CC[C@@H](O)CCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000773014693 1051023718 /nfs/dbraw/zinc/02/37/18/1051023718.db2.gz KAZKTJHQWKWOEH-NVXWUHKLSA-N 1 0 322.468 4.018 20 10 DICDRO CC[C@@H](O)CCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773015848 1051025058 /nfs/dbraw/zinc/02/50/58/1051025058.db2.gz OHQUIALWQGYBJY-YLJYHZDGSA-N 1 0 318.505 4.269 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(OC)cc2F)cc1 ZINC000773039453 1051035292 /nfs/dbraw/zinc/03/52/92/1051035292.db2.gz HJDYHAIUFTWHOH-AWEZNQCLSA-N 1 0 316.420 4.141 20 10 DICDRO C[C@H]([NH2+]CC1(C)CCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000773042869 1051036000 /nfs/dbraw/zinc/03/60/00/1051036000.db2.gz CDNGJGMAANYSPJ-AWEZNQCLSA-N 1 0 322.880 4.017 20 10 DICDRO Cc1cc(C[N@@H+]2CCC=C(c3ccccc3)C2)ccc1N(C)C ZINC001170151861 1051036534 /nfs/dbraw/zinc/03/65/34/1051036534.db2.gz ZQNFWHHAROYPGU-UHFFFAOYSA-N 1 0 306.453 4.350 20 10 DICDRO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccc(N(C)C)cc1 ZINC000773039416 1051036488 /nfs/dbraw/zinc/03/64/88/1051036488.db2.gz GKZLQTDKDYXNBI-PXAZEXFGSA-N 1 0 316.832 4.190 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccncc2)c(C)n1-c1cccc(C)c1 ZINC000743503620 1051037151 /nfs/dbraw/zinc/03/71/51/1051037151.db2.gz ALEOTFMNHIULKE-UHFFFAOYSA-N 1 0 305.425 4.087 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCCO[C@H]2C(C)C)cc1 ZINC000773048580 1051040292 /nfs/dbraw/zinc/04/02/92/1051040292.db2.gz RLGBJQLOJMSWFQ-HQRMLTQVSA-N 1 0 318.505 4.245 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)CCC1 ZINC000773061281 1051044265 /nfs/dbraw/zinc/04/42/65/1051044265.db2.gz VFGVKDNNHFJCHL-KRWDZBQOSA-N 1 0 318.505 4.390 20 10 DICDRO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(N(C)C)cc1 ZINC000773058453 1051044280 /nfs/dbraw/zinc/04/42/80/1051044280.db2.gz HTECGEJKMGYHIA-YVEFUNNKSA-N 1 0 316.832 4.190 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)COC3)cc1 ZINC000773079303 1051053035 /nfs/dbraw/zinc/05/30/35/1051053035.db2.gz IEMAIKIRUKWIDC-OAHLLOKOSA-N 1 0 310.441 4.024 20 10 DICDRO CC[C@H]([NH2+]CCC[C@H]1CCCC[C@@H]1O)c1ccc(N(C)C)cc1 ZINC000773081897 1051056908 /nfs/dbraw/zinc/05/69/08/1051056908.db2.gz SJBWMTTWGSMDKO-HOJAQTOUSA-N 1 0 318.505 4.125 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)C1CC1 ZINC000773090869 1051058203 /nfs/dbraw/zinc/05/82/03/1051058203.db2.gz GHIFWVYVBOZYLI-OXJNMPFZSA-N 1 0 316.489 4.143 20 10 DICDRO CS[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773095295 1051061541 /nfs/dbraw/zinc/06/15/41/1051061541.db2.gz RGZPHNZIKMGHFM-HZPDHXFCSA-N 1 0 306.519 4.469 20 10 DICDRO CCC(CC)(CO)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000773101747 1051062607 /nfs/dbraw/zinc/06/26/07/1051062607.db2.gz JSZNNQWZTWSGIF-KRWDZBQOSA-N 1 0 318.505 4.126 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H]1COc2ccccc21)c1ccc(N(C)C)cc1 ZINC000773105806 1051063201 /nfs/dbraw/zinc/06/32/01/1051063201.db2.gz RHCMHXZKGPSQIB-XPGWFJOJSA-N 1 0 324.468 4.358 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)ncn1 ZINC000773107004 1051064809 /nfs/dbraw/zinc/06/48/09/1051064809.db2.gz NQSGYPLQTMXRMM-QGZVFWFLSA-N 1 0 324.472 4.016 20 10 DICDRO C[C@@H](CO)CCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773114838 1051067337 /nfs/dbraw/zinc/06/73/37/1051067337.db2.gz KTSCZRMVCMPZPF-MSOLQXFVSA-N 1 0 318.505 4.126 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)c1ccc(N(C)C)cc1 ZINC000773128968 1051070664 /nfs/dbraw/zinc/07/06/64/1051070664.db2.gz JARNNEZVYVRFOB-NZSAHSFTSA-N 1 0 318.505 4.387 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1ccc(N(C)C)cc1 ZINC000773128966 1051070977 /nfs/dbraw/zinc/07/09/77/1051070977.db2.gz JARNNEZVYVRFOB-NEWSRXKRSA-N 1 0 318.505 4.387 20 10 DICDRO C[NH+](C)/C=C/c1ccncc1NCc1cc2ccccc2cc1O ZINC001171405974 1051090294 /nfs/dbraw/zinc/09/02/94/1051090294.db2.gz CPUSNZHSGXVQFD-CSKARUKUSA-N 1 0 319.408 4.085 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@@H]1CCc2c(F)cccc2C1 ZINC001171407487 1051096222 /nfs/dbraw/zinc/09/62/22/1051096222.db2.gz IQDGXIMIPMHUCR-GOSISDBHSA-N 1 0 321.395 4.332 20 10 DICDRO COc1ccc([C@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1F ZINC000037074647 1051109509 /nfs/dbraw/zinc/10/95/09/1051109509.db2.gz KJKQJRMBZALLFH-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000037107939 1051111654 /nfs/dbraw/zinc/11/16/54/1051111654.db2.gz JZXQDYJTEFOIBQ-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)c1O ZINC000792189343 1051123358 /nfs/dbraw/zinc/12/33/58/1051123358.db2.gz NDZZDOPCLRUYBO-CYBMUJFWSA-N 1 0 301.352 4.111 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1 ZINC000792190072 1051126818 /nfs/dbraw/zinc/12/68/18/1051126818.db2.gz QJVWWKZNLKKPLZ-OAHLLOKOSA-N 1 0 314.395 4.163 20 10 DICDRO COc1ccc(Cl)c(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000792285280 1051130322 /nfs/dbraw/zinc/13/03/22/1051130322.db2.gz GRFLIIQNGFMCIQ-CYBMUJFWSA-N 1 0 318.848 4.265 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c2C1)c1ccccc1O ZINC001171511976 1051157544 /nfs/dbraw/zinc/15/75/44/1051157544.db2.gz LVOPJQASVGTXES-JQWIXIFHSA-N 1 0 321.342 4.018 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c2C1)c1ccccc1O ZINC001171511977 1051157662 /nfs/dbraw/zinc/15/76/62/1051157662.db2.gz LVOPJQASVGTXES-PWSUYJOCSA-N 1 0 321.342 4.018 20 10 DICDRO Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC001649138775 1051227432 /nfs/dbraw/zinc/22/74/32/1051227432.db2.gz JTNRBSPDVJNAMG-HNNXBMFYSA-N 1 0 300.421 4.359 20 10 DICDRO CCc1cccc(F)c1C[NH2+]CCCSc1nccs1 ZINC000792992168 1051237233 /nfs/dbraw/zinc/23/72/33/1051237233.db2.gz NDYZSBMUYKVDFY-UHFFFAOYSA-N 1 0 310.463 4.117 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CCC(F)(F)C2)c(C(F)(F)F)c1 ZINC000793018253 1051239195 /nfs/dbraw/zinc/23/91/95/1051239195.db2.gz XXSFUWVFIYCNKY-NSHDSACASA-N 1 0 322.321 4.049 20 10 DICDRO COc1ccc2c(c1)CCC[C@H]2C[NH2+][C@@H](C)c1ccccc1O ZINC000766331228 1051255858 /nfs/dbraw/zinc/25/58/58/1051255858.db2.gz NDBOHVUDXRKADV-HOCLYGCPSA-N 1 0 311.425 4.172 20 10 DICDRO CCOc1cccc(C[N@H+](C)Cc2ccccc2SC)c1O ZINC000793233024 1051265513 /nfs/dbraw/zinc/26/55/13/1051265513.db2.gz OBUZNUBAFRXVIS-UHFFFAOYSA-N 1 0 317.454 4.145 20 10 DICDRO CCC[C@@H]([NH2+]Cc1cc(Cl)ccc1O)[C@@H](O)c1ccccc1 ZINC000793241490 1051271090 /nfs/dbraw/zinc/27/10/90/1051271090.db2.gz PBZYWYUVODNEEI-AEFFLSMTSA-N 1 0 319.832 4.038 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)cc1F ZINC000793307928 1051277198 /nfs/dbraw/zinc/27/71/98/1051277198.db2.gz AHKVFZODKQMILC-GOSISDBHSA-N 1 0 316.395 4.198 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(C)cc2)c(O)c1 ZINC000793386090 1051293664 /nfs/dbraw/zinc/29/36/64/1051293664.db2.gz IVCYNKULQFLKRG-RTBURBONSA-N 1 0 311.425 4.135 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000793386539 1051294150 /nfs/dbraw/zinc/29/41/50/1051294150.db2.gz VSPRADBYUPRKST-YGUOUDRMSA-N 1 0 305.780 4.221 20 10 DICDRO COc1ccc(C[NH2+]Cc2c(Cl)oc3ccccc32)c(O)c1 ZINC000793388576 1051296683 /nfs/dbraw/zinc/29/66/83/1051296683.db2.gz PTOHOLOLSBFQEG-UHFFFAOYSA-N 1 0 317.772 4.090 20 10 DICDRO CC[C@H](C[NH2+][C@@H](C)c1cc(OC)ccc1O)CC(F)(F)F ZINC000402560958 1051307949 /nfs/dbraw/zinc/30/79/49/1051307949.db2.gz JMLNTLFLTUWRCH-QWRGUYRKSA-N 1 0 305.340 4.030 20 10 DICDRO CC1(C)C[N@H+](Cc2cc3c(cc2O)CCCC3)[C@H]1c1cccnc1 ZINC000793573296 1051325164 /nfs/dbraw/zinc/32/51/64/1051325164.db2.gz VYVOLDWFHUKMAL-FQEVSTJZSA-N 1 0 322.452 4.249 20 10 DICDRO C[C@@]12CC[N@H+](Cc3cc(Cl)ccc3O)C[C@@H]1C2(Cl)Cl ZINC000793612823 1051327810 /nfs/dbraw/zinc/32/78/10/1051327810.db2.gz LJOSOBAVGMFPNX-QWHCGFSZSA-N 1 0 320.647 4.061 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC=C(c3ccccc3)C2)c1O ZINC000793621491 1051329731 /nfs/dbraw/zinc/32/97/31/1051329731.db2.gz XCQPMMSNOHBJFF-UHFFFAOYSA-N 1 0 309.409 4.080 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H](C)CCOC(C)C ZINC001172441161 1051408030 /nfs/dbraw/zinc/40/80/30/1051408030.db2.gz TYLBAVMKHTZVRZ-HNAYVOBHSA-N 1 0 319.489 4.426 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(CC)CCOCC2)cc1 ZINC000766380979 1051409913 /nfs/dbraw/zinc/40/99/13/1051409913.db2.gz DFVQAFWMGYHLQU-MRXNPFEDSA-N 1 0 304.478 4.000 20 10 DICDRO CC[C@@H]([NH2+]CCOCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000766400487 1051414963 /nfs/dbraw/zinc/41/49/63/1051414963.db2.gz HDPRJSAHPGFZGG-HXUWFJFHSA-N 1 0 312.457 4.010 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)Cc1ccncc1)c1ccc(N2CCCCC2)cc1 ZINC000766490352 1051432388 /nfs/dbraw/zinc/43/23/88/1051432388.db2.gz UEGAPYZHRBUHTG-ZWKOTPCHSA-N 1 0 323.484 4.354 20 10 DICDRO CC[C@@H]([NH2+]CC1(CCO)CCCCC1)c1ccc(N(C)C)cc1 ZINC000766537294 1051464691 /nfs/dbraw/zinc/46/46/91/1051464691.db2.gz TXYRAEPIKKPJLN-LJQANCHMSA-N 1 0 318.505 4.126 20 10 DICDRO CC1(C)CC([NH2+]Cc2ccc(N3CCCC3)cc2)CC(C)(C)O1 ZINC001172643948 1051468853 /nfs/dbraw/zinc/46/88/53/1051468853.db2.gz GWBVTKWKARZPGN-UHFFFAOYSA-N 1 0 316.489 4.113 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCS1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766566812 1051496103 /nfs/dbraw/zinc/49/61/03/1051496103.db2.gz GUCOOQRZMPCDFG-GOEBONIOSA-N 1 0 322.493 4.362 20 10 DICDRO C[C@H]([NH2+]CCc1ccncc1)c1ccc(N2CCCCCC2)cc1 ZINC000766600107 1051524572 /nfs/dbraw/zinc/52/45/72/1051524572.db2.gz DGBMYMJXEQOJFP-SFHVURJKSA-N 1 0 323.484 4.355 20 10 DICDRO C[C@@H]([NH2+]CCc1ccncc1)c1ccc(N2CCCCCC2)cc1 ZINC000766600105 1051525419 /nfs/dbraw/zinc/52/54/19/1051525419.db2.gz DGBMYMJXEQOJFP-GOSISDBHSA-N 1 0 323.484 4.355 20 10 DICDRO C[C@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H](C)c1ccccc1O ZINC001172855797 1051541765 /nfs/dbraw/zinc/54/17/65/1051541765.db2.gz HHSIOLDVUBFURO-NEPJUHHUSA-N 1 0 307.796 4.467 20 10 DICDRO C[C@@H](CSc1ccc(Cl)cc1)[NH2+]Cc1ccccc1O ZINC001172875170 1051558684 /nfs/dbraw/zinc/55/86/84/1051558684.db2.gz MCCDPDDCXNOSDL-LBPRGKRZSA-N 1 0 307.846 4.316 20 10 DICDRO CO[C@@H]1CCC[C@@H]([NH2+][C@H]2c3c(c(C)cc(C)c3O)CC2(C)C)C1 ZINC001172930478 1051576042 /nfs/dbraw/zinc/57/60/42/1051576042.db2.gz IZEMYOQCFIZJKD-CLCXKQKWSA-N 1 0 317.473 4.180 20 10 DICDRO COc1cccc(C2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)c1 ZINC001169300007 1051581649 /nfs/dbraw/zinc/58/16/49/1051581649.db2.gz ISDSOJAMUWONLZ-UHFFFAOYSA-N 1 0 324.468 4.141 20 10 DICDRO C[C@@H]([NH2+]C1CCC(Oc2ccccc2)CC1)c1ccccc1O ZINC001173196104 1051629496 /nfs/dbraw/zinc/62/94/96/1051629496.db2.gz IMFZTXQBZRZJRN-KLHKWILBSA-N 1 0 311.425 4.433 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@@H](CC)C2)ccc1OC ZINC000740899070 1051745255 /nfs/dbraw/zinc/74/52/55/1051745255.db2.gz PFUMLJVSLDIALR-CRAIPNDOSA-N 1 0 305.462 4.290 20 10 DICDRO CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000806141090 1051747803 /nfs/dbraw/zinc/74/78/03/1051747803.db2.gz FZRLXIGEKZAWRD-CPUCHLNUSA-N 1 0 324.415 4.035 20 10 DICDRO CC[C@@H](Nc1ccc2c(c1)ncn2C)c1cccc(Cl)c1O ZINC000806156852 1051758976 /nfs/dbraw/zinc/75/89/76/1051758976.db2.gz LERGAFQKKYDRNI-CQSZACIVSA-N 1 0 315.804 4.496 20 10 DICDRO CCCCCn1cc(C[NH2+]Cc2cc(Cl)ccc2O)c(C)n1 ZINC000767426678 1051807851 /nfs/dbraw/zinc/80/78/51/1051807851.db2.gz KPBKCBPZPJKMDO-UHFFFAOYSA-N 1 0 321.852 4.031 20 10 DICDRO COc1cccc(O)c1C[N@H+](C)Cc1ccc2ccccc2c1 ZINC000768194564 1051900164 /nfs/dbraw/zinc/90/01/64/1051900164.db2.gz BJHXEABTXKKYCE-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO CN(C)c1ccc(C[N@H+](Cc2ccc(Cl)o2)C2CC2)cc1 ZINC000768258203 1051909413 /nfs/dbraw/zinc/90/94/13/1051909413.db2.gz UHZFXLQBNJDLEF-UHFFFAOYSA-N 1 0 304.821 4.164 20 10 DICDRO C[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000768271743 1051911148 /nfs/dbraw/zinc/91/11/48/1051911148.db2.gz NPUJZCOPPGBRSB-QWRGUYRKSA-N 1 0 301.352 4.263 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c(O)c1 ZINC000768267208 1051912405 /nfs/dbraw/zinc/91/24/05/1051912405.db2.gz OEFVIECVCUIGEN-LBPRGKRZSA-N 1 0 321.367 4.262 20 10 DICDRO COc1cccc(O)c1C[N@H+](C)Cc1cccc2ccccc21 ZINC000768244409 1051915033 /nfs/dbraw/zinc/91/50/33/1051915033.db2.gz MKSSWWVTZHVEGM-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO c1ccc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)nc1 ZINC000768356670 1051924579 /nfs/dbraw/zinc/92/45/79/1051924579.db2.gz ZEFIEBOYHYRHLV-NRFANRHFSA-N 1 0 321.468 4.409 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(O)cc1C ZINC000768443825 1051931020 /nfs/dbraw/zinc/93/10/20/1051931020.db2.gz UOKGNQTUIBTEHN-QGZVFWFLSA-N 1 0 315.388 4.185 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]1c1ccccn1)CCCC2 ZINC000768443835 1051931820 /nfs/dbraw/zinc/93/18/20/1051931820.db2.gz UWAUREXARAMJFR-LJQANCHMSA-N 1 0 308.425 4.003 20 10 DICDRO CC[N@H+](CCC(F)(F)F)Cc1cc2c(cc1O)CCCC2 ZINC000768443312 1051931886 /nfs/dbraw/zinc/93/18/86/1051931886.db2.gz FGHFHEUKJWIOQD-UHFFFAOYSA-N 1 0 301.352 4.045 20 10 DICDRO CCCCC[NH+](CCCCC)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768438543 1051932964 /nfs/dbraw/zinc/93/29/64/1051932964.db2.gz BKLRLNIABLIXGG-GOSISDBHSA-N 1 0 321.461 4.000 20 10 DICDRO CCC[N@H+](CCc1cccs1)Cc1cccc(OCC)c1O ZINC000768525663 1051938951 /nfs/dbraw/zinc/93/89/51/1051938951.db2.gz ZELCRLHYDPPUFK-UHFFFAOYSA-N 1 0 319.470 4.307 20 10 DICDRO CC1CCN(c2ccc(C[NH2+]C3CC(C(F)F)C3)cc2)CC1 ZINC000768691263 1051957509 /nfs/dbraw/zinc/95/75/09/1051957509.db2.gz PXBRPFHPLMCQNO-UHFFFAOYSA-N 1 0 308.416 4.056 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)cc(C)c1OC(F)F ZINC000768872186 1051975581 /nfs/dbraw/zinc/97/55/81/1051975581.db2.gz FQPOLSGKDFNJJL-UHFFFAOYSA-N 1 0 321.367 4.242 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@]3(CCCOC3)C2)cc1C(C)C ZINC000747470927 1051991183 /nfs/dbraw/zinc/99/11/83/1051991183.db2.gz FBNVWBVQUPWKPL-FQEVSTJZSA-N 1 0 317.473 4.217 20 10 DICDRO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)cc1 ZINC000769107581 1051999290 /nfs/dbraw/zinc/99/92/90/1051999290.db2.gz YMTBODILYJDBOM-INIZCTEOSA-N 1 0 303.789 4.088 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CCC(c3ccccn3)CC2)cc1 ZINC000769105952 1051999629 /nfs/dbraw/zinc/99/96/29/1051999629.db2.gz PMCQRJMIPOIWTB-UHFFFAOYSA-N 1 0 323.484 4.307 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cncc2ccccc21 ZINC000769201022 1052008240 /nfs/dbraw/zinc/00/82/40/1052008240.db2.gz ODNQPPSVVQAGKT-UHFFFAOYSA-N 1 0 306.409 4.353 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Cl)cc2C)c1 ZINC000769218625 1052009093 /nfs/dbraw/zinc/00/90/93/1052009093.db2.gz WCGZVQYJCNSHDQ-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2CCCc3ccc(C)cc32)c(O)c1 ZINC000808436252 1052020647 /nfs/dbraw/zinc/02/06/47/1052020647.db2.gz SOLJOEUUXOICFP-IBGZPJMESA-N 1 0 311.425 4.267 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000769314072 1052021216 /nfs/dbraw/zinc/02/12/16/1052021216.db2.gz COPBGAMJLVCHCF-SFHVURJKSA-N 1 0 317.816 4.009 20 10 DICDRO CCCO[C@@H]1CCC[N@H+](Cc2ccc(N(CC)CC)cc2)CC1 ZINC000769385309 1052035839 /nfs/dbraw/zinc/03/58/39/1052035839.db2.gz VRAHSCNHTXXCKB-HXUWFJFHSA-N 1 0 318.505 4.314 20 10 DICDRO COc1ccsc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000769384251 1052037718 /nfs/dbraw/zinc/03/77/18/1052037718.db2.gz MXNXLXBZOIVMMU-UHFFFAOYSA-N 1 0 317.454 4.407 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c1 ZINC000769428245 1052047793 /nfs/dbraw/zinc/04/77/93/1052047793.db2.gz OERZMHBVOMQNGK-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc(F)c(F)c2)c1O ZINC000808681517 1052058959 /nfs/dbraw/zinc/05/89/59/1052058959.db2.gz ZAFQITJOOODUAP-SNVBAGLBSA-N 1 0 311.759 4.483 20 10 DICDRO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2c2cccc(N(C)C)c2)c1 ZINC000769461819 1052061262 /nfs/dbraw/zinc/06/12/62/1052061262.db2.gz XKKOMDHPOREIBG-IBGZPJMESA-N 1 0 310.441 4.104 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc(F)cc2F)c1O ZINC000808685281 1052061864 /nfs/dbraw/zinc/06/18/64/1052061864.db2.gz SDULJKJOLSURJP-SNVBAGLBSA-N 1 0 311.759 4.483 20 10 DICDRO Cc1cccc(NC2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)c1 ZINC000769471749 1052063143 /nfs/dbraw/zinc/06/31/43/1052063143.db2.gz COFZQIGSDVOEHS-UHFFFAOYSA-N 1 0 323.484 4.138 20 10 DICDRO Cc1cccc(NC2CC[NH+](Cc3cc(C)c(C)cc3O)CC2)c1 ZINC000769469670 1052064609 /nfs/dbraw/zinc/06/46/09/1052064609.db2.gz CMQMQTDRPPSPHR-UHFFFAOYSA-N 1 0 324.468 4.394 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1O ZINC000808672227 1052065634 /nfs/dbraw/zinc/06/56/34/1052065634.db2.gz GWTKHLAMNNXCCG-ZDUSSCGKSA-N 1 0 318.848 4.271 20 10 DICDRO Cc1ccc([C@H](O)C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cc1 ZINC000808679447 1052067586 /nfs/dbraw/zinc/06/75/86/1052067586.db2.gz PPNHBMZLWXEMQP-CXAGYDPISA-N 1 0 319.832 4.047 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000769502899 1052067854 /nfs/dbraw/zinc/06/78/54/1052067854.db2.gz DXOTYBYAHJGRHS-OAHLLOKOSA-N 1 0 316.832 4.122 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c1O ZINC000808704962 1052068594 /nfs/dbraw/zinc/06/85/94/1052068594.db2.gz OFSYBSXCDWNNKY-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1O ZINC000808704898 1052069074 /nfs/dbraw/zinc/06/90/74/1052069074.db2.gz MRKFAEIITLLJEQ-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)C[C@@H](O)c2ccco2)c1O ZINC000808703830 1052069218 /nfs/dbraw/zinc/06/92/18/1052069218.db2.gz XYMAZRJOVPQYGZ-TYNCELHUSA-N 1 0 323.820 4.110 20 10 DICDRO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808703805 1052069562 /nfs/dbraw/zinc/06/95/62/1052069562.db2.gz XIWMVWGHFFGVDB-CHWSQXEVSA-N 1 0 304.821 4.469 20 10 DICDRO CCOc1ccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c(O)c1 ZINC000769499847 1052070369 /nfs/dbraw/zinc/07/03/69/1052070369.db2.gz RJUVKEJFIJWARC-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)c1O ZINC000769506931 1052071193 /nfs/dbraw/zinc/07/11/93/1052071193.db2.gz YXDZCGIDHCPDPT-ACJLOTCBSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@H]2CCO[C@H](C)C2)c1O ZINC000808712428 1052072596 /nfs/dbraw/zinc/07/25/96/1052072596.db2.gz GNRLQPMVLTXVOG-RDBSUJKOSA-N 1 0 311.853 4.210 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)[C@@H](O)c2ccccc2)c1O ZINC000808720659 1052078114 /nfs/dbraw/zinc/07/81/14/1052078114.db2.gz BMKAKEYHBZMKEY-ZJNRKIDTSA-N 1 0 319.832 4.127 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H](O)c1ccccc1)c1cc(Cl)ccc1O ZINC000808720832 1052079803 /nfs/dbraw/zinc/07/98/03/1052079803.db2.gz ZMBMHSQNSDLYLC-PUECVXPYSA-N 1 0 319.832 4.208 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccc2ccccc2c1O ZINC000808727590 1052084154 /nfs/dbraw/zinc/08/41/54/1052084154.db2.gz JNMPTMSESXJKHF-GDBMZVCRSA-N 1 0 319.404 4.372 20 10 DICDRO Nc1ccc(Cc2ccc(Nc3ccc4[nH+]ccn4c3)cc2)cc1 ZINC001174277935 1052085855 /nfs/dbraw/zinc/08/58/55/1052085855.db2.gz OERJTKSWOVUEGO-UHFFFAOYSA-N 1 0 314.392 4.251 20 10 DICDRO Nc1ccc(Cc2ccccc2Nc2ccc3[nH+]ccn3c2)cc1 ZINC001174277927 1052086324 /nfs/dbraw/zinc/08/63/24/1052086324.db2.gz NRPZXQCHUZRHTH-UHFFFAOYSA-N 1 0 314.392 4.251 20 10 DICDRO CCc1cccc(C[NH2+]Cc2cccc(Br)c2)c1O ZINC000691471897 1052099977 /nfs/dbraw/zinc/09/99/77/1052099977.db2.gz BHWYKMZTIJJXEA-UHFFFAOYSA-N 1 0 320.230 4.007 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccccc2Br)c1O ZINC000691475132 1052118383 /nfs/dbraw/zinc/11/83/83/1052118383.db2.gz RCWPARRZVWUZGL-UHFFFAOYSA-N 1 0 320.230 4.007 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)c1 ZINC000130314338 1052130937 /nfs/dbraw/zinc/13/09/37/1052130937.db2.gz JVMVUOHZKGCWHK-NSHDSACASA-N 1 0 323.795 4.434 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1CC[C@@]12CC[NH2+]C2 ZINC001218117436 1052199028 /nfs/dbraw/zinc/19/90/28/1052199028.db2.gz MYCPAJOPFIKPSG-YTCPRFGJSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CC[C@]34CC[NH2+]C4)cc2)C=C1 ZINC001218113988 1052199164 /nfs/dbraw/zinc/19/91/64/1052199164.db2.gz APZXDSNIWDFQKW-RTBURBONSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CCC3(C[NH2+]C3)C2)=C1 ZINC001218238466 1052210458 /nfs/dbraw/zinc/21/04/58/1052210458.db2.gz POXKEJLLTXSAHH-VNRULFPQSA-N 1 0 323.396 4.329 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1OC1CC2(CC[NH2+]2)C1 ZINC001218248336 1052211437 /nfs/dbraw/zinc/21/14/37/1052211437.db2.gz JMTKCLOZAXHFHP-QZQOTICOSA-N 1 0 309.369 4.081 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@@H]1C=CC[NH2+]C1 ZINC001218334252 1052226545 /nfs/dbraw/zinc/22/65/45/1052226545.db2.gz MRIYAEVJWOHKCK-GOSISDBHSA-N 1 0 322.412 4.356 20 10 DICDRO C[C@H]1[NH2+]C[C@@H]1Oc1ccc2ccccc2c1/N=N/c1nccs1 ZINC001218387523 1052233332 /nfs/dbraw/zinc/23/33/32/1052233332.db2.gz QCSFKGVOPHTZFE-LEQDFOTISA-N 1 0 324.409 4.451 20 10 DICDRO C[C@H]1CC[C@H](Oc2ccccc2NN=C2C=CC=CC2=O)C[NH2+]1 ZINC001218404564 1052234452 /nfs/dbraw/zinc/23/44/52/1052234452.db2.gz JQJVPPBEHXOETG-NBDPHERISA-N 1 0 311.385 4.327 20 10 DICDRO C[C@H]1CC[C@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C[NH2+]1 ZINC001218400334 1052235019 /nfs/dbraw/zinc/23/50/19/1052235019.db2.gz DIDCMHZNHOPXPM-XLLGOIQHSA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CC[C@H]4C[NH2+]C[C@@H]43)cc2)C=C1 ZINC001218468536 1052242404 /nfs/dbraw/zinc/24/24/04/1052242404.db2.gz SEFSQMQBLZPWNZ-FASAQXTFSA-N 1 0 323.396 4.184 20 10 DICDRO C[C@@H]1CC[NH2+]C[C@@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001218483810 1052245493 /nfs/dbraw/zinc/24/54/93/1052245493.db2.gz FKLCAFOEUWSPPI-ACJLOTCBSA-N 1 0 311.385 4.184 20 10 DICDRO C[NH2+]CCC(=O)Nc1ccc(/N=N/c2ccccc2C)cc1C ZINC001219205350 1052276939 /nfs/dbraw/zinc/27/69/39/1052276939.db2.gz CORSDQGKGYFRPQ-QURGRASLSA-N 1 0 310.401 4.267 20 10 DICDRO Cc1ccccc1/N=N/c1ccc(NC(=O)[C@@H]2CC[NH2+]2)c(C)c1 ZINC001219204121 1052277625 /nfs/dbraw/zinc/27/76/25/1052277625.db2.gz ULKPVDYUSWUIIF-SIUCFOQUSA-N 1 0 308.385 4.019 20 10 DICDRO CCC1(C[NH2+][C@H](C)c2ccc3ccccc3c2O)CCOCC1 ZINC000324360986 1052285244 /nfs/dbraw/zinc/28/52/44/1052285244.db2.gz VVNPNDJXHVCWHX-OAHLLOKOSA-N 1 0 313.441 4.403 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1Cc2ccccc2O1)c1ccc2ccccc2c1O ZINC000324389259 1052308483 /nfs/dbraw/zinc/30/84/83/1052308483.db2.gz PPKXUAOBSOMOTK-RHSMWYFYSA-N 1 0 319.404 4.200 20 10 DICDRO C[C@H]1CC2(CCC2)C[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000762136997 1052316198 /nfs/dbraw/zinc/31/61/98/1052316198.db2.gz GTECZSCRMPNZQI-ZDUSSCGKSA-N 1 0 303.446 4.160 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[N@H+](C)Cc2cccc(C)c2)c1O ZINC000314956294 1052327238 /nfs/dbraw/zinc/32/72/38/1052327238.db2.gz ARGYTXCHEAFZQF-UHFFFAOYSA-N 1 0 317.816 4.189 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1ccc(N(C)C)cc1 ZINC000315409084 1052337576 /nfs/dbraw/zinc/33/75/76/1052337576.db2.gz IQJQZKFNJFXFKP-STQMWFEESA-N 1 0 304.384 4.443 20 10 DICDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000316882862 1052376264 /nfs/dbraw/zinc/37/62/64/1052376264.db2.gz APPIWKOOQFPLBW-STQMWFEESA-N 1 0 303.377 4.342 20 10 DICDRO CC(C)(C)OC1CC(CC[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000762457881 1052386459 /nfs/dbraw/zinc/38/64/59/1052386459.db2.gz VAAJCUGEPABHQM-UHFFFAOYSA-N 1 0 311.853 4.119 20 10 DICDRO Clc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)CCC2 ZINC000762478031 1052388648 /nfs/dbraw/zinc/38/86/48/1052388648.db2.gz ZKWSMKHMZONVAO-SFHVURJKSA-N 1 0 313.828 4.442 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC2CC(OC(C)(C)C)C2)c1 ZINC000762640526 1052410209 /nfs/dbraw/zinc/41/02/09/1052410209.db2.gz FTICLUBGBUPFSG-FHERZECASA-N 1 0 305.462 4.335 20 10 DICDRO C[C@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1ccc(N(C)C)cc1 ZINC000762643719 1052410304 /nfs/dbraw/zinc/41/03/04/1052410304.db2.gz QXNCDCJMVVSYPI-LYGPFTKASA-N 1 0 318.505 4.387 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCC2CC(OC(C)(C)C)C2)c1 ZINC000762640529 1052410359 /nfs/dbraw/zinc/41/03/59/1052410359.db2.gz FTICLUBGBUPFSG-QQFBHYJXSA-N 1 0 305.462 4.335 20 10 DICDRO C[N@H+](Cc1ccc(C(F)(F)F)s1)Cc1ccccc1O ZINC000762970624 1052476691 /nfs/dbraw/zinc/47/66/91/1052476691.db2.gz KOMLJYZDXAKNIY-UHFFFAOYSA-N 1 0 301.333 4.105 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)CC(F)(F)F)cc1 ZINC000780590108 1052484070 /nfs/dbraw/zinc/48/40/70/1052484070.db2.gz QWAHKLLYDMZWHY-UHFFFAOYSA-N 1 0 302.384 4.353 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccccc2OC)cc1 ZINC000322296577 1052484111 /nfs/dbraw/zinc/48/41/11/1052484111.db2.gz VGVWVJHCRXKWKH-MRXNPFEDSA-N 1 0 312.457 4.392 20 10 DICDRO CCOC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CCCC1 ZINC000320289612 1052498196 /nfs/dbraw/zinc/49/81/96/1052498196.db2.gz BGERBBVFELPMRM-HUUCEWRRSA-N 1 0 303.446 4.188 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc3c(cc2O)CCC3)cc1 ZINC000915836634 1052501415 /nfs/dbraw/zinc/50/14/15/1052501415.db2.gz QGSGTOAXKAYDQK-FQEVSTJZSA-N 1 0 323.436 4.227 20 10 DICDRO C[C@@H]([NH2+]C[C@H](O)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000153873141 1052592008 /nfs/dbraw/zinc/59/20/08/1052592008.db2.gz ANBGMKBOKTXYRW-UTKZUKDTSA-N 1 0 324.468 4.061 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cc1C ZINC000763396412 1052623080 /nfs/dbraw/zinc/62/30/80/1052623080.db2.gz UDBYWGLLWYLDEO-QGZVFWFLSA-N 1 0 301.817 4.434 20 10 DICDRO Cc1cc(NCc2ccc(N3CCCC3)cc2)c2ccccc2[nH+]1 ZINC000917063044 1052687771 /nfs/dbraw/zinc/68/77/71/1052687771.db2.gz UHGHSSKWSODWMM-UHFFFAOYSA-N 1 0 317.436 4.177 20 10 DICDRO COc1ccc2ccc(O)c(C[N@H+](C)Cc3cccc(C)c3)c2c1 ZINC000917483035 1052731067 /nfs/dbraw/zinc/73/10/67/1052731067.db2.gz MMPPAKRTIRWEBS-UHFFFAOYSA-N 1 0 321.420 4.494 20 10 DICDRO CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000920183776 1052926286 /nfs/dbraw/zinc/92/62/86/1052926286.db2.gz WYNQFMCFTYVSJM-LSDHHAIUSA-N 1 0 319.449 4.109 20 10 DICDRO C[C@@H]([C@H](Oc1ccc(N(C)C)cc1)c1ccccc1)[NH+]1CCCC1 ZINC001227940341 1053030817 /nfs/dbraw/zinc/03/08/17/1053030817.db2.gz KFVIMJDAMQNHFH-UWJYYQICSA-N 1 0 324.468 4.357 20 10 DICDRO Oc1ccccc1C[N@H+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000180659068 1053073880 /nfs/dbraw/zinc/07/38/80/1053073880.db2.gz CPCUXVSBOYQVIT-UHFFFAOYSA-N 1 0 304.393 4.163 20 10 DICDRO CC[N@@H+]1CC[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)C1 ZINC001228418602 1053097534 /nfs/dbraw/zinc/09/75/34/1053097534.db2.gz JSFVJFQOLDBSQD-ATQAJOFPSA-N 1 0 311.385 4.281 20 10 DICDRO c1ccc(C[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C2CC2)cc1 ZINC001318618199 1053178289 /nfs/dbraw/zinc/17/82/89/1053178289.db2.gz RKJHORGOVXHTEW-JOCHJYFZSA-N 1 0 320.480 4.398 20 10 DICDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCS[C@H]2CCCC[C@H]21 ZINC001319828903 1053278562 /nfs/dbraw/zinc/27/85/62/1053278562.db2.gz ORNGVCUQYPZICV-MOPGFXCFSA-N 1 0 316.514 4.147 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)c1ccc(C)cc1 ZINC000181709717 1053282001 /nfs/dbraw/zinc/28/20/01/1053282001.db2.gz DUKFNLMHGBRSKC-SFHVURJKSA-N 1 0 315.388 4.283 20 10 DICDRO COc1cccc2cc(C[NH2+][C@H](C)c3cc(F)ccc3O)oc21 ZINC001320118115 1053305824 /nfs/dbraw/zinc/30/58/24/1053305824.db2.gz DRDKXPOPGJLVEH-LLVKDONJSA-N 1 0 315.344 4.137 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001320118651 1053308547 /nfs/dbraw/zinc/30/85/47/1053308547.db2.gz OKNCNEQCNWQCQQ-WBVHZDCISA-N 1 0 324.468 4.495 20 10 DICDRO CCO[C@H](CC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C)C(C)C ZINC001320119085 1053308819 /nfs/dbraw/zinc/30/88/19/1053308819.db2.gz WLLVPDFJYUNFTK-YQQAZPJKSA-N 1 0 305.462 4.290 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@H](C)c3c1c(O)ccc3C)CO2 ZINC001320134696 1053309232 /nfs/dbraw/zinc/30/92/32/1053309232.db2.gz ZMEWGUFRPVFHNT-CWRNSKLLSA-N 1 0 309.409 4.281 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c(C(F)(F)F)c1 ZINC001474747174 1053317326 /nfs/dbraw/zinc/31/73/26/1053317326.db2.gz QYCCGPGNJFMQCY-BETUJISGSA-N 1 0 312.379 4.003 20 10 DICDRO CC[C@H]([NH2+]CCCc1nc(C)cs1)c1cc(Cl)ccc1O ZINC001320399186 1053330210 /nfs/dbraw/zinc/33/02/10/1053330210.db2.gz XCWPDSNYLNIZJX-AWEZNQCLSA-N 1 0 324.877 4.484 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC1(CCO)CCCCC1 ZINC001320410422 1053330702 /nfs/dbraw/zinc/33/07/02/1053330702.db2.gz BFGMZKPBEUXLGT-CVEARBPZSA-N 1 0 317.473 4.171 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]Cc2cccc(O)c2)cc1 ZINC001200067719 1053347942 /nfs/dbraw/zinc/34/79/42/1053347942.db2.gz LSSPUBJZKMGPFQ-UHFFFAOYSA-N 1 0 312.457 4.308 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000775642097 1053353997 /nfs/dbraw/zinc/35/39/97/1053353997.db2.gz GAYHSEAGWWGOPI-LLVKDONJSA-N 1 0 307.743 4.128 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001320763270 1053359365 /nfs/dbraw/zinc/35/93/65/1053359365.db2.gz GVFJAFOUSZSHLU-WFASDCNBSA-N 1 0 315.388 4.186 20 10 DICDRO C[C@@H]([NH2+]CCCCCCO)c1ccc(N2CCCCCC2)cc1 ZINC000182144211 1053360265 /nfs/dbraw/zinc/36/02/65/1053360265.db2.gz RWCXVZBUEQOEBC-GOSISDBHSA-N 1 0 318.505 4.270 20 10 DICDRO C[N@H+](Cc1cc(F)cc(F)c1)Cc1c(O)ccc2ccccc21 ZINC001320790511 1053362160 /nfs/dbraw/zinc/36/21/60/1053362160.db2.gz JRMOHGGIWNYFIC-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO CO[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC001320779323 1053362638 /nfs/dbraw/zinc/36/26/38/1053362638.db2.gz MPLGTEDRPAJMCB-XKGZKEIXSA-N 1 0 316.489 4.285 20 10 DICDRO COc1ccc(C2([NH2+]Cc3cccc(C)c3O)CCCC2)cc1 ZINC000182209399 1053376312 /nfs/dbraw/zinc/37/63/12/1053376312.db2.gz WCUKUOCNWVFJOQ-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCc1ccc2c(c1)CCO2 ZINC001321017867 1053382236 /nfs/dbraw/zinc/38/22/36/1053382236.db2.gz SSRLLCPGKZGNBZ-YOEHRIQHSA-N 1 0 323.436 4.016 20 10 DICDRO COc1ccc(Cl)cc1CC[NH2+][C@H](C)c1ccc(C)cc1O ZINC001321028255 1053384509 /nfs/dbraw/zinc/38/45/09/1053384509.db2.gz RDYURYYMGUMPKL-CYBMUJFWSA-N 1 0 319.832 4.256 20 10 DICDRO COc1cccc(F)c1C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC001352776849 1053405090 /nfs/dbraw/zinc/40/50/90/1053405090.db2.gz OZXFEOHHVSPXLO-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)nc3ccccc23)c1 ZINC000182370087 1053421784 /nfs/dbraw/zinc/42/17/84/1053421784.db2.gz XPNZHQSEBDACNE-CQSZACIVSA-N 1 0 322.408 4.108 20 10 DICDRO Cc1cccc(C)c1OCC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001321652799 1053426809 /nfs/dbraw/zinc/42/68/09/1053426809.db2.gz FANCHEGQOBENDZ-UHFFFAOYSA-N 1 0 324.468 4.072 20 10 DICDRO CCCCc1nc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)cs1 ZINC000182386571 1053427058 /nfs/dbraw/zinc/42/70/58/1053427058.db2.gz PAFOYRIJSOKWRV-LBPRGKRZSA-N 1 0 320.458 4.051 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCOc2ccccc21 ZINC001200365310 1053595001 /nfs/dbraw/zinc/59/50/01/1053595001.db2.gz IPDMIFBCOSRUDJ-INIZCTEOSA-N 1 0 320.436 4.143 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC001323829237 1053603096 /nfs/dbraw/zinc/60/30/96/1053603096.db2.gz IOZKCBPPGVMTHY-WBTNSWJXSA-N 1 0 317.473 4.432 20 10 DICDRO CCOCCC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001323829886 1053603723 /nfs/dbraw/zinc/60/37/23/1053603723.db2.gz NDWLOLDSCIZYRO-GJZGRUSLSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001323831360 1053604130 /nfs/dbraw/zinc/60/41/30/1053604130.db2.gz LVTJLUWLJZDZKD-BFQNTYOBSA-N 1 0 314.429 4.075 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cccc2cnccc21 ZINC000183219465 1053606666 /nfs/dbraw/zinc/60/66/66/1053606666.db2.gz UKRUVCAHLJYOHC-UHFFFAOYSA-N 1 0 306.409 4.353 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Br)o2)c(O)c1C ZINC001324337176 1053645722 /nfs/dbraw/zinc/64/57/22/1053645722.db2.gz YCMZFBKKGHRMTQ-NSHDSACASA-N 1 0 324.218 4.215 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)o1 ZINC001324348107 1053647026 /nfs/dbraw/zinc/64/70/26/1053647026.db2.gz FWCLWHBVBWJZJS-TZMCWYRMSA-N 1 0 314.429 4.288 20 10 DICDRO C[C@@H]([NH2+]CCSCc1ccccc1F)c1ccccc1O ZINC000183384883 1053650771 /nfs/dbraw/zinc/65/07/71/1053650771.db2.gz IOHADHZONQIOJH-CYBMUJFWSA-N 1 0 305.418 4.115 20 10 DICDRO C[C@H]([NH2+][C@H]1CCSc2c(F)cccc21)c1ccccc1O ZINC000183413986 1053654491 /nfs/dbraw/zinc/65/44/91/1053654491.db2.gz YBCJHCCHINTTAD-NHYWBVRUSA-N 1 0 303.402 4.419 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1nc(C(C)(C)C)cs1 ZINC001324543386 1053660723 /nfs/dbraw/zinc/66/07/23/1053660723.db2.gz SVGIMROBCSKFHV-YPMHNXCESA-N 1 0 316.470 4.484 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC001324602308 1053665372 /nfs/dbraw/zinc/66/53/72/1053665372.db2.gz UKEWPONWAPURBP-BZUAXINKSA-N 1 0 315.457 4.188 20 10 DICDRO C[C@H]([NH2+]C[C@@H](O)c1ccc(C(C)(C)C)cc1)c1ccccc1O ZINC000183516926 1053670313 /nfs/dbraw/zinc/67/03/13/1053670313.db2.gz RICRNRKSLIBEGX-IFXJQAMLSA-N 1 0 313.441 4.074 20 10 DICDRO CC[C@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccccc1F ZINC000183544493 1053677599 /nfs/dbraw/zinc/67/75/99/1053677599.db2.gz TXHPCOQGTLPQBW-UONOGXRCSA-N 1 0 303.377 4.040 20 10 DICDRO Oc1cccc(Br)c1C[NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC001200485333 1053694730 /nfs/dbraw/zinc/69/47/30/1053694730.db2.gz CTMKEGCDVZWGCD-YNEHKIRRSA-N 1 0 324.262 4.213 20 10 DICDRO Cc1noc(C)c1CCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001325341676 1053715136 /nfs/dbraw/zinc/71/51/36/1053715136.db2.gz XXMADCUHIBCMBH-WBMJQRKESA-N 1 0 314.429 4.076 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCCNc1ccccc1 ZINC001325339919 1053715269 /nfs/dbraw/zinc/71/52/69/1053715269.db2.gz LZBXWMMVDCRLBE-NVXWUHKLSA-N 1 0 310.441 4.341 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccccc1N(C)C ZINC001325356779 1053717102 /nfs/dbraw/zinc/71/71/02/1053717102.db2.gz MJLKXOCHMOJFSM-HOCLYGCPSA-N 1 0 310.441 4.105 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccccc1N(C)C ZINC001325356777 1053717527 /nfs/dbraw/zinc/71/75/27/1053717527.db2.gz MJLKXOCHMOJFSM-GDBMZVCRSA-N 1 0 310.441 4.105 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CC(C)(C)c1cccnc1 ZINC001325582625 1053722597 /nfs/dbraw/zinc/72/25/97/1053722597.db2.gz RNHIMZXYSNKGAD-GOEBONIOSA-N 1 0 310.441 4.211 20 10 DICDRO CC[N@@H+]1CC[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001231320609 1053726135 /nfs/dbraw/zinc/72/61/35/1053726135.db2.gz QPSQYEPYJXRHCX-GOSISDBHSA-N 1 0 311.385 4.281 20 10 DICDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001231466760 1053759055 /nfs/dbraw/zinc/75/90/55/1053759055.db2.gz VFVOGEQAFISFSA-MRXNPFEDSA-N 1 0 311.425 4.346 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1O ZINC001231594286 1053791079 /nfs/dbraw/zinc/79/10/79/1053791079.db2.gz DCFCSMWYHRJXRT-MRXNPFEDSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccccc2)Cc2ccncc2)c1O ZINC001231590982 1053791502 /nfs/dbraw/zinc/79/15/02/1053791502.db2.gz MYSDCXXIGGOIOO-UHFFFAOYSA-N 1 0 318.420 4.298 20 10 DICDRO Cc1cccc(C[N@H+](Cc2ccccn2)C2CCCCC2)c1O ZINC001231593897 1053792004 /nfs/dbraw/zinc/79/20/04/1053792004.db2.gz NNXGFBMUTSOPNN-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC001231590473 1053792045 /nfs/dbraw/zinc/79/20/45/1053792045.db2.gz CVOHTMVWGTYJSZ-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO Cc1cccc(C[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)c1O ZINC001231594360 1053792462 /nfs/dbraw/zinc/79/24/62/1053792462.db2.gz FVEPIWWUAOBXJC-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Cc1cccc(C[NH+]2CCC3(CCc4ccccc43)CC2)c1O ZINC001231591332 1053792914 /nfs/dbraw/zinc/79/29/14/1053792914.db2.gz ATPLYENUYWMENM-UHFFFAOYSA-N 1 0 307.437 4.181 20 10 DICDRO Cc1ccc2c(c1)C[N@@H+](Cc1c(O)ccc3ccccc31)CC2 ZINC001231588819 1053793371 /nfs/dbraw/zinc/79/33/71/1053793371.db2.gz VNPUCBVVRJIEJV-UHFFFAOYSA-N 1 0 303.405 4.412 20 10 DICDRO Cc1cccc(C[NH+]2CCC3(CCc4ccccc4O3)CC2)c1O ZINC001231594798 1053796289 /nfs/dbraw/zinc/79/62/89/1053796289.db2.gz PGPZGIJYYWHXEN-UHFFFAOYSA-N 1 0 323.436 4.060 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC001200591436 1053797396 /nfs/dbraw/zinc/79/73/96/1053797396.db2.gz YHMQIKRLRWIMID-MJGOQNOKSA-N 1 0 304.437 4.208 20 10 DICDRO CC[C@H]([NH2+]C1CC2(CC2(F)F)C1)c1cc(Cl)ccc1O ZINC001327227826 1053843964 /nfs/dbraw/zinc/84/39/64/1053843964.db2.gz KCXZWYIFXMVIBL-KHJSKFAYSA-N 1 0 301.764 4.274 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1ccc2ccccc2c1O ZINC000273392969 1053847242 /nfs/dbraw/zinc/84/72/42/1053847242.db2.gz LBXAQLVTQVPMDY-FZKQIMNGSA-N 1 0 321.424 4.007 20 10 DICDRO C[C@@H]([NH2+]C1CC2(CC2(F)F)C1)c1cc2c(cc1O)CCCC2 ZINC001327279883 1053848074 /nfs/dbraw/zinc/84/80/74/1053848074.db2.gz OLZOEIXVHJOHAK-ACCOQDJYSA-N 1 0 307.384 4.109 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CC[C@@H](OC)C1)c1ccc(C(F)(F)F)cc1O ZINC001327534002 1053860838 /nfs/dbraw/zinc/86/08/38/1053860838.db2.gz VHDXCCMCJNPPIM-BZPMIXESSA-N 1 0 317.351 4.019 20 10 DICDRO Cc1ncc(C[N@H+](Cc2ccccc2O)[C@H](C)c2ccccc2)o1 ZINC001354468994 1053875623 /nfs/dbraw/zinc/87/56/23/1053875623.db2.gz KPLJHKYQLKLOFG-OAHLLOKOSA-N 1 0 322.408 4.452 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(C)cc(C)cc1O ZINC001231844351 1053885346 /nfs/dbraw/zinc/88/53/46/1053885346.db2.gz JFOBAOZMLSHHLC-GOSISDBHSA-N 1 0 311.425 4.355 20 10 DICDRO Cc1cc(C)c(C[N@@H+]2CCc3c(Cl)cccc3C2)c(O)c1 ZINC001231845558 1053886562 /nfs/dbraw/zinc/88/65/62/1053886562.db2.gz AMNVOTXYRHPCOG-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1cc(C)c(C[NH+]2CCC(C(=O)c3ccccc3)CC2)c(O)c1 ZINC001231841632 1053887461 /nfs/dbraw/zinc/88/74/61/1053887461.db2.gz GDKOTWBRMGXGTL-UHFFFAOYSA-N 1 0 323.436 4.104 20 10 DICDRO Cc1cc(C)c(C[N@H+](C)Cc2nc3ccccc3s2)c(O)c1 ZINC001231843468 1053888309 /nfs/dbraw/zinc/88/83/09/1053888309.db2.gz ZRRCVFJBPHACJI-UHFFFAOYSA-N 1 0 312.438 4.251 20 10 DICDRO CC[N@H+](Cc1cccc(F)c1F)Cc1c(C)cc(C)cc1O ZINC001231849691 1053891227 /nfs/dbraw/zinc/89/12/27/1053891227.db2.gz UQNMEORFLLPSMZ-UHFFFAOYSA-N 1 0 305.368 4.309 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC001231853067 1053891297 /nfs/dbraw/zinc/89/12/97/1053891297.db2.gz RXJOSXLFMSOGNJ-MRXNPFEDSA-N 1 0 316.470 4.160 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@H+](C)Cc1cccc(Cl)c1 ZINC001231853335 1053891845 /nfs/dbraw/zinc/89/18/45/1053891845.db2.gz VINOYBQSVHEDPS-UHFFFAOYSA-N 1 0 318.848 4.047 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC001231853066 1053892069 /nfs/dbraw/zinc/89/20/69/1053892069.db2.gz RXJOSXLFMSOGNJ-INIZCTEOSA-N 1 0 316.470 4.160 20 10 DICDRO C[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1cc2c(cc1O)CCCC2 ZINC000183991195 1053893948 /nfs/dbraw/zinc/89/39/48/1053893948.db2.gz UYBRLVRLYHATMC-CRAIPNDOSA-N 1 0 317.473 4.271 20 10 DICDRO CC[N@H+](Cc1cccc(OC)c1)Cc1cc(Cl)c(C)cc1O ZINC001231870355 1053898430 /nfs/dbraw/zinc/89/84/30/1053898430.db2.gz VLDVGXDSZKJJOV-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F)c1cc(Cl)ccc1O ZINC001328098295 1053907261 /nfs/dbraw/zinc/90/72/61/1053907261.db2.gz PXQMQIWAWCNCTQ-PMEZXALUSA-N 1 0 301.764 4.130 20 10 DICDRO Cc1cnc(C2CC[NH+](Cc3cc(Cl)ccc3O)CC2)s1 ZINC000763672953 1053989211 /nfs/dbraw/zinc/98/92/11/1053989211.db2.gz 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/nfs/dbraw/zinc/01/79/16/1054017916.db2.gz TVMWUCYKVITCKI-SNAWJCMRSA-N 1 0 318.823 4.348 20 10 DICDRO c1ccc2c(c1)SC[C@@H]2C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001330563366 1054040828 /nfs/dbraw/zinc/04/08/28/1054040828.db2.gz HRZZZLVYNVXZDV-KRWDZBQOSA-N 1 0 324.493 4.266 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1c(C)cccc1OC ZINC001232623522 1054085914 /nfs/dbraw/zinc/08/59/14/1054085914.db2.gz QXIVXDFIDRXHHJ-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(OC(F)F)c1 ZINC000296182925 1054086328 /nfs/dbraw/zinc/08/63/28/1054086328.db2.gz YEUIPMAOAOAXTJ-XHDPSFHLSA-N 1 0 319.351 4.332 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](c1ccccn1)C1CC1 ZINC001332455120 1054119937 /nfs/dbraw/zinc/11/99/37/1054119937.db2.gz GUUZCAOBMNQOAU-JOTOCRJQSA-N 1 0 308.425 4.385 20 10 DICDRO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2O)c1 ZINC001232834770 1054126725 /nfs/dbraw/zinc/12/67/25/1054126725.db2.gz LYPJTLMNHLMWSX-LJQANCHMSA-N 1 0 310.441 4.104 20 10 DICDRO C[C@@]1([NH2+]Cc2ccc(N3CCCC3)cc2)CCOc2ccccc21 ZINC001332796895 1054127032 /nfs/dbraw/zinc/12/70/32/1054127032.db2.gz GGNOLGWJROILBM-OAQYLSRUSA-N 1 0 322.452 4.074 20 10 DICDRO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(N(C)C)cc1O ZINC001232836370 1054127341 /nfs/dbraw/zinc/12/73/41/1054127341.db2.gz OQDNWGFKQNUPIA-IBGZPJMESA-N 1 0 310.441 4.104 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2C2CCCCC2)c(O)c1 ZINC001232840835 1054128591 /nfs/dbraw/zinc/12/85/91/1054128591.db2.gz LIQZDPGNSUJCRX-SFHVURJKSA-N 1 0 302.462 4.003 20 10 DICDRO Cc1cnc(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c(C)c1 ZINC001332947618 1054133988 /nfs/dbraw/zinc/13/39/88/1054133988.db2.gz ZRDPIZMIRKFVPW-WBVHZDCISA-N 1 0 310.441 4.093 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccccc1-n1cccc1 ZINC001232912149 1054149462 /nfs/dbraw/zinc/14/94/62/1054149462.db2.gz JBSDBGIEDMKMHP-UHFFFAOYSA-N 1 0 306.409 4.205 20 10 DICDRO Cc1cnc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)c(C)c1 ZINC000848564123 1054151810 /nfs/dbraw/zinc/15/18/10/1054151810.db2.gz IFAQPQCACFEXQQ-UHFFFAOYSA-N 1 0 323.484 4.021 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)C2CCC(F)(F)CC2)c(O)c1 ZINC000848574926 1054156669 /nfs/dbraw/zinc/15/66/69/1054156669.db2.gz JAWDSPPLKRBVJK-GFCCVEGCSA-N 1 0 313.388 4.095 20 10 DICDRO CC[C@H]([NH2+]Cc1noc2ccccc12)c1ccc(N(C)C)cc1 ZINC000848573128 1054157038 /nfs/dbraw/zinc/15/70/38/1054157038.db2.gz QSFBKAYRAQIRNK-KRWDZBQOSA-N 1 0 309.413 4.135 20 10 DICDRO COc1cccc(F)c1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC001334734294 1054196879 /nfs/dbraw/zinc/19/68/79/1054196879.db2.gz VUEQKGREJPQYSB-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO Nc1ccc(C[N@@H+]2CCC[C@H](c3nc4ccccc4s3)C2)cc1 ZINC001334753334 1054197048 /nfs/dbraw/zinc/19/70/48/1054197048.db2.gz CTZWXEZPKXKBIX-HNNXBMFYSA-N 1 0 323.465 4.258 20 10 DICDRO Nc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)cc1 ZINC001335288844 1054211480 /nfs/dbraw/zinc/21/14/80/1054211480.db2.gz IDKDWEJCEVXUHF-QGZVFWFLSA-N 1 0 307.397 4.137 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@H](c3cccnc3)C2)c1 ZINC001233286322 1054221585 /nfs/dbraw/zinc/22/15/85/1054221585.db2.gz OQNABIQMLDNOFE-INIZCTEOSA-N 1 0 310.441 4.074 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)c1 ZINC001233283922 1054221720 /nfs/dbraw/zinc/22/17/20/1054221720.db2.gz AYEZOLMEXQSVMI-IAGOWNOFSA-N 1 0 315.457 4.023 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2cc(C(C)(C)C)ccc2O)c1 ZINC001233285695 1054221762 /nfs/dbraw/zinc/22/17/62/1054221762.db2.gz QNSOHYZSLIPGKV-UHFFFAOYSA-N 1 0 313.441 4.330 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCc3sccc3C2)c1 ZINC001233283903 1054222444 /nfs/dbraw/zinc/22/24/44/1054222444.db2.gz ACIQBUZKTRWUHW-UHFFFAOYSA-N 1 0 301.455 4.310 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)CCc2ccc(C)cc2)c1O ZINC001233290169 1054225170 /nfs/dbraw/zinc/22/51/70/1054225170.db2.gz MXJLTOMLHXGUNS-UHFFFAOYSA-N 1 0 319.832 4.037 20 10 DICDRO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(Cl)cc(OC)c1O ZINC001233290178 1054225493 /nfs/dbraw/zinc/22/54/93/1054225493.db2.gz NIJCISAGCUDIMY-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)CCc2cccc(C)c2)c1O ZINC001233289998 1054226250 /nfs/dbraw/zinc/22/62/50/1054226250.db2.gz CCPRGTMTLHQDGA-UHFFFAOYSA-N 1 0 319.832 4.037 20 10 DICDRO C[N@H+](Cc1ccc(Cl)o1)Cc1ccc(N2CCCC2)cc1 ZINC001233316278 1054229553 /nfs/dbraw/zinc/22/95/53/1054229553.db2.gz WZSNDXLEVLETRW-UHFFFAOYSA-N 1 0 304.821 4.165 20 10 DICDRO [O-]c1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001233332177 1054233762 /nfs/dbraw/zinc/23/37/62/1054233762.db2.gz BFOZMRAPAGYLEH-OAHLLOKOSA-N 1 0 307.315 4.147 20 10 DICDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2c([O-])ccc(F)c2F)c1 ZINC001233331873 1054233907 /nfs/dbraw/zinc/23/39/07/1054233907.db2.gz OIPHJILXWQKVBN-MRXNPFEDSA-N 1 0 303.352 4.316 20 10 DICDRO CC(C)(C)[N@H+](Cc1ccccc1)Cc1c([O-])ccc(F)c1F ZINC001233332063 1054235835 /nfs/dbraw/zinc/23/58/35/1054235835.db2.gz XCOBAOZSFHEJNA-UHFFFAOYSA-N 1 0 305.368 4.471 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1nc2ccccc2[nH]1)C1CCCC1 ZINC001336960063 1054253296 /nfs/dbraw/zinc/25/32/96/1054253296.db2.gz CBAHWANKXAHTMW-UHFFFAOYSA-N 1 0 321.424 4.213 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC001233452213 1054276882 /nfs/dbraw/zinc/27/68/82/1054276882.db2.gz OBUZLKGIHVEJLC-OAHLLOKOSA-N 1 0 322.330 4.143 20 10 DICDRO C[N@H+](CCc1cccs1)Cc1ccc(C(F)(F)F)cc1O ZINC001233454319 1054276934 /nfs/dbraw/zinc/27/69/34/1054276934.db2.gz PVFYXGMSNMEBAF-UHFFFAOYSA-N 1 0 315.360 4.147 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCCC(F)(F)CC1 ZINC001233452269 1054278176 /nfs/dbraw/zinc/27/81/76/1054278176.db2.gz POXLQFBTIWEGAJ-UHFFFAOYSA-N 1 0 309.278 4.032 20 10 DICDRO CCc1cccc(C[N@H+](C)Cc2nc3ccccc3s2)c1O ZINC000848880933 1054280275 /nfs/dbraw/zinc/28/02/75/1054280275.db2.gz UJJYFZZIXAULJC-UHFFFAOYSA-N 1 0 312.438 4.196 20 10 DICDRO CCc1cccc(C[NH+]2CCC(OC3CCCCC3)CC2)c1O ZINC000848885414 1054284906 /nfs/dbraw/zinc/28/49/06/1054284906.db2.gz NVHRVXVHMWFQEF-UHFFFAOYSA-N 1 0 317.473 4.268 20 10 DICDRO Cc1ccsc1CC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001337800317 1054285539 /nfs/dbraw/zinc/28/55/39/1054285539.db2.gz MWEGLDSIIPVUOL-KBPBESRZSA-N 1 0 301.455 4.451 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC001337797714 1054286416 /nfs/dbraw/zinc/28/64/16/1054286416.db2.gz BWOXDENNNWYZNI-AAEUAGOBSA-N 1 0 314.454 4.373 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2nc3ccccc3s2)c1O ZINC000848897373 1054287340 /nfs/dbraw/zinc/28/73/40/1054287340.db2.gz PTZCZBCSLUFBLD-GFCCVEGCSA-N 1 0 312.438 4.415 20 10 DICDRO COC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)c1ccccc1 ZINC001337801574 1054287591 /nfs/dbraw/zinc/28/75/91/1054287591.db2.gz UQZSMXKFGOENCT-UAGQMJEPSA-N 1 0 311.425 4.226 20 10 DICDRO CCc1cccc(C[NH2+][C@@H](C)c2nc3ccccc3s2)c1O ZINC000848897374 1054288691 /nfs/dbraw/zinc/28/86/91/1054288691.db2.gz PTZCZBCSLUFBLD-LBPRGKRZSA-N 1 0 312.438 4.415 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@@H]2c2csc(C)n2)c1O ZINC000848904306 1054292987 /nfs/dbraw/zinc/29/29/87/1054292987.db2.gz PVGRCBRIPBGLKY-MRXNPFEDSA-N 1 0 302.443 4.057 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c1O ZINC000848915086 1054296570 /nfs/dbraw/zinc/29/65/70/1054296570.db2.gz SMTNJLVSAJRUDX-AWEZNQCLSA-N 1 0 321.342 4.149 20 10 DICDRO CCc1cccc(C[NH2+]C2(c3ccccc3Cl)CC2)c1O ZINC000848920218 1054298770 /nfs/dbraw/zinc/29/87/70/1054298770.db2.gz ZGXVSAFBDRQISE-UHFFFAOYSA-N 1 0 301.817 4.387 20 10 DICDRO Oc1c(C[NH2+]C[C@@H]2CCC3(CCCC3)O2)ccc2ccccc21 ZINC000848928230 1054301713 /nfs/dbraw/zinc/30/17/13/1054301713.db2.gz BDELLJKZYSMGHX-KRWDZBQOSA-N 1 0 311.425 4.127 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000185052140 1054330350 /nfs/dbraw/zinc/33/03/50/1054330350.db2.gz GHJWIIVTLWQGKT-CYBMUJFWSA-N 1 0 303.377 4.171 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000185067996 1054344219 /nfs/dbraw/zinc/34/42/19/1054344219.db2.gz QPQVHFKANPUYBY-MRXNPFEDSA-N 1 0 312.457 4.398 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000185067975 1054344506 /nfs/dbraw/zinc/34/45/06/1054344506.db2.gz QPQVHFKANPUYBY-INIZCTEOSA-N 1 0 312.457 4.398 20 10 DICDRO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233727160 1054345030 /nfs/dbraw/zinc/34/50/30/1054345030.db2.gz JNLNWSYSVBTVQI-GHMZBOCLSA-N 1 0 303.324 4.054 20 10 DICDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233727164 1054345487 /nfs/dbraw/zinc/34/54/87/1054345487.db2.gz JNLNWSYSVBTVQI-PHIMTYICSA-N 1 0 303.324 4.054 20 10 DICDRO C[N@H+](Cc1cccc(OC(F)(F)F)c1O)C1CCCCC1 ZINC001233728745 1054346448 /nfs/dbraw/zinc/34/64/48/1054346448.db2.gz ZYINUAXWJRXLLJ-UHFFFAOYSA-N 1 0 303.324 4.055 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)cccc1OC(F)(F)F ZINC001233761120 1054353114 /nfs/dbraw/zinc/35/31/14/1054353114.db2.gz QBFWVSUVCFCYKA-YPMHNXCESA-N 1 0 315.335 4.055 20 10 DICDRO CC[C@@H]1CCCC[N@@H+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233760056 1054353296 /nfs/dbraw/zinc/35/32/96/1054353296.db2.gz AWNRBHMGZLDLMT-GFCCVEGCSA-N 1 0 303.324 4.055 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@H]2c2ccccc2)cccc1OC(F)(F)F ZINC001233760074 1054354331 /nfs/dbraw/zinc/35/43/31/1054354331.db2.gz BHQVFPFKRLXMPZ-AWEZNQCLSA-N 1 0 323.314 4.238 20 10 DICDRO Oc1c(C[NH+]2C3CCCC2CCC3)cccc1OC(F)(F)F ZINC001233768188 1054356424 /nfs/dbraw/zinc/35/64/24/1054356424.db2.gz LRUZMJKAWFXANB-UHFFFAOYSA-N 1 0 315.335 4.198 20 10 DICDRO Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cc1 ZINC000185098965 1054364939 /nfs/dbraw/zinc/36/49/39/1054364939.db2.gz JIUBVHDXXLGHSI-YWZLYKJASA-N 1 0 321.420 4.238 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccc2ccccc2c1O ZINC000185119933 1054380207 /nfs/dbraw/zinc/38/02/07/1054380207.db2.gz KZSUPTOAARDZII-CABCVRRESA-N 1 0 321.420 4.450 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2coc(-c3cccs3)n2)c1 ZINC000185145560 1054410813 /nfs/dbraw/zinc/41/08/13/1054410813.db2.gz SPXQYTBUTKWNKE-GFCCVEGCSA-N 1 0 314.410 4.268 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1[C@H]2CCCO[C@@H]2C1(C)C ZINC001342406516 1054421137 /nfs/dbraw/zinc/42/11/37/1054421137.db2.gz LUMRZCBMYLFXOP-GOSIZQOLSA-N 1 0 315.457 4.042 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1OC)c1ccccc1O ZINC000185213178 1054466351 /nfs/dbraw/zinc/46/63/51/1054466351.db2.gz NDWLTOOREGZBOV-DOMZBBRYSA-N 1 0 303.377 4.342 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)S3)c2c1c(F)ccc2O ZINC001345123867 1054488463 /nfs/dbraw/zinc/48/84/63/1054488463.db2.gz RBYBOCFODFKVDP-ULQVNCBJSA-N 1 0 307.434 4.096 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@H]4CCC[C@H]43)c2c1 ZINC001234562930 1054546161 /nfs/dbraw/zinc/54/61/61/1054546161.db2.gz XTINPRGPOAXDGR-DNVCBOLYSA-N 1 0 311.425 4.319 20 10 DICDRO Cc1ccccc1[C@@H](O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185435353 1054547301 /nfs/dbraw/zinc/54/73/01/1054547301.db2.gz HDGISICOWFCAHZ-YWZLYKJASA-N 1 0 321.420 4.238 20 10 DICDRO CCC[C@@H]([NH2+]CCCSc1nccs1)c1cccnc1 ZINC000185489776 1054556328 /nfs/dbraw/zinc/55/63/28/1054556328.db2.gz MVXBLCWFJYZBJP-CQSZACIVSA-N 1 0 307.488 4.151 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185567169 1054582366 /nfs/dbraw/zinc/58/23/66/1054582366.db2.gz QFSLEAAXCYBSJR-MNOVXSKESA-N 1 0 307.340 4.091 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185566929 1054582982 /nfs/dbraw/zinc/58/29/82/1054582982.db2.gz IONOFHRGRCSGPR-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC000073052966 1054627985 /nfs/dbraw/zinc/62/79/85/1054627985.db2.gz VYHRYRLJRFHIEQ-HXUWFJFHSA-N 1 0 310.441 4.002 20 10 DICDRO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996346 1054637212 /nfs/dbraw/zinc/63/72/12/1054637212.db2.gz BGKWSAJCZLWVCO-IBGZPJMESA-N 1 0 309.409 4.003 20 10 DICDRO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996348 1054637280 /nfs/dbraw/zinc/63/72/80/1054637280.db2.gz BGKWSAJCZLWVCO-LJQANCHMSA-N 1 0 309.409 4.003 20 10 DICDRO COC[C@H]1CCCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001235003726 1054640012 /nfs/dbraw/zinc/64/00/12/1054640012.db2.gz XGGAIAXXZWYZQD-GOSISDBHSA-N 1 0 311.425 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CCc3cccnc3C2)cccc1-c1ccccc1 ZINC001234999005 1054641365 /nfs/dbraw/zinc/64/13/65/1054641365.db2.gz PZCZHHZWAIKREL-UHFFFAOYSA-N 1 0 316.404 4.013 20 10 DICDRO C[C@]1(F)CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C[C@@H]1F ZINC001234998145 1054641802 /nfs/dbraw/zinc/64/18/02/1054641802.db2.gz GJEFMRBNJRZTPY-HKUYNNGSSA-N 1 0 317.379 4.331 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc2c(c1)CCCN2 ZINC001348855578 1054689216 /nfs/dbraw/zinc/68/92/16/1054689216.db2.gz GVCXZCTVFNMJDC-RDTXWAMCSA-N 1 0 322.452 4.397 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cc3cccc(F)c3[nH]2)cc1 ZINC001235252149 1054691557 /nfs/dbraw/zinc/69/15/57/1054691557.db2.gz OTNPIVXIMSNKPI-UHFFFAOYSA-N 1 0 311.404 4.005 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001235674257 1054766293 /nfs/dbraw/zinc/76/62/93/1054766293.db2.gz FAGNDKXLCOPWIS-IAGOWNOFSA-N 1 0 315.457 4.023 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@H]32)c(O)c1 ZINC001235674255 1054766771 /nfs/dbraw/zinc/76/67/71/1054766771.db2.gz FAGNDKXLCOPWIS-DLBZAZTESA-N 1 0 315.457 4.023 20 10 DICDRO C[N@H+](Cc1ccc(F)cc1)Cc1ccc(C(C)(C)C)cc1O ZINC001235673986 1054767868 /nfs/dbraw/zinc/76/78/68/1054767868.db2.gz CFMCJASVJPYZOT-UHFFFAOYSA-N 1 0 301.405 4.461 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC001235674260 1054771071 /nfs/dbraw/zinc/77/10/71/1054771071.db2.gz FAGNDKXLCOPWIS-SJORKVTESA-N 1 0 315.457 4.023 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(C(C)(C)C)cc1O ZINC001235677740 1054771917 /nfs/dbraw/zinc/77/19/17/1054771917.db2.gz GXMLYHVQBACFRL-UHFFFAOYSA-N 1 0 313.441 4.417 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(O)c1 ZINC001235678048 1054772035 /nfs/dbraw/zinc/77/20/35/1054772035.db2.gz IOKKWJHILISKGH-GOSISDBHSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(O)c1 ZINC001235683495 1054774236 /nfs/dbraw/zinc/77/42/36/1054774236.db2.gz GOFPGUUUOZDPJB-GOSISDBHSA-N 1 0 310.441 4.422 20 10 DICDRO CCCOC1CC[NH+](Cc2ccc(C(C)(C)C)cc2O)CC1 ZINC001235683377 1054775757 /nfs/dbraw/zinc/77/57/57/1054775757.db2.gz FGUHLWQKJUZZTP-UHFFFAOYSA-N 1 0 305.462 4.081 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@H](c3cccnc3)C2)c(O)c1 ZINC001235685404 1054776525 /nfs/dbraw/zinc/77/65/25/1054776525.db2.gz PSVIDWACMVFDIG-INIZCTEOSA-N 1 0 310.441 4.074 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F)c1ccc(N(C)C)cc1 ZINC001350154220 1054879987 /nfs/dbraw/zinc/87/99/87/1054879987.db2.gz IBSPQAQJFCUXGB-SIXLDLHFSA-N 1 0 308.416 4.227 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2c[nH]c3ccccc32)c1O ZINC001236190134 1054986962 /nfs/dbraw/zinc/98/69/62/1054986962.db2.gz FGYJRSFVSPGJMR-SFHVURJKSA-N 1 0 322.408 4.219 20 10 DICDRO Cc1cc(C[NH+]2CCC(c3ccc(N)cc3)CC2)ccc1N(C)C ZINC001236335389 1055063249 /nfs/dbraw/zinc/06/32/49/1055063249.db2.gz OMADACULVPYPIO-UHFFFAOYSA-N 1 0 323.484 4.023 20 10 DICDRO COc1ccc(N2CCC([NH2+]CC3CCC(C)CC3)CC2)cc1 ZINC000764136271 1055112341 /nfs/dbraw/zinc/11/23/41/1055112341.db2.gz CDTZPCZALJIQGE-UHFFFAOYSA-N 1 0 316.489 4.080 20 10 DICDRO C[C@H]([NH2+]CCc1cccc2cccnc21)c1ccc(N(C)C)cc1 ZINC000325251936 1055116475 /nfs/dbraw/zinc/11/64/75/1055116475.db2.gz ZCLJHOPNGUQDFN-INIZCTEOSA-N 1 0 319.452 4.194 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CCC[C@@H](C)[C@@H]3C)CC2)cc1 ZINC000764433624 1055186144 /nfs/dbraw/zinc/18/61/44/1055186144.db2.gz SRDSWNDHOSYRRC-GQIGUUNPSA-N 1 0 316.489 4.078 20 10 DICDRO Oc1cc2ccccc2cc1CN([C@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236662111 1055217645 /nfs/dbraw/zinc/21/76/45/1055217645.db2.gz HVPRAPUIWXKFJL-FQEVSTJZSA-N 1 0 324.468 4.042 20 10 DICDRO Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccc(N(C)C)cc1)CCCO2 ZINC000764636693 1055226924 /nfs/dbraw/zinc/22/69/24/1055226924.db2.gz XFDYOQVZHPRCNP-HXUWFJFHSA-N 1 0 324.468 4.373 20 10 DICDRO COc1ccc(N2CCC([NH2+]CCCC3CCCC3)CC2)cc1 ZINC000764742902 1055242295 /nfs/dbraw/zinc/24/22/95/1055242295.db2.gz CHDAMKSIOSSNAR-UHFFFAOYSA-N 1 0 316.489 4.224 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2c(C)cccc2C)cc1 ZINC001620835754 1055252258 /nfs/dbraw/zinc/25/22/58/1055252258.db2.gz WYPBJJGEBQTBHY-UHFFFAOYSA-N 1 0 310.485 4.482 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[NH+]1CCCCCC1 ZINC001236778246 1055255932 /nfs/dbraw/zinc/25/59/32/1055255932.db2.gz DJJPSFWJBHLFBT-UHFFFAOYSA-N 1 0 311.425 4.347 20 10 DICDRO CC[C@@H]1CCC[N@@H+]1Cc1cc(OCc2ccccc2)ccc1O ZINC001236782111 1055257466 /nfs/dbraw/zinc/25/74/66/1055257466.db2.gz IREZJEGZTAQNHD-GOSISDBHSA-N 1 0 311.425 4.346 20 10 DICDRO CC1(C)[C@@H]2C[N@@H+](Cc3cc(OCc4ccccc4)ccc3O)C[C@@H]21 ZINC001236789869 1055258580 /nfs/dbraw/zinc/25/85/80/1055258580.db2.gz RYIRMHRTTMAHFD-KDURUIRLSA-N 1 0 323.436 4.059 20 10 DICDRO CCc1ccc(C[NH+]2CCC(c3ccc(O)cc3)CC2)c(O)c1 ZINC001236791518 1055260259 /nfs/dbraw/zinc/26/02/59/1055260259.db2.gz IATSOPMMTXKNRW-UHFFFAOYSA-N 1 0 311.425 4.040 20 10 DICDRO C[C@H]1CCC[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001236792448 1055262557 /nfs/dbraw/zinc/26/25/57/1055262557.db2.gz MIVYBWSRBXYXSX-INIZCTEOSA-N 1 0 311.425 4.203 20 10 DICDRO Oc1ccc(OCc2ccccc2)cc1C[N@@H+]1CCCC12CC2 ZINC001236794055 1055263178 /nfs/dbraw/zinc/26/31/78/1055263178.db2.gz WIUGELGGDLCTFS-UHFFFAOYSA-N 1 0 309.409 4.100 20 10 DICDRO COc1ccc(C[N@H+](Cc2ccccc2)C(C)C)c([O-])c1Cl ZINC001236805742 1055268907 /nfs/dbraw/zinc/26/89/07/1055268907.db2.gz IWQLVROARYRETB-UHFFFAOYSA-N 1 0 319.832 4.465 20 10 DICDRO COc1ccc(C[N@H+](C)[C@@H]2CCc3ccccc32)c([O-])c1Cl ZINC001236818662 1055270705 /nfs/dbraw/zinc/27/07/05/1055270705.db2.gz QFKVBTOJLDEBPC-OAHLLOKOSA-N 1 0 317.816 4.174 20 10 DICDRO COc1ccc(C[N@H+](C)CCc2ccc(C)cc2)c([O-])c1Cl ZINC001236811820 1055273239 /nfs/dbraw/zinc/27/32/39/1055273239.db2.gz PLTGSYJHSJCXPR-UHFFFAOYSA-N 1 0 319.832 4.037 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)c([O-])c1Cl ZINC001236813182 1055273910 /nfs/dbraw/zinc/27/39/10/1055273910.db2.gz KTLXJIZQDHUHTC-GFCCVEGCSA-N 1 0 323.845 4.453 20 10 DICDRO CC[N@H+](Cc1ccc(C)cc1)Cc1ccc(OC)c(Cl)c1[O-] ZINC001236810270 1055273951 /nfs/dbraw/zinc/27/39/51/1055273951.db2.gz QYFDSZCDUUVOAI-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO C[N@H+](Cc1ccc(Cl)nc1)Cc1cc2ccccc2cc1O ZINC001236831062 1055278323 /nfs/dbraw/zinc/27/83/23/1055278323.db2.gz DWORUMXTUOCWPE-UHFFFAOYSA-N 1 0 312.800 4.226 20 10 DICDRO Oc1cc2ccccc2cc1C[N@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001236827836 1055279150 /nfs/dbraw/zinc/27/91/50/1055279150.db2.gz ATSKCENQMVIHMC-IYBDPMFKSA-N 1 0 303.352 4.023 20 10 DICDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc3ccccc3cc2O)no1 ZINC001236827629 1055280134 /nfs/dbraw/zinc/28/01/34/1055280134.db2.gz VJQXKPSBRJKFKT-GOSISDBHSA-N 1 0 308.381 4.179 20 10 DICDRO Oc1cc2ccccc2cc1C[N@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001236827988 1055281288 /nfs/dbraw/zinc/28/12/88/1055281288.db2.gz YPKNTEPSPFBUQA-ZBFHGGJFSA-N 1 0 303.352 4.023 20 10 DICDRO C[N@H+](CCC(=O)c1ccccc1)Cc1cc2ccccc2cc1O ZINC001236833167 1055282633 /nfs/dbraw/zinc/28/26/33/1055282633.db2.gz PBSWMBGWTFRTQA-UHFFFAOYSA-N 1 0 319.404 4.250 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001236831488 1055284132 /nfs/dbraw/zinc/28/41/32/1055284132.db2.gz HREKOSTVOPOKGT-MRXNPFEDSA-N 1 0 310.422 4.339 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001236839362 1055289773 /nfs/dbraw/zinc/28/97/73/1055289773.db2.gz FSNLDTLVVJDTLX-HXUWFJFHSA-N 1 0 319.404 4.199 20 10 DICDRO CCC(CC)[N@H+](CC)Cc1ccc(N2CCOCC2)cc1Cl ZINC001236920818 1055318253 /nfs/dbraw/zinc/31/82/53/1055318253.db2.gz YYQJJNGGQYMCNA-UHFFFAOYSA-N 1 0 324.896 4.187 20 10 DICDRO CC[C@H]([NH2+]CCSC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000765240592 1055345191 /nfs/dbraw/zinc/34/51/91/1055345191.db2.gz VKHWUHBRRRPUSM-ZDUSSCGKSA-N 1 0 306.397 4.046 20 10 DICDRO CC[C@@H]([NH2+]CCSC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000765240590 1055345737 /nfs/dbraw/zinc/34/57/37/1055345737.db2.gz VKHWUHBRRRPUSM-CYBMUJFWSA-N 1 0 306.397 4.046 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](OC)c2ccccc2)cc1 ZINC000765261833 1055346572 /nfs/dbraw/zinc/34/65/72/1055346572.db2.gz ONWFBGLKMOBZDI-OXJNMPFZSA-N 1 0 312.457 4.181 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCc3cc(Cl)ccc3C2)c(O)c1 ZINC001237041979 1055347163 /nfs/dbraw/zinc/34/71/63/1055347163.db2.gz BUVFTXHTNZGKJF-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](OC)c2ccccc2)cc1 ZINC000765261835 1055347129 /nfs/dbraw/zinc/34/71/29/1055347129.db2.gz ONWFBGLKMOBZDI-OXQOHEQNSA-N 1 0 312.457 4.181 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2nccs2)c(O)c1 ZINC001237050053 1055348708 /nfs/dbraw/zinc/34/87/08/1055348708.db2.gz WKULWVGTHHNRSJ-OAHLLOKOSA-N 1 0 302.443 4.309 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c(O)c1 ZINC001237046117 1055349139 /nfs/dbraw/zinc/34/91/39/1055349139.db2.gz PTBFCARYHUYASY-HNNXBMFYSA-N 1 0 301.352 4.085 20 10 DICDRO CC(C)c1ccc(C[N@H+](C)Cc2ccc(Cl)nc2)c(O)c1 ZINC001237048046 1055350400 /nfs/dbraw/zinc/35/04/00/1055350400.db2.gz CBOHGAWEMBMCJL-UHFFFAOYSA-N 1 0 304.821 4.196 20 10 DICDRO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(C(C)C)cc2O)no1 ZINC001237045870 1055351667 /nfs/dbraw/zinc/35/16/67/1055351667.db2.gz MCHZHJOFFSTWFZ-KRWDZBQOSA-N 1 0 300.402 4.149 20 10 DICDRO CCOc1ccc(C[N@H+](C)C(C)(C)Cc2ccccc2)c(O)c1 ZINC001237045252 1055352379 /nfs/dbraw/zinc/35/23/79/1055352379.db2.gz FPOVGDMLWUTWGF-UHFFFAOYSA-N 1 0 313.441 4.244 20 10 DICDRO CCC[N@@H+](Cc1ccc(OCC(F)(F)F)cc1O)CC(C)C ZINC001237064233 1055358951 /nfs/dbraw/zinc/35/89/51/1055358951.db2.gz ZEXMHYFPWRYPFY-UHFFFAOYSA-N 1 0 319.367 4.201 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(O)cc2ccccc21 ZINC001237077649 1055361864 /nfs/dbraw/zinc/36/18/64/1055361864.db2.gz XBGMNHRNDCEJBZ-UHFFFAOYSA-N 1 0 307.393 4.273 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(F)c2)cc1 ZINC000765321880 1055364042 /nfs/dbraw/zinc/36/40/42/1055364042.db2.gz AIZUCHLDHSEAJN-CYBMUJFWSA-N 1 0 304.384 4.272 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCCO1)c1ccc(N2CCCCCC2)cc1 ZINC000765341992 1055366993 /nfs/dbraw/zinc/36/69/93/1055366993.db2.gz BGENFAUBXMWCTP-YLJYHZDGSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCCO1)c1ccc(N2CCCCCC2)cc1 ZINC000765341990 1055367169 /nfs/dbraw/zinc/36/71/69/1055367169.db2.gz BGENFAUBXMWCTP-XLIONFOSSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2ccccc2n1)c1ccc(N(C)C)cc1 ZINC000765348049 1055368026 /nfs/dbraw/zinc/36/80/26/1055368026.db2.gz IIOCWZXZMPHZPR-OAHLLOKOSA-N 1 0 305.425 4.152 20 10 DICDRO C[C@H]1CCCCC[N@@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237111135 1055373530 /nfs/dbraw/zinc/37/35/30/1055373530.db2.gz OIBDUQAWNHCKFB-NSHDSACASA-N 1 0 303.324 4.055 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001237127105 1055377599 /nfs/dbraw/zinc/37/75/99/1055377599.db2.gz UZTVCWJWPCLQDJ-LBPRGKRZSA-N 1 0 323.770 4.313 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[NH+]1CCC2(CC(F)(F)C2)CC1 ZINC001237124689 1055379004 /nfs/dbraw/zinc/37/90/04/1055379004.db2.gz RDXZVPLLMFWEDS-UHFFFAOYSA-N 1 0 319.754 4.196 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001237122716 1055381005 /nfs/dbraw/zinc/38/10/05/1055381005.db2.gz LAOSBBGSNYRFBD-YPMHNXCESA-N 1 0 315.335 4.055 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[N@@H+]1CCC2(CCCC2)C1 ZINC001237121990 1055381411 /nfs/dbraw/zinc/38/14/11/1055381411.db2.gz DCCBVDOMZXOBTE-UHFFFAOYSA-N 1 0 315.335 4.057 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC001237138769 1055381665 /nfs/dbraw/zinc/38/16/65/1055381665.db2.gz GHJDGOKRQNABSS-HNNXBMFYSA-N 1 0 322.330 4.143 20 10 DICDRO C[N@H+](Cc1ccccc1F)Cc1cc(C(F)(F)F)ccc1O ZINC001237139682 1055382677 /nfs/dbraw/zinc/38/26/77/1055382677.db2.gz NPFAZLVAJUSYPL-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO C[N@H+](Cc1ccsc1)Cc1cc(C(F)(F)F)ccc1O ZINC001237140394 1055384171 /nfs/dbraw/zinc/38/41/71/1055384171.db2.gz LCIGYJRRBHODHG-UHFFFAOYSA-N 1 0 301.333 4.105 20 10 DICDRO CCCCOCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765455687 1055396205 /nfs/dbraw/zinc/39/62/05/1055396205.db2.gz ZRTSAACGKHAMPL-QGZVFWFLSA-N 1 0 304.478 4.144 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)cc1F ZINC000765475189 1055400574 /nfs/dbraw/zinc/40/05/74/1055400574.db2.gz JZDKKWPDQXMPOL-INIZCTEOSA-N 1 0 316.420 4.288 20 10 DICDRO CC(C)C[C@@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765474974 1055400599 /nfs/dbraw/zinc/40/05/99/1055400599.db2.gz SQAMUHZHKFQLJK-FXAWDEMLSA-N 1 0 318.505 4.125 20 10 DICDRO CC(C)C[C@H](O)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765474975 1055401458 /nfs/dbraw/zinc/40/14/58/1055401458.db2.gz SQAMUHZHKFQLJK-PXNSSMCTSA-N 1 0 318.505 4.125 20 10 DICDRO CC(C)(C)Oc1ccc([C@H]2CC[N@H+](Cc3ccc(N)cc3)C2)cc1 ZINC001237266773 1055409510 /nfs/dbraw/zinc/40/95/10/1055409510.db2.gz ZSHBODPCLLYMRB-SFHVURJKSA-N 1 0 324.468 4.436 20 10 DICDRO Cc1cc(F)cc(C)c1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001237325451 1055426118 /nfs/dbraw/zinc/42/61/18/1055426118.db2.gz KQKCUSDKOUAIAK-UHFFFAOYSA-N 1 0 300.421 4.141 20 10 DICDRO Cc1ccc(C)c(C[NH+]2CCC3(Cc4ccccc4N3)CC2)c1O ZINC001237342616 1055433368 /nfs/dbraw/zinc/43/33/68/1055433368.db2.gz GFJMPGADWCMRSI-UHFFFAOYSA-N 1 0 322.452 4.012 20 10 DICDRO Cc1cccc(O)c1C[N@H+](Cc1ccccc1)Cc1ccccn1 ZINC001237484832 1055458030 /nfs/dbraw/zinc/45/80/30/1055458030.db2.gz ILFZUMUIPQOQSN-UHFFFAOYSA-N 1 0 318.420 4.298 20 10 DICDRO Cc1cccc(O)c1C[N@H+](Cc1ccccc1)Cc1ccncc1 ZINC001237484553 1055459493 /nfs/dbraw/zinc/45/94/93/1055459493.db2.gz FHFIOTRUFWENDJ-UHFFFAOYSA-N 1 0 318.420 4.298 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC(Sc2ccccc2)CC1 ZINC001237489654 1055459616 /nfs/dbraw/zinc/45/96/16/1055459616.db2.gz CNEPEUJGMFRULF-UHFFFAOYSA-N 1 0 313.466 4.457 20 10 DICDRO Cc1cccc(O)c1C[N@H+](Cc1ccccn1)C1CCCCC1 ZINC001237486760 1055459727 /nfs/dbraw/zinc/45/97/27/1055459727.db2.gz CELIQQOBZOMLDY-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO Cc1ccc(O[C@@H]2CCC[N@H+](Cc3c(C)cccc3O)C2)cc1 ZINC001237490656 1055462344 /nfs/dbraw/zinc/46/23/44/1055462344.db2.gz ZFOUXJQWBBJGJZ-GOSISDBHSA-N 1 0 311.425 4.052 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CCCC2(CC(F)C2)CC1 ZINC001237621456 1055485030 /nfs/dbraw/zinc/48/50/30/1055485030.db2.gz AFDQHERDNHOFGN-UHFFFAOYSA-N 1 0 315.791 4.289 20 10 DICDRO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237641312 1055490722 /nfs/dbraw/zinc/49/07/22/1055490722.db2.gz RHMWZSQILIWINE-SJKOYZFVSA-N 1 0 303.352 4.131 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[NH+]1CCC(CF)CC1 ZINC001237646631 1055492984 /nfs/dbraw/zinc/49/29/84/1055492984.db2.gz PZDNATOETAJSMH-UHFFFAOYSA-N 1 0 317.379 4.380 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCn2cccc2C1 ZINC001237644301 1055493390 /nfs/dbraw/zinc/49/33/90/1055493390.db2.gz WUJUIRIRCSQMHV-UHFFFAOYSA-N 1 0 322.383 4.016 20 10 DICDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)cc(C)c2O)cn1 ZINC001237687167 1055502704 /nfs/dbraw/zinc/50/27/04/1055502704.db2.gz SQZUGVGKKQAJNI-KRWDZBQOSA-N 1 0 316.832 4.395 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@H]2CCc3ccccc32)c1O ZINC001237691158 1055504841 /nfs/dbraw/zinc/50/48/41/1055504841.db2.gz YIKBAZHXBCHJBK-KRWDZBQOSA-N 1 0 301.817 4.473 20 10 DICDRO Cc1cc(O)c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1Br ZINC001237676550 1055504895 /nfs/dbraw/zinc/50/48/95/1055504895.db2.gz KUCDPPVFGJRSDJ-BETUJISGSA-N 1 0 324.262 4.085 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc2c(s1)CCCC2 ZINC000765608818 1055513338 /nfs/dbraw/zinc/51/33/38/1055513338.db2.gz LRGCSMASIRYCMM-ZDUSSCGKSA-N 1 0 313.466 4.413 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](C)c2cccs2)ccc1OC ZINC001620903112 1055527190 /nfs/dbraw/zinc/52/71/90/1055527190.db2.gz FKHNGIRYENSNAQ-ZDUSSCGKSA-N 1 0 305.443 4.144 20 10 DICDRO CCCCC[C@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000765637253 1055530217 /nfs/dbraw/zinc/53/02/17/1055530217.db2.gz ANFCHOVLHDHCLN-INIZCTEOSA-N 1 0 304.478 4.222 20 10 DICDRO COc1ccc(N2CCC([NH2+]C3CCCCCCC3)CC2)cc1 ZINC000765638328 1055530338 /nfs/dbraw/zinc/53/03/38/1055530338.db2.gz KHPYONBWTPLDPH-UHFFFAOYSA-N 1 0 316.489 4.367 20 10 DICDRO COc1ccc(N2CCC([NH2+]C3[C@H](C)CCC[C@H]3C)CC2)cc1 ZINC000765638746 1055531402 /nfs/dbraw/zinc/53/14/02/1055531402.db2.gz PKLQICLWDYLSMI-HZPDHXFCSA-N 1 0 316.489 4.078 20 10 DICDRO CC[C@@H](C)N(C)CC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765654623 1055533094 /nfs/dbraw/zinc/53/30/94/1055533094.db2.gz LAFIABKHYJWNOB-QZTJIDSGSA-N 1 0 317.521 4.058 20 10 DICDRO [NH3+]CC[C@@H]1CN(c2cccc(-c3cccnc3)c2)c2ccccc21 ZINC001168550038 1055534504 /nfs/dbraw/zinc/53/45/04/1055534504.db2.gz RVBZMXMKZJADMI-GOSISDBHSA-N 1 0 315.420 4.333 20 10 DICDRO c1ccc([C@@H]2CCC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001620926730 1055545717 /nfs/dbraw/zinc/54/57/17/1055545717.db2.gz CCOJLCLCLJLBRQ-UYAOXDASSA-N 1 0 307.437 4.438 20 10 DICDRO c1ccc([C@H]2CCC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001620926728 1055546139 /nfs/dbraw/zinc/54/61/39/1055546139.db2.gz CCOJLCLCLJLBRQ-ICSRJNTNSA-N 1 0 307.437 4.438 20 10 DICDRO C[N@H+](Cc1cc(F)c(Cl)cc1[O-])[C@H]1CCc2ccccc21 ZINC001237940834 1055563775 /nfs/dbraw/zinc/56/37/75/1055563775.db2.gz DIRMPWKFRUHAQU-INIZCTEOSA-N 1 0 305.780 4.304 20 10 DICDRO CC[C@@H]1CCCC[C@@H]1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001620953435 1055573731 /nfs/dbraw/zinc/57/37/31/1055573731.db2.gz LQARUYUGJXXNDN-ZIAGYGMSSA-N 1 0 310.432 4.337 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC[C@@H]2CCc3ccccc32)cc1F ZINC001620954443 1055575606 /nfs/dbraw/zinc/57/56/06/1055575606.db2.gz ULDIIYVAVRPHNA-KRWDZBQOSA-N 1 0 312.432 4.101 20 10 DICDRO Fc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001620954142 1055575884 /nfs/dbraw/zinc/57/58/84/1055575884.db2.gz JWHUBJOGYFBGIQ-LJQANCHMSA-N 1 0 311.400 4.318 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)cc(C)c1O ZINC001238060629 1055596470 /nfs/dbraw/zinc/59/64/70/1055596470.db2.gz CNBLVURRIQOFBW-KRWDZBQOSA-N 1 0 315.388 4.185 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1O ZINC001238062846 1055598045 /nfs/dbraw/zinc/59/80/45/1055598045.db2.gz SQDRZNYPTLMODZ-QGZVFWFLSA-N 1 0 321.342 4.455 20 10 DICDRO CC[N@@H+](Cc1cccc(F)c1F)Cc1cc(F)cc(C)c1O ZINC001238064480 1055598644 /nfs/dbraw/zinc/59/86/44/1055598644.db2.gz CQFIQGYCWLKSCQ-UHFFFAOYSA-N 1 0 309.331 4.140 20 10 DICDRO COc1ccsc1[C@@H](C)[NH2+]CCCSc1nccs1 ZINC000186171085 1055644915 /nfs/dbraw/zinc/64/49/15/1055644915.db2.gz XRNNSKBOXZCRSL-SNVBAGLBSA-N 1 0 314.501 4.046 20 10 DICDRO CCOc1ccc(C)c(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001238710448 1055729424 /nfs/dbraw/zinc/72/94/24/1055729424.db2.gz DARXBCCHXLSUQP-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO COc1cc(C)c(C)cc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001238771371 1055747964 /nfs/dbraw/zinc/74/79/64/1055747964.db2.gz XZTRLDWEZOFAQS-UHFFFAOYSA-N 1 0 312.457 4.010 20 10 DICDRO Cc1cc(F)cc(Cl)c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001238788982 1055753669 /nfs/dbraw/zinc/75/36/69/1055753669.db2.gz RFXIHRXUPVAVNY-UHFFFAOYSA-N 1 0 305.780 4.051 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)ccc1Cl ZINC001620756545 1055928091 /nfs/dbraw/zinc/92/80/91/1055928091.db2.gz XXESUDGLVKEFQV-UHFFFAOYSA-N 1 0 306.812 4.143 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2csc(C(C)(C)C)n2)c1 ZINC000186202023 1055936147 /nfs/dbraw/zinc/93/61/47/1055936147.db2.gz CHJULNUHSHQBMG-ZDUSSCGKSA-N 1 0 318.486 4.348 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(F)cc1 ZINC001620771431 1055940967 /nfs/dbraw/zinc/94/09/67/1055940967.db2.gz DOUXJOLPLCKPOI-UHFFFAOYSA-N 1 0 313.416 4.218 20 10 DICDRO CCCOc1ccc(C[NH2+]CCC2(CSC)CC2)cc1C ZINC001621000202 1055969408 /nfs/dbraw/zinc/96/94/08/1055969408.db2.gz ULOFNQMEMGEZJN-UHFFFAOYSA-N 1 0 307.503 4.407 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@@H]3CCC[C@@H](C(C)C)C3)C2)cc1 ZINC001621001528 1055969861 /nfs/dbraw/zinc/96/98/61/1055969861.db2.gz PLQFXAFAZMYXCX-KURKYZTESA-N 1 0 316.489 4.078 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccccc2)cc1F ZINC001620695439 1055981039 /nfs/dbraw/zinc/98/10/39/1055981039.db2.gz NOLNQMILVJAAHV-UHFFFAOYSA-N 1 0 300.421 4.004 20 10 DICDRO COc1cc(C[NH2+]CCCCC2CC2)c(O)c(C(C)(C)C)c1 ZINC001621033884 1055995645 /nfs/dbraw/zinc/99/56/45/1055995645.db2.gz AQWOJKFUXUWLRW-UHFFFAOYSA-N 1 0 305.462 4.368 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1F ZINC001620804538 1055999271 /nfs/dbraw/zinc/99/92/71/1055999271.db2.gz MRVINKKOVLMTCF-QGZVFWFLSA-N 1 0 322.374 4.411 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CSc2ccccc21 ZINC001620807924 1056002080 /nfs/dbraw/zinc/00/20/80/1056002080.db2.gz TVSCNTAFJBJTQQ-MRXNPFEDSA-N 1 0 308.450 4.423 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H](C)Oc2ccccc2F)c(Cl)c1 ZINC001620814733 1056009522 /nfs/dbraw/zinc/00/95/22/1056009522.db2.gz YIYFXIFKUWSVGM-LBPRGKRZSA-N 1 0 323.795 4.050 20 10 DICDRO Cc1ccc(C[NH2+]C[C@H](C)Oc2ccc(C(C)C)cc2)c(O)c1 ZINC001621320816 1056027946 /nfs/dbraw/zinc/02/79/46/1056027946.db2.gz KURHCUHJCZSICP-INIZCTEOSA-N 1 0 313.441 4.381 20 10 DICDRO Oc1cc(Cl)ccc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC001621327361 1056034312 /nfs/dbraw/zinc/03/43/12/1056034312.db2.gz QCKRWVJUZRYPGK-UHFFFAOYSA-N 1 0 307.743 4.210 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCCC(F)(F)F)c1 ZINC000756079545 1056067166 /nfs/dbraw/zinc/06/71/66/1056067166.db2.gz QJZMKDXYZJEQQI-WDEREUQCSA-N 1 0 305.340 4.173 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000186326680 1056106561 /nfs/dbraw/zinc/10/65/61/1056106561.db2.gz CRGHQOCEIWJYIY-YRNRMSPPSA-N 1 0 312.457 4.043 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)cc(OC)c1)c1ccc(N(C)C)cc1 ZINC000090972280 1056143888 /nfs/dbraw/zinc/14/38/88/1056143888.db2.gz PYJOEBDKPLGIEC-IBGZPJMESA-N 1 0 316.420 4.141 20 10 DICDRO Fc1ccc([C@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CC2)c(F)c1 ZINC001620820386 1056167987 /nfs/dbraw/zinc/16/79/87/1056167987.db2.gz RLWMCDXQLRMOOT-LJQANCHMSA-N 1 0 315.363 4.141 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1nc(C)cs1 ZINC000921699357 1056334552 /nfs/dbraw/zinc/33/45/52/1056334552.db2.gz VVCVRWMGVFLLME-HNNXBMFYSA-N 1 0 302.443 4.017 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1nc2ccccc2[nH]1 ZINC000921759909 1056464975 /nfs/dbraw/zinc/46/49/75/1056464975.db2.gz BVYIYLPWJWJRPI-MRXNPFEDSA-N 1 0 321.424 4.129 20 10 DICDRO CCC(CC)[C@H](O)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765921857 1056484795 /nfs/dbraw/zinc/48/47/95/1056484795.db2.gz MKNVFRLHHDPWRA-OXQOHEQNSA-N 1 0 318.505 4.125 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc(N(C)C)c(C)c2)cc1C ZINC001615436131 1056509588 /nfs/dbraw/zinc/50/95/88/1056509588.db2.gz SHESORDXJVXAFY-UHFFFAOYSA-N 1 0 312.457 4.010 20 10 DICDRO Cc1ccc(SCC[NH2+][C@@H](C)c2ccc(F)cc2[O-])cc1 ZINC000756359355 1056544781 /nfs/dbraw/zinc/54/47/81/1056544781.db2.gz DGBKAHSOSQSCIB-ZDUSSCGKSA-N 1 0 305.418 4.283 20 10 DICDRO c1ccc([C@H]2C[C@@H]([NH2+]Cc3ccc4c(c3)CCCO4)CCO2)cc1 ZINC000922000524 1056723325 /nfs/dbraw/zinc/72/33/25/1056723325.db2.gz MDGNCZHSXUFLBB-PZJWPPBQSA-N 1 0 323.436 4.022 20 10 DICDRO CCC[C@H](C)CCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC001616865658 1056729658 /nfs/dbraw/zinc/72/96/58/1056729658.db2.gz MSDDRTXHCCPDNH-ROUUACIJSA-N 1 0 318.505 4.390 20 10 DICDRO CCC[C@H](C)CCC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC001616865659 1056730291 /nfs/dbraw/zinc/73/02/91/1056730291.db2.gz MSDDRTXHCCPDNH-ZWKOTPCHSA-N 1 0 318.505 4.390 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CCC(OC3CCC3)CC2)c1O ZINC001143103511 1056767088 /nfs/dbraw/zinc/76/70/88/1056767088.db2.gz DXAUEFAZWNRRHV-UHFFFAOYSA-N 1 0 317.473 4.223 20 10 DICDRO Oc1c(F)cc(F)cc1Nc1cc[nH+]cc1Oc1ccccc1 ZINC001212478191 1056778106 /nfs/dbraw/zinc/77/81/06/1056778106.db2.gz ZSYDGVFLCAYSAU-UHFFFAOYSA-N 1 0 314.291 4.023 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CC[C@H](c2ccccc2)O1)c1ccc(N(C)C)cc1 ZINC001617339416 1056816698 /nfs/dbraw/zinc/81/66/98/1056816698.db2.gz VVQOEWBVNGOVBF-ORYQWCPZSA-N 1 0 324.468 4.324 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H](OC)c1ccccc1 ZINC001617539052 1056846077 /nfs/dbraw/zinc/84/60/77/1056846077.db2.gz RICFTHIHYFOBSI-HXUWFJFHSA-N 1 0 313.441 4.382 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H](OC)c1ccccc1 ZINC001617539051 1056846795 /nfs/dbraw/zinc/84/67/95/1056846795.db2.gz RICFTHIHYFOBSI-FQEVSTJZSA-N 1 0 313.441 4.382 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)ccc1O)c1cc(F)ccc1OC ZINC000922620404 1057040677 /nfs/dbraw/zinc/04/06/77/1057040677.db2.gz BFDQLFIQYQPUOO-INIZCTEOSA-N 1 0 303.377 4.089 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC000766028834 1057127496 /nfs/dbraw/zinc/12/74/96/1057127496.db2.gz GZCKHZDPPVOATF-LJQANCHMSA-N 1 0 314.860 4.492 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)CCCO2 ZINC000766028273 1057127921 /nfs/dbraw/zinc/12/79/21/1057127921.db2.gz DIJCXPQNPNFFNV-HXUWFJFHSA-N 1 0 324.468 4.373 20 10 DICDRO C[C@H]([NH2+]C[C@H](O)CC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000766062160 1057266773 /nfs/dbraw/zinc/26/67/73/1057266773.db2.gz VJCYFFWYXXYGQK-QFBILLFUSA-N 1 0 318.505 4.125 20 10 DICDRO CSCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766071015 1057285081 /nfs/dbraw/zinc/28/50/81/1057285081.db2.gz HORMQXKHUGCWEB-AWEZNQCLSA-N 1 0 310.482 4.220 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccc2c(c1)COC2 ZINC000766072725 1057285222 /nfs/dbraw/zinc/28/52/22/1057285222.db2.gz MHVWJCHQLSJTFW-LBPRGKRZSA-N 1 0 320.483 4.006 20 10 DICDRO CSC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766073504 1057286241 /nfs/dbraw/zinc/28/62/41/1057286241.db2.gz AMOILEOHVQSXKC-KBPBESRZSA-N 1 0 310.482 4.218 20 10 DICDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]CCCSc1nccs1 ZINC000766074675 1057287093 /nfs/dbraw/zinc/28/70/93/1057287093.db2.gz ZDKJLNGEJMAVHT-HNNXBMFYSA-N 1 0 304.484 4.211 20 10 DICDRO CC[C@@H](COC)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766093058 1057323709 /nfs/dbraw/zinc/32/37/09/1057323709.db2.gz GZRJJXFXPLSYJH-AEFFLSMTSA-N 1 0 304.478 4.143 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1OCC1CC1)c1ccc(N(C)C)cc1 ZINC000766107667 1057345386 /nfs/dbraw/zinc/34/53/86/1057345386.db2.gz FTYSQXXWCCUSKF-INIZCTEOSA-N 1 0 324.468 4.392 20 10 DICDRO C[N@H+](Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)[C@@H]1CCOC1 ZINC000730259789 1057709878 /nfs/dbraw/zinc/70/98/78/1057709878.db2.gz DDMSURBSQSWPJO-MRXNPFEDSA-N 1 0 319.489 4.208 20 10 DICDRO CN(CC[N@H+](C)Cc1c(O)ccc2ccccc21)c1ccccc1 ZINC000730803497 1057725875 /nfs/dbraw/zinc/72/58/75/1057725875.db2.gz KVMGPPSRKZDNDQ-UHFFFAOYSA-N 1 0 320.436 4.114 20 10 DICDRO C[N@H+](Cc1ccc(SC(F)F)cc1)Cc1ccccc1O ZINC000731842816 1057756769 /nfs/dbraw/zinc/75/67/69/1057756769.db2.gz HMQNCBDPMVHHDM-UHFFFAOYSA-N 1 0 309.381 4.339 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000732233193 1057771489 /nfs/dbraw/zinc/77/14/89/1057771489.db2.gz XLYMVTASYOGUPM-IRXDYDNUSA-N 1 0 301.817 4.472 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2CC(C)(c3ccccc3)C2)c1 ZINC000733326637 1057812789 /nfs/dbraw/zinc/81/27/89/1057812789.db2.gz QCKQWFYNTWAZDK-UHFFFAOYSA-N 1 0 311.425 4.001 20 10 DICDRO CC(C)c1ccccc1OCC[NH2+]Cc1c(O)cccc1Cl ZINC000733328645 1057813687 /nfs/dbraw/zinc/81/36/87/1057813687.db2.gz XCIPVTVDDQAPTJ-UHFFFAOYSA-N 1 0 319.832 4.338 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1cc2c(s1)CCCC2 ZINC000733327230 1057813778 /nfs/dbraw/zinc/81/37/78/1057813778.db2.gz QCXZWDSMXHJGKS-UHFFFAOYSA-N 1 0 307.846 4.276 20 10 DICDRO Cc1[nH]c2ccccc2c1CC[NH2+]Cc1c(O)cccc1Cl ZINC000733327485 1057814032 /nfs/dbraw/zinc/81/40/32/1057814032.db2.gz ZJTLMTDRBWYISP-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H](C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000733326282 1057814063 /nfs/dbraw/zinc/81/40/63/1057814063.db2.gz UHDNLIMTXNSJHK-ZDUSSCGKSA-N 1 0 323.358 4.440 20 10 DICDRO C[NH2+]Cc1cccc(-c2ccc(-n3c(C)ccc3C)nc2)c1F ZINC001244860156 1058058778 /nfs/dbraw/zinc/05/87/78/1058058778.db2.gz IXJSNAOMVZOBEQ-UHFFFAOYSA-N 1 0 309.388 4.015 20 10 DICDRO C[C@H](CSc1ccc(Cl)cc1)[NH2+]Cc1ccc(N)cc1 ZINC001246170389 1058711941 /nfs/dbraw/zinc/71/19/41/1058711941.db2.gz KHJNQPJRJJCDRE-GFCCVEGCSA-N 1 0 306.862 4.193 20 10 DICDRO C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccc(N)cc1 ZINC001246175140 1058720360 /nfs/dbraw/zinc/72/03/60/1058720360.db2.gz YIYMZAZHOAEGHL-LBPRGKRZSA-N 1 0 308.347 4.008 20 10 DICDRO C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]CCc1ccc(N)cc1 ZINC001246464111 1058949819 /nfs/dbraw/zinc/94/98/19/1058949819.db2.gz FYJJXJYIPFBHKO-GFCCVEGCSA-N 1 0 323.267 4.339 20 10 DICDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCC2(CCC2)O1 ZINC001559492581 1059271063 /nfs/dbraw/zinc/27/10/63/1059271063.db2.gz VQPZLZZPZMBRTR-IBGZPJMESA-N 1 0 316.489 4.065 20 10 DICDRO CCN(C)c1ccc(C[N@H+](CC)CCc2cccs2)cc1 ZINC001559503259 1059285817 /nfs/dbraw/zinc/28/58/17/1059285817.db2.gz YUWYZWNSLDBIBO-UHFFFAOYSA-N 1 0 302.487 4.269 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)ccc1N(C)C ZINC001559561072 1059381750 /nfs/dbraw/zinc/38/17/50/1059381750.db2.gz YFBDSZSWNPIPSZ-HXUWFJFHSA-N 1 0 308.469 4.126 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)CC[C@@H]1c1ccccc1 ZINC001559565166 1059389680 /nfs/dbraw/zinc/38/96/80/1059389680.db2.gz GFNTWWQOYUUEJG-UWJYYQICSA-N 1 0 308.469 4.378 20 10 DICDRO CCC[C@@H](O)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC001559659038 1059488441 /nfs/dbraw/zinc/48/84/41/1059488441.db2.gz YOKAFZMGYDKLQL-VQIMIIECSA-N 1 0 313.441 4.116 20 10 DICDRO COc1ccc(C[NH2+][C@@H](Cc2ccc(F)cc2)C(C)C)cc1C ZINC001559705736 1059532419 /nfs/dbraw/zinc/53/24/19/1059532419.db2.gz YDWCQVDPHCYQDS-IBGZPJMESA-N 1 0 315.432 4.500 20 10 DICDRO CCN(C)c1ccc(C[N@H+](C)CCc2ccc(Cl)cc2)cc1 ZINC001559706300 1059535991 /nfs/dbraw/zinc/53/59/91/1059535991.db2.gz MUCDPAYGJUKFLB-UHFFFAOYSA-N 1 0 316.876 4.471 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)CC(C)(C)C ZINC001559709684 1059538045 /nfs/dbraw/zinc/53/80/45/1059538045.db2.gz NPQVMBHYIAUXKM-IRXDYDNUSA-N 1 0 318.505 4.246 20 10 DICDRO Cc1cc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)ccc1N(C)C ZINC001559714399 1059541051 /nfs/dbraw/zinc/54/10/51/1059541051.db2.gz VKQZSJBFYPSXHM-UHFFFAOYSA-N 1 0 308.469 4.354 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCCCC2)c(C)c1)[C@@H]1CCCO1 ZINC001559738032 1059571098 /nfs/dbraw/zinc/57/10/98/1059571098.db2.gz UHDOAVMJQSDPGY-ICSRJNTNSA-N 1 0 316.489 4.033 20 10 DICDRO CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001559761785 1059596428 /nfs/dbraw/zinc/59/64/28/1059596428.db2.gz DVRZKBGEWDQBEA-SJLPKXTDSA-N 1 0 306.519 4.215 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH+]2CCC(C3CCC3)CC2)c1O ZINC001559983092 1059788724 /nfs/dbraw/zinc/78/87/24/1059788724.db2.gz HBMKFDLVQGJNTD-UHFFFAOYSA-N 1 0 321.848 4.260 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@]2(C)C2CCCCC2)c1O ZINC001560096103 1059905020 /nfs/dbraw/zinc/90/50/20/1059905020.db2.gz LXIRUPBGGIQQHH-LJQANCHMSA-N 1 0 319.420 4.279 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C/C=C/c2ccccc2OC)cc1 ZINC001560274861 1060049910 /nfs/dbraw/zinc/04/99/10/1060049910.db2.gz RSTMTMZNIWSEGQ-CSKARUKUSA-N 1 0 324.468 4.344 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)COc2ccccc2)cc1C ZINC001560295933 1060080969 /nfs/dbraw/zinc/08/09/69/1060080969.db2.gz UUJIMYNRWJNJPY-QGZVFWFLSA-N 1 0 313.441 4.341 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)cc1 ZINC001560327443 1060115683 /nfs/dbraw/zinc/11/56/83/1060115683.db2.gz KGIJYEMQKCIXLW-INIZCTEOSA-N 1 0 314.477 4.161 20 10 DICDRO Cc1ccc(C[C@@H](C)[NH2+]C/C=C/c2ccc(N(C)C)cc2)s1 ZINC001560342836 1060128131 /nfs/dbraw/zinc/12/81/31/1060128131.db2.gz ITEWTSXMOATRDK-LLYBFZRZSA-N 1 0 314.498 4.357 20 10 DICDRO Fc1ccc(/C=C\C[NH2+]CCCSc2nccs2)cc1 ZINC001560348028 1060135681 /nfs/dbraw/zinc/13/56/81/1060135681.db2.gz IKZVMMDBHTUTDS-IWQZZHSRSA-N 1 0 308.447 4.067 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc(N2CCCC2)cc1)Cc1cccs1 ZINC001560360498 1060148325 /nfs/dbraw/zinc/14/83/25/1060148325.db2.gz PBPDMOZWPLIAPU-INIZCTEOSA-N 1 0 314.498 4.317 20 10 DICDRO COc1ccc(C[NH2+]Cc2cc(C)ccc2OC(F)F)cc1C ZINC001560395423 1060180149 /nfs/dbraw/zinc/18/01/49/1060180149.db2.gz NWYOPKFQLWZTLS-UHFFFAOYSA-N 1 0 321.367 4.203 20 10 DICDRO CCOc1cc(C)ccc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC001560394795 1060181485 /nfs/dbraw/zinc/18/14/85/1060181485.db2.gz NOIJAASTULFWLR-UHFFFAOYSA-N 1 0 322.452 4.484 20 10 DICDRO Cc1cccc(C)c1C[NH2+]Cc1c(O)cccc1Br ZINC001560410652 1060194979 /nfs/dbraw/zinc/19/49/79/1060194979.db2.gz JSHHGTDMWZPZCJ-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO C[N@H+](Cc1cccs1)Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249245008 1060200385 /nfs/dbraw/zinc/20/03/85/1060200385.db2.gz UBKREYIJNWCEIF-UHFFFAOYSA-N 1 0 315.438 4.270 20 10 DICDRO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001560415974 1060200673 /nfs/dbraw/zinc/20/06/73/1060200673.db2.gz HQYJHDNMKPYLPF-QVKFZJNVSA-N 1 0 307.437 4.425 20 10 DICDRO C[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001560416687 1060201860 /nfs/dbraw/zinc/20/18/60/1060201860.db2.gz VQEUGTDEDCDTCC-VBKZILBWSA-N 1 0 312.432 4.305 20 10 DICDRO CCO[C@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)c1ccccc1 ZINC001560456856 1060248282 /nfs/dbraw/zinc/24/82/82/1060248282.db2.gz JRXKQLPNPDVUKM-GOSISDBHSA-N 1 0 319.832 4.221 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCCc2ccccc2F)cc1 ZINC001560460526 1060249851 /nfs/dbraw/zinc/24/98/51/1060249851.db2.gz OZPJQRWPAMJTNF-UHFFFAOYSA-N 1 0 314.448 4.394 20 10 DICDRO C[C@@H]1CC[C@H]1[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560466078 1060258732 /nfs/dbraw/zinc/25/87/32/1060258732.db2.gz SKYNBSJTWGBTAF-OXQOHEQNSA-N 1 0 306.453 4.137 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](CO)CC2CCCCC2)cc1C ZINC001560510247 1060306186 /nfs/dbraw/zinc/30/61/86/1060306186.db2.gz LGKALDZTPHWHSE-LJQANCHMSA-N 1 0 319.489 4.205 20 10 DICDRO COc1cc(C[NH2+][C@H]2CCC[C@@H](F)C2)c(O)c(C(C)(C)C)c1 ZINC001560516050 1060314814 /nfs/dbraw/zinc/31/48/14/1060314814.db2.gz RILDIDHXUUJEHW-KGLIPLIRSA-N 1 0 309.425 4.069 20 10 DICDRO CC[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001560533150 1060335386 /nfs/dbraw/zinc/33/53/86/1060335386.db2.gz IHDOGESAQTZFEV-SFHVURJKSA-N 1 0 314.448 4.393 20 10 DICDRO Cc1cc(CC[NH2+]Cc2ccncc2C)c(C)n1-c1ccccc1 ZINC001560550950 1060359687 /nfs/dbraw/zinc/35/96/87/1060359687.db2.gz QTBKLRCOFADSJL-UHFFFAOYSA-N 1 0 319.452 4.130 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH2+]C[C@H]2C=CCC2)cc1 ZINC001560571540 1060383245 /nfs/dbraw/zinc/38/32/45/1060383245.db2.gz XTMBBTHFNUDCNV-INIZCTEOSA-N 1 0 312.482 4.440 20 10 DICDRO CCOc1c(Cl)cccc1C[NH2+][C@@H](C)c1ccccc1O ZINC001560575947 1060388157 /nfs/dbraw/zinc/38/81/57/1060388157.db2.gz WKYVIEIWMIEYSR-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO CCSc1ccccc1CC[NH2+]Cc1c(O)cccc1Cl ZINC001560582593 1060396731 /nfs/dbraw/zinc/39/67/31/1060396731.db2.gz MLVKKLCCIZYXQE-UHFFFAOYSA-N 1 0 321.873 4.490 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CC(C)(C)OC1(C)C ZINC001560600991 1060414503 /nfs/dbraw/zinc/41/45/03/1060414503.db2.gz IZQVIBPPANIZPP-HNNXBMFYSA-N 1 0 314.473 4.170 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCOC23CCCCC3)cc1 ZINC001560607743 1060421553 /nfs/dbraw/zinc/42/15/53/1060421553.db2.gz NAULRDDDVPSAIU-IBGZPJMESA-N 1 0 316.489 4.114 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1cc(Cl)cc(Cl)c1F ZINC001249941759 1060496488 /nfs/dbraw/zinc/49/64/88/1060496488.db2.gz MKZSXIASFUGQRD-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2c(O)cc(C)cc2Cl)cc1F ZINC001560669826 1060500906 /nfs/dbraw/zinc/50/09/06/1060500906.db2.gz FJZLRUOZUDIUMW-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2c(O)cc(C)cc2Cl)C1 ZINC001560676649 1060514326 /nfs/dbraw/zinc/51/43/26/1060514326.db2.gz IGSGAMGABYAALR-STQMWFEESA-N 1 0 313.894 4.460 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC001560719159 1060580321 /nfs/dbraw/zinc/58/03/21/1060580321.db2.gz WVKCLPJGQIXHJC-QGZVFWFLSA-N 1 0 300.471 4.460 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@@H](OC(C)C)C2(C)C)cc1Cl ZINC001560737119 1060606331 /nfs/dbraw/zinc/60/63/31/1060606331.db2.gz SQTWBPCLOVFDJR-JKSUJKDBSA-N 1 0 311.853 4.036 20 10 DICDRO Cc1cc(C[NH+](C(C)C)C(C)C)c(O)cc1Br ZINC001250116930 1060623289 /nfs/dbraw/zinc/62/32/89/1060623289.db2.gz ISQRRRFFLGCZRI-UHFFFAOYSA-N 1 0 300.240 4.082 20 10 DICDRO Cc1cc(C[NH+]2CC3CCC(CC3)C2)c(O)cc1Br ZINC001250134026 1060637320 /nfs/dbraw/zinc/63/73/20/1060637320.db2.gz VUXXTCNIPAGLCG-UHFFFAOYSA-N 1 0 324.262 4.085 20 10 DICDRO Cc1cc(F)cc2c1C[N@H+](C/C=C/c1ccc(N(C)C)cc1)CC2 ZINC001560783783 1060644866 /nfs/dbraw/zinc/64/48/66/1060644866.db2.gz LUVBXKGJNPBCGK-SNAWJCMRSA-N 1 0 324.443 4.272 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC3(CCC3)C2)c(C(F)(F)F)c1 ZINC001560796653 1060656643 /nfs/dbraw/zinc/65/66/43/1060656643.db2.gz HAINGVTUNJHKEW-UHFFFAOYSA-N 1 0 312.379 4.147 20 10 DICDRO CCCN(Cc1ccc(OCC)c(F)c1)c1ccc(C[NH3+])cc1 ZINC001560808666 1060668279 /nfs/dbraw/zinc/66/82/79/1060668279.db2.gz MYZSHFQZZQVKAC-UHFFFAOYSA-N 1 0 316.420 4.100 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)C1CC(C)(c2ccccc2)C1 ZINC001560809142 1060668834 /nfs/dbraw/zinc/66/88/34/1060668834.db2.gz ZEPOJBOQONRMMJ-UHFFFAOYSA-N 1 0 308.469 4.482 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1Cc2ccccc2C2(CCC2)C1 ZINC001560823301 1060681744 /nfs/dbraw/zinc/68/17/44/1060681744.db2.gz BSQAXBVNBPESJL-UHFFFAOYSA-N 1 0 313.828 4.483 20 10 DICDRO CCC1(CC)C[NH+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC001560874993 1060736414 /nfs/dbraw/zinc/73/64/14/1060736414.db2.gz VZBQKPPRXBRLOP-UHFFFAOYSA-N 1 0 305.462 4.320 20 10 DICDRO C[N@H+](Cc1ccc2ccccc2c1O)C1CC(OC(C)(C)C)C1 ZINC001560892872 1060753256 /nfs/dbraw/zinc/75/32/56/1060753256.db2.gz ZHNXKHNSPONBDS-UHFFFAOYSA-N 1 0 313.441 4.323 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CC[C@@H]2CCC[C@@H]21 ZINC001560890782 1060754651 /nfs/dbraw/zinc/75/46/51/1060754651.db2.gz QMKRFBRCCRQCQG-FVCZOJIISA-N 1 0 300.490 4.160 20 10 DICDRO COc1ccc(C[N@H+](C)[C@@H]2CCC[C@@H]2C(C)(C)C)c(O)c1OC ZINC001560893125 1060757213 /nfs/dbraw/zinc/75/72/13/1060757213.db2.gz GZIBNMWBDVKNMS-LSDHHAIUSA-N 1 0 321.461 4.056 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001560921636 1060786073 /nfs/dbraw/zinc/78/60/73/1060786073.db2.gz TVLMDOJFIDGTHB-LJQANCHMSA-N 1 0 300.490 4.463 20 10 DICDRO COc1cc(C[NH2+]Cc2cc(C)ccc2O)cc2ccccc21 ZINC001560937550 1060802561 /nfs/dbraw/zinc/80/25/61/1060802561.db2.gz HEHSINJGTHHQGF-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO CCc1ccc2c(c1)C[N@@H+](Cc1ccc(N(C)C)cc1C)CC2 ZINC001561055602 1060904715 /nfs/dbraw/zinc/90/47/15/1060904715.db2.gz RCNBFWQSXOSGOB-UHFFFAOYSA-N 1 0 308.469 4.182 20 10 DICDRO CC[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)c(C)c2)CCS1 ZINC001473191431 1060950683 /nfs/dbraw/zinc/95/06/83/1060950683.db2.gz ADMIKCDXOJWVBU-SFHVURJKSA-N 1 0 318.530 4.313 20 10 DICDRO CCc1cccc(C[NH2+]CCCc2cccc(Cl)c2)c1O ZINC001462174832 1060993081 /nfs/dbraw/zinc/99/30/81/1060993081.db2.gz LQXSLLQNQOHMJO-UHFFFAOYSA-N 1 0 303.833 4.330 20 10 DICDRO COc1cc(C)cc(C[NH2+]CCCc2cccc(Cl)c2)c1O ZINC001462173704 1060993312 /nfs/dbraw/zinc/99/33/12/1060993312.db2.gz GOISDWGTWWHVSL-UHFFFAOYSA-N 1 0 319.832 4.085 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)[C@@H](C)C2CCCCC2)c1O ZINC001462178231 1060996911 /nfs/dbraw/zinc/99/69/11/1060996911.db2.gz LXAQCJJCQOEURS-LBPRGKRZSA-N 1 0 311.853 4.455 20 10 DICDRO C[N@H+](Cc1cccn1C1CC1)Cc1ccc(N2CCCC2)cc1 ZINC001462205558 1061028023 /nfs/dbraw/zinc/02/80/23/1061028023.db2.gz HJUBHUHMOIZLNF-UHFFFAOYSA-N 1 0 309.457 4.055 20 10 DICDRO CC[C@@H](CCc1ccccc1)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC001462211087 1061030157 /nfs/dbraw/zinc/03/01/57/1061030157.db2.gz UFURFUJTUQEHMO-WBVHZDCISA-N 1 0 313.441 4.463 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nccc3ccccc32)c1 ZINC001462211059 1061030173 /nfs/dbraw/zinc/03/01/73/1061030173.db2.gz SZTKTJRQHWFYFL-UONOGXRCSA-N 1 0 322.408 4.361 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2C[C@H](C(C)C)[C@@H]2C(C)C)c1O ZINC001462228823 1061040649 /nfs/dbraw/zinc/04/06/49/1061040649.db2.gz AZYXBDUKCCUGFY-ZBFHGGJFSA-N 1 0 311.853 4.167 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]C1(c2cccc(Cl)c2)CCC1 ZINC001462370102 1061133759 /nfs/dbraw/zinc/13/37/59/1061133759.db2.gz WDPWABSJHXTEAF-UHFFFAOYSA-N 1 0 305.780 4.354 20 10 DICDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC001462392827 1061145502 /nfs/dbraw/zinc/14/55/02/1061145502.db2.gz HIIXVRZIGVHXCV-STQMWFEESA-N 1 0 319.832 4.336 20 10 DICDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC001462392819 1061146078 /nfs/dbraw/zinc/14/60/78/1061146078.db2.gz HIIXVRZIGVHXCV-QWHCGFSZSA-N 1 0 319.832 4.336 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cc(Cl)ccc2O)c(Cl)c1 ZINC001462396484 1061147429 /nfs/dbraw/zinc/14/74/29/1061147429.db2.gz QLPRXKAGEUDUQM-UHFFFAOYSA-N 1 0 312.196 4.003 20 10 DICDRO Cc1ccc(C[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)c(O)c1 ZINC001462402087 1061152210 /nfs/dbraw/zinc/15/22/10/1061152210.db2.gz FOEIOPWXMOLKLW-MRXNPFEDSA-N 1 0 315.388 4.232 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCCN1C(C)C ZINC001473424275 1061153843 /nfs/dbraw/zinc/15/38/43/1061153843.db2.gz JSBQDEPIXHDTHM-IBGZPJMESA-N 1 0 318.505 4.257 20 10 DICDRO CCC[N@H+](Cc1ccccc1F)Cc1c(C)cc(OC)cc1O ZINC001462438571 1061174361 /nfs/dbraw/zinc/17/43/61/1061174361.db2.gz DHJKYOFHKSHJOR-UHFFFAOYSA-N 1 0 317.404 4.261 20 10 DICDRO Cc1cc(C[NH2+][C@H]2CCCSCC2)c(C)n1-c1ccccc1 ZINC001462513813 1061223883 /nfs/dbraw/zinc/22/38/83/1061223883.db2.gz ZRVKUZMAUUHDBP-SFHVURJKSA-N 1 0 314.498 4.469 20 10 DICDRO C[C@H](CCc1ccc(F)cc1F)[NH2+][C@@H](C)c1ccccc1O ZINC001462514277 1061223966 /nfs/dbraw/zinc/22/39/66/1061223966.db2.gz QWLZNJXLTCKTJP-OLZOCXBDSA-N 1 0 305.368 4.342 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C2([C@H]3CCCCO3)CCC2)c1 ZINC001462529464 1061238703 /nfs/dbraw/zinc/23/87/03/1061238703.db2.gz HLRJPBLMNBYDBO-GOSISDBHSA-N 1 0 303.446 4.097 20 10 DICDRO COc1ccc(N(CCC[NH+]2CCCCC2)CC(C)C)cc1 ZINC001473560275 1061245773 /nfs/dbraw/zinc/24/57/73/1061245773.db2.gz ULGAORMHLBIULS-UHFFFAOYSA-N 1 0 304.478 4.034 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]Cc2cscc2Cl)c1O ZINC001462588930 1061283535 /nfs/dbraw/zinc/28/35/35/1061283535.db2.gz QVPYGNXRNNHPRS-UHFFFAOYSA-N 1 0 318.225 4.059 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@H]2CCOC23CCCCC3)c1 ZINC001462624680 1061304379 /nfs/dbraw/zinc/30/43/79/1061304379.db2.gz RDWWNYVNKXQEEO-SFHVURJKSA-N 1 0 303.446 4.097 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@H]2C[C@H]2Cc2ccccc2)c1 ZINC001462660232 1061323059 /nfs/dbraw/zinc/32/30/59/1061323059.db2.gz IZDLZACAYFMPKP-RTBURBONSA-N 1 0 309.453 4.484 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@H](C3CCCC3)C2)c(O)c1 ZINC001462679154 1061335305 /nfs/dbraw/zinc/33/53/05/1061335305.db2.gz TWCBQPMRCRLOJD-INIZCTEOSA-N 1 0 303.446 4.111 20 10 DICDRO CSC1CC[NH+](Cc2ccc(N3CCCCC3)c(C)c2)CC1 ZINC001473705219 1061358352 /nfs/dbraw/zinc/35/83/52/1061358352.db2.gz WERKXNBGBFHUGQ-UHFFFAOYSA-N 1 0 318.530 4.313 20 10 DICDRO CCOc1cccc(Cl)c1C[NH2+][C@@H](C)c1ccccc1O ZINC001473724539 1061373292 /nfs/dbraw/zinc/37/32/92/1061373292.db2.gz VALKLWZXXJMTIH-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCC[C@@H]2Cc2ccc(O)cc2)cc1 ZINC001473875738 1061445820 /nfs/dbraw/zinc/44/58/20/1061445820.db2.gz WZVVGYSUILIRHS-HXUWFJFHSA-N 1 0 324.468 4.055 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc1F ZINC001473918318 1061465080 /nfs/dbraw/zinc/46/50/80/1061465080.db2.gz PSTADSIMHOWSLB-IIAWOOMASA-N 1 0 322.443 4.479 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)cc1F ZINC001473918319 1061465833 /nfs/dbraw/zinc/46/58/33/1061465833.db2.gz PSTADSIMHOWSLB-IJEWVQPXSA-N 1 0 322.443 4.479 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCc2ccc(Cl)s2)cc1 ZINC001473937880 1061482291 /nfs/dbraw/zinc/48/22/91/1061482291.db2.gz QVDTXUVFJMDXGJ-ONEGZZNKSA-N 1 0 320.889 4.313 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCc2ccc(Cl)s2)cc1 ZINC001473937879 1061483126 /nfs/dbraw/zinc/48/31/26/1061483126.db2.gz QVDTXUVFJMDXGJ-ARJAWSKDSA-N 1 0 320.889 4.313 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)Cc2ccccc2F)c(Cl)c1 ZINC001473952019 1061493966 /nfs/dbraw/zinc/49/39/66/1061493966.db2.gz JRXLUZOJGQBFPG-GFCCVEGCSA-N 1 0 307.796 4.214 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2Cc3ccccc32)cc1F ZINC001473986202 1061529027 /nfs/dbraw/zinc/52/90/27/1061529027.db2.gz PSDLWDICVZLAJO-QGZVFWFLSA-N 1 0 312.432 4.101 20 10 DICDRO CC(C)[C@@H]1CCC[C@H]([NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001473986821 1061529178 /nfs/dbraw/zinc/52/91/78/1061529178.db2.gz QVVIFCUBBRAYNP-HIFRSBDPSA-N 1 0 310.432 4.335 20 10 DICDRO Cc1cccc2c1CC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001473991130 1061535753 /nfs/dbraw/zinc/53/57/53/1061535753.db2.gz AAHJFZVTWMDRRB-OAQYLSRUSA-N 1 0 306.453 4.372 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H](C)SC2)cc1F ZINC001473994797 1061538482 /nfs/dbraw/zinc/53/84/82/1061538482.db2.gz GCSPMPUGZRQGMC-HIFRSBDPSA-N 1 0 310.482 4.046 20 10 DICDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC001474037261 1061579197 /nfs/dbraw/zinc/57/91/97/1061579197.db2.gz BXWAHYWRUBGRQC-WSNITJDQSA-N 1 0 316.395 4.395 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H](c2cccnc2)C(C)C)c(Cl)c1 ZINC001474040082 1061586913 /nfs/dbraw/zinc/58/69/13/1061586913.db2.gz QIPAWXGHVBUJRE-HNNXBMFYSA-N 1 0 318.848 4.278 20 10 DICDRO CCC(CC)(CC)C[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC001474066488 1061614019 /nfs/dbraw/zinc/61/40/19/1061614019.db2.gz WOKBUQSQQFQRQE-UHFFFAOYSA-N 1 0 318.505 4.470 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)cc1C ZINC001474099244 1061645035 /nfs/dbraw/zinc/64/50/35/1061645035.db2.gz IJXVBGUBTVYTMO-MJGOQNOKSA-N 1 0 319.489 4.467 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](CC)[C@@H]2CCCO2)cc1 ZINC001474099235 1061645534 /nfs/dbraw/zinc/64/55/34/1061645534.db2.gz IEILFENISWDFNO-PMACEKPBSA-N 1 0 318.505 4.360 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCCc3sccc32)cc1 ZINC001474102762 1061650603 /nfs/dbraw/zinc/65/06/03/1061650603.db2.gz OAXZNEVQJZMNEL-PYTPGESOSA-N 1 0 312.482 4.495 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H](C)c2ncc(C)s2)cc1 ZINC001474106420 1061655413 /nfs/dbraw/zinc/65/54/13/1061655413.db2.gz UCUUWMZFRNFSBL-AWEZNQCLSA-N 1 0 317.502 4.191 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2cc3ccccc3[nH]2)cc1 ZINC001474144839 1061691126 /nfs/dbraw/zinc/69/11/26/1061691126.db2.gz DIXBCJJHEUEWJK-WAYWQWQTSA-N 1 0 305.425 4.037 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2cc(C)ccc2F)cc1 ZINC001474148794 1061693505 /nfs/dbraw/zinc/69/35/05/1061693505.db2.gz GGWFZYXLTUCATN-UHFFFAOYSA-N 1 0 314.448 4.313 20 10 DICDRO Cc1cc(O)c(CNc2cc3c(c[nH+]2)CCCC3)c(Cl)c1 ZINC001474159263 1061701877 /nfs/dbraw/zinc/70/18/77/1061701877.db2.gz IOPKEJFBORAPRV-UHFFFAOYSA-N 1 0 302.805 4.240 20 10 DICDRO CCOCc1cc(C[NH2+][C@]2(C)CCCC[C@@H]2C)ccc1OC ZINC001474169227 1061716262 /nfs/dbraw/zinc/71/62/62/1061716262.db2.gz AJNDJTBMBCMRQH-HNAYVOBHSA-N 1 0 305.462 4.290 20 10 DICDRO C[C@](Cc1ccccc1)([NH2+]Cc1ccc2c(c1)CCO2)C1CC1 ZINC001474182213 1061729934 /nfs/dbraw/zinc/72/99/34/1061729934.db2.gz CXSWMAGTZUUWFC-OAQYLSRUSA-N 1 0 307.437 4.123 20 10 DICDRO CCc1ccc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)s1 ZINC001474185026 1061733984 /nfs/dbraw/zinc/73/39/84/1061733984.db2.gz MCBROXQMCXDFPY-HNNXBMFYSA-N 1 0 316.514 4.406 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)c(F)c1 ZINC001474185594 1061734275 /nfs/dbraw/zinc/73/42/75/1061734275.db2.gz UKGNVFOFJQPEHN-INIZCTEOSA-N 1 0 314.448 4.229 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1N)c1ccccc1O ZINC001474253929 1061822594 /nfs/dbraw/zinc/82/25/94/1061822594.db2.gz ZCURDMGVOHEYHC-SECBINFHSA-N 1 0 311.212 4.132 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@H]2CCC(F)(F)C2)cc1 ZINC001474292630 1061861509 /nfs/dbraw/zinc/86/15/09/1061861509.db2.gz MYZIBWLOJKKLFK-OAHLLOKOSA-N 1 0 310.432 4.448 20 10 DICDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001474309490 1061875471 /nfs/dbraw/zinc/87/54/71/1061875471.db2.gz HPKWKHMTWUTTAD-QWHCGFSZSA-N 1 0 314.395 4.392 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCN(C)C[C@@H]2c2ccccc2)c1 ZINC001474308054 1061878001 /nfs/dbraw/zinc/87/80/01/1061878001.db2.gz ZSMJRSFRKIFWBV-HXUWFJFHSA-N 1 0 324.468 4.004 20 10 DICDRO CCC[N@H+](Cc1cccc(CC)c1O)[C@H]1C[C@@H](OCC)C1(C)C ZINC001474316375 1061887847 /nfs/dbraw/zinc/88/78/47/1061887847.db2.gz AGZLHRLAJGFCPH-ZWKOTPCHSA-N 1 0 319.489 4.370 20 10 DICDRO Oc1cc(Cl)ccc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC001474330187 1061920238 /nfs/dbraw/zinc/92/02/38/1061920238.db2.gz LOYAFRJBTXYITI-UHFFFAOYSA-N 1 0 307.743 4.210 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC001474345172 1061944782 /nfs/dbraw/zinc/94/47/82/1061944782.db2.gz FIEQZUWNJSYPNE-LAEWNIMASA-N 1 0 322.452 4.309 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC001474345174 1061952505 /nfs/dbraw/zinc/95/25/05/1061952505.db2.gz FIEQZUWNJSYPNE-VEBBDIFPSA-N 1 0 322.452 4.309 20 10 DICDRO COc1ccc2cc(C[N@H+](C)Cc3ccc(C)cc3O)ccc2c1 ZINC001474353535 1061967814 /nfs/dbraw/zinc/96/78/14/1061967814.db2.gz RGZIBMWHLSQVIG-UHFFFAOYSA-N 1 0 321.420 4.494 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC001254010867 1062010643 /nfs/dbraw/zinc/01/06/43/1062010643.db2.gz OBVBFPAKQOXMJU-GHTZIAJQSA-N 1 0 323.436 4.060 20 10 DICDRO COc1cc(C[N@H+](C)[C@@H](C)c2ccco2)c(O)c(C(C)(C)C)c1 ZINC001474400923 1062058148 /nfs/dbraw/zinc/05/81/48/1062058148.db2.gz BTJPOPHSCPNACQ-ZDUSSCGKSA-N 1 0 317.429 4.484 20 10 DICDRO Cc1cnccc1C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC001474408744 1062073071 /nfs/dbraw/zinc/07/30/71/1062073071.db2.gz JLVVGYCWBSUSAF-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@H+](C)[C@H]2CCc3ccccc32)cc1 ZINC001474413026 1062076571 /nfs/dbraw/zinc/07/65/71/1062076571.db2.gz QYPIWSAQFMCZHS-BXKJMJEDSA-N 1 0 306.453 4.385 20 10 DICDRO CC[C@@H]1CCC[C@@H](CN(C)c2ccc(OCC[NH+](C)C)cc2)C1 ZINC001474421997 1062093490 /nfs/dbraw/zinc/09/34/90/1062093490.db2.gz PNHRKVNEBFDVDH-QZTJIDSGSA-N 1 0 318.505 4.280 20 10 DICDRO CCC[N@H+](CCc1cccs1)Cc1c(C)cc(OC)cc1O ZINC001474422724 1062093820 /nfs/dbraw/zinc/09/38/20/1062093820.db2.gz VXXLPGPAUQNYKO-UHFFFAOYSA-N 1 0 319.470 4.225 20 10 DICDRO CCc1ccccc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001459350200 1062103846 /nfs/dbraw/zinc/10/38/46/1062103846.db2.gz MMBBJOZRFGHMDN-UHFFFAOYSA-N 1 0 308.469 4.480 20 10 DICDRO COc1ccc(N2CCC[N@@H+]([C@@H](C)c3ccccc3C)CC2)cc1 ZINC001459350424 1062105063 /nfs/dbraw/zinc/10/50/63/1062105063.db2.gz OLOPFKAXMNYCPR-SFHVURJKSA-N 1 0 324.468 4.277 20 10 DICDRO CCc1cccc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c1O ZINC001474436518 1062112523 /nfs/dbraw/zinc/11/25/23/1062112523.db2.gz HRFYBTGKEDWICI-RISCZKNCSA-N 1 0 301.352 4.117 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@@H](C)CCC2CC2)c1O ZINC001474466856 1062146713 /nfs/dbraw/zinc/14/67/13/1062146713.db2.gz MXOVCLAGYJXAQF-NSHDSACASA-N 1 0 312.251 4.131 20 10 DICDRO COC[C@H](C[N@H+](Cc1ccccc1O)C1CCCC1)C(C)C ZINC001459467349 1062153842 /nfs/dbraw/zinc/15/38/42/1062153842.db2.gz MENGLOXWFDECDE-KRWDZBQOSA-N 1 0 305.462 4.055 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)cc1Cl ZINC001474475014 1062154588 /nfs/dbraw/zinc/15/45/88/1062154588.db2.gz UVBRQMQOMNTNMP-GOSISDBHSA-N 1 0 319.807 4.425 20 10 DICDRO CCCN(C[C@@H](C)c1ccc(F)cc1)c1ccc(C[NH3+])cc1 ZINC001474495035 1062175312 /nfs/dbraw/zinc/17/53/12/1062175312.db2.gz JKYUJKBBYTVCGK-OAHLLOKOSA-N 1 0 300.421 4.305 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)[C@H](OC)c1ccccc1 ZINC001474496232 1062175990 /nfs/dbraw/zinc/17/59/90/1062175990.db2.gz RUOFOAHIZFBBRP-JXFKEZNVSA-N 1 0 312.457 4.138 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1C[C@H](OC(C)(C)C)C1(C)C ZINC001474494971 1062177294 /nfs/dbraw/zinc/17/72/94/1062177294.db2.gz HEEUNYMRLKFMDJ-ROUUACIJSA-N 1 0 318.505 4.344 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[NH+]2CC(C3CC3)C2)cc1 ZINC001474548441 1062243830 /nfs/dbraw/zinc/24/38/30/1062243830.db2.gz ARGHWAZRVBDGRV-UHFFFAOYSA-N 1 0 312.482 4.226 20 10 DICDRO COc1cc(C)c(C[NH2+]Cc2ccc(C)c3ccccc23)c(O)c1 ZINC001474582027 1062290141 /nfs/dbraw/zinc/29/01/41/1062290141.db2.gz RTNMKMMFXGGQEP-UHFFFAOYSA-N 1 0 321.420 4.461 20 10 DICDRO COc1cc(C[N@@H+]2C[C@H](C)[C@@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001474588819 1062299364 /nfs/dbraw/zinc/29/93/64/1062299364.db2.gz MWRJRNUFYSARHB-BFHYXJOUSA-N 1 0 305.462 4.175 20 10 DICDRO CCN(C)c1ccc(C[NH+]2CCC(c3ccc(O)cc3)CC2)cc1 ZINC001459686336 1062308126 /nfs/dbraw/zinc/30/81/26/1062308126.db2.gz NNRVSPNYPYDLPD-UHFFFAOYSA-N 1 0 324.468 4.228 20 10 DICDRO C[C@H](CCc1ccc(F)cc1)[NH2+]Cc1cc(Cl)ccc1O ZINC001474608575 1062321344 /nfs/dbraw/zinc/32/13/44/1062321344.db2.gz GWJFJDNNJULDOV-GFCCVEGCSA-N 1 0 307.796 4.296 20 10 DICDRO CC(C)(C)O[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)C1(C)C ZINC001474608810 1062322601 /nfs/dbraw/zinc/32/26/01/1062322601.db2.gz JUYABYCVRZWZFT-GJZGRUSLSA-N 1 0 311.853 4.117 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)Cc2ccc(C3CC3)cc2)cc1 ZINC001474613028 1062331149 /nfs/dbraw/zinc/33/11/49/1062331149.db2.gz VCWSQEJQHWXMPJ-UHFFFAOYSA-N 1 0 324.468 4.141 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)CC2(CCCC2)O1 ZINC001474614223 1062331713 /nfs/dbraw/zinc/33/17/13/1062331713.db2.gz PNDSKDIWYKLBDF-HNNXBMFYSA-N 1 0 311.425 4.079 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+]CCC3CCCCCC3)C2)cc1 ZINC001474624082 1062346858 /nfs/dbraw/zinc/34/68/58/1062346858.db2.gz JVFXCFQUJJGJCC-SFHVURJKSA-N 1 0 316.489 4.224 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@H](c3ccc(F)c(F)c3)C2)c(O)c1 ZINC001474642101 1062367966 /nfs/dbraw/zinc/36/79/66/1062367966.db2.gz LKIBMZVERCDWAG-HNNXBMFYSA-N 1 0 317.379 4.358 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H]2CCCC[C@H]2C(C)(C)C)c1O ZINC001459790406 1062402824 /nfs/dbraw/zinc/40/28/24/1062402824.db2.gz DNENQBFYKHLYKV-IAGOWNOFSA-N 1 0 321.436 4.428 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1c2ccccc2CC[C@@H]1F ZINC001474680216 1062410577 /nfs/dbraw/zinc/41/05/77/1062410577.db2.gz VGUXPAVQYLEZKW-VQTJNVASSA-N 1 0 312.432 4.176 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1c2ccccc2CC[C@H]1F ZINC001474680218 1062410608 /nfs/dbraw/zinc/41/06/08/1062410608.db2.gz VGUXPAVQYLEZKW-WOJBJXKFSA-N 1 0 312.432 4.176 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)CCCC(=O)OC(C)(C)C)c1 ZINC001474737701 1062455074 /nfs/dbraw/zinc/45/50/74/1062455074.db2.gz BECNRVIVBQNVQT-UHFFFAOYSA-N 1 0 321.461 4.069 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC001255719222 1062538634 /nfs/dbraw/zinc/53/86/34/1062538634.db2.gz CHORTTDCINTCLH-HOCLYGCPSA-N 1 0 314.395 4.306 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)CSc2ccc(F)cc2)cc1C ZINC001255736467 1062559031 /nfs/dbraw/zinc/55/90/31/1062559031.db2.gz ZXSIRLYMYZIMJJ-CQSZACIVSA-N 1 0 319.445 4.413 20 10 DICDRO COc1ccc(C[NH2+]C2(c3ccccc3Cl)CC2)cc1C ZINC001460291653 1062761616 /nfs/dbraw/zinc/76/16/16/1062761616.db2.gz KSYKBRQQEGEWCW-UHFFFAOYSA-N 1 0 301.817 4.436 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC001256798239 1062985451 /nfs/dbraw/zinc/98/54/51/1062985451.db2.gz OJLWBVXMNIIXCB-PXNSSMCTSA-N 1 0 311.425 4.019 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCO[C@@H](c3ccccc3)C2)cc1C ZINC001256800108 1062989035 /nfs/dbraw/zinc/98/90/35/1062989035.db2.gz YURJGYUMLWFWFI-AZUAARDMSA-N 1 0 311.425 4.014 20 10 DICDRO CCC[C@H](CC)[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001257264135 1063170006 /nfs/dbraw/zinc/17/00/06/1063170006.db2.gz ILDLBUIAQDPZKL-AWEZNQCLSA-N 1 0 300.446 4.124 20 10 DICDRO COc1cc(C[NH2+][C@H]2CCCC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001461002119 1063178868 /nfs/dbraw/zinc/17/88/68/1063178868.db2.gz QQSDHYVXZFBKER-GUYCJALGSA-N 1 0 305.462 4.367 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)CCc2ccco2)cc1F ZINC001461004259 1063179511 /nfs/dbraw/zinc/17/95/11/1063179511.db2.gz QCABJBSADUMPGJ-OAHLLOKOSA-N 1 0 318.436 4.376 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCO[C@@H]2CCCC[C@H]2C)c(Cl)c1 ZINC001461053839 1063222651 /nfs/dbraw/zinc/22/26/51/1063222651.db2.gz PITWCFYQFLMSHJ-CXAGYDPISA-N 1 0 311.853 4.039 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccccc2OC(C)C)c(Cl)c1 ZINC001461088942 1063243455 /nfs/dbraw/zinc/24/34/55/1063243455.db2.gz VOPKJLVGLWRWRB-UHFFFAOYSA-N 1 0 319.832 4.431 20 10 DICDRO CCOc1ccccc1CC[NH2+]Cc1c(C)c2ccccc2n1C ZINC001461176817 1063311177 /nfs/dbraw/zinc/31/11/77/1063311177.db2.gz GIQUPSFHODUZBB-UHFFFAOYSA-N 1 0 322.452 4.218 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2CCC3(CC3)CC2)cc1F ZINC001461182799 1063318092 /nfs/dbraw/zinc/31/80/92/1063318092.db2.gz RLFHTRHCUAZUNR-UHFFFAOYSA-N 1 0 304.453 4.484 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C/C=C\c1ccc(F)c(F)c1 ZINC001461195378 1063325142 /nfs/dbraw/zinc/32/51/42/1063325142.db2.gz NXIICEPHMOWNTB-PLNGDYQASA-N 1 0 316.395 4.142 20 10 DICDRO CC[C@H](C[NH2+]Cc1c(O)cccc1Cl)Oc1ccccc1F ZINC001461270848 1063380487 /nfs/dbraw/zinc/38/04/87/1063380487.db2.gz ZHYZEWWRBSNTFM-GFCCVEGCSA-N 1 0 323.795 4.132 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)C[C@H](O)c1ccccc1 ZINC001461416490 1063486743 /nfs/dbraw/zinc/48/67/43/1063486743.db2.gz XFGDDFDEZFUWLH-BTYIYWSLSA-N 1 0 322.452 4.089 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2(SC)CCC2)cc1F ZINC001461463278 1063521968 /nfs/dbraw/zinc/52/19/68/1063521968.db2.gz OGWRMWMQKSMXDB-UHFFFAOYSA-N 1 0 310.482 4.047 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)c2ccccc2O1 ZINC001461520592 1063552618 /nfs/dbraw/zinc/55/26/18/1063552618.db2.gz OOZSZOAIWATKQK-BGJVTSJYSA-N 1 0 322.452 4.268 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)c2ccccc2O1 ZINC001461520594 1063553834 /nfs/dbraw/zinc/55/38/34/1063553834.db2.gz OOZSZOAIWATKQK-YCLSTDHLSA-N 1 0 322.452 4.268 20 10 DICDRO COc1ccc(C[NH2+]CCc2ccc(Cl)c(C)c2)cc1C ZINC001461530336 1063561728 /nfs/dbraw/zinc/56/17/28/1063561728.db2.gz RIMMJAYADRCARZ-UHFFFAOYSA-N 1 0 303.833 4.298 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCCCC2(F)F)cc1 ZINC001461531839 1063562211 /nfs/dbraw/zinc/56/22/11/1063562211.db2.gz XUCFLGOSCZXNRL-KJPDOMRESA-N 1 0 308.416 4.181 20 10 DICDRO CSCC[C@H](C)[NH2+][C@@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001258213552 1063563999 /nfs/dbraw/zinc/56/39/99/1063563999.db2.gz RPBNDMFHQYVWHL-SUMWQHHRSA-N 1 0 307.503 4.364 20 10 DICDRO CCCC1CCC([NH2+][C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 ZINC001461629353 1063624442 /nfs/dbraw/zinc/62/44/42/1063624442.db2.gz HCZXAKZILLFKGY-DAWZGUTISA-N 1 0 316.489 4.222 20 10 DICDRO COc1cc(C[NH2+][C@H](C(C)C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC001461644833 1063632920 /nfs/dbraw/zinc/63/29/20/1063632920.db2.gz FYMLJUGSVAYWIB-QGZVFWFLSA-N 1 0 305.462 4.223 20 10 DICDRO C[C@H]([NH2+]Cc1cnc(-c2ccsc2)s1)c1ccccc1O ZINC001461728516 1063682167 /nfs/dbraw/zinc/68/21/67/1063682167.db2.gz GEQVOOLHRCOZSZ-NSHDSACASA-N 1 0 316.451 4.428 20 10 DICDRO CC1(C)CC[C@@H]([NH2+]Cc2cc(Cl)c3cccnc3c2[O-])C1 ZINC001258595759 1063697633 /nfs/dbraw/zinc/69/76/33/1063697633.db2.gz KEYCEYSDJVRFHB-GFCCVEGCSA-N 1 0 304.821 4.262 20 10 DICDRO COc1cc(C[NH2+]C2CCC=CCC2)c(O)c(C(C)(C)C)c1 ZINC001461780354 1063713174 /nfs/dbraw/zinc/71/31/74/1063713174.db2.gz SWCTWFPQTXCUJG-UHFFFAOYSA-N 1 0 303.446 4.287 20 10 DICDRO C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]Cc1ccccc1O ZINC001258671667 1063739858 /nfs/dbraw/zinc/73/98/58/1063739858.db2.gz CAMMSZYLKRNFDR-NSHDSACASA-N 1 0 310.224 4.420 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(OC)cc2)c1O ZINC001461839506 1063743405 /nfs/dbraw/zinc/74/34/05/1063743405.db2.gz USVQLBWFMWRLOG-IBGZPJMESA-N 1 0 311.425 4.300 20 10 DICDRO C[C@@H]([N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F)C1(C)CC1 ZINC001461881361 1063771516 /nfs/dbraw/zinc/77/15/16/1063771516.db2.gz JWXWWYJJQOZUMD-GFCCVEGCSA-N 1 0 314.395 4.392 20 10 DICDRO C[C@H]([N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F)C1(C)CC1 ZINC001461881368 1063771544 /nfs/dbraw/zinc/77/15/44/1063771544.db2.gz JWXWWYJJQOZUMD-LBPRGKRZSA-N 1 0 314.395 4.392 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC001461885145 1063776173 /nfs/dbraw/zinc/77/61/73/1063776173.db2.gz UDWMDRSKJRHPOM-UHFFFAOYSA-N 1 0 323.367 4.350 20 10 DICDRO CCCC[C@@H](CCC)[NH2+]C1CCN(Cc2ccccc2O)CC1 ZINC001258756813 1063803160 /nfs/dbraw/zinc/80/31/60/1063803160.db2.gz WJTJQENYRMIRNO-GOSISDBHSA-N 1 0 318.505 4.305 20 10 DICDRO CCc1cccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c1O ZINC001461930020 1063816093 /nfs/dbraw/zinc/81/60/93/1063816093.db2.gz QYBMBHBZYQVRDI-LBPRGKRZSA-N 1 0 317.379 4.352 20 10 DICDRO COc1cc(C[N@@H+]2CCS[C@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001461965036 1063844477 /nfs/dbraw/zinc/84/44/77/1063844477.db2.gz YWPIVSMJSYQZLR-CHWSQXEVSA-N 1 0 323.502 4.024 20 10 DICDRO CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001258838083 1063861112 /nfs/dbraw/zinc/86/11/12/1063861112.db2.gz MGZRLKVVCKECRT-FQEVSTJZSA-N 1 0 308.469 4.398 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc(F)c(F)c2)cc1Cl ZINC001462016783 1063881730 /nfs/dbraw/zinc/88/17/30/1063881730.db2.gz AXQARBDQMCFTOD-UHFFFAOYSA-N 1 0 311.759 4.264 20 10 DICDRO CCOc1ccc(C[N@H+](C)Cc2cc(Cl)c(C)cc2O)cc1 ZINC001462028251 1063888904 /nfs/dbraw/zinc/88/89/04/1063888904.db2.gz MDTWTTANXSWKDH-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO Cc1csc(CCC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)n1 ZINC001261137957 1063910862 /nfs/dbraw/zinc/91/08/62/1063910862.db2.gz BLHHIGOPWKKFIZ-GFCCVEGCSA-N 1 0 324.877 4.402 20 10 DICDRO COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2Cc2ccc(C)cc2O)c1 ZINC001462086906 1063923414 /nfs/dbraw/zinc/92/34/14/1063923414.db2.gz KYXTZWFWTQBABC-KXBFYZLASA-N 1 0 311.425 4.292 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H](C(F)(F)F)C1(C)C ZINC001462095588 1063926825 /nfs/dbraw/zinc/92/68/25/1063926825.db2.gz SGWHHLHYFACXTQ-HNNXBMFYSA-N 1 0 314.395 4.224 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C1CC1)C1CCOCC1 ZINC001261515265 1063930243 /nfs/dbraw/zinc/93/02/43/1063930243.db2.gz BCJRZEWCDVSKEF-PSGMQZRDSA-N 1 0 315.457 4.044 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001261602482 1063940272 /nfs/dbraw/zinc/94/02/72/1063940272.db2.gz VNUIOPTUJKOJGS-POQQGIQPSA-N 1 0 307.384 4.272 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCCc3sccc32)cc1F ZINC001261814280 1063946312 /nfs/dbraw/zinc/94/63/12/1063946312.db2.gz WNFVPHNUXKBMCI-OAHLLOKOSA-N 1 0 322.424 4.260 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1noc2ccccc12 ZINC001262033862 1063954338 /nfs/dbraw/zinc/95/43/38/1063954338.db2.gz KYXGZNHAUZIKOD-TZMCWYRMSA-N 1 0 308.381 4.180 20 10 DICDRO C[C@H](Cc1ccsc1)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000393392527 1064276553 /nfs/dbraw/zinc/27/65/53/1064276553.db2.gz JJPCKYXXBFOOPA-MRXNPFEDSA-N 1 0 314.498 4.459 20 10 DICDRO C[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000393476928 1064282861 /nfs/dbraw/zinc/28/28/61/1064282861.db2.gz FYPPEEWNBHXTND-MRXNPFEDSA-N 1 0 312.432 4.147 20 10 DICDRO CCC[C@@H](CC)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000729682981 1064415705 /nfs/dbraw/zinc/41/57/05/1064415705.db2.gz LHKXUMHOWDUASZ-MRXNPFEDSA-N 1 0 319.449 4.253 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000743870409 1064974725 /nfs/dbraw/zinc/97/47/25/1064974725.db2.gz QGYHPXZWUYACBM-CQSZACIVSA-N 1 0 314.385 4.274 20 10 DICDRO CC[C@@H]1C[C@H]1C[N@H+](CC)Cc1cc(Br)ccc1O ZINC001307496911 1065442529 /nfs/dbraw/zinc/44/25/29/1065442529.db2.gz QEPPWNSIKPJMIU-NEPJUHHUSA-N 1 0 312.251 4.023 20 10 DICDRO CCOc1ccc(N2CC[NH+](CCCC3CCCC3)CC2)cc1 ZINC001307598877 1065506491 /nfs/dbraw/zinc/50/64/91/1065506491.db2.gz CQGIPULKTNDREQ-UHFFFAOYSA-N 1 0 316.489 4.178 20 10 DICDRO CCO[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)c(C)c1 ZINC001307834145 1065644634 /nfs/dbraw/zinc/64/46/34/1065644634.db2.gz FWFJEUBEMPESDS-UYAOXDASSA-N 1 0 316.489 4.033 20 10 DICDRO COc1cccc(C2([NH2+]Cc3ccc(N(C)C)c(C)c3)CCC2)c1 ZINC001307953966 1065696746 /nfs/dbraw/zinc/69/67/46/1065696746.db2.gz KVQTUDANMHQNEJ-UHFFFAOYSA-N 1 0 324.468 4.239 20 10 DICDRO CCC[C@@H]1CCC[N@@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC001308133057 1065771928 /nfs/dbraw/zinc/77/19/28/1065771928.db2.gz FSSSWCKFRKTCPI-GOSISDBHSA-N 1 0 316.489 4.066 20 10 DICDRO CCC[C@H]1CCC[N@@H+]1Cc1ccc(N2CCC(OC)CC2)cc1 ZINC001308133058 1065774039 /nfs/dbraw/zinc/77/40/39/1065774039.db2.gz FSSSWCKFRKTCPI-SFHVURJKSA-N 1 0 316.489 4.066 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](C)Cc2cccs2)ccc1OC ZINC001308258170 1065860464 /nfs/dbraw/zinc/86/04/64/1065860464.db2.gz YKTRYQBCRAKCGS-AWEZNQCLSA-N 1 0 319.470 4.014 20 10 DICDRO CCO[C@H]1CCC[C@H]([NH2+]Cc2ccc(N(CC)CC)c(F)c2)C1 ZINC001308261516 1065862577 /nfs/dbraw/zinc/86/25/77/1065862577.db2.gz UHYVLVVYOXFIBY-IRXDYDNUSA-N 1 0 322.468 4.109 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCc3ccccc32)cc1 ZINC001308265792 1065866047 /nfs/dbraw/zinc/86/60/47/1065866047.db2.gz IJFHZGCVRJZVRK-IBGZPJMESA-N 1 0 308.469 4.352 20 10 DICDRO Cc1ccc(C[C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(C)c1 ZINC001308270199 1065869671 /nfs/dbraw/zinc/86/96/71/1065869671.db2.gz UHGFSFVCWFAIKN-INIZCTEOSA-N 1 0 314.448 4.229 20 10 DICDRO CCOCc1cc(C[NH2+]CC(C)(C)CC(C)C)ccc1OC ZINC001308302275 1065896248 /nfs/dbraw/zinc/89/62/48/1065896248.db2.gz YJSKDRKVXQNXPT-UHFFFAOYSA-N 1 0 307.478 4.394 20 10 DICDRO Cc1cc(O)c(CNc2cc(C)cc(C[NH+](C)C)c2)c(Cl)c1 ZINC001308356281 1065935634 /nfs/dbraw/zinc/93/56/34/1065935634.db2.gz ZJISRIDJGXLUBJ-UHFFFAOYSA-N 1 0 318.848 4.336 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](C)CC(F)(F)F)cc1C ZINC001308439995 1065988632 /nfs/dbraw/zinc/98/86/32/1065988632.db2.gz NVMBQIZDMBRCQX-LBPRGKRZSA-N 1 0 303.368 4.462 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@]2(CCC)CCOC2)cc1 ZINC001308401050 1065963358 /nfs/dbraw/zinc/96/33/58/1065963358.db2.gz GYTDYPWAHUDPGN-HXUWFJFHSA-N 1 0 318.505 4.362 20 10 DICDRO COc1cc(C[NH2+]C2(C3(C)CC3)CC2)c(O)c(C(C)(C)C)c1 ZINC001308403457 1065964784 /nfs/dbraw/zinc/96/47/84/1065964784.db2.gz QWLCBQGOYCGNGU-UHFFFAOYSA-N 1 0 303.446 4.121 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3ccc(OC)c(C)c3)C2)c1 ZINC001308404208 1065966614 /nfs/dbraw/zinc/96/66/14/1065966614.db2.gz QCPMZMYPJHOEPW-IYARVYRRSA-N 1 0 311.425 4.048 20 10 DICDRO Fc1ccc(C2CC2)cc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308416361 1065973470 /nfs/dbraw/zinc/97/34/70/1065973470.db2.gz KSBFUVKTUMSPCH-UHFFFAOYSA-N 1 0 311.400 4.318 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCCc2c(F)cccc21 ZINC001308421866 1065978773 /nfs/dbraw/zinc/97/87/73/1065978773.db2.gz ZMAIMPOIYAVFFS-INIZCTEOSA-N 1 0 305.780 4.352 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001308439406 1065988647 /nfs/dbraw/zinc/98/86/47/1065988647.db2.gz DFEWPTUYNGFJJT-CYBMUJFWSA-N 1 0 322.905 4.497 20 10 DICDRO COc1ccccc1C1([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC001308443141 1065990963 /nfs/dbraw/zinc/99/09/63/1065990963.db2.gz GNXSSRWRARDREW-VOTSOKGWSA-N 1 0 322.452 4.053 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](COC)CC(C)(C)C)cc1C ZINC001308447927 1065995111 /nfs/dbraw/zinc/99/51/11/1065995111.db2.gz APCSJGLGINXKAV-KRWDZBQOSA-N 1 0 307.478 4.325 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C/C=C\c2ccc(F)c(F)c2)c1 ZINC001308451093 1065996437 /nfs/dbraw/zinc/99/64/37/1065996437.db2.gz UYBOBOXGASULCO-MVZIDQBPSA-N 1 0 319.351 4.043 20 10 DICDRO CCSc1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC001308502556 1066032179 /nfs/dbraw/zinc/03/21/79/1066032179.db2.gz UXCFZIFSSLPGAN-UHFFFAOYSA-N 1 0 307.846 4.447 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CCCC2(F)F)c(Cl)c1 ZINC001308502508 1066032196 /nfs/dbraw/zinc/03/21/96/1066032196.db2.gz SSKJAMMUSXSKJW-NSHDSACASA-N 1 0 303.780 4.269 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCCc3ccccc3C2)cc1 ZINC001308538736 1066055101 /nfs/dbraw/zinc/05/51/01/1066055101.db2.gz YUMSLPACBKDVSL-NGXITPROSA-N 1 0 320.480 4.303 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cc1C ZINC001308537961 1066055436 /nfs/dbraw/zinc/05/54/36/1066055436.db2.gz VJGMQRXMIQQPTM-OAHLLOKOSA-N 1 0 311.425 4.179 20 10 DICDRO COc1ccc(C[NH2+]CC[C@@H]2C[C@H]2Cc2ccccc2)cc1C ZINC001308541281 1066057417 /nfs/dbraw/zinc/05/74/17/1066057417.db2.gz ODXCUQWBCZQRDU-WOJBJXKFSA-N 1 0 309.453 4.362 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2(OC)CCCCCC2)cc1 ZINC001308543686 1066058285 /nfs/dbraw/zinc/05/82/85/1066058285.db2.gz MWSSCPLESAEUCM-UHFFFAOYSA-N 1 0 318.505 4.362 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2C[C@@H]3CCC[C@H]23)c(C(F)(F)F)c1 ZINC001308548219 1066061860 /nfs/dbraw/zinc/06/18/60/1066061860.db2.gz XSZPQTBKGQUTFE-HZUKXOBISA-N 1 0 312.379 4.050 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCCc2ccsc2)cc1 ZINC001308556046 1066067849 /nfs/dbraw/zinc/06/78/49/1066067849.db2.gz RHGKADSIWOTCAE-HWKANZROSA-N 1 0 300.471 4.050 20 10 DICDRO CCS[C@H]1CCCC[N@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC001308566988 1066076794 /nfs/dbraw/zinc/07/67/94/1066076794.db2.gz HGSXVSKXFJXMCT-ZDUSSCGKSA-N 1 0 313.894 4.462 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@@H](C)Cc2ccc(OC)cc2)c1O ZINC001308582576 1066099847 /nfs/dbraw/zinc/09/98/47/1066099847.db2.gz UFMBABWYTHFJSQ-HNNXBMFYSA-N 1 0 313.441 4.026 20 10 DICDRO CCC[N@H+](Cc1ccc(C)cc1O)[C@@H]1CCc2ccccc2C1 ZINC001308592086 1066105653 /nfs/dbraw/zinc/10/56/53/1066105653.db2.gz WXWVZYWQZFJEJF-HXUWFJFHSA-N 1 0 309.453 4.470 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C[C@H]1C ZINC001308617561 1066120466 /nfs/dbraw/zinc/12/04/66/1066120466.db2.gz ATBDPKWFWAJDQZ-IYBDPMFKSA-N 1 0 314.498 4.472 20 10 DICDRO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC001308629838 1066126498 /nfs/dbraw/zinc/12/64/98/1066126498.db2.gz YUPDHCRJRSUPBB-OSJSJHBBSA-N 1 0 324.468 4.034 20 10 DICDRO CC(C)[C@H]1CC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001308638060 1066131256 /nfs/dbraw/zinc/13/12/56/1066131256.db2.gz CNBUCBWFEDSPQY-OAHLLOKOSA-N 1 0 300.368 4.002 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H](OC)C2CCCC2)cc1 ZINC001308645105 1066135021 /nfs/dbraw/zinc/13/50/21/1066135021.db2.gz IMIKOYAZRFVOIS-HXUWFJFHSA-N 1 0 318.505 4.170 20 10 DICDRO Cc1cccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1F ZINC001308661935 1066144034 /nfs/dbraw/zinc/14/40/34/1066144034.db2.gz FDLUSNMAUBMPKU-UHFFFAOYSA-N 1 0 312.432 4.365 20 10 DICDRO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1(C)C ZINC001308667538 1066145924 /nfs/dbraw/zinc/14/59/24/1066145924.db2.gz DHVDLXHEPRNTBE-QZTJIDSGSA-N 1 0 313.441 4.227 20 10 DICDRO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)C1(C)C ZINC001308667540 1066146009 /nfs/dbraw/zinc/14/60/09/1066146009.db2.gz DHVDLXHEPRNTBE-ZWKOTPCHSA-N 1 0 313.441 4.227 20 10 DICDRO COc1cc(C)c(C[NH2+]Cc2c(C)oc3ccccc32)c(O)c1 ZINC001308668217 1066146189 /nfs/dbraw/zinc/14/61/89/1066146189.db2.gz INDDSFSKGISHDB-UHFFFAOYSA-N 1 0 311.381 4.054 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCC(C)(C)C2)c(C(F)(F)F)c1 ZINC001308691713 1066183656 /nfs/dbraw/zinc/18/36/56/1066183656.db2.gz VYBCJYFUASNXCY-UHFFFAOYSA-N 1 0 314.395 4.393 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](C)C3(CCCCC3)C2)c1 ZINC001308707594 1066191263 /nfs/dbraw/zinc/19/12/63/1066191263.db2.gz WACOEFOYTAEVOC-HNNXBMFYSA-N 1 0 303.446 4.193 20 10 DICDRO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(C)cc1O ZINC001308731403 1066206843 /nfs/dbraw/zinc/20/68/43/1066206843.db2.gz HYYVCGHGRJWTBV-QGZVFWFLSA-N 1 0 319.832 4.174 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](c3ccccc3F)C2)cc1Cl ZINC001308782748 1066258184 /nfs/dbraw/zinc/25/81/84/1066258184.db2.gz QHUVHZISMFZNLP-ZDUSSCGKSA-N 1 0 319.807 4.483 20 10 DICDRO CCc1cccc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c1O ZINC001308791836 1066268008 /nfs/dbraw/zinc/26/80/08/1066268008.db2.gz HZVMBCGUQVDNQU-UHFFFAOYSA-N 1 0 320.436 4.315 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)Cc2ccccc2N(C)C)cc1Cl ZINC001308795806 1066270713 /nfs/dbraw/zinc/27/07/13/1066270713.db2.gz WLIMJSPIVJZZDA-UHFFFAOYSA-N 1 0 318.848 4.052 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+][C@@H](C(C)C)C2(CO)CCCC2)c1 ZINC001308807214 1066284588 /nfs/dbraw/zinc/28/45/88/1066284588.db2.gz QTMOGPMRCUTKLA-IBGZPJMESA-N 1 0 319.489 4.183 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H]1C[C@@H]2CCCC[C@@H]21 ZINC001308825877 1066300782 /nfs/dbraw/zinc/30/07/82/1066300782.db2.gz QGIGIAOQKUSFDC-LQJIQPLVSA-N 1 0 300.490 4.160 20 10 DICDRO CC[C@@H](Cc1ccc(C)cc1)[NH2+]Cc1cc(Cl)ccc1O ZINC001308846777 1066322978 /nfs/dbraw/zinc/32/29/78/1066322978.db2.gz VQCSZCHTOWXAMC-KRWDZBQOSA-N 1 0 303.833 4.465 20 10 DICDRO CCC[C@H]([NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)C1CCCC1 ZINC001308860207 1066341449 /nfs/dbraw/zinc/34/14/49/1066341449.db2.gz QDJCCJYLPHRZQH-PXNSSMCTSA-N 1 0 316.489 4.222 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]CC2([C@H]3CCCCO3)CCC2)c1 ZINC001308886596 1066367732 /nfs/dbraw/zinc/36/77/32/1066367732.db2.gz LWVRHDVMXBBKEZ-LJQANCHMSA-N 1 0 317.473 4.345 20 10 DICDRO Oc1cccc2c1CN(CCc1cc(Cl)cc(Cl)c1)C2 ZINC001308910265 1066386975 /nfs/dbraw/zinc/38/69/75/1066386975.db2.gz LSUAEPPBOKCHIH-UHFFFAOYSA-N 1 0 308.208 4.257 20 10 DICDRO Oc1cc(Br)ccc1C[NH2+]C[C@H]1CCC=CCCC1 ZINC001308974492 1066427428 /nfs/dbraw/zinc/42/74/28/1066427428.db2.gz IMQVLZFDEAVQRJ-ZDUSSCGKSA-N 1 0 324.262 4.381 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(OC(F)F)c1 ZINC000079249394 185162305 /nfs/dbraw/zinc/16/23/05/185162305.db2.gz CNWMJWCYSRGPBY-GFCCVEGCSA-N 1 0 319.351 4.074 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(N2CCCC2)c1 ZINC000088764939 185264449 /nfs/dbraw/zinc/26/44/49/185264449.db2.gz NFLNJZSQLBXCGB-KRWDZBQOSA-N 1 0 323.484 4.204 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1cccnc1 ZINC000092747615 193187539 /nfs/dbraw/zinc/18/75/39/193187539.db2.gz IJUFGSNEUQMZRZ-QGZVFWFLSA-N 1 0 309.457 4.169 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c1 ZINC000021502075 182275323 /nfs/dbraw/zinc/27/53/23/182275323.db2.gz GPGBAIAGNSQSPX-NEPJUHHUSA-N 1 0 305.805 4.466 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cc(C)sc2C)c1 ZINC000037122973 182867973 /nfs/dbraw/zinc/86/79/73/182867973.db2.gz QJSOQUNJLMPZQO-VXGBXAGGSA-N 1 0 305.443 4.491 20 10 DICDRO Oc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000105487292 194105644 /nfs/dbraw/zinc/10/56/44/194105644.db2.gz XFDIAIIHOBNMQI-FQEVSTJZSA-N 1 0 322.452 4.160 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000271582257 129937906 /nfs/dbraw/zinc/93/79/06/129937906.db2.gz WZZRRLNYAXHJCM-ZIFCJYIRSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1OC(F)F)c1ccccc1O ZINC000272816446 130065805 /nfs/dbraw/zinc/06/58/05/130065805.db2.gz DZZCQYSENHABMJ-NEPJUHHUSA-N 1 0 307.340 4.405 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(O)c1 ZINC000273345822 130109366 /nfs/dbraw/zinc/10/93/66/130109366.db2.gz ASBVKPPMXWETMD-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO CCOCc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273441679 130121733 /nfs/dbraw/zinc/12/17/33/130121733.db2.gz YRDOOMZFUCPDKL-MRXNPFEDSA-N 1 0 313.441 4.396 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2-n2ccnc2)c(O)c1C ZINC000273442942 130122148 /nfs/dbraw/zinc/12/21/48/130122148.db2.gz ZDFMLERSRQJSAI-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c(O)c1C ZINC000273470695 130125292 /nfs/dbraw/zinc/12/52/92/130125292.db2.gz JNWOVDUQTAQRHJ-SUMWQHHRSA-N 1 0 315.388 4.323 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc2ccccc2c1O ZINC000273516555 130130490 /nfs/dbraw/zinc/13/04/90/130130490.db2.gz SNYGZOFNQIZENX-GOEBONIOSA-N 1 0 311.425 4.298 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1cc2c(cc1O)CCCC2 ZINC000273528133 130132792 /nfs/dbraw/zinc/13/27/92/130132792.db2.gz VVHLMRHAUXRBRD-YOEHRIQHSA-N 1 0 315.457 4.023 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000273530951 130134089 /nfs/dbraw/zinc/13/40/89/130134089.db2.gz WISLYZLSLJJOAK-CYBMUJFWSA-N 1 0 303.377 4.008 20 10 DICDRO CC(C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc3ccccc3c2O)[nH]1 ZINC000273542902 130135085 /nfs/dbraw/zinc/13/50/85/130135085.db2.gz YROHFMNGTPUWRT-CHWSQXEVSA-N 1 0 324.428 4.199 20 10 DICDRO CC(C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2O)[nH]1 ZINC000273542908 130135728 /nfs/dbraw/zinc/13/57/28/130135728.db2.gz YROHFMNGTPUWRT-STQMWFEESA-N 1 0 324.428 4.199 20 10 DICDRO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273571662 130139227 /nfs/dbraw/zinc/13/92/27/130139227.db2.gz KVJKCTCRMWWQMJ-STQMWFEESA-N 1 0 320.458 4.024 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](CCCO)c2ccccc2)c(O)c1C ZINC000273598151 130141961 /nfs/dbraw/zinc/14/19/61/130141961.db2.gz REMBIKQXNKTZEH-LPHOPBHVSA-N 1 0 313.441 4.173 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1nc(C)cs1)c1ccc(C)cc1O ZINC000280095431 130782984 /nfs/dbraw/zinc/78/29/84/130782984.db2.gz MSGKIRSWJFWWDB-DOMZBBRYSA-N 1 0 304.459 4.310 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H](CCCO)c2ccccc2)c(O)c1 ZINC000283912728 131033434 /nfs/dbraw/zinc/03/34/34/131033434.db2.gz DIEALVLXLNNHMT-SJLPKXTDSA-N 1 0 313.441 4.173 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2-n2ccnc2)c(O)c1 ZINC000284140195 131053204 /nfs/dbraw/zinc/05/32/04/131053204.db2.gz OTLSQWSRYGMBPT-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000285304299 131155977 /nfs/dbraw/zinc/15/59/77/131155977.db2.gz SFBCWLQEHJUUJJ-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc3ncccc3c2)c(O)c1 ZINC000285396143 131164477 /nfs/dbraw/zinc/16/44/77/131164477.db2.gz WYDQGTVPXVSOAG-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cncc2F)c(O)c1C ZINC000285540116 131178238 /nfs/dbraw/zinc/17/82/38/131178238.db2.gz DEPGWXNBLHGGKU-NWDGAFQWSA-N 1 0 306.356 4.094 20 10 DICDRO CSCc1ccc(C[NH2+][C@@H](C)c2ccc(F)c(F)c2[O-])cc1 ZINC000285728883 131197575 /nfs/dbraw/zinc/19/75/75/131197575.db2.gz QQILSALXIMPDIL-NSHDSACASA-N 1 0 323.408 4.384 20 10 DICDRO CSCc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000285813311 131203501 /nfs/dbraw/zinc/20/35/01/131203501.db2.gz WPVDUIBDUVODLU-GFCCVEGCSA-N 1 0 305.418 4.245 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(CSC)cc2)c1 ZINC000285856928 131206086 /nfs/dbraw/zinc/20/60/86/131206086.db2.gz ZJEIJZOZESYVHY-CYBMUJFWSA-N 1 0 317.454 4.115 20 10 DICDRO Cc1ccnc([C@H](C)[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c1 ZINC000286034477 131216798 /nfs/dbraw/zinc/21/67/98/131216798.db2.gz KGYJQVWAIBIQEE-SFHVURJKSA-N 1 0 323.484 4.477 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)C[C@@H](C)O)c1cc(Cl)cc(Cl)c1[O-] ZINC000287712695 131296282 /nfs/dbraw/zinc/29/62/82/131296282.db2.gz OEIHBBQBIKONFF-RULNRJAQSA-N 1 0 320.260 4.147 20 10 DICDRO Cc1ccc(-c2nc(C[NH2+][C@@H]3CCc4cccc(O)c43)co2)cc1 ZINC000297887929 132038765 /nfs/dbraw/zinc/03/87/65/132038765.db2.gz VLLGOLXXIXYNQF-QGZVFWFLSA-N 1 0 320.392 4.133 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cnc2ccsc2c1 ZINC000126461751 331995664 /nfs/dbraw/zinc/99/56/64/331995664.db2.gz ONUHJTPZSPIBCZ-CYBMUJFWSA-N 1 0 311.454 4.213 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCOc2c(Cl)cccc21)c1cc(F)ccc1O ZINC000185185461 333205184 /nfs/dbraw/zinc/20/51/84/333205184.db2.gz VXDHWYBDCHVKMZ-ZUZCIYMTSA-N 1 0 321.779 4.359 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2cccs2)c(O)c1 ZINC000294821834 335127782 /nfs/dbraw/zinc/12/77/82/335127782.db2.gz QLWWJWZUUGRNIT-KKUMJFAQSA-N 1 0 319.470 4.233 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCCC[C@H]2CC(F)(F)F)c1O ZINC000294910344 335130427 /nfs/dbraw/zinc/13/04/27/335130427.db2.gz ACFTZDOPYNNUQG-AAEUAGOBSA-N 1 0 317.351 4.002 20 10 DICDRO Cc1cc(C)n(CCC[NH2+][C@H](C)c2ccc3ccccc3c2O)n1 ZINC000184872253 333367726 /nfs/dbraw/zinc/36/77/26/333367726.db2.gz TYMYSQKJUGIOFV-MRXNPFEDSA-N 1 0 323.440 4.100 20 10 DICDRO CCc1nc(C)c(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)o1 ZINC000291836633 333791021 /nfs/dbraw/zinc/79/10/21/333791021.db2.gz FQFLNRIJRXOLJH-LBPRGKRZSA-N 1 0 310.397 4.255 20 10 DICDRO Cc1csc([C@@H](C)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)n1 ZINC000273409364 334046298 /nfs/dbraw/zinc/04/62/98/334046298.db2.gz HPYCXTKODXCNJS-SMDDNHRTSA-N 1 0 304.459 4.228 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000192791292 336261963 /nfs/dbraw/zinc/26/19/63/336261963.db2.gz UGYPITVEXSZTAB-XOBRGWDASA-N 1 0 323.392 4.434 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000192839116 336265441 /nfs/dbraw/zinc/26/54/41/336265441.db2.gz WZJAVWVQRAJWFF-SDDRHHMPSA-N 1 0 317.351 4.173 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)c1 ZINC000373257117 336954665 /nfs/dbraw/zinc/95/46/65/336954665.db2.gz TWWUQQJHRLTVFA-RIFZZMRRSA-N 1 0 311.425 4.129 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c(O)c1 ZINC000375344662 337008538 /nfs/dbraw/zinc/00/85/38/337008538.db2.gz HNCJMPGWGAVHPV-BLLLJJGKSA-N 1 0 301.361 4.014 20 10 DICDRO COCCC1CC[NH+]([C@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000527936618 337777158 /nfs/dbraw/zinc/77/71/58/337777158.db2.gz PXXLHLGXXDLWQB-CYBMUJFWSA-N 1 0 311.853 4.164 20 10 DICDRO CCOc1ccccc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC000475199449 339441234 /nfs/dbraw/zinc/44/12/34/339441234.db2.gz VLTBUFOYSPFLFP-UHFFFAOYSA-N 1 0 308.425 4.175 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000475201254 339441354 /nfs/dbraw/zinc/44/13/54/339441354.db2.gz HNNJQBCLUXZMIA-UHFFFAOYSA-N 1 0 318.342 4.194 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc(C)c(O)c(C)c1 ZINC000517626010 340473935 /nfs/dbraw/zinc/47/39/35/340473935.db2.gz SLPUSYQYOVUXJS-UHFFFAOYSA-N 1 0 308.425 4.099 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1O ZINC000236933599 340666549 /nfs/dbraw/zinc/66/65/49/340666549.db2.gz GATOCCVCNHLSKO-LJQANCHMSA-N 1 0 323.392 4.263 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000273379437 341635201 /nfs/dbraw/zinc/63/52/01/341635201.db2.gz HZAVFPWAQHGTHF-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H]2CCCc3sccc32)c1 ZINC000160980214 521154944 /nfs/dbraw/zinc/15/49/44/521154944.db2.gz OUXWTUMUNWAYGJ-HNNXBMFYSA-N 1 0 303.427 4.020 20 10 DICDRO CC[C@@H]([NH2+]CCCCc1nc(C)cs1)c1ccccc1O ZINC000155589230 522827006 /nfs/dbraw/zinc/82/70/06/522827006.db2.gz XYFLTROPLGAPKQ-OAHLLOKOSA-N 1 0 304.459 4.221 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCCOc2cc(F)ccc21)c1ccccc1O ZINC000157497366 522949919 /nfs/dbraw/zinc/94/99/19/522949919.db2.gz DOMMWXVJIJFJOD-SJORKVTESA-N 1 0 315.388 4.486 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc(N(C)C)cc1 ZINC000130448634 522951179 /nfs/dbraw/zinc/95/11/79/522951179.db2.gz UOEWRIBRQXTFDY-MOPGFXCFSA-N 1 0 310.441 4.186 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccccc1O ZINC000156768679 522951629 /nfs/dbraw/zinc/95/16/29/522951629.db2.gz IYUQCBFBCXYOTR-DOTOQJQBSA-N 1 0 303.446 4.315 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)c3cccs3)CC2)cc1 ZINC000154493156 524404358 /nfs/dbraw/zinc/40/43/58/524404358.db2.gz REJURBUHIBHDDD-CQSZACIVSA-N 1 0 316.470 4.076 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@H]2OCC[C@@H]21)c1ccc2ccccc2c1O ZINC000185772768 525612310 /nfs/dbraw/zinc/61/23/10/525612310.db2.gz IDDHLXYSBYOVMV-NUDXDXSLSA-N 1 0 311.425 4.154 20 10 DICDRO CSCc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000188719399 525739054 /nfs/dbraw/zinc/73/90/54/525739054.db2.gz UKJYIJBCQOHDIE-GFCCVEGCSA-N 1 0 305.418 4.245 20 10 DICDRO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000160532942 526677122 /nfs/dbraw/zinc/67/71/22/526677122.db2.gz COOUQDIPIIJSMS-CYBMUJFWSA-N 1 0 317.502 4.492 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(OC)c(OC)c1 ZINC000287539954 535808764 /nfs/dbraw/zinc/80/87/64/535808764.db2.gz PFNIVAKUNSNXRR-CZUORRHYSA-N 1 0 315.413 4.211 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccccc1O ZINC000286930948 535930583 /nfs/dbraw/zinc/93/05/83/535930583.db2.gz GGJCMFUPWMNWAR-IRXDYDNUSA-N 1 0 319.832 4.210 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1ccco1 ZINC000273470206 536809134 /nfs/dbraw/zinc/80/91/34/536809134.db2.gz RWOJHZBNWMKERK-GDBMZVCRSA-N 1 0 303.402 4.030 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)c1ccc(C)o1 ZINC000273507678 536809626 /nfs/dbraw/zinc/80/96/26/536809626.db2.gz ZWMFGYTUJURBNQ-NVXWUHKLSA-N 1 0 317.429 4.339 20 10 DICDRO Cc1noc(C)c1C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000153903659 1035601659 /nfs/dbraw/zinc/60/16/59/1035601659.db2.gz QXPXNMLMHZHFHA-CQSZACIVSA-N 1 0 313.445 4.133 20 10 DICDRO CC(C)(C)c1cc(C[N@@H+]2CCCOCC2)c(O)c(C(C)(C)C)c1 ZINC000748072086 1035760998 /nfs/dbraw/zinc/76/09/98/1035760998.db2.gz MBLYBIHSIALXQD-UHFFFAOYSA-N 1 0 319.489 4.210 20 10 DICDRO COc1ccc(N2CCC[N@H+](Cc3ccc(C)c(C)c3)CC2)cc1 ZINC001167108911 1036095776 /nfs/dbraw/zinc/09/57/76/1036095776.db2.gz VYYACCBUIATFKB-UHFFFAOYSA-N 1 0 324.468 4.024 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(C)c2F)cc1 ZINC001648832747 1036612212 /nfs/dbraw/zinc/61/22/12/1036612212.db2.gz KJIBVNVLUNWTMW-UHFFFAOYSA-N 1 0 300.421 4.270 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCSc3ccc(F)cc32)c1 ZINC000071407397 1036689983 /nfs/dbraw/zinc/68/99/83/1036689983.db2.gz FGXGULWJPABQGP-OAHLLOKOSA-N 1 0 303.402 4.166 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccccc3Cl)ccc21 ZINC000050266805 1037175540 /nfs/dbraw/zinc/17/55/40/1037175540.db2.gz PEKOFCXBBPIYDC-UHFFFAOYSA-N 1 0 300.833 4.012 20 10 DICDRO CSc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1F ZINC000160537449 1037186207 /nfs/dbraw/zinc/18/62/07/1037186207.db2.gz IVVKEMWCJXJXQH-ZDUSSCGKSA-N 1 0 318.461 4.464 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC000160542381 1037199380 /nfs/dbraw/zinc/19/93/80/1037199380.db2.gz ATFXKFAUKYSQLY-HXUWFJFHSA-N 1 0 311.473 4.060 20 10 DICDRO CCCc1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001167434181 1037294133 /nfs/dbraw/zinc/29/41/33/1037294133.db2.gz DZPORFNWRNOACG-UHFFFAOYSA-N 1 0 323.484 4.003 20 10 DICDRO C[C@@H]([NH2+]Cc1c(O)cccc1Br)c1cccs1 ZINC000706809549 1037451955 /nfs/dbraw/zinc/45/19/55/1037451955.db2.gz DSQJYSPDFVOAFK-SECBINFHSA-N 1 0 312.232 4.067 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C(C)C)cc1 ZINC000066236467 1037477679 /nfs/dbraw/zinc/47/76/79/1037477679.db2.gz UWKMEFLBUJQEQO-FQEVSTJZSA-N 1 0 312.457 4.248 20 10 DICDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1c(O)cccc1Br ZINC000706833832 1037480936 /nfs/dbraw/zinc/48/09/36/1037480936.db2.gz JUXMGXHDJTXPCB-NEPJUHHUSA-N 1 0 312.251 4.071 20 10 DICDRO COc1cccc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)c1O ZINC000067011131 1037503303 /nfs/dbraw/zinc/50/33/03/1037503303.db2.gz WUHBVGJFHRVOKY-UHFFFAOYSA-N 1 0 305.805 4.079 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1cc(F)cc(F)c1[O-] ZINC000834840315 1037598969 /nfs/dbraw/zinc/59/89/69/1037598969.db2.gz JDQZMBBJVDQCHT-UWVGGRQHSA-N 1 0 305.315 4.147 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)cn1 ZINC000834902074 1037743099 /nfs/dbraw/zinc/74/30/99/1037743099.db2.gz DHPOAHPPNLQTFU-CYBMUJFWSA-N 1 0 304.821 4.217 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)cc1C ZINC000074230622 1037743704 /nfs/dbraw/zinc/74/37/04/1037743704.db2.gz CVYXQYBNRGIBFD-ZDUSSCGKSA-N 1 0 321.367 4.456 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001140464714 1038128343 /nfs/dbraw/zinc/12/83/43/1038128343.db2.gz AMNKBIIPHCYMTB-CYBMUJFWSA-N 1 0 305.780 4.174 20 10 DICDRO Cc1cc(O)c(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)cc1C ZINC000175990485 1038152522 /nfs/dbraw/zinc/15/25/22/1038152522.db2.gz YRMLROFUILMCKG-UHFFFAOYSA-N 1 0 305.368 4.312 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccccc2)N2CCCC2)c(O)c1 ZINC000323907787 1038241198 /nfs/dbraw/zinc/24/11/98/1038241198.db2.gz RBUCMUMUARXURP-XLIONFOSSA-N 1 0 324.468 4.188 20 10 DICDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N(C)CC)cc2)C1 ZINC001167496030 1038298074 /nfs/dbraw/zinc/29/80/74/1038298074.db2.gz IZEKVXDDYJYEBU-QZTJIDSGSA-N 1 0 306.519 4.249 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](CC)Cc1cc2c(cc1O)CCC2 ZINC000172613617 1038621345 /nfs/dbraw/zinc/62/13/45/1038621345.db2.gz CLCUCXPBZFSXAZ-IBGZPJMESA-N 1 0 310.441 4.249 20 10 DICDRO CC[C@](C)([NH2+]Cc1cc(Cl)ccc1O)c1nc(C)cs1 ZINC000174503873 1038952641 /nfs/dbraw/zinc/95/26/41/1038952641.db2.gz YFBJQCCBIXWCFS-HNNXBMFYSA-N 1 0 310.850 4.226 20 10 DICDRO COc1ccc(N2C(C)(C)CC([NH3+])CC2(C)C)c2ccccc12 ZINC001167625710 1038976367 /nfs/dbraw/zinc/97/63/67/1038976367.db2.gz ZNIAZRCQUSSMEK-UHFFFAOYSA-N 1 0 312.457 4.333 20 10 DICDRO CCCOc1ccc(N2C(C)(C)CC([NH3+])CC2(C)C)c(F)c1 ZINC001167626623 1038979969 /nfs/dbraw/zinc/97/99/69/1038979969.db2.gz PRTZJHVWQDBHKN-UHFFFAOYSA-N 1 0 308.441 4.099 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](c1ccccc1)N1CCCC1)c1ccccc1O ZINC000324040105 1039377998 /nfs/dbraw/zinc/37/79/98/1039377998.db2.gz RCDXELNEOAQEGZ-UXHICEINSA-N 1 0 324.468 4.270 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1ccccc1O ZINC000130134633 1039587535 /nfs/dbraw/zinc/58/75/35/1039587535.db2.gz GMSYIBUTLUMISZ-INIZCTEOSA-N 1 0 317.816 4.221 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CC=CCC1)c1cc(Br)ccc1O ZINC000088747607 1039598129 /nfs/dbraw/zinc/59/81/29/1039598129.db2.gz MPMVVCNMLIOWLH-TZMCWYRMSA-N 1 0 310.235 4.304 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC001203223761 1039650749 /nfs/dbraw/zinc/65/07/49/1039650749.db2.gz ZYEDEHAHHIFFBS-GFCCVEGCSA-N 1 0 311.256 4.160 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000029891457 1039834139 /nfs/dbraw/zinc/83/41/39/1039834139.db2.gz IPPQDZRVGNZVMJ-NRFANRHFSA-N 1 0 319.404 4.119 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@H](C)CCC(C)C)CC2)cc1 ZINC000151608544 1039838838 /nfs/dbraw/zinc/83/88/38/1039838838.db2.gz WWRDOUGVNHDZSC-MRXNPFEDSA-N 1 0 304.478 4.078 20 10 DICDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)cc(C(F)(F)F)c1 ZINC001143456885 1039987207 /nfs/dbraw/zinc/98/72/07/1039987207.db2.gz BJEYIEBEVRPPQI-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000926594554 1040093615 /nfs/dbraw/zinc/09/36/15/1040093615.db2.gz DJOHGJBAPVALII-DJXYKJKZSA-N 1 0 318.530 4.008 20 10 DICDRO COc1ccc2[nH]cc(C3=CCN(c4cc[nH+]cc4C)CC3)c2c1 ZINC000191979234 1040474364 /nfs/dbraw/zinc/47/43/64/1040474364.db2.gz BLMWUEONWUUCHC-UHFFFAOYSA-N 1 0 319.408 4.174 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2ccccc2Cl)c1O ZINC000177231382 1040577410 /nfs/dbraw/zinc/57/74/10/1040577410.db2.gz XWZBBGBETLNDKL-SNVBAGLBSA-N 1 0 321.779 4.238 20 10 DICDRO C[C@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccccc1O ZINC000179894329 1040610687 /nfs/dbraw/zinc/61/06/87/1040610687.db2.gz KJKOLMDDGLNNMF-ZDUSSCGKSA-N 1 0 310.422 4.367 20 10 DICDRO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]Cc1cc(F)ccc1O ZINC000318411839 1040633455 /nfs/dbraw/zinc/63/34/55/1040633455.db2.gz LLRQFYJYSPMQRJ-HNNXBMFYSA-N 1 0 303.377 4.236 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](CCO)c2ccccc2)c1O ZINC000808699420 1041007526 /nfs/dbraw/zinc/00/75/26/1041007526.db2.gz YMUFFYPNPUDGJQ-SUMWQHHRSA-N 1 0 319.832 4.128 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](O)c2ccccc2C)c1O ZINC000808696948 1041008131 /nfs/dbraw/zinc/00/81/31/1041008131.db2.gz YWHYQBJDBVTPHM-CXAGYDPISA-N 1 0 319.832 4.047 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c1O ZINC000808699899 1041008367 /nfs/dbraw/zinc/00/83/67/1041008367.db2.gz RYRRRTAIWMHKRW-BHADISHBSA-N 1 0 323.864 4.208 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCNc2ccccc2)c1O ZINC000808700331 1041008958 /nfs/dbraw/zinc/00/89/58/1041008958.db2.gz DDQVPTJKYLYSCW-ZDUSSCGKSA-N 1 0 304.821 4.117 20 10 DICDRO COC[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)c1ccc(C)o1 ZINC000808699920 1041009268 /nfs/dbraw/zinc/00/92/68/1041009268.db2.gz DTBRZXFYURXZQF-WFASDCNBSA-N 1 0 323.820 4.294 20 10 DICDRO CC[C@H]([NH2+][C@H](COC)c1cccc(Cl)c1)c1ccccc1O ZINC000808733325 1041019950 /nfs/dbraw/zinc/01/99/50/1041019950.db2.gz UUQLCPLIVMSQIB-DLBZAZTESA-N 1 0 319.832 4.474 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c1 ZINC000809693778 1041216154 /nfs/dbraw/zinc/21/61/54/1041216154.db2.gz BTAQOILCOVZZDL-XUVXKRRUSA-N 1 0 323.436 4.169 20 10 DICDRO Cc1ccc(C)c(C[NH2+]Cc2cc(Br)ccc2O)c1 ZINC000809712843 1041230349 /nfs/dbraw/zinc/23/03/49/1041230349.db2.gz WAMYGYDWNVHBKP-UHFFFAOYSA-N 1 0 320.230 4.061 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cc1)c1cc(F)ccc1O ZINC000176986957 1041233511 /nfs/dbraw/zinc/23/35/11/1041233511.db2.gz OBFLRSDVNZABTQ-SNVBAGLBSA-N 1 0 313.294 4.401 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](Cc2ccccn2)C2CC2)cc1 ZINC000809762973 1041247257 /nfs/dbraw/zinc/24/72/57/1041247257.db2.gz GCUUVCUROAKUMH-UHFFFAOYSA-N 1 0 309.457 4.092 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000809782689 1041254536 /nfs/dbraw/zinc/25/45/36/1041254536.db2.gz DJXVKXZYEANBHI-QGZVFWFLSA-N 1 0 317.454 4.436 20 10 DICDRO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1cc(F)ccc1O ZINC000809784675 1041255028 /nfs/dbraw/zinc/25/50/28/1041255028.db2.gz WYPAMJHUMWDOOK-QGZVFWFLSA-N 1 0 303.377 4.123 20 10 DICDRO Cc1ccc(O)c(C[N@@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)c1 ZINC000809789963 1041257986 /nfs/dbraw/zinc/25/79/86/1041257986.db2.gz PTNXKIRXEBGBMV-OKILXGFUSA-N 1 0 301.352 4.254 20 10 DICDRO C[N@H+](Cc1cc(F)ccc1O)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000809789932 1041259339 /nfs/dbraw/zinc/25/93/39/1041259339.db2.gz OCAQGZPOORAYEP-BJHJDKERSA-N 1 0 305.315 4.084 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccc3sccc3c2)cc1F ZINC000810159968 1041328887 /nfs/dbraw/zinc/32/88/87/1041328887.db2.gz OVLDSFYKCCTHLU-UHFFFAOYSA-N 1 0 314.429 4.396 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc3sccc3c2)c1 ZINC000810159773 1041329289 /nfs/dbraw/zinc/32/92/89/1041329289.db2.gz HVHJBFKEOVDAIG-UHFFFAOYSA-N 1 0 313.422 4.295 20 10 DICDRO CCC[C@](C)(O)C[NH2+][C@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000810218009 1041337545 /nfs/dbraw/zinc/33/75/45/1041337545.db2.gz NQHKSPZNROBECN-HIFRSBDPSA-N 1 0 319.367 4.003 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](OC)C(C)C)c1ccc(C(F)(F)F)cc1O ZINC000810221515 1041339182 /nfs/dbraw/zinc/33/91/82/1041339182.db2.gz QHPOKBCBLCBBHC-DZGCQCFKSA-N 1 0 319.367 4.123 20 10 DICDRO CC[C@@H]([NH2+]CCC[C@@H](O)CC)c1ccc(C(F)(F)F)cc1O ZINC000810227343 1041341981 /nfs/dbraw/zinc/34/19/81/1041341981.db2.gz VUNOAHDLJDBICP-GXTWGEPZSA-N 1 0 319.367 4.003 20 10 DICDRO Cc1cc([C@H](C)[NH2+]CCc2cc(C)n(-c3ccccc3)c2C)no1 ZINC000810207322 1041346401 /nfs/dbraw/zinc/34/64/01/1041346401.db2.gz JKJXSKGXASKQPE-INIZCTEOSA-N 1 0 323.440 4.284 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)CCc2ccco2)cc1 ZINC000314082274 1041429883 /nfs/dbraw/zinc/42/98/83/1041429883.db2.gz VXPFGJHYEJSOAR-MRXNPFEDSA-N 1 0 300.446 4.237 20 10 DICDRO C[C@H]([NH2+]CCCOC1CCCCC1)c1cc(F)cc(F)c1[O-] ZINC000756357568 1041514540 /nfs/dbraw/zinc/51/45/40/1041514540.db2.gz DXIROHUSBSKJSA-LBPRGKRZSA-N 1 0 313.388 4.060 20 10 DICDRO C[C@@H]([NH2+]CCCOC1CCCCC1)c1cc(F)cc(F)c1[O-] ZINC000756357567 1041514641 /nfs/dbraw/zinc/51/46/41/1041514641.db2.gz DXIROHUSBSKJSA-GFCCVEGCSA-N 1 0 313.388 4.060 20 10 DICDRO c1ccc2c(c1)C[C@H]2C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000236673681 1041540208 /nfs/dbraw/zinc/54/02/08/1041540208.db2.gz REDMDOAZMKEEPR-IBGZPJMESA-N 1 0 306.453 4.106 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)cc1C(C)C ZINC000811781195 1041566884 /nfs/dbraw/zinc/56/68/84/1041566884.db2.gz ZTTBZELGLPIOED-OALUTQOASA-N 1 0 317.473 4.213 20 10 DICDRO Cc1nc(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)cs1 ZINC000318640997 1041593997 /nfs/dbraw/zinc/59/39/97/1041593997.db2.gz AGSYUTUJMDCHCN-GFCCVEGCSA-N 1 0 312.438 4.204 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OC(C)(C)C)nc2)c(O)c1 ZINC000186507682 1041632781 /nfs/dbraw/zinc/63/27/81/1041632781.db2.gz DAMXISLNFSTXPQ-CQSZACIVSA-N 1 0 314.429 4.124 20 10 DICDRO C[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1cc(F)cc(F)c1O ZINC000812739387 1041643346 /nfs/dbraw/zinc/64/33/46/1041643346.db2.gz PUEFIIQCGRZZEY-JTQLQIEISA-N 1 0 304.340 4.117 20 10 DICDRO COc1cc(O)c(C[NH2+][C@@H]2CCCCC23CCCC3)cc1OC ZINC000812780415 1041647252 /nfs/dbraw/zinc/64/72/52/1041647252.db2.gz DKHSQECIDDWNNF-GOSISDBHSA-N 1 0 319.445 4.002 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H]3CC[C@H](C)[C@H](C)C3)CC2)cc1 ZINC000812841629 1041655203 /nfs/dbraw/zinc/65/52/03/1041655203.db2.gz GBKBKHLOAISYQW-LZLYRXPVSA-N 1 0 316.489 4.078 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)C(C)(C)c2ccccc2)c1 ZINC000756539534 1041701003 /nfs/dbraw/zinc/70/10/03/1041701003.db2.gz PTXUGEXCSYEIML-LSDHHAIUSA-N 1 0 313.441 4.418 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@H](C)C2)ccc1OC ZINC000747853677 1041701769 /nfs/dbraw/zinc/70/17/69/1041701769.db2.gz AFAJVCLJIHBPEC-JKSUJKDBSA-N 1 0 305.462 4.148 20 10 DICDRO CCOCc1cc(C[NH2+]CCCC2CCCC2)ccc1OC ZINC000747854587 1041702649 /nfs/dbraw/zinc/70/26/49/1041702649.db2.gz PWJRKXCFLBGOMT-UHFFFAOYSA-N 1 0 305.462 4.292 20 10 DICDRO CCSc1cccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)c1 ZINC000813885141 1041742765 /nfs/dbraw/zinc/74/27/65/1041742765.db2.gz QJFODVHJKPRFMV-CYBMUJFWSA-N 1 0 317.454 4.364 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000813886013 1041742872 /nfs/dbraw/zinc/74/28/72/1041742872.db2.gz SPEWPAGKHKOBCK-NSHDSACASA-N 1 0 322.836 4.454 20 10 DICDRO CCOC1(C)CC[NH+](Cc2ccc(N(CC)CC)c(F)c2)CC1 ZINC000814170290 1041783175 /nfs/dbraw/zinc/78/31/75/1041783175.db2.gz URZPHVSQMPMVSB-UHFFFAOYSA-N 1 0 322.468 4.063 20 10 DICDRO COc1ccc(N2CCC([NH2+]CC(C)(C)C(C)(C)C)CC2)cc1 ZINC000814297875 1041806888 /nfs/dbraw/zinc/80/68/88/1041806888.db2.gz LZUNGKRXEKKQFS-UHFFFAOYSA-N 1 0 318.505 4.326 20 10 DICDRO CCc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)nc1 ZINC000815019482 1041904894 /nfs/dbraw/zinc/90/48/94/1041904894.db2.gz NOPTWRUECYTPAE-UHFFFAOYSA-N 1 0 311.473 4.121 20 10 DICDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815052606 1041906358 /nfs/dbraw/zinc/90/63/58/1041906358.db2.gz UTNPJGMYQONKLZ-GOSISDBHSA-N 1 0 324.468 4.059 20 10 DICDRO C[C@H]([NH2+][C@H]1C=CCCCCC1)c1ccc(N2CCOCC2)cc1 ZINC000815082395 1041912952 /nfs/dbraw/zinc/91/29/52/1041912952.db2.gz OMJKNLTVRFBCHN-HKUYNNGSSA-N 1 0 314.473 4.063 20 10 DICDRO Cc1csc([C@H]([NH2+]Cc2ccc(N(C)C)c(C)c2)C2CC2)n1 ZINC000815084000 1041912956 /nfs/dbraw/zinc/91/29/56/1041912956.db2.gz MJRGTQQGFIJCGF-QGZVFWFLSA-N 1 0 315.486 4.067 20 10 DICDRO Cc1ccccc1C(C)(C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000815150562 1041928187 /nfs/dbraw/zinc/92/81/87/1041928187.db2.gz ABLMIMKAHIHGSF-UHFFFAOYSA-N 1 0 300.421 4.225 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)Oc2ccccc2Cl)c(O)c1 ZINC000756732505 1041944728 /nfs/dbraw/zinc/94/47/28/1041944728.db2.gz MCOFHNFDPRNGHE-KBPBESRZSA-N 1 0 319.832 4.472 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cccc3cccnc32)c(O)c1 ZINC000815557053 1041963267 /nfs/dbraw/zinc/96/32/67/1041963267.db2.gz LGZXUJCEUMHVLB-MRXNPFEDSA-N 1 0 320.436 4.451 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCc2nc3ccccc3[nH]2)c(O)c1 ZINC000815565904 1041963855 /nfs/dbraw/zinc/96/38/55/1041963855.db2.gz DHFUVTLQCPLYIK-OAHLLOKOSA-N 1 0 323.440 4.169 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]Cc1ccoc1 ZINC000815563794 1041964141 /nfs/dbraw/zinc/96/41/41/1041964141.db2.gz OIOGSDQWJMEDDP-IBGZPJMESA-N 1 0 307.393 4.449 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c(O)c1 ZINC000815580496 1041965780 /nfs/dbraw/zinc/96/57/80/1041965780.db2.gz LIVYMDRAZWYRNF-MRXNPFEDSA-N 1 0 312.457 4.234 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccc(F)cc1C ZINC000815580907 1041966350 /nfs/dbraw/zinc/96/63/50/1041966350.db2.gz SWQMAGZHHUNEOU-OAHLLOKOSA-N 1 0 300.421 4.359 20 10 DICDRO COC(C)(C)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815588970 1041968368 /nfs/dbraw/zinc/96/83/68/1041968368.db2.gz FBLHIINBBFRPLX-SFHVURJKSA-N 1 0 313.441 4.081 20 10 DICDRO COc1cc(CC[NH2+][C@H](C)c2ccc(C)cc2O)ccc1Cl ZINC000815657659 1041980585 /nfs/dbraw/zinc/98/05/85/1041980585.db2.gz FGAGNUAWLLDAON-CYBMUJFWSA-N 1 0 319.832 4.256 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C(C)(F)F)cc1)c1cc(F)ccc1O ZINC000815637893 1041982018 /nfs/dbraw/zinc/98/20/18/1041982018.db2.gz ITIMAZAJYMBGDJ-LLVKDONJSA-N 1 0 309.331 4.494 20 10 DICDRO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cc(Cl)ccc1O ZINC000756757916 1041982311 /nfs/dbraw/zinc/98/23/11/1041982311.db2.gz OULMZADTJZZVJX-LKFCYVNXSA-N 1 0 324.207 4.483 20 10 DICDRO CC(C)C1([NH2+][C@H](C)c2ccc(N3CCOCC3)cc2Cl)CC1 ZINC000815647806 1041983874 /nfs/dbraw/zinc/98/38/74/1041983874.db2.gz VSKSOZNBPFDDTN-CQSZACIVSA-N 1 0 322.880 4.016 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(C(F)(F)F)cc1O)C(C)(C)O ZINC000815651951 1041986828 /nfs/dbraw/zinc/98/68/28/1041986828.db2.gz JWRGPRXMCFMIJF-GXTWGEPZSA-N 1 0 319.367 4.001 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3SCCS[C@H]23)c(O)c1C ZINC000756777699 1042015570 /nfs/dbraw/zinc/01/55/70/1042015570.db2.gz KPNCIEVASCBOAD-DPAVQSFQSA-N 1 0 323.527 4.039 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@H]2c2cccs2)c1O ZINC000748046801 1042025380 /nfs/dbraw/zinc/02/53/80/1042025380.db2.gz PFCTXHOFPLZGSQ-HNNXBMFYSA-N 1 0 319.401 4.133 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)c3ccsc3)CC2)cc1 ZINC000178464070 1042026758 /nfs/dbraw/zinc/02/67/58/1042026758.db2.gz ZBXFTXVJWIYEKH-AWEZNQCLSA-N 1 0 316.470 4.076 20 10 DICDRO c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc(N3CCCCC3)cc1)C2 ZINC000104862199 1042057119 /nfs/dbraw/zinc/05/71/19/1042057119.db2.gz GYZLLSMDGAQFQT-OAQYLSRUSA-N 1 0 320.480 4.324 20 10 DICDRO CCOc1ccccc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816537409 1042062688 /nfs/dbraw/zinc/06/26/88/1042062688.db2.gz DWBXCHJAZJDOPR-UHFFFAOYSA-N 1 0 307.393 4.234 20 10 DICDRO Oc1c(C[NH2+][C@H]2C[C@H]2Cc2ccccc2)ccc2ccccc21 ZINC000816551488 1042064273 /nfs/dbraw/zinc/06/42/73/1042064273.db2.gz CWRGNWQKKHDKCD-QUCCMNQESA-N 1 0 303.405 4.266 20 10 DICDRO Oc1c(C[NH2+]CCc2cccc(F)c2F)ccc2ccccc21 ZINC000816549793 1042064654 /nfs/dbraw/zinc/06/46/54/1042064654.db2.gz YHNZONZMSSVALD-UHFFFAOYSA-N 1 0 313.347 4.156 20 10 DICDRO CS[C@H]1CCC[C@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816549953 1042064787 /nfs/dbraw/zinc/06/47/87/1042064787.db2.gz DBVBYKOMCYRIFO-HOTGVXAUSA-N 1 0 301.455 4.309 20 10 DICDRO C[C@@H](C[C@@H](O)c1ccccc1)[NH2+]Cc1ccc2ccccc2c1O ZINC000816559172 1042066928 /nfs/dbraw/zinc/06/69/28/1042066928.db2.gz ALAWLMFLVDSMPU-MGPUTAFESA-N 1 0 321.420 4.147 20 10 DICDRO CC(C)OC1CCC([NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816558199 1042067160 /nfs/dbraw/zinc/06/71/60/1042067160.db2.gz QGIWLYKUTWISKF-UHFFFAOYSA-N 1 0 313.441 4.371 20 10 DICDRO CC(C)[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)c1cccnc1 ZINC000816555500 1042067329 /nfs/dbraw/zinc/06/73/29/1042067329.db2.gz HJEYDSAEILGQSB-HXUWFJFHSA-N 1 0 320.436 4.470 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2ccccc2c1O)[C@H]1CCCCO1 ZINC000816556426 1042067726 /nfs/dbraw/zinc/06/77/26/1042067726.db2.gz IRVXLZAIANXSGD-GOSISDBHSA-N 1 0 313.441 4.230 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+]Cc3ccc4ccccc4c3O)nc2c1 ZINC000816553769 1042067856 /nfs/dbraw/zinc/06/78/56/1042067856.db2.gz GHCXZEJSSOTMMS-UHFFFAOYSA-N 1 0 317.392 4.020 20 10 DICDRO COc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c1O ZINC000816630416 1042070431 /nfs/dbraw/zinc/07/04/31/1042070431.db2.gz DCOTVFRMSGCOAZ-IBGZPJMESA-N 1 0 309.409 4.128 20 10 DICDRO COc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccccc2)c1O ZINC000816630417 1042070692 /nfs/dbraw/zinc/07/06/92/1042070692.db2.gz DCOTVFRMSGCOAZ-LJQANCHMSA-N 1 0 309.409 4.128 20 10 DICDRO Oc1c(C[NH+]2CCC(c3ccncc3)CC2)ccc2ccccc21 ZINC000816610716 1042073129 /nfs/dbraw/zinc/07/31/29/1042073129.db2.gz VREIEDSHTJKRMQ-UHFFFAOYSA-N 1 0 318.420 4.320 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c1O ZINC000816619399 1042073608 /nfs/dbraw/zinc/07/36/08/1042073608.db2.gz FAPJQYCQEKGSAH-QGZVFWFLSA-N 1 0 311.425 4.171 20 10 DICDRO C[C@H](O)C[C@H]1CCCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816608787 1042073722 /nfs/dbraw/zinc/07/37/22/1042073722.db2.gz JOOGWWKMFIIWLZ-MAUKXSAKSA-N 1 0 313.441 4.061 20 10 DICDRO CCc1nocc1C[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000816652868 1042076476 /nfs/dbraw/zinc/07/64/76/1042076476.db2.gz XGDCEZCTLIMXFM-UHFFFAOYSA-N 1 0 322.408 4.242 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CC23CCSCC3)c(O)c1 ZINC000817588525 1042118512 /nfs/dbraw/zinc/11/85/12/1042118512.db2.gz GVWVOFKSYREVTF-HUUCEWRRSA-N 1 0 305.487 4.193 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)cc(C)n1 ZINC000817590072 1042119976 /nfs/dbraw/zinc/11/99/76/1042119976.db2.gz SXNPNXLOQGEWBU-OAHLLOKOSA-N 1 0 310.441 4.134 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cc2c(s1)CCCC2 ZINC000817956146 1042131680 /nfs/dbraw/zinc/13/16/80/1042131680.db2.gz RRKIXRQMLWDBIR-ZDUSSCGKSA-N 1 0 300.471 4.102 20 10 DICDRO CC(C)c1ccc([C@H](N)C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000817954211 1042131817 /nfs/dbraw/zinc/13/18/17/1042131817.db2.gz WBYVMHOFUKMMJE-FZKQIMNGSA-N 1 0 316.420 4.005 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1cc(Cl)ccc1OC ZINC000817956257 1042132276 /nfs/dbraw/zinc/13/22/76/1042132276.db2.gz UYPIUALJVIUDIU-QGZVFWFLSA-N 1 0 318.848 4.214 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccc(Cl)c1[O-] ZINC000817963111 1042132550 /nfs/dbraw/zinc/13/25/50/1042132550.db2.gz NKXJSGJSNUHZFR-YVEFUNNKSA-N 1 0 318.848 4.306 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)c(O)c1C ZINC000817967430 1042133482 /nfs/dbraw/zinc/13/34/82/1042133482.db2.gz IJDARYDUKRJKBM-AUUYWEPGSA-N 1 0 310.441 4.319 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)c(O)c1 ZINC000817967185 1042133975 /nfs/dbraw/zinc/13/39/75/1042133975.db2.gz DRLDUHGLAFBYBN-KBXCAEBGSA-N 1 0 310.441 4.319 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc2c1CCCN2)c1ccc(N(C)C)cc1 ZINC000817974508 1042134661 /nfs/dbraw/zinc/13/46/61/1042134661.db2.gz BJEYFIBXEWHOOT-FQEVSTJZSA-N 1 0 323.484 4.352 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc2c1CCCN2)c1cc(Cl)ccc1O ZINC000817974510 1042134733 /nfs/dbraw/zinc/13/47/33/1042134733.db2.gz BJTRWAKJUYTQKW-GFCCVEGCSA-N 1 0 316.832 4.255 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(Cl)cc(Cl)c1[O-] ZINC000817976083 1042134825 /nfs/dbraw/zinc/13/48/25/1042134825.db2.gz FNJKQOCZDGBKTL-IINYFYTJSA-N 1 0 319.276 4.257 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccc(C)cc1O ZINC000817968119 1042135026 /nfs/dbraw/zinc/13/50/26/1042135026.db2.gz PGOMJZGDRKSGMD-OALUTQOASA-N 1 0 310.441 4.401 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc3c2CCCN3)c(O)c1C ZINC000817976319 1042135130 /nfs/dbraw/zinc/13/51/30/1042135130.db2.gz XQYGKTRAJKJAMJ-OAHLLOKOSA-N 1 0 310.441 4.218 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000817976710 1042135252 /nfs/dbraw/zinc/13/52/52/1042135252.db2.gz RZOKANNIIWOFNS-MFKMUULPSA-N 1 0 319.276 4.257 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)cc(N)c1)c1cc(Cl)ccc1O ZINC000817981515 1042136048 /nfs/dbraw/zinc/13/60/48/1042136048.db2.gz SPFDITOEIIEWMP-INIZCTEOSA-N 1 0 304.821 4.177 20 10 DICDRO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1cc(C)ccc1O ZINC000818230335 1042145278 /nfs/dbraw/zinc/14/52/78/1042145278.db2.gz FGDGVZIGWUJZMM-UHFFFAOYSA-N 1 0 319.832 4.388 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCCn1ccc2ccccc21 ZINC000317468890 1042228024 /nfs/dbraw/zinc/22/80/24/1042228024.db2.gz XFELEJCDGRUJLW-UHFFFAOYSA-N 1 0 314.816 4.180 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccncc1F)C1CCCCC1 ZINC000823375405 1042323024 /nfs/dbraw/zinc/32/30/24/1042323024.db2.gz PNWUCSQJUYLZKL-UHFFFAOYSA-N 1 0 314.404 4.261 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cc(F)ncc1F)C1CCCC1 ZINC000823448436 1042326579 /nfs/dbraw/zinc/32/65/79/1042326579.db2.gz WMHZYDVVIAFVAD-UHFFFAOYSA-N 1 0 318.367 4.010 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(C)o2)cc1F ZINC000236932003 1042414322 /nfs/dbraw/zinc/41/43/22/1042414322.db2.gz VXSIIAPDVUAGEW-AWEZNQCLSA-N 1 0 304.409 4.424 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H](C)c2cc(C)sc2C)c1O ZINC000894165288 1042481206 /nfs/dbraw/zinc/48/12/06/1042481206.db2.gz OOWPZYBWMCUDFV-GFCCVEGCSA-N 1 0 305.443 4.238 20 10 DICDRO CC[C@@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1ccc(C)cc1O ZINC000280036720 1042561557 /nfs/dbraw/zinc/56/15/57/1042561557.db2.gz IMYJIWDEJJAPND-CVEARBPZSA-N 1 0 303.402 4.030 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)c1cccnc1 ZINC000280075267 1042563678 /nfs/dbraw/zinc/56/36/78/1042563678.db2.gz XYQPKKUWVJYGOR-GFCCVEGCSA-N 1 0 323.362 4.017 20 10 DICDRO CC[C@@H]([NH2+]Cc1csc([C@@H](C)OC)n1)c1ccc(C)cc1O ZINC000280097791 1042564473 /nfs/dbraw/zinc/56/44/73/1042564473.db2.gz MXGVRZGPDLORME-IUODEOHRSA-N 1 0 320.458 4.105 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccc(C)cc1O ZINC000280142388 1042565114 /nfs/dbraw/zinc/56/51/14/1042565114.db2.gz PSVJIEKWUBYYPJ-SFHVURJKSA-N 1 0 310.441 4.215 20 10 DICDRO CC[C@H]([NH2+]Cc1cnn(-c2ccccc2)c1)c1ccc(C)cc1O ZINC000280113216 1042565450 /nfs/dbraw/zinc/56/54/50/1042565450.db2.gz NSVZJBKOQCFZKY-IBGZPJMESA-N 1 0 321.424 4.127 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2OC)c1 ZINC000319628220 1042579085 /nfs/dbraw/zinc/57/90/85/1042579085.db2.gz BKYGZEJXOJJDGT-UONOGXRCSA-N 1 0 315.413 4.130 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000280754444 1042580077 /nfs/dbraw/zinc/58/00/77/1042580077.db2.gz BZWOTIRZYFCGSG-SECBINFHSA-N 1 0 313.294 4.108 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000237129334 1042689353 /nfs/dbraw/zinc/68/93/53/1042689353.db2.gz VQLZWKXPLJKBBB-UHFFFAOYSA-N 1 0 324.468 4.064 20 10 DICDRO CCCOc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000319815710 1042874797 /nfs/dbraw/zinc/87/47/97/1042874797.db2.gz LHEISDVIXDDPOD-INIZCTEOSA-N 1 0 312.457 4.392 20 10 DICDRO COc1ccccc1CC(C)(C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000237139684 1042909169 /nfs/dbraw/zinc/90/91/69/1042909169.db2.gz GSKQQTAMOJESOD-UHFFFAOYSA-N 1 0 313.441 4.129 20 10 DICDRO COc1ccccc1C[NH2+]Cc1cc(C)n(-c2ccccc2)c1C ZINC000017310942 1042912100 /nfs/dbraw/zinc/91/21/00/1042912100.db2.gz ZOZVFIDWBAZUBW-UHFFFAOYSA-N 1 0 320.436 4.393 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCCOC2CCCC2)cc1F ZINC000740004830 1042955985 /nfs/dbraw/zinc/95/59/85/1042955985.db2.gz XCOWULMTECNCKC-UHFFFAOYSA-N 1 0 322.468 4.111 20 10 DICDRO COc1ccccc1CC[N@H+](C)Cc1c(O)ccc2ccccc21 ZINC000729466369 1042973938 /nfs/dbraw/zinc/97/39/38/1042973938.db2.gz RGPMKSNYIDIYSN-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000729468316 1042975122 /nfs/dbraw/zinc/97/51/22/1042975122.db2.gz CDJKRIQREKXAKV-INIZCTEOSA-N 1 0 322.383 4.069 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H](c3cccc(F)c3)C1)CCC2 ZINC000729468665 1042975673 /nfs/dbraw/zinc/97/56/73/1042975673.db2.gz DKIULOUBDGDLOI-QGZVFWFLSA-N 1 0 311.400 4.010 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2cc(C3CC3)ccc2F)c1O ZINC000894872274 1042995903 /nfs/dbraw/zinc/99/59/03/1042995903.db2.gz GYYLEEBCVPQGQP-UHFFFAOYSA-N 1 0 315.388 4.016 20 10 DICDRO CC[C@@H]([NH2+]CCCCNc1ccccn1)c1ccc(C)cc1O ZINC000794805105 1043049051 /nfs/dbraw/zinc/04/90/51/1043049051.db2.gz FTWKFXUVZFDPFV-QGZVFWFLSA-N 1 0 313.445 4.029 20 10 DICDRO CC[C@H]([NH2+]CCCCNc1ccccn1)c1ccc(C)cc1O ZINC000794805102 1043049124 /nfs/dbraw/zinc/04/91/24/1043049124.db2.gz FTWKFXUVZFDPFV-KRWDZBQOSA-N 1 0 313.445 4.029 20 10 DICDRO CCc1nc(CC[NH2+][C@H](CC)c2ccc(C)cc2O)cs1 ZINC000794804979 1043049299 /nfs/dbraw/zinc/04/92/99/1043049299.db2.gz ONLSAPUMPBFRAF-OAHLLOKOSA-N 1 0 304.459 4.003 20 10 DICDRO CC[C@@H]([NH2+]Cc1nc(C)c2ccccc2n1)c1ccc(C)cc1O ZINC000794803441 1043050901 /nfs/dbraw/zinc/05/09/01/1043050901.db2.gz IZACRRNJJGIEQI-QGZVFWFLSA-N 1 0 321.424 4.193 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](CC)c2ccc(C)cc2O)C12CCC2 ZINC000794803694 1043051369 /nfs/dbraw/zinc/05/13/69/1043051369.db2.gz RVOPETLYQMYWJF-KBAYOESNSA-N 1 0 303.446 4.089 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(Cl)nc1)c1ccc(C)cc1O ZINC000794811642 1043058032 /nfs/dbraw/zinc/05/80/32/1043058032.db2.gz SWBSGQIQGXOIJF-HNNXBMFYSA-N 1 0 304.821 4.032 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2c1cccc2OC)c1ccc(C)cc1O ZINC000794810959 1043058055 /nfs/dbraw/zinc/05/80/55/1043058055.db2.gz PEDQSZPFCCYWNN-ROUUACIJSA-N 1 0 311.425 4.437 20 10 DICDRO CC[C@H]([NH2+][C@H](C)Cc1cccc(OC)c1)c1ccc(C)cc1O ZINC000794810898 1043058186 /nfs/dbraw/zinc/05/81/86/1043058186.db2.gz NPQCTNUVSUVYDC-BEFAXECRSA-N 1 0 313.441 4.381 20 10 DICDRO CC[C@@H]([NH2+]CCc1nc(C)c(C)s1)c1ccc(C)cc1O ZINC000794812683 1043059165 /nfs/dbraw/zinc/05/91/65/1043059165.db2.gz YQQBFOMNOLBLEH-OAHLLOKOSA-N 1 0 304.459 4.057 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794811918 1043060787 /nfs/dbraw/zinc/06/07/87/1043060787.db2.gz URMCOFWVTSKZBT-OAHLLOKOSA-N 1 0 302.418 4.054 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C)cc1O ZINC000794818496 1043062107 /nfs/dbraw/zinc/06/21/07/1043062107.db2.gz SYIYJQJSBBDJIX-BBRMVZONSA-N 1 0 314.385 4.411 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CC[C@H]2SCCS[C@H]12)c1ccc(C)cc1O ZINC000794817741 1043063123 /nfs/dbraw/zinc/06/31/23/1043063123.db2.gz PUCGUVBWPWZPET-XOSAIJSUSA-N 1 0 323.527 4.121 20 10 DICDRO CCC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)[C@H](O)c1ccccc1 ZINC000794830523 1043067842 /nfs/dbraw/zinc/06/78/42/1043067842.db2.gz JSPYLSYDOYSFAY-ZAAXVRCTSA-N 1 0 313.441 4.254 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)c1cc(F)ccc1O ZINC000794832194 1043069673 /nfs/dbraw/zinc/06/96/73/1043069673.db2.gz HDRMCJWNNBRXGD-PIGZYNQJSA-N 1 0 303.352 4.399 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CCC(OC(C)(C)C)CC2)cc1C ZINC000865698645 1043125019 /nfs/dbraw/zinc/12/50/19/1043125019.db2.gz QWFQAKGTERZHPJ-UHFFFAOYSA-N 1 0 305.462 4.225 20 10 DICDRO CCOc1ccc(C[NH2+]C2CCC(OC(C)(C)C)CC2)c(O)c1 ZINC000865699200 1043126721 /nfs/dbraw/zinc/12/67/21/1043126721.db2.gz WGXKOTFVZSXDQB-UHFFFAOYSA-N 1 0 321.461 4.007 20 10 DICDRO C[C@@H]([NH2+]Cc1ccoc1)c1ccc(N2CCCCC2)c(F)c1 ZINC000178474624 1043131704 /nfs/dbraw/zinc/13/17/04/1043131704.db2.gz VRCLLYZJYPEMCW-CQSZACIVSA-N 1 0 302.393 4.260 20 10 DICDRO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccccc1O ZINC000183332211 1043160478 /nfs/dbraw/zinc/16/04/78/1043160478.db2.gz XPQZAFYAEBXZQG-CYBMUJFWSA-N 1 0 304.459 4.387 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1OC(F)(F)F)c1ccccc1O ZINC000183393021 1043163176 /nfs/dbraw/zinc/16/31/76/1043163176.db2.gz ADSFQVZRPVQYFA-NSHDSACASA-N 1 0 311.303 4.142 20 10 DICDRO CC(C)COC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccco1 ZINC000183478145 1043164563 /nfs/dbraw/zinc/16/45/63/1043164563.db2.gz SUMAFZPANPLDSR-GDBMZVCRSA-N 1 0 303.402 4.050 20 10 DICDRO C[C@H]([NH2+]CCCCOCCc1ccccc1)c1ccccc1O ZINC000183430860 1043164672 /nfs/dbraw/zinc/16/46/72/1043164672.db2.gz ZQIZZLUNZXDTRT-KRWDZBQOSA-N 1 0 313.441 4.082 20 10 DICDRO CC(C)[C@H]([NH2+][C@H](C)c1ccccc1O)c1nc2ccccc2[nH]1 ZINC000183448053 1043165335 /nfs/dbraw/zinc/16/53/35/1043165335.db2.gz BHMDJJXPZRWJQU-ACJLOTCBSA-N 1 0 309.413 4.316 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccccc1O ZINC000183644866 1043169129 /nfs/dbraw/zinc/16/91/29/1043169129.db2.gz WTVSTJUTSZMUPB-XHBKTUGNSA-N 1 0 317.816 4.226 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(C)oc3ccccc32)c1 ZINC000184720776 1043187731 /nfs/dbraw/zinc/18/77/31/1043187731.db2.gz QYAMABKGGJDDLA-GFCCVEGCSA-N 1 0 311.381 4.306 20 10 DICDRO CC(C)Oc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cn1 ZINC000185046002 1043195435 /nfs/dbraw/zinc/19/54/35/1043195435.db2.gz SHLOVMFHVOTINE-GFCCVEGCSA-N 1 0 320.820 4.079 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(C(F)F)cc2)c(O)c1 ZINC000185172397 1043196831 /nfs/dbraw/zinc/19/68/31/1043196831.db2.gz IFGBHDHFPXWXJD-UHFFFAOYSA-N 1 0 321.367 4.408 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1cccc([N+](=O)[O-])c1 ZINC000185149623 1043197245 /nfs/dbraw/zinc/19/72/45/1043197245.db2.gz GJDNMHONKAVWLU-GHMZBOCLSA-N 1 0 320.776 4.366 20 10 DICDRO Cc1csc(CCCC[NH2+][C@@H](C)c2cc(C)ccc2O)n1 ZINC000185318769 1043197897 /nfs/dbraw/zinc/19/78/97/1043197897.db2.gz INRARRGXEPDBGF-AWEZNQCLSA-N 1 0 304.459 4.139 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOc2ccccc21)c1cc(F)ccc1O ZINC000185271359 1043198156 /nfs/dbraw/zinc/19/81/56/1043198156.db2.gz HESHTFKMZYGRFN-WBMJQRKESA-N 1 0 301.361 4.096 20 10 DICDRO CC(C)COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccco1 ZINC000185289462 1043198758 /nfs/dbraw/zinc/19/87/58/1043198758.db2.gz WDGHPQQIMQDJNJ-CJNGLKHVSA-N 1 0 321.392 4.189 20 10 DICDRO CC(C)c1nc(CC[NH2+][C@H](C)c2cc(F)ccc2O)cs1 ZINC000185310373 1043198797 /nfs/dbraw/zinc/19/87/97/1043198797.db2.gz QIJQOBARVBIDCE-LLVKDONJSA-N 1 0 308.422 4.005 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOc2ccccc21)c1cc(F)ccc1O ZINC000185271325 1043199065 /nfs/dbraw/zinc/19/90/65/1043199065.db2.gz HESHTFKMZYGRFN-MLGOLLRUSA-N 1 0 301.361 4.096 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc3cccnc3c2)c(O)c1 ZINC000866431333 1043201886 /nfs/dbraw/zinc/20/18/86/1043201886.db2.gz OPJSVLFTMRXNEO-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO CCc1cnc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000185584568 1043204170 /nfs/dbraw/zinc/20/41/70/1043204170.db2.gz NHJRHEUBORONFG-GFCCVEGCSA-N 1 0 316.470 4.141 20 10 DICDRO CCc1cnc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000185584549 1043205377 /nfs/dbraw/zinc/20/53/77/1043205377.db2.gz NHJRHEUBORONFG-LBPRGKRZSA-N 1 0 316.470 4.141 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cc(C)ccc2O)on1 ZINC000185561752 1043205616 /nfs/dbraw/zinc/20/56/16/1043205616.db2.gz GGZHMQOKJBIEGU-ZDUSSCGKSA-N 1 0 302.418 4.443 20 10 DICDRO CC(C)c1csc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)n1 ZINC000185807768 1043207697 /nfs/dbraw/zinc/20/76/97/1043207697.db2.gz ZTNHMWSHFRXLML-JTQLQIEISA-N 1 0 310.850 4.476 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccc(F)cc2)c1 ZINC000185838218 1043209225 /nfs/dbraw/zinc/20/92/25/1043209225.db2.gz AKKQPWOUIQOALT-KSMMKXTCSA-N 1 0 317.404 4.003 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(OC)c1OC ZINC000866509027 1043214626 /nfs/dbraw/zinc/21/46/26/1043214626.db2.gz UJURQXQNYRDRKS-XJKSGUPXSA-N 1 0 315.413 4.211 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccc1O ZINC000186106317 1043214754 /nfs/dbraw/zinc/21/47/54/1043214754.db2.gz FBWWXYDVRVRZKO-LJQANCHMSA-N 1 0 310.441 4.233 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(O)c1 ZINC000186093019 1043214849 /nfs/dbraw/zinc/21/48/49/1043214849.db2.gz ZWGFKQZPMGSUHB-KBPBESRZSA-N 1 0 314.385 4.329 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(F)c(F)c1 ZINC000186225891 1043218166 /nfs/dbraw/zinc/21/81/66/1043218166.db2.gz OROJLUIAYCVXAB-PXAZEXFGSA-N 1 0 321.367 4.017 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(F)c(F)c1 ZINC000186225929 1043218649 /nfs/dbraw/zinc/21/86/49/1043218649.db2.gz OROJLUIAYCVXAB-SJKOYZFVSA-N 1 0 321.367 4.017 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CC=CC[C@H]1C(F)(F)F)CC2 ZINC000866536412 1043219088 /nfs/dbraw/zinc/21/90/88/1043219088.db2.gz POYVAOBEZRCRFK-MJBXVCDLSA-N 1 0 311.347 4.114 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1[N+](=O)[O-] ZINC000866541084 1043221166 /nfs/dbraw/zinc/22/11/66/1043221166.db2.gz VXPSHPJHWJLJIH-NSHDSACASA-N 1 0 320.776 4.113 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(OC(C)(C)C)nc2)c1 ZINC000186507497 1043227055 /nfs/dbraw/zinc/22/70/55/1043227055.db2.gz VKYLBCQGRLORNF-CQSZACIVSA-N 1 0 314.429 4.124 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C(C)(C)C)o2)c1 ZINC000866573715 1043227263 /nfs/dbraw/zinc/22/72/63/1043227263.db2.gz LXPYJSHQQSKJAO-LBPRGKRZSA-N 1 0 303.402 4.142 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCOc3c(F)cccc32)c(O)c1 ZINC000186506809 1043227690 /nfs/dbraw/zinc/22/76/90/1043227690.db2.gz FNFFTRLAMYKDMX-DYVFJYSZSA-N 1 0 315.388 4.404 20 10 DICDRO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2cc(Cl)ccc2O)n1 ZINC000186561664 1043229681 /nfs/dbraw/zinc/22/96/81/1043229681.db2.gz ZHUHQUQXBURPBK-ONGXEEELSA-N 1 0 310.850 4.265 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1nccs1)c1ccc(N(C)C)cc1 ZINC000186736670 1043233833 /nfs/dbraw/zinc/23/38/33/1043233833.db2.gz VVPHAMWQPRPGRR-CJNGLKHVSA-N 1 0 303.475 4.054 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2noc3cc(F)ccc32)c(O)c1 ZINC000866612462 1043235878 /nfs/dbraw/zinc/23/58/78/1043235878.db2.gz JFZAGEQZYCYOPW-LBPRGKRZSA-N 1 0 314.360 4.140 20 10 DICDRO CCSc1cc(C[NH2+][C@@H](CC)c2ccccc2O)ccn1 ZINC000187787749 1043251873 /nfs/dbraw/zinc/25/18/73/1043251873.db2.gz GTWLAKMMWHVPCG-HNNXBMFYSA-N 1 0 302.443 4.140 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)c1O ZINC000777440647 1043252845 /nfs/dbraw/zinc/25/28/45/1043252845.db2.gz OQUYDGPKIXTLHU-HZPDHXFCSA-N 1 0 311.853 4.037 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(C(F)(F)F)cc1)c1ccccc1O ZINC000783489220 1043263709 /nfs/dbraw/zinc/26/37/09/1043263709.db2.gz BCTSTNHHCPLKEL-LBPRGKRZSA-N 1 0 309.331 4.304 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000121906864 1043265132 /nfs/dbraw/zinc/26/51/32/1043265132.db2.gz JYOAGSLLDAGRAA-LIRRHRJNSA-N 1 0 310.441 4.099 20 10 DICDRO C[C@H]1C[C@H]([NH3+])CN1C(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000868090651 1043272265 /nfs/dbraw/zinc/27/22/65/1043272265.db2.gz MUFAQUDNEGDJRT-KBPBESRZSA-N 1 0 323.400 4.055 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@H]3CCCNc4ccccc43)ccc21 ZINC000192780904 1043274452 /nfs/dbraw/zinc/27/44/52/1043274452.db2.gz XHVICOQIPBBRRM-FQEVSTJZSA-N 1 0 321.468 4.106 20 10 DICDRO CCCN(Cc1ccnc2ccccc12)c1ccc(C[NH3+])cc1 ZINC000320756327 1043283483 /nfs/dbraw/zinc/28/34/83/1043283483.db2.gz IYHWLLCETRRGOA-UHFFFAOYSA-N 1 0 305.425 4.110 20 10 DICDRO COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccc(Cl)cc1 ZINC000194255649 1043290402 /nfs/dbraw/zinc/29/04/02/1043290402.db2.gz DNIJYXLIGUKSGL-BZNIZROVSA-N 1 0 323.795 4.223 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000122425363 1043303575 /nfs/dbraw/zinc/30/35/75/1043303575.db2.gz SSIWXQKHGAIZNS-ZIAGYGMSSA-N 1 0 316.420 4.312 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000122425164 1043304157 /nfs/dbraw/zinc/30/41/57/1043304157.db2.gz SSIWXQKHGAIZNS-UONOGXRCSA-N 1 0 316.420 4.312 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1F ZINC000122690041 1043321992 /nfs/dbraw/zinc/32/19/92/1043321992.db2.gz OSCSPOWXUMTUSE-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)cn1 ZINC000268747815 1043327701 /nfs/dbraw/zinc/32/77/01/1043327701.db2.gz BKGGASRAYQVLBM-KRWDZBQOSA-N 1 0 309.457 4.231 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccnc1Cl ZINC000268811133 1043334254 /nfs/dbraw/zinc/33/42/54/1043334254.db2.gz KSFYQOGOAPTVGS-AWEZNQCLSA-N 1 0 315.848 4.186 20 10 DICDRO CC[C@@H]([NH2+]CC1(CCOC)CCC1)c1ccc(N(C)C)cc1 ZINC000123053646 1043344277 /nfs/dbraw/zinc/34/42/77/1043344277.db2.gz UGVXMVHUFZBKIN-GOSISDBHSA-N 1 0 304.478 4.000 20 10 DICDRO CC[N@H+](Cc1ccc(N2CCC(OC)CC2)cc1)C1CCCC1 ZINC000271147501 1043405525 /nfs/dbraw/zinc/40/55/25/1043405525.db2.gz ISEXEZQKWQUGIA-UHFFFAOYSA-N 1 0 316.489 4.066 20 10 DICDRO C[C@H]([NH2+]CC1(C)CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC000271471322 1043422533 /nfs/dbraw/zinc/42/25/33/1043422533.db2.gz IWORDZDCNGFTMB-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO CC[C@H](CCC(F)(F)F)[NH2+]CCCSc1nccs1 ZINC000872039942 1043431073 /nfs/dbraw/zinc/43/10/73/1043431073.db2.gz WQFQHOISNSLJJD-SNVBAGLBSA-N 1 0 312.426 4.336 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2cccc3ncccc23)c2c1c(F)ccc2O ZINC000872124300 1043468885 /nfs/dbraw/zinc/46/88/85/1043468885.db2.gz JDFPVAPJTHZGOY-PXAZEXFGSA-N 1 0 322.383 4.418 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@H](OCC(C)C)C2)cc1C(C)C ZINC000759150944 1043548563 /nfs/dbraw/zinc/54/85/63/1043548563.db2.gz MXEHSQAOXJCTAD-KRWDZBQOSA-N 1 0 305.462 4.071 20 10 DICDRO C[N@H+](CCC(C)(C)C)Cc1c(O)cccc1Br ZINC000707133695 1043564579 /nfs/dbraw/zinc/56/45/79/1043564579.db2.gz ZGVYITZQMHIGPX-UHFFFAOYSA-N 1 0 300.240 4.023 20 10 DICDRO CCCN(Cc1cc2ccncc2s1)c1ccc(C[NH3+])cc1 ZINC000825710399 1043566401 /nfs/dbraw/zinc/56/64/01/1043566401.db2.gz OCAOCUJVMDIERB-UHFFFAOYSA-N 1 0 311.454 4.172 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1C ZINC000926903155 1043652198 /nfs/dbraw/zinc/65/21/98/1043652198.db2.gz SKICYXWSHXVMBI-STQMWFEESA-N 1 0 303.377 4.260 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1C ZINC000926903153 1043652398 /nfs/dbraw/zinc/65/23/98/1043652398.db2.gz SKICYXWSHXVMBI-QWHCGFSZSA-N 1 0 303.377 4.260 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3cccnc32)c2c1c(F)ccc2O ZINC000927061436 1043676160 /nfs/dbraw/zinc/67/61/60/1043676160.db2.gz OAUCJDLOWKJBHR-DFBGVHRSSA-N 1 0 312.388 4.142 20 10 DICDRO C[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3cccnc32)c2c1c(F)ccc2O ZINC000927061439 1043676211 /nfs/dbraw/zinc/67/62/11/1043676211.db2.gz OAUCJDLOWKJBHR-NILFDRSVSA-N 1 0 312.388 4.142 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccc(Cl)cc1O ZINC000927062766 1043678203 /nfs/dbraw/zinc/67/82/03/1043678203.db2.gz PANAKLUUWULAPI-IAQYHMDHSA-N 1 0 302.805 4.169 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](c2cnn(C)c2)C(C)C)c1O ZINC000927070552 1043682841 /nfs/dbraw/zinc/68/28/41/1043682841.db2.gz OZOMEAYDAPIYCH-MLGOLLRUSA-N 1 0 321.852 4.135 20 10 DICDRO C[C@@H]([NH2+]Cc1cc(C2CC2)nn1C)c1ccc2ccccc2c1O ZINC000927101781 1043687431 /nfs/dbraw/zinc/68/74/31/1043687431.db2.gz OJNNPIXPKWWZSE-CYBMUJFWSA-N 1 0 321.424 4.007 20 10 DICDRO COc1cccc(C[N@H+](C)[C@@H](C)c2cc3ccccc3o2)c1O ZINC000126023452 1043694653 /nfs/dbraw/zinc/69/46/53/1043694653.db2.gz NBBZJARFYDSUKP-ZDUSSCGKSA-N 1 0 311.381 4.340 20 10 DICDRO CCc1cccc(C[NH2+]Cc2cc(C3CC3)ccc2OC)c1O ZINC000895535867 1043702244 /nfs/dbraw/zinc/70/22/44/1043702244.db2.gz CJTKCFWNAPQGFU-UHFFFAOYSA-N 1 0 311.425 4.130 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)c(O)c1 ZINC000876933757 1043725604 /nfs/dbraw/zinc/72/56/04/1043725604.db2.gz YKEDQGYLZZEFCN-LBPRGKRZSA-N 1 0 307.340 4.153 20 10 DICDRO Cc1cccc(O)c1C[NH2+]Cc1ccc(F)cc1C(F)(F)F ZINC000876932310 1043726506 /nfs/dbraw/zinc/72/65/06/1043726506.db2.gz JNYAFAYUTJVIFC-UHFFFAOYSA-N 1 0 313.294 4.148 20 10 DICDRO Cc1cccc(O)c1C[NH2+]Cc1cccc(COC(C)(C)C)c1 ZINC000876996415 1043731422 /nfs/dbraw/zinc/73/14/22/1043731422.db2.gz UBJWLNZQRZACGM-UHFFFAOYSA-N 1 0 313.441 4.306 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)c(O)c1 ZINC000877094710 1043743333 /nfs/dbraw/zinc/74/33/33/1043743333.db2.gz MPEQDKSDFXCKQM-KRWDZBQOSA-N 1 0 309.409 4.237 20 10 DICDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000825934046 1043743908 /nfs/dbraw/zinc/74/39/08/1043743908.db2.gz FWBWPIMMYCJAFS-INIZCTEOSA-N 1 0 304.821 4.332 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc3c(cccc3C)[nH]2)c1 ZINC000825935397 1043746777 /nfs/dbraw/zinc/74/67/77/1043746777.db2.gz SHZITMWWKMSQES-CYBMUJFWSA-N 1 0 310.397 4.041 20 10 DICDRO COCCCC[C@@H]([NH2+]Cc1ccc(C)cc1O)c1ccccc1 ZINC000877489427 1043766213 /nfs/dbraw/zinc/76/62/13/1043766213.db2.gz NQVRXWJUAJPTSA-LJQANCHMSA-N 1 0 313.441 4.348 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccsc2C(F)(F)F)c(O)c1 ZINC000877663109 1043786324 /nfs/dbraw/zinc/78/63/24/1043786324.db2.gz GTZYQOFTVDEVNS-UHFFFAOYSA-N 1 0 301.333 4.071 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(CSC(F)F)o1)c1ccccc1O ZINC000877756303 1043792009 /nfs/dbraw/zinc/79/20/09/1043792009.db2.gz FWNLEFIDGBKOQF-SNVBAGLBSA-N 1 0 313.369 4.292 20 10 DICDRO CC(C)c1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1[N+](=O)[O-] ZINC000877756595 1043792890 /nfs/dbraw/zinc/79/28/90/1043792890.db2.gz WROQATWREYGFBA-CYBMUJFWSA-N 1 0 314.385 4.275 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(CSC(F)F)o1)c1ccccc1O ZINC000877757098 1043793219 /nfs/dbraw/zinc/79/32/19/1043793219.db2.gz FWNLEFIDGBKOQF-JTQLQIEISA-N 1 0 313.369 4.292 20 10 DICDRO C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1F)c1ccccc1O ZINC000877757330 1043793277 /nfs/dbraw/zinc/79/32/77/1043793277.db2.gz QBECHBBYHAWFOH-JTQLQIEISA-N 1 0 313.294 4.401 20 10 DICDRO Cc1cccnc1[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccccc2O)C1 ZINC000877755478 1043793430 /nfs/dbraw/zinc/79/34/30/1043793430.db2.gz CEJKFMLRQJVIGA-ZACQAIPSSA-N 1 0 310.441 4.473 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(OC)cc1OC)c1ccccc1O ZINC000319560387 1043798423 /nfs/dbraw/zinc/79/84/23/1043798423.db2.gz KSJRLMAMISEBAD-GUYCJALGSA-N 1 0 315.413 4.211 20 10 DICDRO CCCN(Cc1cccc2cccnc21)c1ccc(C[NH3+])cc1 ZINC000320249384 1043835724 /nfs/dbraw/zinc/83/57/24/1043835724.db2.gz ZXBNTMGDBTUTDS-UHFFFAOYSA-N 1 0 305.425 4.110 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000127421891 1043930382 /nfs/dbraw/zinc/93/03/82/1043930382.db2.gz WAXGCWJPPYXPDA-WMZOPIPTSA-N 1 0 316.489 4.285 20 10 DICDRO CC(=O)c1c(C)cc(C)c(C[NH2+][C@H](C)c2ccccc2O)c1C ZINC000879648034 1043976164 /nfs/dbraw/zinc/97/61/64/1043976164.db2.gz WLMQDDSGLVWVRP-OAHLLOKOSA-N 1 0 311.425 4.371 20 10 DICDRO CC(C)CCc1nc(C[NH2+][C@@H](C)c2ccccc2O)cs1 ZINC000879651645 1043979333 /nfs/dbraw/zinc/97/93/33/1043979333.db2.gz FJPRWCHJKLQFRQ-ZDUSSCGKSA-N 1 0 304.459 4.288 20 10 DICDRO CC(=O)c1c(C)cc(C)c(C[NH2+][C@@H](C)c2ccccc2O)c1C ZINC000879653765 1043979972 /nfs/dbraw/zinc/97/99/72/1043979972.db2.gz WLMQDDSGLVWVRP-HNNXBMFYSA-N 1 0 311.425 4.371 20 10 DICDRO FC(F)(F)[C@H]1CCC[C@@H]([NH2+]CCCSc2nccs2)C1 ZINC000129976713 1044187982 /nfs/dbraw/zinc/18/79/82/1044187982.db2.gz RNMVXFFUCDDVDT-WDEREUQCSA-N 1 0 324.437 4.336 20 10 DICDRO CCc1cnc(CC[NH2+][C@H](CC)c2ccc(N(C)C)cc2)s1 ZINC000130285400 1044198329 /nfs/dbraw/zinc/19/83/29/1044198329.db2.gz WFYSKTCVWXEKBW-QGZVFWFLSA-N 1 0 317.502 4.055 20 10 DICDRO CCc1cnc(CC[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)s1 ZINC000130285191 1044199207 /nfs/dbraw/zinc/19/92/07/1044199207.db2.gz WFYSKTCVWXEKBW-KRWDZBQOSA-N 1 0 317.502 4.055 20 10 DICDRO Cc1csc(C[N@H+](Cc2ccccc2O)C2CCCCC2)n1 ZINC000130802940 1044217099 /nfs/dbraw/zinc/21/70/99/1044217099.db2.gz GQWRZDAQFMTMKM-UHFFFAOYSA-N 1 0 316.470 4.492 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(Cl)cn1 ZINC000778212850 1044221773 /nfs/dbraw/zinc/22/17/73/1044221773.db2.gz DISZGPMNRDQGSM-UHFFFAOYSA-N 1 0 317.864 4.212 20 10 DICDRO CCn1cc(C[NH2+][C@H](C)c2ccccc2O)c(-c2ccccc2)n1 ZINC000883224921 1044239994 /nfs/dbraw/zinc/23/99/94/1044239994.db2.gz VTHVDSVXWKWTPO-OAHLLOKOSA-N 1 0 321.424 4.126 20 10 DICDRO CCSc1ccc(C[NH2+][C@H](C)c2cccc(OC)c2O)cc1 ZINC000883245371 1044244487 /nfs/dbraw/zinc/24/44/87/1044244487.db2.gz KJLNDKKGQBRFSI-CYBMUJFWSA-N 1 0 317.454 4.364 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c(Cl)n1 ZINC000883301538 1044260124 /nfs/dbraw/zinc/26/01/24/1044260124.db2.gz BWMXXACMCQPGCW-CYBMUJFWSA-N 1 0 304.821 4.217 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1Cl)c1ccc(N(C)C)cc1 ZINC000883301804 1044263576 /nfs/dbraw/zinc/26/35/76/1044263576.db2.gz IMSLYIQGZAUQRP-QGZVFWFLSA-N 1 0 317.864 4.350 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(-n3cccn3)cc2)c(O)c1 ZINC000293252241 1044264090 /nfs/dbraw/zinc/26/40/90/1044264090.db2.gz BQHRJLLQMKHFFW-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H](CC)c2ccc(C)cc2O)o1 ZINC000293272337 1044266408 /nfs/dbraw/zinc/26/64/08/1044266408.db2.gz CKMPWIZXJNRAEV-OAHLLOKOSA-N 1 0 302.418 4.190 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C3CC3)cc2F)c1 ZINC000293279288 1044267514 /nfs/dbraw/zinc/26/75/14/1044267514.db2.gz CQZRVZBISIFEER-GFCCVEGCSA-N 1 0 315.388 4.268 20 10 DICDRO COC[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000883321241 1044273702 /nfs/dbraw/zinc/27/37/02/1044273702.db2.gz VKAIOMWNWXWKHG-JENIJYKNSA-N 1 0 316.489 4.143 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2c3ccccc3CC[C@H]2F)c1O ZINC000883377847 1044293401 /nfs/dbraw/zinc/29/34/01/1044293401.db2.gz SADVDVGJNYXPOD-BJOOFOGMSA-N 1 0 315.388 4.077 20 10 DICDRO CC[C@H]([NH2+][C@@H](Cn1ccnc1)c1ccccc1)c1ccccc1O ZINC000883387811 1044302618 /nfs/dbraw/zinc/30/26/18/1044302618.db2.gz FNWOEXIUXMRTBI-OALUTQOASA-N 1 0 321.424 4.071 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H](C)CC1CCOCC1 ZINC000475192788 1044313859 /nfs/dbraw/zinc/31/38/59/1044313859.db2.gz BWBVSXGOUCBUGE-HNNXBMFYSA-N 1 0 314.473 4.029 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)c1cc(F)ccc1F ZINC000132165141 1044314549 /nfs/dbraw/zinc/31/45/49/1044314549.db2.gz HTJWZPRLEUQTEM-JTQLQIEISA-N 1 0 314.426 4.254 20 10 DICDRO C[C@@H]([NH2+]CCCSc1nccs1)c1cc(F)ccc1F ZINC000132165346 1044315511 /nfs/dbraw/zinc/31/55/11/1044315511.db2.gz HTJWZPRLEUQTEM-SNVBAGLBSA-N 1 0 314.426 4.254 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000192807612 1044316670 /nfs/dbraw/zinc/31/66/70/1044316670.db2.gz AILZLHREXAPYTF-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1OC)c1ccccc1O ZINC000192808356 1044316971 /nfs/dbraw/zinc/31/69/71/1044316971.db2.gz VLHPRYYWDPCKKZ-BLLLJJGKSA-N 1 0 303.377 4.342 20 10 DICDRO c1csc(SCCC[NH2+][C@@H]2CCSc3ccccc32)n1 ZINC000132190444 1044316848 /nfs/dbraw/zinc/31/68/48/1044316848.db2.gz JLAJPCYHEYAAKS-CYBMUJFWSA-N 1 0 322.524 4.452 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1OC)c1ccccc1O ZINC000192808374 1044317940 /nfs/dbraw/zinc/31/79/40/1044317940.db2.gz VLHPRYYWDPCKKZ-WBMJQRKESA-N 1 0 303.377 4.342 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc(F)c(F)cc1F ZINC000475197194 1044319553 /nfs/dbraw/zinc/31/95/53/1044319553.db2.gz LUAOQGGXVWPQBJ-UHFFFAOYSA-N 1 0 318.342 4.194 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2cccc(C(F)(F)F)n2)c1 ZINC000293720602 1044320969 /nfs/dbraw/zinc/32/09/69/1044320969.db2.gz NOAWKYDWKRJZLV-LBPRGKRZSA-N 1 0 324.346 4.008 20 10 DICDRO CC[C@](C)([NH2+]Cc1ccc(N(C)C)c(C)c1)c1nc(C)cs1 ZINC000293894248 1044349502 /nfs/dbraw/zinc/34/95/02/1044349502.db2.gz VKEGZEDRFPODQM-SFHVURJKSA-N 1 0 317.502 4.241 20 10 DICDRO COCC[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000840835802 1044359460 /nfs/dbraw/zinc/35/94/60/1044359460.db2.gz AQIXUQBSEPYBDX-MSOLQXFVSA-N 1 0 318.505 4.390 20 10 DICDRO COCC[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000840838623 1044367618 /nfs/dbraw/zinc/36/76/18/1044367618.db2.gz SASIETVGQGKZBL-DLBZAZTESA-N 1 0 304.478 4.000 20 10 DICDRO CO[C@@](C)([C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O)C1CC1 ZINC000840858846 1044395682 /nfs/dbraw/zinc/39/56/82/1044395682.db2.gz HBQXUMSLFJBKMJ-MNVSYLFESA-N 1 0 313.441 4.400 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000121301637 1044422955 /nfs/dbraw/zinc/42/29/55/1044422955.db2.gz GZFJAHVNLDOMIO-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000294821899 1044464002 /nfs/dbraw/zinc/46/40/02/1044464002.db2.gz QMLXQFOOVVAMBZ-CHWSQXEVSA-N 1 0 320.458 4.024 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)on1 ZINC000121146455 1044521698 /nfs/dbraw/zinc/52/16/98/1044521698.db2.gz BOVOPWZAFDUGFH-AWEZNQCLSA-N 1 0 315.461 4.495 20 10 DICDRO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297002787 1044655002 /nfs/dbraw/zinc/65/50/02/1044655002.db2.gz SWHZMMMSOYJBJX-BBRMVZONSA-N 1 0 321.424 4.100 20 10 DICDRO c1coc([C@@H](NCc2ccc3c(c2)CCO3)c2ccccc2)c1 ZINC000043288581 1044683645 /nfs/dbraw/zinc/68/36/45/1044683645.db2.gz HRLQRMBCMUYEOL-FQEVSTJZSA-N 1 0 305.377 4.094 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccccc1O ZINC000155250444 1044690735 /nfs/dbraw/zinc/69/07/35/1044690735.db2.gz NDHPDQTZHFMCBM-UHFFFAOYSA-N 1 0 310.441 4.015 20 10 DICDRO CC(C)n1ncc2c1[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)CCC2 ZINC000368158797 1044768050 /nfs/dbraw/zinc/76/80/50/1044768050.db2.gz IWQAORCWDJBJMX-WBMJQRKESA-N 1 0 317.408 4.037 20 10 DICDRO CC[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(Cl)c1[O-] ZINC000368575886 1044782989 /nfs/dbraw/zinc/78/29/89/1044782989.db2.gz PBEWXXJGMUCLCD-MQBCKMQZSA-N 1 0 322.880 4.103 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCCS1)c1ccc2ccccc2c1O ZINC000156318455 1044789634 /nfs/dbraw/zinc/78/96/34/1044789634.db2.gz HZFQHYAWYQNPHN-DZGCQCFKSA-N 1 0 301.455 4.482 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCCS1)c1ccc2ccccc2c1O ZINC000156318322 1044790910 /nfs/dbraw/zinc/79/09/10/1044790910.db2.gz HZFQHYAWYQNPHN-HIFRSBDPSA-N 1 0 301.455 4.482 20 10 DICDRO C[C@H](CC(F)(F)F)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000222909435 1044816487 /nfs/dbraw/zinc/81/64/87/1044816487.db2.gz LZTHMRKLZSCQOR-CYBMUJFWSA-N 1 0 300.368 4.107 20 10 DICDRO CCC[C@H](C)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000157722293 1044942144 /nfs/dbraw/zinc/94/21/44/1044942144.db2.gz CTJPOWHLSIRBCI-ZDUSSCGKSA-N 1 0 312.404 4.035 20 10 DICDRO CC[C@H]([NH2+]Cc1cn(C)nc1-c1ccccc1)c1ccccc1O ZINC000157937261 1044957602 /nfs/dbraw/zinc/95/76/02/1044957602.db2.gz HCFYYKUALXQHRJ-SFHVURJKSA-N 1 0 321.424 4.034 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000134910121 1044969371 /nfs/dbraw/zinc/96/93/71/1044969371.db2.gz OSSKPCNRABXOPA-KGLIPLIRSA-N 1 0 315.461 4.372 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000134918000 1044973112 /nfs/dbraw/zinc/97/31/12/1044973112.db2.gz OHKGRUNDSQMVEF-QWHCGFSZSA-N 1 0 301.434 4.064 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000134925800 1044973315 /nfs/dbraw/zinc/97/33/15/1044973315.db2.gz PNLXNHDSCRGJNT-NEPJUHHUSA-N 1 0 319.424 4.203 20 10 DICDRO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cc(F)ccc1O ZINC000778986026 1045104945 /nfs/dbraw/zinc/10/49/45/1045104945.db2.gz YVDUGNWEQTXNBH-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)C2CCSCC2)cc1 ZINC000779002960 1045119374 /nfs/dbraw/zinc/11/93/74/1045119374.db2.gz IVHCMMRZQIGQFU-OAHLLOKOSA-N 1 0 306.519 4.154 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(CC)CC)cc1)c1ccc(F)cn1 ZINC000779021816 1045147136 /nfs/dbraw/zinc/14/71/36/1045147136.db2.gz XWKXQMGLXPEFLH-GOSISDBHSA-N 1 0 315.436 4.308 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1ccns1 ZINC000925010212 1045219648 /nfs/dbraw/zinc/21/96/48/1045219648.db2.gz FDLHYAUNPKGYAD-HNNXBMFYSA-N 1 0 315.486 4.230 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cc(Cl)ccc1O ZINC000528035653 1045295614 /nfs/dbraw/zinc/29/56/14/1045295614.db2.gz JGKVJQWSXOSSKN-IINYFYTJSA-N 1 0 308.784 4.382 20 10 DICDRO CO[C@@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cccc(C)c1O ZINC000779150253 1045323833 /nfs/dbraw/zinc/32/38/33/1045323833.db2.gz SKQRQMIHVBIOFK-FZKQIMNGSA-N 1 0 319.832 4.220 20 10 DICDRO CO[C@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cccc(C)c1O ZINC000779150250 1045324422 /nfs/dbraw/zinc/32/44/22/1045324422.db2.gz SKQRQMIHVBIOFK-ACJLOTCBSA-N 1 0 319.832 4.220 20 10 DICDRO COc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000188796024 1045339443 /nfs/dbraw/zinc/33/94/43/1045339443.db2.gz UPDCFVVZQQTGEB-KBPBESRZSA-N 1 0 322.408 4.361 20 10 DICDRO CCOC1CC(CC[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000189255249 1045344701 /nfs/dbraw/zinc/34/47/01/1045344701.db2.gz JCMKUOZFTHZSNE-KSTDHSDQSA-N 1 0 317.473 4.127 20 10 DICDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000189374117 1045345788 /nfs/dbraw/zinc/34/57/88/1045345788.db2.gz KFIGSVBOSOYPED-HNAYVOBHSA-N 1 0 310.441 4.235 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000779178508 1045349554 /nfs/dbraw/zinc/34/95/54/1045349554.db2.gz QRLQUZAIYKWTMZ-CVAIRZPRSA-N 1 0 318.505 4.387 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](c1ccncc1)C1CC1 ZINC001120257847 1045535528 /nfs/dbraw/zinc/53/55/28/1045535528.db2.gz ANDVHKLDTCKOTA-PSGMQZRDSA-N 1 0 308.425 4.385 20 10 DICDRO COc1cccc(F)c1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC001120363709 1045538180 /nfs/dbraw/zinc/53/81/80/1045538180.db2.gz IKJULMGRDFQARU-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO Nc1ccc(C[N@@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cc1 ZINC001120264035 1045538219 /nfs/dbraw/zinc/53/82/19/1045538219.db2.gz ZZFBGDDFNJLUGP-QGZVFWFLSA-N 1 0 305.425 4.130 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)c1 ZINC000800494865 1045633176 /nfs/dbraw/zinc/63/31/76/1045633176.db2.gz GIPXEPWTIXHBBP-MLGOLLRUSA-N 1 0 301.817 4.172 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c(O)c1 ZINC000800496863 1045634011 /nfs/dbraw/zinc/63/40/11/1045634011.db2.gz ZVEIFZHJNXEKEU-WBMJQRKESA-N 1 0 301.817 4.172 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCC12CCOCC2)c1ccc(N(C)C)cc1 ZINC000800498249 1045635553 /nfs/dbraw/zinc/63/55/53/1045635553.db2.gz GAZACDSNTOWKKZ-OALUTQOASA-N 1 0 316.489 4.143 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000800525308 1045638486 /nfs/dbraw/zinc/63/84/86/1045638486.db2.gz SOPPDMIVAMYTMM-GHTZIAJQSA-N 1 0 323.484 4.483 20 10 DICDRO COc1ccc(C[NH2+]C[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1C ZINC000752266993 1045669853 /nfs/dbraw/zinc/66/98/53/1045669853.db2.gz UPKBWVAGFNEWSR-HIFRSBDPSA-N 1 0 315.379 4.462 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc2OC1)c1cc(Cl)ccc1O ZINC000800987423 1045678311 /nfs/dbraw/zinc/67/83/11/1045678311.db2.gz XSRVYGACWORHHP-IUODEOHRSA-N 1 0 317.816 4.090 20 10 DICDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000800994770 1045680166 /nfs/dbraw/zinc/68/01/66/1045680166.db2.gz XHLHLCQQMDMOHC-SJCJKPOMSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)c1O ZINC000779431879 1045711101 /nfs/dbraw/zinc/71/11/01/1045711101.db2.gz GTIJUNBWQZCMLL-INIZCTEOSA-N 1 0 317.816 4.358 20 10 DICDRO CC(C)SCC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000801522912 1045732105 /nfs/dbraw/zinc/73/21/05/1045732105.db2.gz FHOYQDSUDDYGNN-UHFFFAOYSA-N 1 0 305.443 4.129 20 10 DICDRO Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1cc(F)ccc1O ZINC000191671054 1045745877 /nfs/dbraw/zinc/74/58/77/1045745877.db2.gz VFCZCEADPTZHTR-UHFFFAOYSA-N 1 0 313.294 4.148 20 10 DICDRO CCCC[N@H+](Cc1nc2ccccc2[nH]1)Cc1ccccc1O ZINC000801599241 1045751550 /nfs/dbraw/zinc/75/15/50/1045751550.db2.gz GRWRLTNFOMZZEG-UHFFFAOYSA-N 1 0 309.413 4.071 20 10 DICDRO C[N@H+](Cc1ccoc1)Cc1ccc(OCc2ccccc2)cc1O ZINC000753535227 1045758444 /nfs/dbraw/zinc/75/84/44/1045758444.db2.gz JEBABAMTKIDMJS-UHFFFAOYSA-N 1 0 323.392 4.196 20 10 DICDRO C[C@H](CCC(F)(F)F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000753617287 1045778445 /nfs/dbraw/zinc/77/84/45/1045778445.db2.gz RVYPLXHFMLAWHT-CYBMUJFWSA-N 1 0 300.368 4.107 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(F)c(F)c1F)c1ccc(N(C)C)cc1 ZINC000753742248 1045798736 /nfs/dbraw/zinc/79/87/36/1045798736.db2.gz AFSCORRSQSOJQW-LBPRGKRZSA-N 1 0 322.374 4.063 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(F)c(F)c1F)c1ccc(N(C)C)cc1 ZINC000753742240 1045799640 /nfs/dbraw/zinc/79/96/40/1045799640.db2.gz AFSCORRSQSOJQW-GFCCVEGCSA-N 1 0 322.374 4.063 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(C(F)(F)F)c1 ZINC000079249434 1045875002 /nfs/dbraw/zinc/87/50/02/1045875002.db2.gz RNNINOSLUWJOIT-LBPRGKRZSA-N 1 0 321.342 4.491 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2)c1O ZINC000754727629 1045921882 /nfs/dbraw/zinc/92/18/82/1045921882.db2.gz LAVIRVSPJBPCDK-GOSISDBHSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@H](c3ccccc3)[C@H]2C)c1O ZINC000754740539 1045924041 /nfs/dbraw/zinc/92/40/41/1045924041.db2.gz UVJNTBNVCHOIMF-QAPCUYQASA-N 1 0 311.425 4.087 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[NH2+]C(C)(C)c2cccs2)c1O ZINC000754825439 1045929604 /nfs/dbraw/zinc/92/96/04/1045929604.db2.gz OLPJCBSCFHVGSK-UHFFFAOYSA-N 1 0 323.845 4.335 20 10 DICDRO C[N@H+](Cc1c[nH]c2ccc(Cl)cc12)Cc1ccccc1O ZINC001137714264 1045944161 /nfs/dbraw/zinc/94/41/61/1045944161.db2.gz JYYDZGQGEYSGKP-UHFFFAOYSA-N 1 0 300.789 4.159 20 10 DICDRO COc1cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)ccc1Cl ZINC000828958652 1045946317 /nfs/dbraw/zinc/94/63/17/1045946317.db2.gz BBPPCBKGNYFSRG-CYBMUJFWSA-N 1 0 318.848 4.265 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)CCCC(F)(F)F)c1O ZINC000755222366 1045964357 /nfs/dbraw/zinc/96/43/57/1045964357.db2.gz FQKVELIICNPMOB-LLVKDONJSA-N 1 0 305.340 4.002 20 10 DICDRO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(C)n(-c2ccccc2)c1C ZINC001137859307 1045987637 /nfs/dbraw/zinc/98/76/37/1045987637.db2.gz SGSJGWFHESISBL-HXUWFJFHSA-N 1 0 310.441 4.038 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c(C)n1-c1ccccc1 ZINC001137859165 1045987878 /nfs/dbraw/zinc/98/78/78/1045987878.db2.gz LXPOXEORDZUTQZ-OAQYLSRUSA-N 1 0 324.468 4.097 20 10 DICDRO CCC[C@@H](C)[N@H+](CC)Cc1cc(Br)ccc1O ZINC001644709890 1046041134 /nfs/dbraw/zinc/04/11/34/1046041134.db2.gz AAUFIRCHEHRWTB-LLVKDONJSA-N 1 0 300.240 4.165 20 10 DICDRO CCCC[N@H+](Cc1sccc1OC)Cc1ccccc1O ZINC000802657514 1046027324 /nfs/dbraw/zinc/02/73/24/1046027324.db2.gz GYXQAXLFLBSFTL-UHFFFAOYSA-N 1 0 305.443 4.265 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)Cc1ccc(F)nc1C ZINC000802657491 1046027552 /nfs/dbraw/zinc/02/75/52/1046027552.db2.gz GHZYCESSXOFHMX-UHFFFAOYSA-N 1 0 302.393 4.037 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1 ZINC000802657978 1046030682 /nfs/dbraw/zinc/03/06/82/1046030682.db2.gz XYDGHFBWKVLAPB-OAHLLOKOSA-N 1 0 313.363 4.255 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)c1O ZINC000802659119 1046030711 /nfs/dbraw/zinc/03/07/11/1046030711.db2.gz DTVVPVGYVYZYSR-STQMWFEESA-N 1 0 311.853 4.037 20 10 DICDRO CCC[C@H](C)[N@H+](CC)Cc1cc(Br)ccc1O ZINC001644709891 1046041381 /nfs/dbraw/zinc/04/13/81/1046041381.db2.gz AAUFIRCHEHRWTB-NSHDSACASA-N 1 0 300.240 4.165 20 10 DICDRO C[N@H+](Cc1ccccc1O)Cc1cccc(C(F)(F)F)c1F ZINC001138011769 1046054840 /nfs/dbraw/zinc/05/48/40/1046054840.db2.gz HKDOGSSBTSPZKR-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cccc(N3CCCC3)c2)cc1C ZINC000756144778 1046055786 /nfs/dbraw/zinc/05/57/86/1046055786.db2.gz BCRLWNFMDPIPOO-KRWDZBQOSA-N 1 0 324.468 4.455 20 10 DICDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2c1O ZINC000193701122 1046060359 /nfs/dbraw/zinc/06/03/59/1046060359.db2.gz YEZODUSXYTUKPO-ZDUSSCGKSA-N 1 0 322.364 4.304 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]CCc2ccccc2F)c2c1c(F)ccc2O ZINC000756358315 1046068903 /nfs/dbraw/zinc/06/89/03/1046068903.db2.gz WFKSJFWPEQGLGG-XHDPSFHLSA-N 1 0 303.352 4.051 20 10 DICDRO C[C@@H]([NH2+]CCCO[C@H](C)c1ccccc1)c1cc(F)ccc1O ZINC000756359143 1046069140 /nfs/dbraw/zinc/06/91/40/1046069140.db2.gz NYEAMPPYEZBFNC-HUUCEWRRSA-N 1 0 317.404 4.350 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCc2ccccc2F)c2c1c(F)ccc2O ZINC000756358301 1046069651 /nfs/dbraw/zinc/06/96/51/1046069651.db2.gz WFKSJFWPEQGLGG-ABAIWWIYSA-N 1 0 303.352 4.051 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCc2cccc(F)c2)c2c1c(F)ccc2O ZINC000756357182 1046069680 /nfs/dbraw/zinc/06/96/80/1046069680.db2.gz CJRGKZYYNCXKIO-NHYWBVRUSA-N 1 0 303.352 4.051 20 10 DICDRO Cc1ccc(SCC[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756361948 1046069801 /nfs/dbraw/zinc/06/98/01/1046069801.db2.gz LWKNJYOHRQPBBW-CYBMUJFWSA-N 1 0 305.418 4.283 20 10 DICDRO Cc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)cc1F ZINC000756362743 1046070253 /nfs/dbraw/zinc/07/02/53/1046070253.db2.gz CKAGAJBZNZNALG-NHYWBVRUSA-N 1 0 303.352 4.317 20 10 DICDRO C[C@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1cc(Cl)ccc1O ZINC000756369251 1046071477 /nfs/dbraw/zinc/07/14/77/1046071477.db2.gz BBZRPBURJPVIBV-XHDPSFHLSA-N 1 0 324.877 4.061 20 10 DICDRO COCc1ccccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756373760 1046071897 /nfs/dbraw/zinc/07/18/97/1046071897.db2.gz YODMCIFXKMVYBE-LRDDRELGSA-N 1 0 315.388 4.016 20 10 DICDRO C[C@H]([NH2+]CCCOc1ccccc1)c1cc(Cl)ccc1O ZINC000756365242 1046072294 /nfs/dbraw/zinc/07/22/94/1046072294.db2.gz OIBOAWVTOVTFAG-ZDUSSCGKSA-N 1 0 305.805 4.165 20 10 DICDRO C[C@H](Cc1cccs1)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756379747 1046073874 /nfs/dbraw/zinc/07/38/74/1046073874.db2.gz QBLQDFWHMSHUGD-MISXGVKJSA-N 1 0 305.418 4.362 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccc3cccnc32)c(O)c1C ZINC000756392834 1046076304 /nfs/dbraw/zinc/07/63/04/1046076304.db2.gz NNOXXYXIPGNRTA-MRXNPFEDSA-N 1 0 320.436 4.451 20 10 DICDRO C[C@H]([NH2+]CCN1CCCC[C@@H]1C)c1ccc2ccccc2c1O ZINC000756419464 1046078240 /nfs/dbraw/zinc/07/82/40/1046078240.db2.gz UQPHAYIFUHABKS-HOTGVXAUSA-N 1 0 312.457 4.070 20 10 DICDRO CCc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)s1 ZINC000756413978 1046078622 /nfs/dbraw/zinc/07/86/22/1046078622.db2.gz HFIAGNONNSSDOI-IINYFYTJSA-N 1 0 305.418 4.493 20 10 DICDRO C[C@H]([NH2+][C@H](Cn1ccnc1)C(C)(C)C)c1cc(Cl)ccc1O ZINC000756440749 1046080425 /nfs/dbraw/zinc/08/04/25/1046080425.db2.gz GTFVWINQHXGNLV-BLLLJJGKSA-N 1 0 321.852 4.008 20 10 DICDRO CCOc1ccccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756442655 1046081869 /nfs/dbraw/zinc/08/18/69/1046081869.db2.gz FRWQHMMNCDCSMV-IUODEOHRSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCCN(C)c2ccccc2)c1 ZINC000756447418 1046081919 /nfs/dbraw/zinc/08/19/19/1046081919.db2.gz WKEAJJRZCHYDHN-KRWDZBQOSA-N 1 0 312.457 4.268 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)c1 ZINC000756464847 1046084394 /nfs/dbraw/zinc/08/43/94/1046084394.db2.gz HZRFCEFBQCLLOK-CQSZACIVSA-N 1 0 324.424 4.350 20 10 DICDRO C[C@H](Cc1ccsc1)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756457991 1046084857 /nfs/dbraw/zinc/08/48/57/1046084857.db2.gz ITAGEDFZBUYRPY-MISXGVKJSA-N 1 0 305.418 4.362 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)COc2ccc(F)cc2F)c1 ZINC000756454760 1046085077 /nfs/dbraw/zinc/08/50/77/1046085077.db2.gz NUCJUWAOSWGXIX-STQMWFEESA-N 1 0 321.367 4.097 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1cc2c(cc1O)CCCC2 ZINC000756459763 1046085136 /nfs/dbraw/zinc/08/51/36/1046085136.db2.gz WYFVKGHIQNMVGJ-LBPRGKRZSA-N 1 0 317.379 4.400 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)c1 ZINC000756483505 1046088620 /nfs/dbraw/zinc/08/86/20/1046088620.db2.gz RVQQXMFRFJBFSN-CXAGYDPISA-N 1 0 315.388 4.404 20 10 DICDRO COc1ccccc1C(C)(C)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000756493996 1046090304 /nfs/dbraw/zinc/09/03/04/1046090304.db2.gz CIIYQBRXHGTENB-HNNXBMFYSA-N 1 0 313.441 4.338 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(O)c1C ZINC000756497577 1046090643 /nfs/dbraw/zinc/09/06/43/1046090643.db2.gz QNXMEVKJBPFENE-AWEZNQCLSA-N 1 0 316.420 4.065 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2F)c2c1c(F)ccc2O ZINC000756496081 1046090904 /nfs/dbraw/zinc/09/09/04/1046090904.db2.gz MYOFCKRSHDMKDM-YMTOWFKASA-N 1 0 307.315 4.148 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc3ccccc3n2)c(O)c1 ZINC000756497340 1046092369 /nfs/dbraw/zinc/09/23/69/1046092369.db2.gz TXFPYELQKDGRJV-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCCOC2CCCC2)c2c1c(F)ccc2O ZINC000756501128 1046092508 /nfs/dbraw/zinc/09/25/08/1046092508.db2.gz BEHIIPRTZQBEDJ-DOMZBBRYSA-N 1 0 307.409 4.019 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2cc(F)cc(F)c2)c(O)c1C ZINC000756509446 1046093271 /nfs/dbraw/zinc/09/32/71/1046093271.db2.gz BUNAKSDYUYJMKB-ZDUSSCGKSA-N 1 0 305.368 4.181 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2ccccc2c1O ZINC000756514942 1046093681 /nfs/dbraw/zinc/09/36/81/1046093681.db2.gz KOQNTVOBOIAKKA-CQSZACIVSA-N 1 0 319.404 4.331 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2cc(F)cc(F)c2)c(O)c1C ZINC000756509443 1046094872 /nfs/dbraw/zinc/09/48/72/1046094872.db2.gz BUNAKSDYUYJMKB-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN([C@H](C)c3ccccc3)C2)c(O)c1 ZINC000756535947 1046095879 /nfs/dbraw/zinc/09/58/79/1046095879.db2.gz SSUGPVIYRPHYBO-YQVWRLOYSA-N 1 0 324.468 4.187 20 10 DICDRO Cc1csc([C@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000756533264 1046095904 /nfs/dbraw/zinc/09/59/04/1046095904.db2.gz DDKCHCKCZDIDGV-QRTLGDNMSA-N 1 0 306.406 4.195 20 10 DICDRO C[C@@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccc2ccccc2c1O ZINC000756534876 1046096329 /nfs/dbraw/zinc/09/63/29/1046096329.db2.gz LIEFZHHEBTZQCH-KUHUBIRLSA-N 1 0 313.441 4.137 20 10 DICDRO COc1ccc(CC[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1F ZINC000756539554 1046098765 /nfs/dbraw/zinc/09/87/65/1046098765.db2.gz QIIVOAVXIIUAOU-CQSZACIVSA-N 1 0 317.404 4.050 20 10 DICDRO C[C@H]1C[C@H]([NH2+]Cc2cc(F)ccc2F)c2c1c(F)ccc2O ZINC000756547862 1046099056 /nfs/dbraw/zinc/09/90/56/1046099056.db2.gz IBXSWDOQOWSSSN-XPTSAGLGSA-N 1 0 307.315 4.148 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1cc2c(cc1O)CCCC2 ZINC000756550876 1046099240 /nfs/dbraw/zinc/09/92/40/1046099240.db2.gz UBTUZHKMRLONNO-DJJJIMSYSA-N 1 0 323.436 4.315 20 10 DICDRO CC(C)c1cc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)on1 ZINC000756570874 1046099697 /nfs/dbraw/zinc/09/96/97/1046099697.db2.gz GJOMJWXGUHLRLL-CYBMUJFWSA-N 1 0 314.429 4.233 20 10 DICDRO CC(C)c1cc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)on1 ZINC000756570880 1046100904 /nfs/dbraw/zinc/10/09/04/1046100904.db2.gz GJOMJWXGUHLRLL-ZDUSSCGKSA-N 1 0 314.429 4.233 20 10 DICDRO CC(C)n1cc([C@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)cn1 ZINC000756575866 1046101753 /nfs/dbraw/zinc/10/17/53/1046101753.db2.gz QSCXBSRKQFVWGS-XUJVJEKNSA-N 1 0 317.408 4.208 20 10 DICDRO Cc1noc(C)c1[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756575467 1046102167 /nfs/dbraw/zinc/10/21/67/1046102167.db2.gz UGXMZSRERZEVLT-VYUIOLGVSA-N 1 0 304.365 4.035 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000756582348 1046104334 /nfs/dbraw/zinc/10/43/34/1046104334.db2.gz HOETUUYZHXAQPD-SJORKVTESA-N 1 0 310.441 4.020 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000756581519 1046104828 /nfs/dbraw/zinc/10/48/28/1046104828.db2.gz DCDIPBJCIUIGTG-IAGOWNOFSA-N 1 0 310.441 4.020 20 10 DICDRO CC(C)n1ccc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)n1 ZINC000756596011 1046106177 /nfs/dbraw/zinc/10/61/77/1046106177.db2.gz XMKVVRJFWQLUGG-CQSZACIVSA-N 1 0 309.413 4.174 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccc(Cl)cc1 ZINC000756608475 1046108417 /nfs/dbraw/zinc/10/84/17/1046108417.db2.gz CLQRARWRMAQHTL-APPDUMDISA-N 1 0 323.795 4.223 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1ccc(Cl)cc1 ZINC000756608476 1046108484 /nfs/dbraw/zinc/10/84/84/1046108484.db2.gz CLQRARWRMAQHTL-DIFFPNOSSA-N 1 0 323.795 4.223 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)C12CCC2 ZINC000756613489 1046110600 /nfs/dbraw/zinc/11/06/00/1046110600.db2.gz PSDNCXLINMSJHP-IUIKQTSFSA-N 1 0 309.837 4.044 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)Oc2ccccc2F)c(O)c1C ZINC000756609717 1046110765 /nfs/dbraw/zinc/11/07/65/1046110765.db2.gz NAJXSXIXFWTAQI-HIFRSBDPSA-N 1 0 317.404 4.266 20 10 DICDRO Cc1cccc2oc(CC[NH2+][C@H](C)c3ccc(C)c(C)c3O)nc21 ZINC000756624387 1046112109 /nfs/dbraw/zinc/11/21/09/1046112109.db2.gz FJYMUKFFJHIGPB-OAHLLOKOSA-N 1 0 324.424 4.352 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3ccc(C)c(C)c3O)nc2c1 ZINC000756629580 1046112232 /nfs/dbraw/zinc/11/22/32/1046112232.db2.gz PZMOYQFYNRXYOA-CQSZACIVSA-N 1 0 309.413 4.045 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)c2ccc(F)cc2F)c1 ZINC000756620905 1046112516 /nfs/dbraw/zinc/11/25/16/1046112516.db2.gz OHDIBXGMTDLJTA-STQMWFEESA-N 1 0 305.368 4.433 20 10 DICDRO CSc1ccc(F)cc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756625305 1046112534 /nfs/dbraw/zinc/11/25/34/1046112534.db2.gz JFHQOIUFAQHGIJ-JTQLQIEISA-N 1 0 309.381 4.243 20 10 DICDRO CCC1(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CCOCC1 ZINC000756628350 1046112544 /nfs/dbraw/zinc/11/25/44/1046112544.db2.gz LJDRGJZLTVUMKC-HNNXBMFYSA-N 1 0 317.473 4.128 20 10 DICDRO Cc1ccccc1[C@@H](CO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000756635025 1046114054 /nfs/dbraw/zinc/11/40/54/1046114054.db2.gz DFMBPPDIDCEPPF-MGPUTAFESA-N 1 0 321.420 4.238 20 10 DICDRO CCO[C@H](CC[NH2+][C@H](C)c1cc(C)ccc1O)C1CCCC1 ZINC000756634674 1046114295 /nfs/dbraw/zinc/11/42/95/1046114295.db2.gz CCYSBTHTRPVMAK-DNVCBOLYSA-N 1 0 305.462 4.337 20 10 DICDRO CC[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)Oc1ccccc1F ZINC000756637289 1046114850 /nfs/dbraw/zinc/11/48/50/1046114850.db2.gz IWUZRVFBNDYUGV-GJZGRUSLSA-N 1 0 317.404 4.348 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000756645708 1046115661 /nfs/dbraw/zinc/11/56/61/1046115661.db2.gz JGSPPLRZKCTFKL-KDOFPFPSSA-N 1 0 311.425 4.356 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000756645706 1046116068 /nfs/dbraw/zinc/11/60/68/1046116068.db2.gz JGSPPLRZKCTFKL-KBXCAEBGSA-N 1 0 311.425 4.356 20 10 DICDRO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc3ccccc3c2O)CCO1 ZINC000756663506 1046117616 /nfs/dbraw/zinc/11/76/16/1046117616.db2.gz JWHFBAJKMUNNDO-ZSZQSSIHSA-N 1 0 313.441 4.400 20 10 DICDRO CSc1cc(C)ccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756651904 1046117741 /nfs/dbraw/zinc/11/77/41/1046117741.db2.gz YVCIJJXBBIVWQI-LBPRGKRZSA-N 1 0 305.418 4.412 20 10 DICDRO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756678370 1046119761 /nfs/dbraw/zinc/11/97/61/1046119761.db2.gz WBIAKZDLOMGHBG-LSDHHAIUSA-N 1 0 310.441 4.386 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCc2cccc(Cl)c2)c1 ZINC000756682800 1046119811 /nfs/dbraw/zinc/11/98/11/1046119811.db2.gz PWBNGJPTRCIIPV-CYBMUJFWSA-N 1 0 319.832 4.338 20 10 DICDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000756684150 1046120098 /nfs/dbraw/zinc/12/00/98/1046120098.db2.gz LAFSQAGNDQJNIV-KSSFIOAISA-N 1 0 311.425 4.437 20 10 DICDRO COc1ccc(C(C)(C)C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000756682156 1046120442 /nfs/dbraw/zinc/12/04/42/1046120442.db2.gz NICLULJOKFKMFG-ZDUSSCGKSA-N 1 0 317.404 4.168 20 10 DICDRO C[C@@H]([NH2+]CCc1cccc(F)c1F)c1cc(Cl)ccc1O ZINC000756713529 1046121555 /nfs/dbraw/zinc/12/15/55/1046121555.db2.gz VISQJEQKYYPISV-SNVBAGLBSA-N 1 0 311.759 4.217 20 10 DICDRO COC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)c1ccccc1 ZINC000756705230 1046122537 /nfs/dbraw/zinc/12/25/37/1046122537.db2.gz SGVQRWQZCRXHFH-MAZHCROVSA-N 1 0 315.388 4.057 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1cccc(Cl)c1 ZINC000756734654 1046123532 /nfs/dbraw/zinc/12/35/32/1046123532.db2.gz XZRJEMBGSHOTFI-GTNSWQLSSA-N 1 0 323.795 4.223 20 10 DICDRO CC(C)[C@H]1OCCC[C@@H]1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756735820 1046124608 /nfs/dbraw/zinc/12/46/08/1046124608.db2.gz IXXUVVZNRVWTEH-PITQQHRWSA-N 1 0 321.436 4.120 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CC(c3ccccc3C)C2)c1 ZINC000756730635 1046124687 /nfs/dbraw/zinc/12/46/87/1046124687.db2.gz BHCPIZLCJCZLGK-QQFBHYJXSA-N 1 0 311.425 4.306 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@H]1Oc2ccccc2[C@@H]1C ZINC000756747883 1046125411 /nfs/dbraw/zinc/12/54/11/1046125411.db2.gz SEAJCSCWQQGJQM-NSAWSLCGSA-N 1 0 315.388 4.135 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccccc2Cl)c(O)c1C ZINC000756741285 1046126172 /nfs/dbraw/zinc/12/61/72/1046126172.db2.gz WZWVIDZNSVKQIU-DYVFJYSZSA-N 1 0 319.832 4.047 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCC[C@H]2CCCC[C@@H]2O)c2c1c(F)ccc2O ZINC000756761783 1046127313 /nfs/dbraw/zinc/12/73/13/1046127313.db2.gz VCTCJFBVYKHAMF-VDERGJSUSA-N 1 0 321.436 4.001 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)[C@@H]2CCCCO2)c(O)c1C ZINC000756758175 1046127645 /nfs/dbraw/zinc/12/76/45/1046127645.db2.gz SNAZEVUBLFSEPT-WBVHZDCISA-N 1 0 305.462 4.255 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)c1 ZINC000756757763 1046127759 /nfs/dbraw/zinc/12/77/59/1046127759.db2.gz BRHXYVQOEPAWSV-NHYWBVRUSA-N 1 0 303.789 4.138 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000756758545 1046128275 /nfs/dbraw/zinc/12/82/75/1046128275.db2.gz GOGCMGNBYNMSQS-MRXNPFEDSA-N 1 0 305.462 4.257 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)c1 ZINC000756757765 1046128329 /nfs/dbraw/zinc/12/83/29/1046128329.db2.gz BRHXYVQOEPAWSV-XHDPSFHLSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@@H](C)c3c1c(O)ccc3F)CO2 ZINC000756758308 1046128410 /nfs/dbraw/zinc/12/84/10/1046128410.db2.gz DDZSGZAXYDYJCZ-KCPJHIHWSA-N 1 0 313.372 4.111 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCC[C@@H]2CCCC[C@@H]2O)c2c1c(F)ccc2O ZINC000756761792 1046128529 /nfs/dbraw/zinc/12/85/29/1046128529.db2.gz VCTCJFBVYKHAMF-VRKREXBASA-N 1 0 321.436 4.001 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1Cl ZINC000756760150 1046128679 /nfs/dbraw/zinc/12/86/79/1046128679.db2.gz LZZQGTZKOXBIBW-FZKQIMNGSA-N 1 0 319.832 4.392 20 10 DICDRO Cc1c(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c2ccccc2n1C ZINC001138252428 1046128844 /nfs/dbraw/zinc/12/88/44/1046128844.db2.gz HDNOHFYMFPIMME-INIZCTEOSA-N 1 0 310.363 4.056 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c2ccccc2n1C ZINC001138256659 1046128895 /nfs/dbraw/zinc/12/88/95/1046128895.db2.gz FPZUWFBTTXZQGA-HXUWFJFHSA-N 1 0 305.425 4.219 20 10 DICDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)cc1 ZINC000195662011 1046129308 /nfs/dbraw/zinc/12/93/08/1046129308.db2.gz LOKLZKBSGQCCOC-HXUWFJFHSA-N 1 0 310.441 4.098 20 10 DICDRO COc1cccc(C(C)(C)C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000756771014 1046129445 /nfs/dbraw/zinc/12/94/45/1046129445.db2.gz YMSPJDMSDBZZBS-OAHLLOKOSA-N 1 0 313.441 4.338 20 10 DICDRO Cc1c(C[NH+]2CCC3(CC(F)C3)CC2)c2ccccc2n1C ZINC001138253665 1046129409 /nfs/dbraw/zinc/12/94/09/1046129409.db2.gz BKYNQUKKLYCGFF-UHFFFAOYSA-N 1 0 300.421 4.201 20 10 DICDRO Cc1c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c2ccccc2n1C ZINC001138256620 1046129666 /nfs/dbraw/zinc/12/96/66/1046129666.db2.gz CVIOJGPEPOMZMK-GOSISDBHSA-N 1 0 320.436 4.140 20 10 DICDRO CC(C)OC1CCC([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756770346 1046129821 /nfs/dbraw/zinc/12/98/21/1046129821.db2.gz TZIGKPNUJSMOCR-WLIAPVHPSA-N 1 0 321.436 4.405 20 10 DICDRO COc1cccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000756768838 1046130160 /nfs/dbraw/zinc/13/01/60/1046130160.db2.gz NUMIPOGKSORWDU-HNNXBMFYSA-N 1 0 313.441 4.338 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCOCc2ccc(Cl)cc2)c(O)c1 ZINC000756771344 1046130544 /nfs/dbraw/zinc/13/05/44/1046130544.db2.gz VUVDUSZPTJWPMO-AWEZNQCLSA-N 1 0 319.832 4.221 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756769256 1046130682 /nfs/dbraw/zinc/13/06/82/1046130682.db2.gz PGRREZSZIDFFBS-RULNRJAQSA-N 1 0 318.392 4.078 20 10 DICDRO COc1ccc(CC[N@H+](C)Cc2c3ccccc3n(C)c2C)cc1 ZINC001138258017 1046132350 /nfs/dbraw/zinc/13/23/50/1046132350.db2.gz IMJKAGDLFYWOFO-UHFFFAOYSA-N 1 0 322.452 4.170 20 10 DICDRO COc1ccccc1C[N@H+](C)Cc1c2ccccc2n(C)c1C ZINC001138256780 1046132455 /nfs/dbraw/zinc/13/24/55/1046132455.db2.gz KMUZQRRYKLEYCN-UHFFFAOYSA-N 1 0 308.425 4.127 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756786129 1046133110 /nfs/dbraw/zinc/13/31/10/1046133110.db2.gz JPPBUZRHKOVJIG-NEPJUHHUSA-N 1 0 304.821 4.415 20 10 DICDRO C[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1cc(Cl)ccc1O ZINC000756785058 1046133335 /nfs/dbraw/zinc/13/33/35/1046133335.db2.gz RWEBTLXDNGDBKW-DIFFPNOSSA-N 1 0 302.805 4.243 20 10 DICDRO C[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000756786118 1046133513 /nfs/dbraw/zinc/13/35/13/1046133513.db2.gz XNFCYOZZQBFCBM-SZNDQCEHSA-N 1 0 322.452 4.468 20 10 DICDRO Cc1ccsc1CC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756785564 1046133707 /nfs/dbraw/zinc/13/37/07/1046133707.db2.gz GEDJGMJRHVJWKD-DGCLKSJQSA-N 1 0 305.418 4.282 20 10 DICDRO COc1ccc(C[C@H](C)C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000756783653 1046134049 /nfs/dbraw/zinc/13/40/49/1046134049.db2.gz GUUOIMCQNWVQQO-HOTGVXAUSA-N 1 0 313.441 4.239 20 10 DICDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000756790337 1046136023 /nfs/dbraw/zinc/13/60/23/1046136023.db2.gz MTPOCXSHKRPMHE-LPMFXHHGSA-N 1 0 317.404 4.267 20 10 DICDRO COc1ccc(C2([NH2+][C@H](C)c3ccc(C)c(C)c3O)CC2)cc1 ZINC000756817675 1046140866 /nfs/dbraw/zinc/14/08/66/1046140866.db2.gz MNIDCPGZJGZLMR-OAHLLOKOSA-N 1 0 311.425 4.358 20 10 DICDRO COc1ccc(C2([NH2+][C@H](C)c3cc(Cl)ccc3O)CC2)cc1 ZINC000756821074 1046140971 /nfs/dbraw/zinc/14/09/71/1046140971.db2.gz LHRDHNRUBHBQOS-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO COc1cccc(C2([NH2+][C@@H](C)c3cc(Cl)ccc3O)CC2)c1 ZINC000756845028 1046142600 /nfs/dbraw/zinc/14/26/00/1046142600.db2.gz QJPMAFGUDIFTLI-LBPRGKRZSA-N 1 0 317.816 4.394 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C2(Cc3ccccc3)CCC2)c1 ZINC000756844241 1046142704 /nfs/dbraw/zinc/14/27/04/1046142704.db2.gz LUPBZOPRUKSTOY-HNNXBMFYSA-N 1 0 311.425 4.217 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2cc(F)cc(F)c2O)c1 ZINC000756857477 1046145781 /nfs/dbraw/zinc/14/57/81/1046145781.db2.gz JYKWALSYJLXNEG-GFCCVEGCSA-N 1 0 320.383 4.214 20 10 DICDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CCO1 ZINC000756874512 1046147476 /nfs/dbraw/zinc/14/74/76/1046147476.db2.gz QCBQKRWBTJVGIT-IXYNUQLISA-N 1 0 321.436 4.263 20 10 DICDRO CC(C)C[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)CCO1 ZINC000756873744 1046147807 /nfs/dbraw/zinc/14/78/07/1046147807.db2.gz JKKBQHWYWLTMFZ-AEGPPILISA-N 1 0 311.853 4.290 20 10 DICDRO Cc1ccc2[nH]c(C[N@@H+](C)Cc3ccc(N(C)C)cc3)cc2c1 ZINC001138418661 1046175698 /nfs/dbraw/zinc/17/56/98/1046175698.db2.gz XRZMOOBMANKHGV-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO COCC[C@H]([NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)c1ccco1 ZINC000757639279 1046195066 /nfs/dbraw/zinc/19/50/66/1046195066.db2.gz QIVGHQOUZOSBJV-UBHSHLNASA-N 1 0 319.376 4.040 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(F)c(F)c2F)c1 ZINC000757657030 1046197973 /nfs/dbraw/zinc/19/79/73/1046197973.db2.gz UFRCXCIJXANTNS-LLVKDONJSA-N 1 0 309.331 4.011 20 10 DICDRO COC1CCC(CC[NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000757680206 1046200957 /nfs/dbraw/zinc/20/09/57/1046200957.db2.gz NORZWPARCONTGY-DNOWBOINSA-N 1 0 311.853 4.292 20 10 DICDRO CC[C@@H]([NH2+]CCC1CCC(OC)CC1)c1ccc(N(C)C)cc1 ZINC000757678681 1046200991 /nfs/dbraw/zinc/20/09/91/1046200991.db2.gz DGOOZAMRZRNZIN-RRWXTXHCSA-N 1 0 318.505 4.389 20 10 DICDRO COC1CCC(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000757681182 1046201377 /nfs/dbraw/zinc/20/13/77/1046201377.db2.gz XVSRSCWCYUNABW-WOICTCIZSA-N 1 0 321.436 4.265 20 10 DICDRO COC1CCC(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000757681179 1046201821 /nfs/dbraw/zinc/20/18/21/1046201821.db2.gz XVSRSCWCYUNABW-WLIAPVHPSA-N 1 0 321.436 4.265 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000757706958 1046204412 /nfs/dbraw/zinc/20/44/12/1046204412.db2.gz QEFRLDWLETUCSK-QGZVFWFLSA-N 1 0 309.409 4.237 20 10 DICDRO C[N@H+](Cc1ccccn1)Cc1cc(-c2ccccc2)ccc1O ZINC000757889553 1046222848 /nfs/dbraw/zinc/22/28/48/1046222848.db2.gz JVYKNGGTOQNDRS-UHFFFAOYSA-N 1 0 304.393 4.086 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1cc2c(cc1O)CCCC2)c1cncs1 ZINC000903310471 1046232316 /nfs/dbraw/zinc/23/23/16/1046232316.db2.gz JOBMRUNGUAHSHQ-VXGBXAGGSA-N 1 0 302.443 4.139 20 10 DICDRO C[C@H]1C[C@H]([NH2+]C2CC3(C2)COC(C)(C)C3)c2c1c(F)ccc2O ZINC000903323270 1046237568 /nfs/dbraw/zinc/23/75/68/1046237568.db2.gz IHUOYHRBROSEPU-BWPGJZFPSA-N 1 0 319.420 4.017 20 10 DICDRO C[C@H]1CCC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000088698665 1046238356 /nfs/dbraw/zinc/23/83/56/1046238356.db2.gz GCTXGUYFYQMVHL-GUYCJALGSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1cc(C[NH2+]Cc2cncs2)c(C)n1-c1cccc(C)c1 ZINC000758015973 1046238644 /nfs/dbraw/zinc/23/86/44/1046238644.db2.gz OODDDZFFOYONES-UHFFFAOYSA-N 1 0 311.454 4.149 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)c(O)c1 ZINC000903404870 1046268087 /nfs/dbraw/zinc/26/80/87/1046268087.db2.gz MPZFAFLNRNPGIJ-GJZGRUSLSA-N 1 0 313.445 4.109 20 10 DICDRO CC(C)[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)cc1F ZINC000758507870 1046275923 /nfs/dbraw/zinc/27/59/23/1046275923.db2.gz MLALAUSCSDEESY-IBGZPJMESA-N 1 0 317.379 4.387 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC001202859945 1046280886 /nfs/dbraw/zinc/28/08/86/1046280886.db2.gz KVSRKIYRSLBBQA-XJABCFGWSA-N 1 0 322.496 4.385 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC001202859941 1046281232 /nfs/dbraw/zinc/28/12/32/1046281232.db2.gz KVSRKIYRSLBBQA-AGHHOFFYSA-N 1 0 322.496 4.385 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](c2cccnc2)C2CC2)cc1 ZINC000758633769 1046282626 /nfs/dbraw/zinc/28/26/26/1046282626.db2.gz YBJRCSZJVOZZDD-FQEVSTJZSA-N 1 0 309.457 4.169 20 10 DICDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)c(C)c1 ZINC001202861304 1046286787 /nfs/dbraw/zinc/28/67/87/1046286787.db2.gz ZIXWPEQQVPWCOG-GOSISDBHSA-N 1 0 310.485 4.399 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(F)c(F)c1 ZINC000321530957 1046311057 /nfs/dbraw/zinc/31/10/57/1046311057.db2.gz YSHLZWNJGFDKDT-CYBMUJFWSA-N 1 0 316.395 4.198 20 10 DICDRO COCCC(C)(C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000759186907 1046330715 /nfs/dbraw/zinc/33/07/15/1046330715.db2.gz WAQKAXQWXQWZID-UHFFFAOYSA-N 1 0 313.441 4.212 20 10 DICDRO CC(C)Oc1cccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001138985877 1046348862 /nfs/dbraw/zinc/34/88/62/1046348862.db2.gz NWYMALJKNDEYPQ-UHFFFAOYSA-N 1 0 312.457 4.172 20 10 DICDRO C[C@@H]([NH2+]CCc1cc(F)c(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000780743620 1046401848 /nfs/dbraw/zinc/40/18/48/1046401848.db2.gz HKRQFWCXTNMHJY-GFCCVEGCSA-N 1 0 322.374 4.063 20 10 DICDRO Cc1cccc2[nH]cc(C[N@@H+](C)Cc3ccc(N(C)C)cc3)c21 ZINC001139199478 1046411413 /nfs/dbraw/zinc/41/14/13/1046411413.db2.gz RCCCRMYUFNYVRC-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000090886848 1046426913 /nfs/dbraw/zinc/42/69/13/1046426913.db2.gz IQRJUTOUPZUWSW-YVEFUNNKSA-N 1 0 301.434 4.159 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000090886850 1046427533 /nfs/dbraw/zinc/42/75/33/1046427533.db2.gz IQRJUTOUPZUWSW-SJKOYZFVSA-N 1 0 301.434 4.159 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(F)cc(OC)c2)cc1 ZINC000090972444 1046433366 /nfs/dbraw/zinc/43/33/66/1046433366.db2.gz XTZZIJZGCSNAFG-CQSZACIVSA-N 1 0 316.420 4.141 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CC3CCC2CC3)ccc1OC ZINC001202929401 1046441465 /nfs/dbraw/zinc/44/14/65/1046441465.db2.gz HSASYWLWUDWYBZ-VMWRSERWSA-N 1 0 317.473 4.148 20 10 DICDRO CCOc1ccc(C[NH2+]C2(c3cccc(Cl)c3)CC2)c(O)c1 ZINC000740900164 1046448208 /nfs/dbraw/zinc/44/82/08/1046448208.db2.gz GLRSPEPFMPMFDM-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO CCOc1ccc(C)cc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001139606789 1046484793 /nfs/dbraw/zinc/48/47/93/1046484793.db2.gz BLJXHDFOHQDGPW-UHFFFAOYSA-N 1 0 312.457 4.092 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccccc2C(F)F)cc1 ZINC001139800387 1046519916 /nfs/dbraw/zinc/51/99/16/1046519916.db2.gz MRQZYFJGMNDOOG-UHFFFAOYSA-N 1 0 304.384 4.322 20 10 DICDRO Oc1ccc(F)cc1CN1CCC[C@H]1c1c(F)cccc1F ZINC001140060204 1046578213 /nfs/dbraw/zinc/57/82/13/1046578213.db2.gz PEXPEVRZSNGABI-HNNXBMFYSA-N 1 0 307.315 4.147 20 10 DICDRO CN(Cc1cc(F)ccc1O)Cc1cccc(Cl)c1Cl ZINC001140055246 1046579195 /nfs/dbraw/zinc/57/91/95/1046579195.db2.gz OXGKPOGLRDGKFE-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(Cc2cccc(F)c2)CC1 ZINC001140058758 1046579457 /nfs/dbraw/zinc/57/94/57/1046579457.db2.gz LAPRVENLDODAJG-UHFFFAOYSA-N 1 0 317.379 4.125 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCC=CO1)c1ccc(N2CCCCC2)cc1 ZINC000783311125 1046580112 /nfs/dbraw/zinc/58/01/12/1046580112.db2.gz UHGZBBFVGGXUTQ-VQIMIIECSA-N 1 0 300.446 4.020 20 10 DICDRO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1[O-] ZINC000841744127 1046601554 /nfs/dbraw/zinc/60/15/54/1046601554.db2.gz MBIQDDRVXXTTRT-KGLIPLIRSA-N 1 0 312.885 4.207 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOc2ccc(F)cc21)c1ccccc1O ZINC000783502437 1046602341 /nfs/dbraw/zinc/60/23/41/1046602341.db2.gz SQXUSPQPMUCFOP-BLLLJJGKSA-N 1 0 301.361 4.096 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOc2ccc(F)cc21)c1ccccc1O ZINC000783502443 1046602397 /nfs/dbraw/zinc/60/23/97/1046602397.db2.gz SQXUSPQPMUCFOP-WBMJQRKESA-N 1 0 301.361 4.096 20 10 DICDRO C[C@@H]([NH2+][C@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1O ZINC000783518530 1046603602 /nfs/dbraw/zinc/60/36/02/1046603602.db2.gz DENKISZWCIEVCB-PBHICJAKSA-N 1 0 309.409 4.489 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1O ZINC000783518532 1046603658 /nfs/dbraw/zinc/60/36/58/1046603658.db2.gz DENKISZWCIEVCB-WMLDXEAASA-N 1 0 309.409 4.489 20 10 DICDRO C[C@@H]([NH2+][C@H]1COc2c1ccc(Cl)c2Cl)c1ccccc1O ZINC000783519279 1046603771 /nfs/dbraw/zinc/60/37/71/1046603771.db2.gz RBVHPOPWDQXEHK-RNCFNFMXSA-N 1 0 324.207 4.483 20 10 DICDRO Cc1ccc(N2CCC[C@H]([NH2+][C@H](C)c3ccccc3O)C2)cc1 ZINC000783516774 1046603807 /nfs/dbraw/zinc/60/38/07/1046603807.db2.gz IXBMMUHBTJFMNH-SJORKVTESA-N 1 0 310.441 4.020 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1ccc(Cl)cc1 ZINC000783520097 1046604049 /nfs/dbraw/zinc/60/40/49/1046604049.db2.gz ZRWNDIANMNEWMV-PXAZEXFGSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@H]([NH2+][C@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1O ZINC000783518533 1046604419 /nfs/dbraw/zinc/60/44/19/1046604419.db2.gz DENKISZWCIEVCB-YOEHRIQHSA-N 1 0 309.409 4.489 20 10 DICDRO C[C@@H]([NH2+]CC1(c2ccccc2Cl)CC1)c1ccccc1O ZINC000783526087 1046605759 /nfs/dbraw/zinc/60/57/59/1046605759.db2.gz RQAZPMXRUHRZFX-CYBMUJFWSA-N 1 0 301.817 4.428 20 10 DICDRO Cc1ccc(C)c(C[N@@H+]2CCc3cc(Cl)ccc3C2)c1O ZINC001140182546 1046609322 /nfs/dbraw/zinc/60/93/22/1046609322.db2.gz UYNZQFQITLAQDT-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO Cc1ccc(C)c(C[N@@H+]2CCc3ccc(Cl)cc3C2)c1O ZINC001140178527 1046609592 /nfs/dbraw/zinc/60/95/92/1046609592.db2.gz NMUPMEDBGPQIFN-UHFFFAOYSA-N 1 0 301.817 4.221 20 10 DICDRO COc1ccc([C@@H]2CC[N@H+](Cc3c(C)ccc(C)c3O)C2)cc1 ZINC001140184495 1046610291 /nfs/dbraw/zinc/61/02/91/1046610291.db2.gz WSRITJSHKUCKAD-QGZVFWFLSA-N 1 0 311.425 4.007 20 10 DICDRO CCS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000248497456 1046618352 /nfs/dbraw/zinc/61/83/52/1046618352.db2.gz LURPTSDJDHSTAZ-SRCQZFHVSA-N 1 0 309.475 4.116 20 10 DICDRO COc1ccc([C@@H]([NH2+][C@H]2CCc3cccc(O)c32)C(C)C)cc1 ZINC000834496984 1046623291 /nfs/dbraw/zinc/62/32/91/1046623291.db2.gz UUUJCVXWAWDUDW-PXNSSMCTSA-N 1 0 311.425 4.375 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C)c1ccccc1O ZINC000248556723 1046623964 /nfs/dbraw/zinc/62/39/64/1046623964.db2.gz LBVOHKARDHSOIW-QILLFSRXSA-N 1 0 305.462 4.274 20 10 DICDRO Cc1c2cc(F)ccc2oc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834533936 1046627397 /nfs/dbraw/zinc/62/73/97/1046627397.db2.gz CJYCYRITEDLCFM-OAHLLOKOSA-N 1 0 311.356 4.363 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCCOc3ccc(F)cc31)CC2 ZINC000834540510 1046629182 /nfs/dbraw/zinc/62/91/82/1046629182.db2.gz BMZPOEDYFRSNLJ-CVEARBPZSA-N 1 0 313.372 4.022 20 10 DICDRO CCC(CC)c1cc(C[NH2+][C@@H]2CCc3cccc(O)c32)on1 ZINC000834602100 1046636385 /nfs/dbraw/zinc/63/63/85/1046636385.db2.gz JIJDBYJRURVCFA-OAHLLOKOSA-N 1 0 300.402 4.061 20 10 DICDRO Cc1c(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cccc1[N+](=O)[O-] ZINC000841754020 1046637312 /nfs/dbraw/zinc/63/73/12/1046637312.db2.gz YQFBUZQPFICUPC-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO CO[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1Cl ZINC000834681027 1046648459 /nfs/dbraw/zinc/64/84/59/1046648459.db2.gz SXQDJQLQNDGKJD-DOTOQJQBSA-N 1 0 317.816 4.010 20 10 DICDRO CC(C)(C)Oc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000834714205 1046655381 /nfs/dbraw/zinc/65/53/81/1046655381.db2.gz RFNLQSBELNZPDZ-QGZVFWFLSA-N 1 0 311.425 4.347 20 10 DICDRO C[C@@H](CCCc1cccnc1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000834769915 1046667967 /nfs/dbraw/zinc/66/79/67/1046667967.db2.gz QRUINDHMEHJTBQ-IRXDYDNUSA-N 1 0 311.473 4.210 20 10 DICDRO COc1cccc(CCC[N@H+](C)Cc2c(O)cccc2Cl)c1 ZINC001140341739 1046668318 /nfs/dbraw/zinc/66/83/18/1046668318.db2.gz FQHANIGEPWYOFH-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO Oc1ccc(C2CC[NH+](Cc3c(O)cccc3Cl)CC2)cc1 ZINC001140341678 1046668371 /nfs/dbraw/zinc/66/83/71/1046668371.db2.gz BNQVPQFKAMDDNJ-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c(C)c1 ZINC000834783101 1046670611 /nfs/dbraw/zinc/67/06/11/1046670611.db2.gz CMXONJBHNGRNMW-GOSISDBHSA-N 1 0 311.425 4.267 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2c(F)cccc21)c1cc(F)ccc1O ZINC000834813997 1046674439 /nfs/dbraw/zinc/67/44/39/1046674439.db2.gz CCJUHLFILPMTEW-APPDUMDISA-N 1 0 303.352 4.399 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCC2CCOCC2)cc1 ZINC000834819368 1046676014 /nfs/dbraw/zinc/67/60/14/1046676014.db2.gz VBWFNZHILDEAII-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3ccc(Cl)cc32)c1 ZINC000784267014 1046677615 /nfs/dbraw/zinc/67/76/15/1046677615.db2.gz UXFIVCQOAWVMLP-DIFFPNOSSA-N 1 0 317.816 4.392 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1 ZINC000784267016 1046677885 /nfs/dbraw/zinc/67/78/85/1046677885.db2.gz UXFIVCQOAWVMLP-PIGZYNQJSA-N 1 0 317.816 4.392 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCn2ccnc21)c1ccc(N2CCCCCC2)cc1 ZINC000834834670 1046679986 /nfs/dbraw/zinc/67/99/86/1046679986.db2.gz DWVJRXWMDGQWID-VQIMIIECSA-N 1 0 324.472 4.059 20 10 DICDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000834843797 1046684192 /nfs/dbraw/zinc/68/41/92/1046684192.db2.gz LZTTVGNVSRUWGU-JSGCOSHPSA-N 1 0 319.367 4.099 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2c[nH]c3ccc(F)cc23)cc1 ZINC001137342688 1046685998 /nfs/dbraw/zinc/68/59/98/1046685998.db2.gz IQCVTRNOTHJWCG-UHFFFAOYSA-N 1 0 311.404 4.005 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2ccccn2)c2c1c(F)ccc2O ZINC000834849298 1046686992 /nfs/dbraw/zinc/68/69/92/1046686992.db2.gz ACORYTQCGSNTPE-OCCSQVGLSA-N 1 0 314.404 4.042 20 10 DICDRO C[C@@H](CC(C)(C)O)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000834880425 1046695699 /nfs/dbraw/zinc/69/56/99/1046695699.db2.gz ZGCSFJFMEHQQJZ-GJZGRUSLSA-N 1 0 322.468 4.016 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834885300 1046698695 /nfs/dbraw/zinc/69/86/95/1046698695.db2.gz VGYSPPUWJFDKHB-BXUZGUMPSA-N 1 0 302.245 4.244 20 10 DICDRO C[C@H]([NH2+]CCCSc1nccs1)[C@@H]1C[C@H]1c1cccs1 ZINC000841762342 1046696997 /nfs/dbraw/zinc/69/69/97/1046696997.db2.gz ITRZHTVFQWPNAO-RWMBFGLXSA-N 1 0 324.540 4.469 20 10 DICDRO Cc1cccnc1CCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000834883313 1046697141 /nfs/dbraw/zinc/69/71/41/1046697141.db2.gz IRVIVTORBGQEHI-XJKSGUPXSA-N 1 0 314.404 4.005 20 10 DICDRO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841762971 1046697259 /nfs/dbraw/zinc/69/72/59/1046697259.db2.gz LBHMKRJONVARIC-NWDGAFQWSA-N 1 0 307.825 4.235 20 10 DICDRO CC[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1ccc(F)cc1[O-] ZINC000834885265 1046698084 /nfs/dbraw/zinc/69/80/84/1046698084.db2.gz UOZFPDYIHGYAIX-AAEUAGOBSA-N 1 0 306.208 4.156 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000834883909 1046698312 /nfs/dbraw/zinc/69/83/12/1046698312.db2.gz UYZVOYXBHGMEOR-APWZRJJASA-N 1 0 316.489 4.143 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCO[C@H](C(C)C)C2)c(O)c1C ZINC000834887108 1046701376 /nfs/dbraw/zinc/70/13/76/1046701376.db2.gz YHGSJLOVRBBNDK-BQFCYCMXSA-N 1 0 305.462 4.111 20 10 DICDRO CN(C)c1cc[nH+]c(NCc2cc(-c3ccccc3)ccc2O)c1 ZINC000784628150 1046702872 /nfs/dbraw/zinc/70/28/72/1046702872.db2.gz IGBBVPZCPMXFMK-UHFFFAOYSA-N 1 0 319.408 4.132 20 10 DICDRO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000834897253 1046706476 /nfs/dbraw/zinc/70/64/76/1046706476.db2.gz ZBQYJMYQMABLNV-UONOGXRCSA-N 1 0 309.413 4.174 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1O ZINC000834896020 1046707107 /nfs/dbraw/zinc/70/71/07/1046707107.db2.gz GYIXWOJSCMNNCE-ZANVPECISA-N 1 0 307.315 4.148 20 10 DICDRO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000834897251 1046707399 /nfs/dbraw/zinc/70/73/99/1046707399.db2.gz ZBQYJMYQMABLNV-KGLIPLIRSA-N 1 0 309.413 4.174 20 10 DICDRO C[C@@H]([NH2+]C1CCC(OC(F)F)CC1)c1cc(Cl)ccc1O ZINC000834901830 1046712521 /nfs/dbraw/zinc/71/25/21/1046712521.db2.gz DCNXEFYNGPPIQY-OIKLOGQESA-N 1 0 319.779 4.247 20 10 DICDRO C[C@H]([NH2+]CCC[C@@H]1CCOC1)c1ccc(N2CCCCC2)cc1 ZINC000834903559 1046713874 /nfs/dbraw/zinc/71/38/74/1046713874.db2.gz KTOJEDFQENJTAO-ZWKOTPCHSA-N 1 0 316.489 4.144 20 10 DICDRO CO[C@@H]([C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C1CC1 ZINC000834903401 1046714142 /nfs/dbraw/zinc/71/41/42/1046714142.db2.gz JEUILRHUBGVZDO-FTRWYGJKSA-N 1 0 316.489 4.141 20 10 DICDRO C[C@H]([NH2+]CCC[C@H]1CCOC1)c1ccc(N2CCCCC2)cc1 ZINC000834903556 1046714592 /nfs/dbraw/zinc/71/45/92/1046714592.db2.gz KTOJEDFQENJTAO-ROUUACIJSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)C(C)(C)O)c1ccc(N2CCCCC2)cc1 ZINC000834903754 1046714614 /nfs/dbraw/zinc/71/46/14/1046714614.db2.gz QSXXUSFBHOPOMQ-MRXNPFEDSA-N 1 0 318.505 4.125 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1ccc(N(C)C)cc1 ZINC000834905196 1046716733 /nfs/dbraw/zinc/71/67/33/1046716733.db2.gz RIBGTWZVURBTHM-JXFKEZNVSA-N 1 0 323.484 4.375 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c1O ZINC000834908627 1046717254 /nfs/dbraw/zinc/71/72/54/1046717254.db2.gz GTVXEOMJUMBOLU-QWHCGFSZSA-N 1 0 311.853 4.210 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1cc2c(cc1O)CCCC2 ZINC000834907985 1046718961 /nfs/dbraw/zinc/71/89/61/1046718961.db2.gz BLAONLUIRGQOLI-CABCVRRESA-N 1 0 317.473 4.127 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccc2ccccc2c1O ZINC000834911117 1046719070 /nfs/dbraw/zinc/71/90/70/1046719070.db2.gz RSOHKPVWDJOOED-HUUCEWRRSA-N 1 0 313.441 4.401 20 10 DICDRO CCC[N@H+](Cc1ccccc1)Cc1c(O)ccc2ccncc21 ZINC000834915256 1046721501 /nfs/dbraw/zinc/72/15/01/1046721501.db2.gz PKOJVDJQJQTHET-UHFFFAOYSA-N 1 0 306.409 4.353 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccc(C)c1 ZINC000796722320 1046722415 /nfs/dbraw/zinc/72/24/15/1046722415.db2.gz BJEQRPZMVIHBHX-SFHVURJKSA-N 1 0 300.421 4.441 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001140466494 1046737188 /nfs/dbraw/zinc/73/71/88/1046737188.db2.gz HMNBQBONFSFZJJ-HNNXBMFYSA-N 1 0 301.817 4.110 20 10 DICDRO CC[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000835041472 1046747459 /nfs/dbraw/zinc/74/74/59/1046747459.db2.gz MEJHTSBCFIGCRV-DVBCCOPCSA-N 1 0 313.445 4.112 20 10 DICDRO C[C@H](CCCC(F)(F)F)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835048928 1046748927 /nfs/dbraw/zinc/74/89/27/1046748927.db2.gz NBBUOXWCISEMRH-BRLPQQTGSA-N 1 0 314.395 4.477 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cc1 ZINC000835048669 1046749607 /nfs/dbraw/zinc/74/96/07/1046749607.db2.gz KGDULVTZNXIHRU-NHZBNJEXSA-N 1 0 312.379 4.040 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000797007894 1046771212 /nfs/dbraw/zinc/77/12/12/1046771212.db2.gz JCMRPIGQRMPXPJ-LBPRGKRZSA-N 1 0 305.418 4.412 20 10 DICDRO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1 ZINC000797058470 1046781451 /nfs/dbraw/zinc/78/14/51/1046781451.db2.gz FMEPOAPFWDXSLS-FHSNZYRGSA-N 1 0 319.832 4.127 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@@H](O)c1ccc(C)cc1)c1ccc(C)cc1O ZINC000797060363 1046783455 /nfs/dbraw/zinc/78/34/55/1046783455.db2.gz LYGKDSLSSYWHFS-MOXGXCLJSA-N 1 0 313.441 4.172 20 10 DICDRO CC[C@H]([NH2+][C@H](C)[C@H](O)c1ccc(C)cc1)c1ccc(C)cc1O ZINC000797060354 1046783728 /nfs/dbraw/zinc/78/37/28/1046783728.db2.gz LYGKDSLSSYWHFS-BPAFIMBUSA-N 1 0 313.441 4.172 20 10 DICDRO CC[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1cc(Cl)ccc1O ZINC000797071752 1046787012 /nfs/dbraw/zinc/78/70/12/1046787012.db2.gz VDNMSCHQYCSCFQ-LLVKDONJSA-N 1 0 307.743 4.429 20 10 DICDRO CSCc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000797097337 1046789529 /nfs/dbraw/zinc/78/95/29/1046789529.db2.gz CWDWZKCYMYAMIV-CQSZACIVSA-N 1 0 301.455 4.414 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1c(F)cncc1F ZINC000797125198 1046793252 /nfs/dbraw/zinc/79/32/52/1046793252.db2.gz IKDJNCGXHCXTAY-KKFJDGPESA-N 1 0 322.330 4.104 20 10 DICDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1c([O-])cc(F)cc1F ZINC001140584386 1046794933 /nfs/dbraw/zinc/79/49/33/1046794933.db2.gz PKTNMWBPKFCRSZ-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](Oc3ccccc3C)C2)c1 ZINC001140621280 1046813940 /nfs/dbraw/zinc/81/39/40/1046813940.db2.gz TZKMBRMWBJIKAX-GOSISDBHSA-N 1 0 311.425 4.052 20 10 DICDRO COc1cccc([C@H]2CCCC[N@@H+]2Cc2cc(C)ccc2O)c1 ZINC001140621212 1046814514 /nfs/dbraw/zinc/81/45/14/1046814514.db2.gz RIFJCEYIVXYYNR-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO Cc1ccc(O)c(C[NH+]2CCC3(C=Cc4ccccc43)CC2)c1 ZINC001140619698 1046815664 /nfs/dbraw/zinc/81/56/64/1046815664.db2.gz LGIOOMVKBYVTFJ-UHFFFAOYSA-N 1 0 305.421 4.261 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c1 ZINC001140620940 1046815708 /nfs/dbraw/zinc/81/57/08/1046815708.db2.gz JDIITDOWJDZTJI-CQSZACIVSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)c1 ZINC001140622866 1046816086 /nfs/dbraw/zinc/81/60/86/1046816086.db2.gz CLJWHRYQCUVYJZ-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](Sc3ccc(F)cc3)C2)c1 ZINC001140623944 1046817464 /nfs/dbraw/zinc/81/74/64/1046817464.db2.gz YEBSFCPWRTVWII-KRWDZBQOSA-N 1 0 317.429 4.206 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c1 ZINC001140623542 1046818285 /nfs/dbraw/zinc/81/82/85/1046818285.db2.gz URDPHEZPRAEAOV-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(C)ccc1O ZINC001140623692 1046818795 /nfs/dbraw/zinc/81/87/95/1046818795.db2.gz PXYWMWLLYQPXNO-SFHVURJKSA-N 1 0 311.425 4.184 20 10 DICDRO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)o1 ZINC000237372447 1046875377 /nfs/dbraw/zinc/87/53/77/1046875377.db2.gz OIUYJSHVWHPCEU-KDOFPFPSSA-N 1 0 310.441 4.075 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c1O ZINC001140746054 1046881873 /nfs/dbraw/zinc/88/18/73/1046881873.db2.gz UDNZMIQBMCFELV-MRXNPFEDSA-N 1 0 317.816 4.397 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@H](c3ccccc3F)C2)c1 ZINC000797997117 1046917561 /nfs/dbraw/zinc/91/75/61/1046917561.db2.gz QXFAGUNNGDSGMN-MGPQQGTHSA-N 1 0 315.388 4.137 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](Cc2ccccc2)C2CC2)c(O)c1 ZINC001140855468 1046931391 /nfs/dbraw/zinc/93/13/91/1046931391.db2.gz AGWPHKWKAMIFIK-UHFFFAOYSA-N 1 0 324.468 4.403 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c(O)c1 ZINC001140855521 1046931680 /nfs/dbraw/zinc/93/16/80/1046931680.db2.gz CYPANBNAQUFZRQ-QAPCUYQASA-N 1 0 302.462 4.003 20 10 DICDRO CN(C)c1ccc(CN2CCC[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC001140923773 1046950609 /nfs/dbraw/zinc/95/06/09/1046950609.db2.gz IMGQOELEIFKPIR-GFCCVEGCSA-N 1 0 320.786 4.180 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2cccc(Br)c2)c(O)c1 ZINC001140948046 1046957282 /nfs/dbraw/zinc/95/72/82/1046957282.db2.gz QMIJJSSMYXFIIF-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1O ZINC000798500919 1046958008 /nfs/dbraw/zinc/95/80/08/1046958008.db2.gz BVIUEGLBNPGUPR-QAQDUYKDSA-N 1 0 311.425 4.135 20 10 DICDRO Cc1ccc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c(O)c1 ZINC001140950871 1046959449 /nfs/dbraw/zinc/95/94/49/1046959449.db2.gz MFYFXLYUMXDCOU-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1 ZINC000798502418 1046959747 /nfs/dbraw/zinc/95/97/47/1046959747.db2.gz ZVRJGVFQOHKPNB-JCNLHEQBSA-N 1 0 311.425 4.135 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)c(O)c1 ZINC001140951017 1046960464 /nfs/dbraw/zinc/96/04/64/1046960464.db2.gz TZLGAMYCAACLOO-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000798925586 1046985091 /nfs/dbraw/zinc/98/50/91/1046985091.db2.gz BWTUHPALGQLKNC-RBUKOAKNSA-N 1 0 322.452 4.141 20 10 DICDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC001141158446 1047029801 /nfs/dbraw/zinc/02/98/01/1047029801.db2.gz AAWUXQCUWYCHBL-MRXNPFEDSA-N 1 0 303.789 4.088 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)c2c1c(F)ccc2O ZINC000799729986 1047058948 /nfs/dbraw/zinc/05/89/48/1047058948.db2.gz XFQTUBBTMRPNJF-SJKOYZFVSA-N 1 0 324.399 4.393 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1ccc(N(C)C)cc1 ZINC000799729932 1047059211 /nfs/dbraw/zinc/05/92/11/1047059211.db2.gz WCAWBOBLZYYDRR-OAHLLOKOSA-N 1 0 307.441 4.127 20 10 DICDRO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1cc(Cl)ccc1O ZINC001116445517 1047142006 /nfs/dbraw/zinc/14/20/06/1047142006.db2.gz SVSOZYOBANELKY-UHFFFAOYSA-N 1 0 300.789 4.159 20 10 DICDRO CS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC001116444890 1047142520 /nfs/dbraw/zinc/14/25/20/1047142520.db2.gz CXOQJOKUHJLMIS-RBUKOAKNSA-N 1 0 318.530 4.393 20 10 DICDRO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(N3CCCC3)cc2)cc1 ZINC001116442482 1047142581 /nfs/dbraw/zinc/14/25/81/1047142581.db2.gz YTZSFMABPUMNIY-NRFANRHFSA-N 1 0 322.452 4.330 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1N(C)C)c1ccc2ccccc2c1O ZINC001116565391 1047155966 /nfs/dbraw/zinc/15/59/66/1047155966.db2.gz QUZYJHVAVZPLLM-GDIGMMSISA-N 1 0 312.457 4.069 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC001116569053 1047158556 /nfs/dbraw/zinc/15/85/56/1047158556.db2.gz ZLXWVEPQMHIDLR-OWCLPIDISA-N 1 0 315.457 4.330 20 10 DICDRO COC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CCCCC1 ZINC001116651090 1047164775 /nfs/dbraw/zinc/16/47/75/1047164775.db2.gz MBNJKIHKHYIBJS-HUUCEWRRSA-N 1 0 303.446 4.188 20 10 DICDRO C[C@@H](CCCc1cccnc1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000839150974 1047198448 /nfs/dbraw/zinc/19/84/48/1047198448.db2.gz PLAXYAIGESEUNL-KKMIYCERSA-N 1 0 323.484 4.162 20 10 DICDRO Cc1cc(NCc2c(O)cccc2Cl)ccc1C[NH+](C)C ZINC000839188528 1047202423 /nfs/dbraw/zinc/20/24/23/1047202423.db2.gz IKHNAYDBWKOBHL-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO Cc1cccc(CC[N@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000827919421 1047235189 /nfs/dbraw/zinc/23/51/89/1047235189.db2.gz JBUUAPMNZWAKHB-UHFFFAOYSA-N 1 0 310.441 4.083 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CCO[C@H](C(C)C)C1 ZINC001117779643 1047245220 /nfs/dbraw/zinc/24/52/20/1047245220.db2.gz UIPFILNWVZLWKW-CVYDXHPNSA-N 1 0 317.473 4.290 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000840140706 1047288017 /nfs/dbraw/zinc/28/80/17/1047288017.db2.gz SJPZHPFBTLNJCD-LJQANCHMSA-N 1 0 320.392 4.261 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCOCc2ccccc2)c1 ZINC000389930230 1047292346 /nfs/dbraw/zinc/29/23/46/1047292346.db2.gz HXSHIRJPMQEZBB-IAGOWNOFSA-N 1 0 313.441 4.347 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)CCOCc2ccccc2)cc1C ZINC000389952115 1047293487 /nfs/dbraw/zinc/29/34/87/1047293487.db2.gz XNTVWKHDWBRQNO-KRWDZBQOSA-N 1 0 313.441 4.089 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCCN1Cc1ccccc1)c1ccccc1O ZINC000390569507 1047297132 /nfs/dbraw/zinc/29/71/32/1047297132.db2.gz RWAXVYHONHRBLQ-AZUAARDMSA-N 1 0 324.468 4.098 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@H]3CCCc4ccccc43)ccc21 ZINC000390586978 1047299896 /nfs/dbraw/zinc/29/98/96/1047299896.db2.gz FQUYZGVFPXWFDY-FQEVSTJZSA-N 1 0 306.453 4.236 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)N1CCCCC1 ZINC000390933132 1047301623 /nfs/dbraw/zinc/30/16/23/1047301623.db2.gz MWKPSOHDDMJIEG-HZPDHXFCSA-N 1 0 312.457 4.070 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCCn2ccc3ccccc32)c1 ZINC000391881654 1047305763 /nfs/dbraw/zinc/30/57/63/1047305763.db2.gz KHWNQQOXYWLPHK-HNNXBMFYSA-N 1 0 324.424 4.096 20 10 DICDRO COc1ccccc1CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000392310670 1047307945 /nfs/dbraw/zinc/30/79/45/1047307945.db2.gz NCCJDOIVVUCUBO-OAHLLOKOSA-N 1 0 321.420 4.447 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000392231576 1047309019 /nfs/dbraw/zinc/30/90/19/1047309019.db2.gz XALCXZRZRHEDHF-XLIONFOSSA-N 1 0 324.468 4.188 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)c1 ZINC000393378673 1047310279 /nfs/dbraw/zinc/31/02/79/1047310279.db2.gz BSDGPDMHVMYRMR-SFHVURJKSA-N 1 0 303.377 4.027 20 10 DICDRO Cc1ccc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)cn1 ZINC000725845600 1047318056 /nfs/dbraw/zinc/31/80/56/1047318056.db2.gz GAVVVLUVGBMYRH-UHFFFAOYSA-N 1 0 304.393 4.052 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@H](CC)c2ccccc2OC)c1 ZINC000725847338 1047320027 /nfs/dbraw/zinc/32/00/27/1047320027.db2.gz IQQCPOXEIUWNTR-QGZVFWFLSA-N 1 0 315.413 4.040 20 10 DICDRO FC(F)(F)[C@@H]1CC=CC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001118989146 1047320645 /nfs/dbraw/zinc/32/06/45/1047320645.db2.gz LEFOUEFBUILCMH-IAGOWNOFSA-N 1 0 324.390 4.274 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(C)c1 ZINC000840720239 1047320637 /nfs/dbraw/zinc/32/06/37/1047320637.db2.gz LVTPVSZGQKUEHL-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO C[C@@H](CN1CCCCC1)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725847957 1047321452 /nfs/dbraw/zinc/32/14/52/1047321452.db2.gz YDGKCNVYFLDZNA-KRWDZBQOSA-N 1 0 324.468 4.023 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cnn(CC2CCC2)c1)c1ccccc1O ZINC000898181545 1047325794 /nfs/dbraw/zinc/32/57/94/1047325794.db2.gz JQQPNAPGYYZMEG-KBXCAEBGSA-N 1 0 313.445 4.191 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000398235209 1047326743 /nfs/dbraw/zinc/32/67/43/1047326743.db2.gz YMIIBIGUCGYBRO-JENIJYKNSA-N 1 0 324.468 4.014 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccccc1O ZINC000398163649 1047326841 /nfs/dbraw/zinc/32/68/41/1047326841.db2.gz CTIAPOBFSIIPNE-POAQFYNOSA-N 1 0 324.468 4.096 20 10 DICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@H]1CCC(F)(F)C1 ZINC001119306160 1047327893 /nfs/dbraw/zinc/32/78/93/1047327893.db2.gz WOJNJHQVCDKBIW-AWEZNQCLSA-N 1 0 321.367 4.423 20 10 DICDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@@H]1CCC(F)(F)C1 ZINC001119306162 1047328039 /nfs/dbraw/zinc/32/80/39/1047328039.db2.gz WOJNJHQVCDKBIW-CQSZACIVSA-N 1 0 321.367 4.423 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCCc2cccnc2)c(O)c1C ZINC000840771110 1047330885 /nfs/dbraw/zinc/33/08/85/1047330885.db2.gz ARYRLTOAUWEYJU-DOTOQJQBSA-N 1 0 312.457 4.466 20 10 DICDRO c1cc([C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C2CC2)ccn1 ZINC000898323978 1047337327 /nfs/dbraw/zinc/33/73/27/1047337327.db2.gz ATKLJZQUKRSRIX-NRFANRHFSA-N 1 0 321.468 4.313 20 10 DICDRO Cc1cc(O)c(CNc2ccc(C[NH+](C)C)cc2)c(Cl)c1 ZINC000840879420 1047351251 /nfs/dbraw/zinc/35/12/51/1047351251.db2.gz ODSPAPGOALUVJD-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO C[C@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc2ccccc2c1O ZINC000840874994 1047351515 /nfs/dbraw/zinc/35/15/15/1047351515.db2.gz BTBWEHJEUHBNIF-AWEZNQCLSA-N 1 0 313.441 4.401 20 10 DICDRO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2C)n1 ZINC000840914889 1047357987 /nfs/dbraw/zinc/35/79/87/1047357987.db2.gz HTWAKELXNJYZTI-HXUWFJFHSA-N 1 0 309.457 4.102 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)c(Cl)c1 ZINC000840942146 1047362214 /nfs/dbraw/zinc/36/22/14/1047362214.db2.gz UGRFAMMCHLRTFE-SNVBAGLBSA-N 1 0 307.743 4.128 20 10 DICDRO Cc1cnc([C@@H](C)C[NH2+]Cc2c(O)cc(C)cc2Cl)s1 ZINC000840939837 1047362637 /nfs/dbraw/zinc/36/26/37/1047362637.db2.gz RPOHYOZHOKLETJ-JTQLQIEISA-N 1 0 310.850 4.012 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000840938405 1047363272 /nfs/dbraw/zinc/36/32/72/1047363272.db2.gz DIALKCPEFNMPIA-TZIWHRDSSA-N 1 0 324.468 4.071 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3ccncc3)CC2)c(Cl)c1 ZINC000840946098 1047364147 /nfs/dbraw/zinc/36/41/47/1047364147.db2.gz IOKLJETWGOVMTO-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3cccnc3)CC2)c(Cl)c1 ZINC000840949334 1047364189 /nfs/dbraw/zinc/36/41/89/1047364189.db2.gz WMCNWXTXJOZDDR-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO CCOc1cccc(C[NH2+]C2(c3ccc(F)cc3)CCC2)c1O ZINC000726605727 1047369900 /nfs/dbraw/zinc/36/99/00/1047369900.db2.gz HZTAIUGIHOJCEZ-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CCc1ccc(N)cc1 ZINC000841037929 1047372832 /nfs/dbraw/zinc/37/28/32/1047372832.db2.gz DBLYAJCMFIKXGM-ZDUSSCGKSA-N 1 0 322.374 4.051 20 10 DICDRO C[NH2+]Cc1ccccc1NCc1ccc(N2CCCCC2)cc1 ZINC000841043461 1047374970 /nfs/dbraw/zinc/37/49/70/1047374970.db2.gz QISWDWHQTMQLLS-UHFFFAOYSA-N 1 0 309.457 4.008 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc3c(c2)CCCN3)c(Cl)c1 ZINC000841069905 1047378457 /nfs/dbraw/zinc/37/84/57/1047378457.db2.gz HFMFREGJFMAZNH-UHFFFAOYSA-N 1 0 316.832 4.002 20 10 DICDRO C[C@H](Cc1ccncc1)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000749297154 1047408991 /nfs/dbraw/zinc/40/89/91/1047408991.db2.gz TZWOJHBZGJUINV-MRXNPFEDSA-N 1 0 318.420 4.175 20 10 DICDRO Oc1ccc2ccccc2c1C[NH+]1CCC(OC2CCC2)CC1 ZINC000841687582 1047441541 /nfs/dbraw/zinc/44/15/41/1047441541.db2.gz OJDSXFATNJWSCW-UHFFFAOYSA-N 1 0 311.425 4.079 20 10 DICDRO CCOCc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841744380 1047446815 /nfs/dbraw/zinc/44/68/15/1047446815.db2.gz HHCPJGIITXLOFI-CYBMUJFWSA-N 1 0 319.832 4.433 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccccc1 ZINC000841744488 1047446981 /nfs/dbraw/zinc/44/69/81/1047446981.db2.gz HYWOCFKLFIQXJM-YVEFUNNKSA-N 1 0 305.805 4.084 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(Cl)cc2[O-])CCC1 ZINC000841747418 1047448280 /nfs/dbraw/zinc/44/82/80/1047448280.db2.gz AULJMXJQKZRZKQ-CYBMUJFWSA-N 1 0 311.853 4.293 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccccc1[N+](=O)[O-] ZINC000841750878 1047450480 /nfs/dbraw/zinc/45/04/80/1047450480.db2.gz KAXHMYJPMZWAIR-MNOVXSKESA-N 1 0 320.776 4.366 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccc(Cl)cc1O ZINC000841753749 1047451767 /nfs/dbraw/zinc/45/17/67/1047451767.db2.gz VPQZRFYZXIAAFY-BMIGLBTASA-N 1 0 321.779 4.359 20 10 DICDRO COCC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccc(C)o1 ZINC000841753835 1047452185 /nfs/dbraw/zinc/45/21/85/1047452185.db2.gz NQZUHZXAWPACLP-WFASDCNBSA-N 1 0 323.820 4.375 20 10 DICDRO C[C@@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1ccc(Cl)cc1O ZINC000841758026 1047453440 /nfs/dbraw/zinc/45/34/40/1047453440.db2.gz RDMXPUHQTOQBHV-PRHODGIISA-N 1 0 308.636 4.280 20 10 DICDRO CCc1noc(CC)c1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841756792 1047453476 /nfs/dbraw/zinc/45/34/76/1047453476.db2.gz CHWUBHUUGBVLMH-JTQLQIEISA-N 1 0 308.809 4.009 20 10 DICDRO COc1ccc(C)cc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841759722 1047454604 /nfs/dbraw/zinc/45/46/04/1047454604.db2.gz POKIRADTPNAZET-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO CCOc1ccc(N2CC[NH+](Cc3cc(C)ccc3C)CC2)cc1 ZINC001168332044 1047476870 /nfs/dbraw/zinc/47/68/70/1047476870.db2.gz VIPJSZCWNLWOMW-UHFFFAOYSA-N 1 0 324.468 4.024 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2(c3ccccc3F)CCC2)c1 ZINC000842748965 1047501696 /nfs/dbraw/zinc/50/16/96/1047501696.db2.gz WAAMEMNWUHBDMP-UHFFFAOYSA-N 1 0 315.388 4.099 20 10 DICDRO CCOc1ccc(C[NH2+]C2(c3cccc(C)c3)CCC2)c(O)c1 ZINC000842744740 1047502038 /nfs/dbraw/zinc/50/20/38/1047502038.db2.gz AOLOUIMJNYMGSB-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(c3ccccc3Cl)CC2)c1 ZINC000842886010 1047511339 /nfs/dbraw/zinc/51/13/39/1047511339.db2.gz GDSXZRNPUNBGAA-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(c3cccc(C)c3)CCC2)c1 ZINC000842901375 1047511628 /nfs/dbraw/zinc/51/16/28/1047511628.db2.gz NKLLVZJSSCGBHZ-OAHLLOKOSA-N 1 0 311.425 4.439 20 10 DICDRO CC(C)[N@H+](Cc1cccc(C(C)(C)C)c1O)C1CCOCC1 ZINC001143116444 1047533342 /nfs/dbraw/zinc/53/33/42/1047533342.db2.gz BQHLTMUZUSOWPR-UHFFFAOYSA-N 1 0 305.462 4.079 20 10 DICDRO COc1cccc(C[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)c1O ZINC000843435060 1047551388 /nfs/dbraw/zinc/55/13/88/1047551388.db2.gz GKTHSCGGSDMXGJ-HXUWFJFHSA-N 1 0 321.420 4.294 20 10 DICDRO COc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(O)c1 ZINC001204375365 1047569614 /nfs/dbraw/zinc/56/96/14/1047569614.db2.gz RCVZSIFTSCVNGI-GOSISDBHSA-N 1 0 315.388 4.185 20 10 DICDRO COC1CCC(CC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000757681874 1047598057 /nfs/dbraw/zinc/59/80/57/1047598057.db2.gz GEFJUFAJYYCVCN-GTPINHCMSA-N 1 0 305.462 4.255 20 10 DICDRO c1cc(Nc2ccc3c(c2)CCCN3)ccc1CC[NH+]1CCCC1 ZINC001159509334 1047857946 /nfs/dbraw/zinc/85/79/46/1047857946.db2.gz AAXPPSXCOCIREI-UHFFFAOYSA-N 1 0 321.468 4.427 20 10 DICDRO [NH3+]Cc1cnccc1Nc1ccc(N=Nc2ccccc2)cc1 ZINC001159516543 1047859522 /nfs/dbraw/zinc/85/95/22/1047859522.db2.gz LUADVRICFAQCSJ-GHVJWSGMSA-N 1 0 303.369 4.121 20 10 DICDRO [O-]c1c(C[N@@H+](Cc2ccccc2F)CC2CC2)ccc(F)c1F ZINC001182950116 1047865635 /nfs/dbraw/zinc/86/56/35/1047865635.db2.gz TYSBCHCSVFBBGV-UHFFFAOYSA-N 1 0 321.342 4.222 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCc2c1cccc2F ZINC000479434603 1047888496 /nfs/dbraw/zinc/88/84/96/1047888496.db2.gz DGBLZCIKYQQDFW-SFHVURJKSA-N 1 0 308.400 4.403 20 10 DICDRO CCn1nc(C)c([C@@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)c1C ZINC000479439781 1047889073 /nfs/dbraw/zinc/88/90/73/1047889073.db2.gz QSNCFAUHJBHAHK-CQSZACIVSA-N 1 0 324.472 4.171 20 10 DICDRO CCn1nc(C)c([C@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)c1C ZINC000479439772 1047890616 /nfs/dbraw/zinc/89/06/16/1047890616.db2.gz QSNCFAUHJBHAHK-AWEZNQCLSA-N 1 0 324.472 4.171 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1cnn(C(C)C)c1C ZINC000479452089 1047894665 /nfs/dbraw/zinc/89/46/65/1047894665.db2.gz HXRAMGFVBQHHIO-OAHLLOKOSA-N 1 0 324.472 4.423 20 10 DICDRO Oc1ccc([C@@H]2CC[N@H+](Cc3ccc4ccccc4c3O)C2)cc1 ZINC001183157046 1047904287 /nfs/dbraw/zinc/90/42/87/1047904287.db2.gz QQDVFBFWMSTJEE-QGZVFWFLSA-N 1 0 319.404 4.241 20 10 DICDRO Cc1cccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)c1O ZINC000775827143 1047933106 /nfs/dbraw/zinc/93/31/06/1047933106.db2.gz DQRQJYVOPLIMNW-UHFFFAOYSA-N 1 0 321.342 4.498 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(F)c1Cl)c1ccc(N(C)C)cc1 ZINC000775830154 1047933839 /nfs/dbraw/zinc/93/38/39/1047933839.db2.gz DUSLULKZTMTUCQ-GFCCVEGCSA-N 1 0 306.812 4.396 20 10 DICDRO CSc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000775833512 1047937672 /nfs/dbraw/zinc/93/76/72/1047937672.db2.gz KIYPARDLCROXAV-AWEZNQCLSA-N 1 0 300.471 4.325 20 10 DICDRO COc1ccccc1CCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000775838367 1047940956 /nfs/dbraw/zinc/94/09/56/1047940956.db2.gz XXHUYZQTVKWRBC-MRXNPFEDSA-N 1 0 312.457 4.045 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2Cc3ccccc3[C@H](C)C2)cc1Cl ZINC001183674140 1047955027 /nfs/dbraw/zinc/95/50/27/1047955027.db2.gz VMKBFCGZLGHJRK-CYBMUJFWSA-N 1 0 301.817 4.473 20 10 DICDRO Cc1cc(C[N@H+]2CCCSC[C@H]2C)ccc1N1CCCCC1 ZINC001198516925 1047970607 /nfs/dbraw/zinc/97/06/07/1047970607.db2.gz GAUZPMSOZICGIK-QGZVFWFLSA-N 1 0 318.530 4.313 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@]3(C2)OCc2ccccc23)cc1C ZINC000774701411 1047986034 /nfs/dbraw/zinc/98/60/34/1047986034.db2.gz IVORZIDIUIHJPG-NRFANRHFSA-N 1 0 323.436 4.031 20 10 DICDRO Oc1cc2ccccc2cc1CNc1ccc2c([nH+]1)CCCC2 ZINC001160206956 1047997356 /nfs/dbraw/zinc/99/73/56/1047997356.db2.gz PBWAMYJZZCFBRI-UHFFFAOYSA-N 1 0 304.393 4.431 20 10 DICDRO CCOc1ccc(CC[N@H+](C)Cc2cccc(CC)c2O)cc1 ZINC001184227847 1048013286 /nfs/dbraw/zinc/01/32/86/1048013286.db2.gz GNLDMPZAKPADMM-UHFFFAOYSA-N 1 0 313.441 4.028 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000773427356 1048034798 /nfs/dbraw/zinc/03/47/98/1048034798.db2.gz KRLHGKYTOOBBJU-QGZVFWFLSA-N 1 0 323.484 4.485 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)cc1 ZINC001199110958 1048038417 /nfs/dbraw/zinc/03/84/17/1048038417.db2.gz RSWOHWCEXHZULZ-OAQYLSRUSA-N 1 0 323.436 4.261 20 10 DICDRO CC(C)[C@H](C[NH2+]Cc1ccc2c(c1)CCCO2)Nc1ccccc1 ZINC001199117770 1048039103 /nfs/dbraw/zinc/03/91/03/1048039103.db2.gz FZSMERHHJVNGLM-FQEVSTJZSA-N 1 0 324.468 4.238 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](C)N2CCCC[C@H]2C)cc1C ZINC001199296685 1048053613 /nfs/dbraw/zinc/05/36/13/1048053613.db2.gz XOYFHVXGZWFOIC-MSOLQXFVSA-N 1 0 318.505 4.136 20 10 DICDRO CCCOc1ccc(CNC2CC[NH+](C(C)(C)C)CC2)cc1C ZINC001199419883 1048061748 /nfs/dbraw/zinc/06/17/48/1048061748.db2.gz DRQNRHRATSPTCS-UHFFFAOYSA-N 1 0 318.505 4.136 20 10 DICDRO CCC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCCc2cccnc21 ZINC000775996659 1048081287 /nfs/dbraw/zinc/08/12/87/1048081287.db2.gz QJABTXUWUPZKAP-FQEVSTJZSA-N 1 0 323.484 4.437 20 10 DICDRO CCC[N@H+](Cc1cc(C)ccc1O)[C@H]1CCCc2cccnc21 ZINC000775995674 1048081352 /nfs/dbraw/zinc/08/13/52/1048081352.db2.gz PBBXOKAXYKTBBM-SFHVURJKSA-N 1 0 310.441 4.385 20 10 DICDRO Cc1cc(C)c(C[NH2+]C(C)(C)c2ccnc(Cl)c2)c(O)c1 ZINC001160811520 1048086836 /nfs/dbraw/zinc/08/68/36/1048086836.db2.gz PQTDCPKRNZONOU-UHFFFAOYSA-N 1 0 304.821 4.082 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)cc1C ZINC000776012191 1048086871 /nfs/dbraw/zinc/08/68/71/1048086871.db2.gz FHUNQRSBQUMMNJ-JSGCOSHPSA-N 1 0 301.352 4.172 20 10 DICDRO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000776013768 1048090209 /nfs/dbraw/zinc/09/02/09/1048090209.db2.gz OFOWCYOZAOIYDA-BXKDBHETSA-N 1 0 307.743 4.208 20 10 DICDRO CCO[C@@H](CC[NH2+]Cc1ccc(OC)c(C)c1)C1CCCC1 ZINC001200961564 1048163187 /nfs/dbraw/zinc/16/31/87/1048163187.db2.gz XYCWKFACXJSEES-IBGZPJMESA-N 1 0 305.462 4.079 20 10 DICDRO CC(C)(C)c1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000776153862 1048233223 /nfs/dbraw/zinc/23/32/23/1048233223.db2.gz HLNQGFAOLPZHJD-UHFFFAOYSA-N 1 0 301.455 4.270 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c(O)c1 ZINC001203634889 1048273868 /nfs/dbraw/zinc/27/38/68/1048273868.db2.gz ZYRWCJRWIZOBIQ-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)o1)c1ccccc1O ZINC001175419506 1048300989 /nfs/dbraw/zinc/30/09/89/1048300989.db2.gz WEILOMZOXZRZRL-KGLIPLIRSA-N 1 0 308.381 4.459 20 10 DICDRO C(=C\c1ccccc1)\C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001201692747 1048360985 /nfs/dbraw/zinc/36/09/85/1048360985.db2.gz FVAWFYKVRYDXDK-YFHOEESVSA-N 1 0 306.453 4.480 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(Br)cc1)c1ccccc1O ZINC000042238816 1048361180 /nfs/dbraw/zinc/36/11/80/1048361180.db2.gz URTLYTAMESDOAD-LLVKDONJSA-N 1 0 306.203 4.006 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H](Cc2cccnc2)C2CCCC2)cc1 ZINC001175600746 1048367646 /nfs/dbraw/zinc/36/76/46/1048367646.db2.gz BCDXFLMBKOVRJN-OAQYLSRUSA-N 1 0 323.484 4.039 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CSc3ccccc32)c1O ZINC000776207901 1048367821 /nfs/dbraw/zinc/36/78/21/1048367821.db2.gz QVGRDSSFXWDUSE-CQSZACIVSA-N 1 0 305.830 4.291 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCCC2CCC2)c(C(F)(F)F)c1 ZINC001203169192 1048387494 /nfs/dbraw/zinc/38/74/94/1048387494.db2.gz VLVPHWVZAUEJFR-UHFFFAOYSA-N 1 0 314.395 4.441 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](C)c2nc(C)cs2)cc1C ZINC001201919313 1048401836 /nfs/dbraw/zinc/40/18/36/1048401836.db2.gz CXMFHWHWUPNMEJ-AWEZNQCLSA-N 1 0 318.486 4.442 20 10 DICDRO C[C@@H]([NH2+]CCOc1ccc2ccccc2c1)c1ccccc1O ZINC000775131868 1048408102 /nfs/dbraw/zinc/40/81/02/1048408102.db2.gz XWLLZEWONBADAG-OAHLLOKOSA-N 1 0 307.393 4.275 20 10 DICDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2O)cn1 ZINC001203664258 1048409117 /nfs/dbraw/zinc/40/91/17/1048409117.db2.gz UQIMALLGOOTVOK-INIZCTEOSA-N 1 0 302.805 4.086 20 10 DICDRO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3ccccc3O)co2)cc1 ZINC000775135028 1048423045 /nfs/dbraw/zinc/42/30/45/1048423045.db2.gz BURLNMXZLHLADX-CQSZACIVSA-N 1 0 308.381 4.206 20 10 DICDRO CCC(C)(C)C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC001202001168 1048426066 /nfs/dbraw/zinc/42/60/66/1048426066.db2.gz VMMNICBLLGLANQ-UHFFFAOYSA-N 1 0 319.449 4.111 20 10 DICDRO CCCN(Cc1cncc2ccccc21)c1ccc(C[NH3+])cc1 ZINC000775144665 1048445258 /nfs/dbraw/zinc/44/52/58/1048445258.db2.gz DCSALLGZPGQJBQ-UHFFFAOYSA-N 1 0 305.425 4.110 20 10 DICDRO COCCC1(C[NH2+]Cc2ccc3c(c2)CCCO3)CCCCC1 ZINC001202092528 1048447927 /nfs/dbraw/zinc/44/79/27/1048447927.db2.gz KXKWPRKOEMAGGK-UHFFFAOYSA-N 1 0 317.473 4.088 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)c1O ZINC000776252819 1048467541 /nfs/dbraw/zinc/46/75/41/1048467541.db2.gz FXTVZJBRNABOJZ-GJZGRUSLSA-N 1 0 311.853 4.037 20 10 DICDRO COc1ccc(N(c2ccc(N)cc2)c2ccc(C[NH3+])cc2)cc1 ZINC001175970664 1048510832 /nfs/dbraw/zinc/51/08/32/1048510832.db2.gz GGJBEBCAHGODAA-UHFFFAOYSA-N 1 0 319.408 4.206 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@H](C)Cc2ccccc2C)c1O ZINC000775205231 1048561582 /nfs/dbraw/zinc/56/15/82/1048561582.db2.gz WLRAPZJSSXSBBO-MRXNPFEDSA-N 1 0 313.441 4.162 20 10 DICDRO Cc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)c(C)n1-c1ccccc1 ZINC001137854202 1048569062 /nfs/dbraw/zinc/56/90/62/1048569062.db2.gz MNCKFONTHUOEEH-UHFFFAOYSA-N 1 0 316.395 4.325 20 10 DICDRO COc1ccccc1[C@H]([NH2+]Cc1ccccc1O)c1ccccc1 ZINC000108421431 1048599939 /nfs/dbraw/zinc/59/99/39/1048599939.db2.gz BQXLYWUGLGVTHZ-OAQYLSRUSA-N 1 0 319.404 4.280 20 10 DICDRO CCC(C)(C)CC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000775257061 1048630418 /nfs/dbraw/zinc/63/04/18/1048630418.db2.gz FGWDEUQZAZPFGS-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO COc1cc(C[NH2+]Cc2cscc2C)c(O)c(C(C)(C)C)c1 ZINC000850280690 1048630704 /nfs/dbraw/zinc/63/07/04/1048630704.db2.gz FCYAZUJUIAEWOJ-UHFFFAOYSA-N 1 0 319.470 4.358 20 10 DICDRO COc1cc(C[NH2+]C[C@H](C)CC(F)F)c(O)c(C(C)(C)C)c1 ZINC000850334117 1048634571 /nfs/dbraw/zinc/63/45/71/1048634571.db2.gz KVCYGMMCTYWXFD-LLVKDONJSA-N 1 0 315.404 4.079 20 10 DICDRO CNc1ccccc1N[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001164499602 1048636385 /nfs/dbraw/zinc/63/63/85/1048636385.db2.gz SQUHFZJWYUYXOO-GBESFXJTSA-N 1 0 321.468 4.051 20 10 DICDRO COc1cccc(C[NH2+][C@H](c2ccccc2F)C(C)C)c1O ZINC000850362565 1048638517 /nfs/dbraw/zinc/63/85/17/1048638517.db2.gz PDZDRIKNFNFFSL-KRWDZBQOSA-N 1 0 303.377 4.027 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2cc3cc(C)ccc3o2)c1 ZINC000850376166 1048644418 /nfs/dbraw/zinc/64/44/18/1048644418.db2.gz BRUGIAAZBZWUSZ-UHFFFAOYSA-N 1 0 311.381 4.135 20 10 DICDRO COc1cccc(C2([NH2+]Cc3ccc(OC)c(C)c3)CCC2)c1 ZINC000850405248 1048650021 /nfs/dbraw/zinc/65/00/21/1048650021.db2.gz KZWMFDXAFJFJQL-UHFFFAOYSA-N 1 0 311.425 4.181 20 10 DICDRO Cc1ccncc1CC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000850505945 1048672656 /nfs/dbraw/zinc/67/26/56/1048672656.db2.gz DMQHNYAVFGRPER-SFHVURJKSA-N 1 0 323.484 4.274 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccnc3ccccc23)c(O)c1 ZINC000850506318 1048673104 /nfs/dbraw/zinc/67/31/04/1048673104.db2.gz INNBXDFSUCKDAH-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@H](O)c2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000850530516 1048682577 /nfs/dbraw/zinc/68/25/77/1048682577.db2.gz ZGYWPIBFRJKFCF-LPLGYCIKSA-N 1 0 323.436 4.100 20 10 DICDRO COCc1csc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000850532748 1048684142 /nfs/dbraw/zinc/68/41/42/1048684142.db2.gz ONRYHETWNCJPON-QMTHXVAHSA-N 1 0 321.417 4.077 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@]2(C)CC2(F)F)c1O ZINC000850535904 1048684834 /nfs/dbraw/zinc/68/48/34/1048684834.db2.gz DOLUGNASSMOIKU-IINYFYTJSA-N 1 0 303.780 4.440 20 10 DICDRO CC[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(C(F)(F)F)cc1O ZINC000850536622 1048684955 /nfs/dbraw/zinc/68/49/55/1048684955.db2.gz MBIROYQUQDXMNC-WCQYABFASA-N 1 0 323.305 4.497 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)c1O ZINC000850544020 1048686583 /nfs/dbraw/zinc/68/65/83/1048686583.db2.gz SLARLJXEWNSKHB-IQUTYRLHSA-N 1 0 311.425 4.293 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cc(Cl)ccc1O ZINC000850543078 1048687037 /nfs/dbraw/zinc/68/70/37/1048687037.db2.gz XZPJESPLFRHQTD-DLBZAZTESA-N 1 0 317.816 4.479 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2CCC3(CC3(F)F)CC2)c1O ZINC000850548991 1048689000 /nfs/dbraw/zinc/68/90/00/1048689000.db2.gz CDYDRAQEPOCARD-OPGSHWCFSA-N 1 0 311.372 4.019 20 10 DICDRO COc1cccc(C2([NH2+][C@H](C)c3ccc(N(C)C)cc3)CCC2)c1 ZINC000850565127 1048694203 /nfs/dbraw/zinc/69/42/03/1048694203.db2.gz ASCDAJWQSVHATJ-MRXNPFEDSA-N 1 0 324.468 4.491 20 10 DICDRO COc1cccc(C2([NH2+][C@@H](C)c3ccc(N(C)C)cc3)CCC2)c1 ZINC000850565126 1048694315 /nfs/dbraw/zinc/69/43/15/1048694315.db2.gz ASCDAJWQSVHATJ-INIZCTEOSA-N 1 0 324.468 4.491 20 10 DICDRO C[C@@H]([NH2+]CCC1SCCS1)c1cc2c(cc1O)CCCC2 ZINC000850569809 1048696330 /nfs/dbraw/zinc/69/63/30/1048696330.db2.gz CAMKRJRSDCBGMY-GFCCVEGCSA-N 1 0 323.527 4.118 20 10 DICDRO COc1cccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c1C ZINC000850579186 1048699759 /nfs/dbraw/zinc/69/97/59/1048699759.db2.gz TVCIQLUJGORVPF-NHYWBVRUSA-N 1 0 315.388 4.186 20 10 DICDRO COc1ccc([C@@H](C)C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000775365704 1048708260 /nfs/dbraw/zinc/70/82/60/1048708260.db2.gz WCZKNKGUOKRKRX-HOTGVXAUSA-N 1 0 312.457 4.216 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1ccc(N(C)C)cc1 ZINC000775366071 1048708457 /nfs/dbraw/zinc/70/84/57/1048708457.db2.gz ZNCOFQOQPRCPRL-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC001206707384 1048709498 /nfs/dbraw/zinc/70/94/98/1048709498.db2.gz HLPPUJHXBITCQU-KRWDZBQOSA-N 1 0 302.805 4.072 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCc3ccccc32)c1 ZINC000775369908 1048713247 /nfs/dbraw/zinc/71/32/47/1048713247.db2.gz BYQPBCFBOSBHBM-ZBFHGGJFSA-N 1 0 311.425 4.172 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1O ZINC000775412786 1048786791 /nfs/dbraw/zinc/78/67/91/1048786791.db2.gz QLGBLNRVZNZABH-WFASDCNBSA-N 1 0 300.358 4.102 20 10 DICDRO CC[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccccc1O ZINC000775415458 1048792806 /nfs/dbraw/zinc/79/28/06/1048792806.db2.gz SBYQOSYOJBQVLD-INIZCTEOSA-N 1 0 314.429 4.205 20 10 DICDRO Cc1cc(C[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)ccc1N(C)C ZINC001191003927 1048818038 /nfs/dbraw/zinc/81/80/38/1048818038.db2.gz MEBZZALPFATAHD-YLJYHZDGSA-N 1 0 308.469 4.439 20 10 DICDRO CCCC[C@H](CC)C[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC001177082056 1048820089 /nfs/dbraw/zinc/82/00/89/1048820089.db2.gz TVOMINGJYITKOB-KRWDZBQOSA-N 1 0 318.505 4.470 20 10 DICDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000852355210 1048836527 /nfs/dbraw/zinc/83/65/27/1048836527.db2.gz PXUYXEZAXWJVIN-MRXNPFEDSA-N 1 0 318.505 4.216 20 10 DICDRO CCN(CCC[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC001177136189 1048838520 /nfs/dbraw/zinc/83/85/20/1048838520.db2.gz HWIYDVVFTMVLTJ-UHFFFAOYSA-N 1 0 318.848 4.052 20 10 DICDRO CCOc1cccc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)c1O ZINC000853091776 1048881104 /nfs/dbraw/zinc/88/11/04/1048881104.db2.gz RBVINOZGRCIDSN-FQEVSTJZSA-N 1 0 311.425 4.206 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC(C)(C)CC(F)(F)F)cc1 ZINC000853095975 1048882549 /nfs/dbraw/zinc/88/25/49/1048882549.db2.gz HUPRZGIVJQNCPH-WAYWQWQTSA-N 1 0 314.395 4.334 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000853239783 1048888602 /nfs/dbraw/zinc/88/86/02/1048888602.db2.gz DMWYKIMHKGNOEB-GJZGRUSLSA-N 1 0 311.425 4.437 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc2c(c1)CCCO2 ZINC000853239726 1048889198 /nfs/dbraw/zinc/88/91/98/1048889198.db2.gz CTFQSXUVSYKIII-CXAGYDPISA-N 1 0 309.409 4.055 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC2(CO1)CCCCC2 ZINC001191288301 1048916509 /nfs/dbraw/zinc/91/65/09/1048916509.db2.gz FAUMQTLYIAFFQT-SFHVURJKSA-N 1 0 317.473 4.344 20 10 DICDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001177646828 1048930623 /nfs/dbraw/zinc/93/06/23/1048930623.db2.gz QCFNAQPQWVZVDF-NYPGBQQYSA-N 1 0 306.453 4.351 20 10 DICDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001177646826 1048930845 /nfs/dbraw/zinc/93/08/45/1048930845.db2.gz QCFNAQPQWVZVDF-KTBYTZPXSA-N 1 0 306.453 4.351 20 10 DICDRO CNc1ccccc1C[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC001177733534 1048937331 /nfs/dbraw/zinc/93/73/31/1048937331.db2.gz MWVOHVPRAJZTLV-UHFFFAOYSA-N 1 0 323.484 4.254 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c1O ZINC001203602455 1048939794 /nfs/dbraw/zinc/93/97/94/1048939794.db2.gz XXJPFUJZSIUPPS-UHFFFAOYSA-N 1 0 317.816 4.003 20 10 DICDRO CCOc1cccc(C[NH+]2CCC(c3cccs3)CC2)c1O ZINC001203608918 1048940334 /nfs/dbraw/zinc/94/03/34/1048940334.db2.gz ARLOMDUOIGEDNL-UHFFFAOYSA-N 1 0 317.454 4.232 20 10 DICDRO CCOc1cccc(C[N@H+](C)CCc2ccccc2Cl)c1O ZINC001203608926 1048940352 /nfs/dbraw/zinc/94/03/52/1048940352.db2.gz BCXSSZZVWNMFTM-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO COc1cc(C)cc(C[N@H+](Cc2ccc(F)cc2)C2CC2)c1O ZINC000111932979 1048940892 /nfs/dbraw/zinc/94/08/92/1048940892.db2.gz JJMLQRYZXAFXOT-UHFFFAOYSA-N 1 0 315.388 4.013 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2C2CCCCC2)c1O ZINC001203614316 1048941843 /nfs/dbraw/zinc/94/18/43/1048941843.db2.gz WLLJHAZJWHHDLB-KRWDZBQOSA-N 1 0 303.446 4.336 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2ccccc2)C2CCC2)c1O ZINC001203617347 1048942008 /nfs/dbraw/zinc/94/20/08/1048942008.db2.gz OLVHXNBYUUNXKV-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c(O)c1 ZINC001203627789 1048944885 /nfs/dbraw/zinc/94/48/85/1048944885.db2.gz PDUFEPGCANLXOF-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1cc(C[N@H+]2CC[C@H](c3ccccc3)[C@H]2C)ccc1N(C)C ZINC001191445772 1048946079 /nfs/dbraw/zinc/94/60/79/1048946079.db2.gz WOSOYIJPUXGHAW-XLIONFOSSA-N 1 0 308.469 4.439 20 10 DICDRO Cc1cc(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)ccc1N(C)C ZINC001191445770 1048946681 /nfs/dbraw/zinc/94/66/81/1048946681.db2.gz WOSOYIJPUXGHAW-FXAWDEMLSA-N 1 0 308.469 4.439 20 10 DICDRO COCCC1(C[NH2+]Cc2ccc(N(C)C)cc2C)CCCCC1 ZINC001177805043 1048947168 /nfs/dbraw/zinc/94/71/68/1048947168.db2.gz XFRVVDMGEVKWJR-UHFFFAOYSA-N 1 0 318.505 4.138 20 10 DICDRO Cc1cc(C[N@H+]2CC[C@@H](c3ccccc3)[C@H]2C)ccc1N(C)C ZINC001191445773 1048947546 /nfs/dbraw/zinc/94/75/46/1048947546.db2.gz WOSOYIJPUXGHAW-YLJYHZDGSA-N 1 0 308.469 4.439 20 10 DICDRO C[C@@H]1[C@H](Cc2ccccc2)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001191474195 1048949211 /nfs/dbraw/zinc/94/92/11/1048949211.db2.gz HMJSSZYYTUUNQT-XLIONFOSSA-N 1 0 308.469 4.206 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000854225792 1048954763 /nfs/dbraw/zinc/95/47/63/1048954763.db2.gz KUUFOGNEQVUHEC-VQTJNVASSA-N 1 0 309.457 4.063 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000854225790 1048954889 /nfs/dbraw/zinc/95/48/89/1048954889.db2.gz KUUFOGNEQVUHEC-PMACEKPBSA-N 1 0 309.457 4.063 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2ccccc2C(F)(F)F)cc1 ZINC001203693510 1048964341 /nfs/dbraw/zinc/96/43/41/1048964341.db2.gz BBLASWNEIJZIQQ-UHFFFAOYSA-N 1 0 322.374 4.403 20 10 DICDRO c1ccc(CC2(C[NH2+]Cc3ccc(N4CCCC4)cc3)CC2)cc1 ZINC001178245015 1049000627 /nfs/dbraw/zinc/00/06/27/1049000627.db2.gz YUQYGYDRSAJQEJ-UHFFFAOYSA-N 1 0 320.480 4.399 20 10 DICDRO CCC(CC)[C@H](CC[NH2+]Cc1ccc(N2CCCC2)cc1)OC ZINC001178249974 1049001914 /nfs/dbraw/zinc/00/19/14/1049001914.db2.gz YTMOJPUPEBDMEW-FQEVSTJZSA-N 1 0 318.505 4.218 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)OCO2)c1cc(Cl)ccc1O ZINC000775483115 1049002231 /nfs/dbraw/zinc/00/22/31/1049002231.db2.gz LHBMUVPOWRWFKP-CQSZACIVSA-N 1 0 319.788 4.015 20 10 DICDRO CCOc1cccc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC001178231737 1049006817 /nfs/dbraw/zinc/00/68/17/1049006817.db2.gz IMEDINGBBCMAQG-UHFFFAOYSA-N 1 0 324.468 4.018 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(COC)cc1)c1cc(Cl)ccc1O ZINC000775487679 1049008523 /nfs/dbraw/zinc/00/85/23/1049008523.db2.gz NDGDLJYASFRGAQ-QGZVFWFLSA-N 1 0 319.832 4.433 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(c3ccsc3)CC2)cc1C ZINC000776782512 1049009285 /nfs/dbraw/zinc/00/92/85/1049009285.db2.gz YGCPFLRPLCZIJS-UHFFFAOYSA-N 1 0 301.455 4.450 20 10 DICDRO CCOCc1cc(C[NH2+]Cc2c(C)cccc2C)ccc1OC ZINC001178280736 1049012126 /nfs/dbraw/zinc/01/21/26/1049012126.db2.gz QTKXBTCPKKJMTJ-UHFFFAOYSA-N 1 0 313.441 4.138 20 10 DICDRO CC[C@H]([NH2+]CCc1nc(C)cs1)c1cc(Cl)ccc1O ZINC000775492050 1049017818 /nfs/dbraw/zinc/01/78/18/1049017818.db2.gz KXRIGRKBKOIISW-ZDUSSCGKSA-N 1 0 310.850 4.094 20 10 DICDRO CC[C@H]([NH2+]CCCCN(C)c1ccccc1)c1ccccc1O ZINC000775491846 1049019931 /nfs/dbraw/zinc/01/99/31/1049019931.db2.gz MICWJYGCJYYSNH-IBGZPJMESA-N 1 0 312.457 4.350 20 10 DICDRO CC[C@@H]([NH2+]CCc1csc(C)n1)c1cc(Cl)ccc1O ZINC000775492808 1049021761 /nfs/dbraw/zinc/02/17/61/1049021761.db2.gz SLFXXCIDIZFBKH-CQSZACIVSA-N 1 0 310.850 4.094 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC001203886566 1049022449 /nfs/dbraw/zinc/02/24/49/1049022449.db2.gz GFZRQBGFADQODW-UHFFFAOYSA-N 1 0 322.374 4.403 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2ncsc2c1 ZINC000776809051 1049030426 /nfs/dbraw/zinc/03/04/26/1049030426.db2.gz XAUWFMYJHKZIOR-CYBMUJFWSA-N 1 0 311.454 4.213 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccoc1C)c1cc(Br)ccc1O ZINC000775496730 1049031794 /nfs/dbraw/zinc/03/17/94/1049031794.db2.gz JWNBYQDUACOSON-CQSZACIVSA-N 1 0 324.218 4.297 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(Cl)ccc1O ZINC000775499904 1049034529 /nfs/dbraw/zinc/03/45/29/1049034529.db2.gz GXAHIOYKLUUCQQ-INIZCTEOSA-N 1 0 317.816 4.221 20 10 DICDRO CCN(CC)c1ccc(C[NH+]2CCC3(CC(F)C3)CC2)cc1 ZINC001203939592 1049034715 /nfs/dbraw/zinc/03/47/15/1049034715.db2.gz DHOXFKGSKODWOG-UHFFFAOYSA-N 1 0 304.453 4.247 20 10 DICDRO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001203937136 1049035629 /nfs/dbraw/zinc/03/56/29/1049035629.db2.gz MGUIMHIOOXCWEZ-FQEVSTJZSA-N 1 0 324.468 4.236 20 10 DICDRO CCN(CC)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cc1 ZINC001203940722 1049038293 /nfs/dbraw/zinc/03/82/93/1049038293.db2.gz XDPUZGNDRSTMJU-IYBDPMFKSA-N 1 0 308.416 4.010 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)Oc1cccc(F)c1)c1ccccc1O ZINC000775508630 1049042938 /nfs/dbraw/zinc/04/29/38/1049042938.db2.gz KZFGEGBIOONWHX-GUYCJALGSA-N 1 0 303.377 4.040 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H](c2ccccc2)C(F)(F)F)cc1C ZINC000776815118 1049044647 /nfs/dbraw/zinc/04/46/47/1049044647.db2.gz HOAOURLDQWNHTN-MRXNPFEDSA-N 1 0 323.358 4.445 20 10 DICDRO CC(C)(C)OC1CC(CC[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001178478351 1049044764 /nfs/dbraw/zinc/04/47/64/1049044764.db2.gz WEXBUOQJEKCJLZ-UHFFFAOYSA-N 1 0 317.473 4.085 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)c2ccccc2O1 ZINC001202494185 1049047845 /nfs/dbraw/zinc/04/78/45/1049047845.db2.gz HXUFGUBLEBWFPP-RDTXWAMCSA-N 1 0 309.409 4.014 20 10 DICDRO CC[C@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1ccccc1O ZINC000775507559 1049048747 /nfs/dbraw/zinc/04/87/47/1049048747.db2.gz NFKJZGNELQGHKG-KRWDZBQOSA-N 1 0 312.388 4.296 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)Cc1ccncc1)c1cc(Cl)ccc1O ZINC000775513340 1049050075 /nfs/dbraw/zinc/05/00/75/1049050075.db2.gz XKRCSLWXSVIHMD-MLGOLLRUSA-N 1 0 304.821 4.113 20 10 DICDRO CC[C@H]([NH2+]CCc1c[nH]c2c1cccc2C)c1ccccc1O ZINC000775509079 1049050369 /nfs/dbraw/zinc/05/03/69/1049050369.db2.gz HMDIZLQTSIFHSP-SFHVURJKSA-N 1 0 308.425 4.465 20 10 DICDRO COC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCCCC1 ZINC001178525213 1049051732 /nfs/dbraw/zinc/05/17/32/1049051732.db2.gz XMKZVBFSUSIBRB-UHFFFAOYSA-N 1 0 316.489 4.116 20 10 DICDRO CC[C@@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1cc(Cl)ccc1O ZINC000775511093 1049054690 /nfs/dbraw/zinc/05/46/90/1049054690.db2.gz BEJOUNSZZWLXKD-CABCVRRESA-N 1 0 323.820 4.375 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H](CC)c2ccccc2O)C12CCCC2 ZINC000775512511 1049058307 /nfs/dbraw/zinc/05/83/07/1049058307.db2.gz LPCAIRWCDBOMJP-BPQIPLTHSA-N 1 0 303.446 4.171 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@H]2C)ccc1OC ZINC001178595868 1049059000 /nfs/dbraw/zinc/05/90/00/1049059000.db2.gz VQVVFCATCLFVBY-NUJGCVRESA-N 1 0 319.489 4.394 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@@H]2C)ccc1OC ZINC001178595870 1049060232 /nfs/dbraw/zinc/06/02/32/1049060232.db2.gz VQVVFCATCLFVBY-RYRKJORJSA-N 1 0 319.489 4.394 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)[C@@H](C)O ZINC001178709954 1049080053 /nfs/dbraw/zinc/08/00/53/1049080053.db2.gz QBYVPHRNZAWQIM-DYVFJYSZSA-N 1 0 321.505 4.236 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775523523 1049087135 /nfs/dbraw/zinc/08/71/35/1049087135.db2.gz JQCSCTQNOCKFTG-ZUZCIYMTSA-N 1 0 322.836 4.495 20 10 DICDRO CC[C@H]([NH2+]CCOCc1ccc(Cl)cc1)c1ccccc1O ZINC000775525252 1049088392 /nfs/dbraw/zinc/08/83/92/1049088392.db2.gz YWFOAYAWFQATHD-KRWDZBQOSA-N 1 0 319.832 4.303 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccccc1O ZINC000775525265 1049088850 /nfs/dbraw/zinc/08/88/50/1049088850.db2.gz FLTOXEWKYHZDIQ-CYBMUJFWSA-N 1 0 313.294 4.190 20 10 DICDRO CC[C@H]([NH2+]C[C@H](C)Cc1ccc(OC)cc1)c1ccccc1O ZINC000775524720 1049088929 /nfs/dbraw/zinc/08/89/29/1049088929.db2.gz HHUIBYOCOXNGOL-BEFAXECRSA-N 1 0 313.441 4.320 20 10 DICDRO CC[C@@H]([NH2+][C@H](COC)c1ccccc1)c1cc(Cl)ccc1O ZINC000775524963 1049089003 /nfs/dbraw/zinc/08/90/03/1049089003.db2.gz VGTTVLZKZWQXBB-IAGOWNOFSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)[C@@H](O)C(C)C)c1cc(Cl)ccc1O ZINC000775524985 1049089211 /nfs/dbraw/zinc/08/92/11/1049089211.db2.gz XEPFMVKUQOPFFZ-ZBFHGGJFSA-N 1 0 313.869 4.129 20 10 DICDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1cc(Cl)ccc1O ZINC000775527034 1049093288 /nfs/dbraw/zinc/09/32/88/1049093288.db2.gz VTLHXHMYZWVUQS-GUDXXQAFSA-N 1 0 321.848 4.044 20 10 DICDRO C[C@H]([NH2+]CCOC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000776888988 1049094897 /nfs/dbraw/zinc/09/48/97/1049094897.db2.gz CXVMCKYUJQZSGF-INIZCTEOSA-N 1 0 304.478 4.143 20 10 DICDRO C[C@@H]1CC[C@H](C)[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001204163204 1049099266 /nfs/dbraw/zinc/09/92/66/1049099266.db2.gz QAOCLHKTOMJGJB-OLZOCXBDSA-N 1 0 314.395 4.392 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)c3ccccc23)CCC1(F)F ZINC001204234022 1049116098 /nfs/dbraw/zinc/11/60/98/1049116098.db2.gz WCRCNZMPYUDQPU-CQSZACIVSA-N 1 0 318.411 4.383 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@](C)(F)[C@@H](F)C2)c2ccccc21 ZINC001204233152 1049116573 /nfs/dbraw/zinc/11/65/73/1049116573.db2.gz OLGVYMBEBPWBLG-RBUKOAKNSA-N 1 0 318.411 4.178 20 10 DICDRO CC[C@@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(C(F)(F)F)cc1O ZINC000857059437 1049124488 /nfs/dbraw/zinc/12/44/88/1049124488.db2.gz PQSXPFZQLXSJHO-CMPLNLGQSA-N 1 0 323.305 4.497 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000857081648 1049125653 /nfs/dbraw/zinc/12/56/53/1049125653.db2.gz PUGPXURVSZRDTF-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO COc1ccc(-n2c(C)cc(C[N@H+](C)CC(C)C)c2C)cc1 ZINC001204278310 1049125654 /nfs/dbraw/zinc/12/56/54/1049125654.db2.gz AHILZHIRZUHWAB-UHFFFAOYSA-N 1 0 300.446 4.191 20 10 DICDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)c(O)c1 ZINC001204279234 1049125971 /nfs/dbraw/zinc/12/59/71/1049125971.db2.gz TVHYJNMEOUONHI-GFCCVEGCSA-N 1 0 309.818 4.150 20 10 DICDRO COc1ccc(F)c(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000857081199 1049126130 /nfs/dbraw/zinc/12/61/30/1049126130.db2.gz NCHYMPQUNYGAGP-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CC2(Cl)Cl)c2c1c(F)ccc2O ZINC000857082345 1049127770 /nfs/dbraw/zinc/12/77/70/1049127770.db2.gz MUFDWPFUIYNKLZ-FXPVBKGRSA-N 1 0 318.219 4.253 20 10 DICDRO Cc1cc[nH+]c(NC/C=C/c2ccc(N(C)C)cc2)c1C1CC1 ZINC001179094720 1049130977 /nfs/dbraw/zinc/13/09/77/1049130977.db2.gz AACDOQZQTQPMAQ-SNAWJCMRSA-N 1 0 307.441 4.459 20 10 DICDRO CSCC1(CC[NH2+]Cc2c(C)c3ccccc3n2C)CC1 ZINC001179117088 1049133562 /nfs/dbraw/zinc/13/35/62/1049133562.db2.gz WKJQUVVLBVNPNI-UHFFFAOYSA-N 1 0 302.487 4.110 20 10 DICDRO c1ccc2c(c1)C[N@H+](Cc1ccc(N3CCCC3)cc1)CCS2 ZINC001204328778 1049142200 /nfs/dbraw/zinc/14/22/00/1049142200.db2.gz MDFKCXVCURDJOF-UHFFFAOYSA-N 1 0 324.493 4.395 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)c1nccs1)c1cc(Cl)ccc1O ZINC000775551025 1049142528 /nfs/dbraw/zinc/14/25/28/1049142528.db2.gz GIRYJMNPCIJCGU-ZWNOBZJWSA-N 1 0 310.850 4.347 20 10 DICDRO Fc1ccc([C@H]2CC[N@H+](Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001204322641 1049142621 /nfs/dbraw/zinc/14/26/21/1049142621.db2.gz UNGPRCAGQOAJDE-IBGZPJMESA-N 1 0 324.443 4.415 20 10 DICDRO C[N@H+](CC/C=C/c1cccnc1)Cc1ccc(N2CCCC2)cc1 ZINC001204328852 1049143031 /nfs/dbraw/zinc/14/30/31/1049143031.db2.gz QGWHNBUCGGHQFF-FARCUNLSSA-N 1 0 321.468 4.217 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)c1nccs1)c1cc(Cl)ccc1O ZINC000775551024 1049143247 /nfs/dbraw/zinc/14/32/47/1049143247.db2.gz GIRYJMNPCIJCGU-MFKMUULPSA-N 1 0 310.850 4.347 20 10 DICDRO CC[C@H]([NH2+]CCCNc1ccccc1F)c1ccccc1O ZINC000775551526 1049144711 /nfs/dbraw/zinc/14/47/11/1049144711.db2.gz OGZSXNBNAYPIQB-INIZCTEOSA-N 1 0 302.393 4.074 20 10 DICDRO CC[C@H]([NH2+]C[C@@]1(C)CCO[C@@H]1C1CC1)c1cc(Cl)ccc1O ZINC000775553391 1049148238 /nfs/dbraw/zinc/14/82/38/1049148238.db2.gz BKILLFFXJOXXIF-CGTJXYLNSA-N 1 0 323.864 4.292 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@H]2CCCS2)cc1F ZINC001179266054 1049148613 /nfs/dbraw/zinc/14/86/13/1049148613.db2.gz HUFWFOARXOYQAS-OAHLLOKOSA-N 1 0 310.482 4.047 20 10 DICDRO c1ccc([C@H]2CCC[C@H]2[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001179347693 1049153184 /nfs/dbraw/zinc/15/31/84/1049153184.db2.gz APWNMCBOCGOQLM-WOJBJXKFSA-N 1 0 307.437 4.438 20 10 DICDRO [O-]c1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001204460163 1049166759 /nfs/dbraw/zinc/16/67/59/1049166759.db2.gz JUPMCQDVNCVYDV-HNNXBMFYSA-N 1 0 317.379 4.125 20 10 DICDRO C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001179598081 1049182405 /nfs/dbraw/zinc/18/24/05/1049182405.db2.gz KLBURLWGTQYISQ-WCQYABFASA-N 1 0 300.368 4.050 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCc3c2cccc3F)cc1 ZINC001179617024 1049185645 /nfs/dbraw/zinc/18/56/45/1049185645.db2.gz WJBPSDPTMYZLJL-DPZZJQGRSA-N 1 0 310.416 4.182 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCO[C@H]2CC(C)C)c(O)c1C ZINC000775585828 1049191888 /nfs/dbraw/zinc/19/18/88/1049191888.db2.gz KGSHERRAFCFXGZ-SZMVWBNQSA-N 1 0 305.462 4.253 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(n1)CCC2 ZINC001204584448 1049194820 /nfs/dbraw/zinc/19/48/20/1049194820.db2.gz CUJLIMQTANZVMZ-UHFFFAOYSA-N 1 0 323.484 4.047 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCCCC1 ZINC000775589580 1049196511 /nfs/dbraw/zinc/19/65/11/1049196511.db2.gz UNDHTWXWOOCYPR-INIZCTEOSA-N 1 0 305.462 4.338 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)cc1 ZINC001193430734 1049211087 /nfs/dbraw/zinc/21/10/87/1049211087.db2.gz PIZRUVSHVAIZCU-HNNXBMFYSA-N 1 0 314.395 4.306 20 10 DICDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001179850175 1049215223 /nfs/dbraw/zinc/21/52/23/1049215223.db2.gz SJBZFVPFYDAQBK-GUYCJALGSA-N 1 0 310.432 4.431 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]Cc2ccc(Cl)s2)cc1F ZINC000858092071 1049215386 /nfs/dbraw/zinc/21/53/86/1049215386.db2.gz MRKJIOMUHDTVRD-UHFFFAOYSA-N 1 0 316.804 4.036 20 10 DICDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001179850176 1049215835 /nfs/dbraw/zinc/21/58/35/1049215835.db2.gz SJBZFVPFYDAQBK-SUMWQHHRSA-N 1 0 310.432 4.431 20 10 DICDRO C[C@@H]1C[C@H]1c1ccc(CNCc2cc(F)c(N(C)C)cc2F)o1 ZINC000858100618 1049218003 /nfs/dbraw/zinc/21/80/03/1049218003.db2.gz LJWVLNRMDPPPAQ-BXUZGUMPSA-N 1 0 320.383 4.037 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2ccccc2c1O ZINC000192936300 1049220797 /nfs/dbraw/zinc/22/07/97/1049220797.db2.gz UMGWSOGFZIZQPL-HNNXBMFYSA-N 1 0 320.436 4.462 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cc(C)c(C)cc2OC(F)F)c1 ZINC000858237811 1049228884 /nfs/dbraw/zinc/22/88/84/1049228884.db2.gz QIHFYCMLHJLJAD-UHFFFAOYSA-N 1 0 321.367 4.209 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH+]1CCC(c2ccccc2)CC1 ZINC001179970361 1049240765 /nfs/dbraw/zinc/24/07/65/1049240765.db2.gz XYMHYPOLRGTDBF-UHFFFAOYSA-N 1 0 308.469 4.441 20 10 DICDRO C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(N(C)C)cc1 ZINC000195615661 1049240658 /nfs/dbraw/zinc/24/06/58/1049240658.db2.gz KJWDOGZRCVCDNL-OAHLLOKOSA-N 1 0 307.441 4.127 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccccc2CC(F)(F)F)cc1 ZINC000858329784 1049243629 /nfs/dbraw/zinc/24/36/29/1049243629.db2.gz FAOUOWVZOAYUIT-UHFFFAOYSA-N 1 0 322.374 4.147 20 10 DICDRO COc1ccc(O)c(C[N@H+](Cc2ccccc2)CC(C)(C)C)c1 ZINC001179997428 1049246255 /nfs/dbraw/zinc/24/62/55/1049246255.db2.gz MSGGLZLYCDASCV-UHFFFAOYSA-N 1 0 313.441 4.449 20 10 DICDRO CCc1cccc(C[N@@H+]2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c1O ZINC001180017479 1049257640 /nfs/dbraw/zinc/25/76/40/1049257640.db2.gz CLLYITPAXKJRSZ-KBXCAEBGSA-N 1 0 313.416 4.472 20 10 DICDRO CCc1cccc(C[N@@H+]2C[C@H](c3ccc(F)cc3)C[C@H]2C)c1O ZINC001180017482 1049259066 /nfs/dbraw/zinc/25/90/66/1049259066.db2.gz CLLYITPAXKJRSZ-RDTXWAMCSA-N 1 0 313.416 4.472 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)nc1 ZINC000858488138 1049263799 /nfs/dbraw/zinc/26/37/99/1049263799.db2.gz OHBSOPZOPXPGEB-MRXNPFEDSA-N 1 0 312.457 4.341 20 10 DICDRO CCCC[N@H+](CCc1ncc(C)cc1C)Cc1ccccc1O ZINC001193838637 1049263887 /nfs/dbraw/zinc/26/38/87/1049263887.db2.gz LRRGWLFQBWAHFN-UHFFFAOYSA-N 1 0 312.457 4.249 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c1O ZINC001180094195 1049265850 /nfs/dbraw/zinc/26/58/50/1049265850.db2.gz ZONBZTRAMAJODR-LBPRGKRZSA-N 1 0 317.816 4.001 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@H](C)Cc1cccs1 ZINC001180064905 1049271106 /nfs/dbraw/zinc/27/11/06/1049271106.db2.gz ZJTOGIIGPZHNSU-OAHLLOKOSA-N 1 0 302.487 4.186 20 10 DICDRO Cc1cc(CN[C@H](C)c2cscn2)c(C)n1-c1ccccc1 ZINC000858543078 1049271792 /nfs/dbraw/zinc/27/17/92/1049271792.db2.gz PUVVREKBCASDCS-CQSZACIVSA-N 1 0 311.454 4.401 20 10 DICDRO Cc1cc(CN[C@H]2C[C@H](C)n3ccnc32)c(C)n1-c1ccccc1 ZINC000858542574 1049272687 /nfs/dbraw/zinc/27/26/87/1049272687.db2.gz MGAJGFSDUGJGOX-LIRRHRJNSA-N 1 0 320.440 4.086 20 10 DICDRO Cc1cc(CN[C@H]2C[C@@H](C)n3ccnc32)c(C)n1-c1ccccc1 ZINC000858542572 1049273197 /nfs/dbraw/zinc/27/31/97/1049273197.db2.gz MGAJGFSDUGJGOX-KUHUBIRLSA-N 1 0 320.440 4.086 20 10 DICDRO C[C@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1cc(F)ccc1O ZINC000858563044 1049274452 /nfs/dbraw/zinc/27/44/52/1049274452.db2.gz LMTBLLFXKDNOKM-QMMMGPOBSA-N 1 0 319.323 4.462 20 10 DICDRO C[C@@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1ccccc1O ZINC000858563817 1049274794 /nfs/dbraw/zinc/27/47/94/1049274794.db2.gz WPDPQMNSMQUPLI-SECBINFHSA-N 1 0 301.333 4.323 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c1 ZINC000858567307 1049276794 /nfs/dbraw/zinc/27/67/94/1049276794.db2.gz BCHZYQPFEPYXRY-LBPRGKRZSA-N 1 0 301.352 4.474 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c(O)c1 ZINC000858568302 1049276925 /nfs/dbraw/zinc/27/69/25/1049276925.db2.gz KOEFIFGKLGVILV-LBPRGKRZSA-N 1 0 301.352 4.474 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-])c1ccns1 ZINC000858576375 1049277951 /nfs/dbraw/zinc/27/79/51/1049277951.db2.gz JWAMSPLRPSUDQW-DTWKUNHWSA-N 1 0 316.348 4.279 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-])c1ccns1 ZINC000858576377 1049278219 /nfs/dbraw/zinc/27/82/19/1049278219.db2.gz JWAMSPLRPSUDQW-RKDXNWHRSA-N 1 0 316.348 4.279 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1CC(F)(F)F)CC2 ZINC000858591332 1049283267 /nfs/dbraw/zinc/28/32/67/1049283267.db2.gz QVHAVXNFHAFREH-OAHLLOKOSA-N 1 0 321.342 4.274 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001180113633 1049288136 /nfs/dbraw/zinc/28/81/36/1049288136.db2.gz ZNKXCUMIMHETTM-PXNSSMCTSA-N 1 0 311.400 4.433 20 10 DICDRO Oc1ccc(F)cc1C[N@@H+]1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001180113634 1049289842 /nfs/dbraw/zinc/28/98/42/1049289842.db2.gz ZNKXCUMIMHETTM-XLIONFOSSA-N 1 0 311.400 4.433 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@H+](C)CCCc2ccccc2)cc1 ZINC001180121889 1049291100 /nfs/dbraw/zinc/29/11/00/1049291100.db2.gz XBQTUSVGCVBURJ-XYOKQWHBSA-N 1 0 308.469 4.330 20 10 DICDRO COc1ccc(C[N@@H+]2CCCC[C@H]2CCC(C)C)c(O)c1OC ZINC001180116888 1049292151 /nfs/dbraw/zinc/29/21/51/1049292151.db2.gz NNHGTSHHNYFKSW-INIZCTEOSA-N 1 0 321.461 4.200 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@H]2CCCN(c3ccccc3)C2)c1O ZINC001180202963 1049307891 /nfs/dbraw/zinc/30/78/91/1049307891.db2.gz GBLNMFTVUSMCOB-FQEVSTJZSA-N 1 0 324.468 4.055 20 10 DICDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001204917241 1049309691 /nfs/dbraw/zinc/30/96/91/1049309691.db2.gz YGQXBAQUIOWFIW-AWEZNQCLSA-N 1 0 301.817 4.344 20 10 DICDRO Cc1cc(C[NH2+][C@H](c2ccccn2)C2CCC2)ccc1N(C)C ZINC000859568075 1049339999 /nfs/dbraw/zinc/33/99/99/1049339999.db2.gz NGYMVTQDCWKXOD-FQEVSTJZSA-N 1 0 309.457 4.087 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccccc2)cc1F ZINC001205039262 1049349979 /nfs/dbraw/zinc/34/99/79/1049349979.db2.gz JAPGYFMBAOYKRL-SFHVURJKSA-N 1 0 316.395 4.368 20 10 DICDRO COCC[N@H+](Cc1ccccc1)Cc1c(O)cc(C)cc1Cl ZINC001180497523 1049375328 /nfs/dbraw/zinc/37/53/28/1049375328.db2.gz MHXMYKWKEJHDGF-UHFFFAOYSA-N 1 0 319.832 4.003 20 10 DICDRO [O-]c1c(F)cc(F)cc1C[N@@H+]1CCCC[C@@H]1c1ccccc1 ZINC001180584816 1049386900 /nfs/dbraw/zinc/38/69/00/1049386900.db2.gz KMPLZDDMEPASJG-QGZVFWFLSA-N 1 0 303.352 4.398 20 10 DICDRO Cc1ccc([C@H]2CC[N@H+](Cc3ccc(Cl)cc3O)C2)cc1 ZINC001180819814 1049410515 /nfs/dbraw/zinc/41/05/15/1049410515.db2.gz KZFKOYAGADTHLP-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@H+](Cc2cccs2)C2CC2)cc1 ZINC001205207765 1049411343 /nfs/dbraw/zinc/41/13/43/1049411343.db2.gz CVGRCKSXQSGQDL-HWKANZROSA-N 1 0 312.482 4.492 20 10 DICDRO CC(C)[C@@H](C[NH2+]Cc1cc(F)ccc1O)Cc1ccccc1 ZINC001180997793 1049426347 /nfs/dbraw/zinc/42/63/47/1049426347.db2.gz ZBTKQXJPFNARIJ-MRXNPFEDSA-N 1 0 301.405 4.136 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@@H]2CCC[C@H](C(C)C)CC2)c1O ZINC001181072392 1049441766 /nfs/dbraw/zinc/44/17/66/1049441766.db2.gz HGEGMPGQMJXHSQ-DOTOQJQBSA-N 1 0 305.462 4.404 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)C1CC1 ZINC001181223063 1049455371 /nfs/dbraw/zinc/45/53/71/1049455371.db2.gz MSZPSBOXWUAMNB-KBPBESRZSA-N 1 0 306.881 4.464 20 10 DICDRO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1ccc2ccccc2c1O ZINC001205391153 1049457293 /nfs/dbraw/zinc/45/72/93/1049457293.db2.gz JUBSLIRVKUNXJS-OAHLLOKOSA-N 1 0 319.404 4.329 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2cc3ccccc3s2)c1 ZINC001205423063 1049465456 /nfs/dbraw/zinc/46/54/56/1049465456.db2.gz CVGCMJTTYXHEKX-GFCCVEGCSA-N 1 0 313.422 4.466 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cc1Cl ZINC001181350741 1049466395 /nfs/dbraw/zinc/46/63/95/1049466395.db2.gz UOCXMOMJNYXVPM-GXSJLCMTSA-N 1 0 307.743 4.127 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](CC(F)(F)F)C(C)C ZINC001205434845 1049469125 /nfs/dbraw/zinc/46/91/25/1049469125.db2.gz RIPAFJYVTDBAQJ-HNNXBMFYSA-N 1 0 302.384 4.128 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@](F)(c3ccccc3)C2)cc1 ZINC001205526551 1049491069 /nfs/dbraw/zinc/49/10/69/1049491069.db2.gz ACXGGOXQKZMYDU-IRUYWQDXSA-N 1 0 324.443 4.337 20 10 DICDRO Cc1ccc(F)c(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001205649057 1049520550 /nfs/dbraw/zinc/52/05/50/1049520550.db2.gz ZSUZOBXXTRHMMG-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC000775652527 1049525126 /nfs/dbraw/zinc/52/51/26/1049525126.db2.gz MMPBUBYRVHXXJW-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC(OC(C)(C)C)CC2)c1O ZINC000775662078 1049539480 /nfs/dbraw/zinc/53/94/80/1049539480.db2.gz UFFFOJADBJKCDZ-UHFFFAOYSA-N 1 0 311.853 4.134 20 10 DICDRO CC[N@H+](Cc1cc(OC)ccc1O)[C@H](C)c1ccc(F)cc1 ZINC000775658187 1049540114 /nfs/dbraw/zinc/54/01/14/1049540114.db2.gz GHFNIDCZEIOHQT-CYBMUJFWSA-N 1 0 303.377 4.123 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCc3ccccc3[C@@H](C)C2)cc1 ZINC001195808284 1049572058 /nfs/dbraw/zinc/57/20/58/1049572058.db2.gz APRZOMKCXZPCGT-KRWDZBQOSA-N 1 0 308.469 4.305 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCNc2ccccc21 ZINC000774193062 1049620875 /nfs/dbraw/zinc/62/08/75/1049620875.db2.gz RWYGSVHSCKFCQE-FQEVSTJZSA-N 1 0 309.457 4.098 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000775695619 1049629803 /nfs/dbraw/zinc/62/98/03/1049629803.db2.gz PGWZCAHETMAPSK-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)c1 ZINC000775706987 1049639229 /nfs/dbraw/zinc/63/92/29/1049639229.db2.gz SXVJNYXHFMIRQH-FZKQIMNGSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1C ZINC000119939663 1049646500 /nfs/dbraw/zinc/64/65/00/1049646500.db2.gz MOAWCKLDTOYNJN-KSSFIOAISA-N 1 0 317.454 4.033 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)Cc2ccccc2SC)c1O ZINC000794667646 1049650375 /nfs/dbraw/zinc/65/03/75/1049650375.db2.gz ZRCGSLFXIGPEMJ-UHFFFAOYSA-N 1 0 317.454 4.063 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@@H]2CCC[C@H]2C(C)(C)C)c1O ZINC001182444468 1049653999 /nfs/dbraw/zinc/65/39/99/1049653999.db2.gz RRVHDWVEANLLLR-HZPDHXFCSA-N 1 0 305.462 4.356 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccc(N(C)C)cc1 ZINC000774445812 1049664903 /nfs/dbraw/zinc/66/49/03/1049664903.db2.gz RWGDEEXHEFLYCG-FQEVSTJZSA-N 1 0 323.484 4.267 20 10 DICDRO Cc1cc(C[NH2+][C@@H](c2cccs2)C2CC2)ccc1N(C)C ZINC000774446566 1049665155 /nfs/dbraw/zinc/66/51/55/1049665155.db2.gz CGZWHSSZLAGVFS-GOSISDBHSA-N 1 0 300.471 4.363 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)c1 ZINC000775724919 1049669958 /nfs/dbraw/zinc/66/99/58/1049669958.db2.gz LHTFBSSHQMCRRD-YJYMSZOUSA-N 1 0 315.388 4.123 20 10 DICDRO CCO[C@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)c1ccccc1 ZINC000774498701 1049677220 /nfs/dbraw/zinc/67/72/20/1049677220.db2.gz SFQSSCVJJOORNN-VQIMIIECSA-N 1 0 313.441 4.437 20 10 DICDRO CCO[C@@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)c1ccccc1 ZINC000774498691 1049677726 /nfs/dbraw/zinc/67/77/26/1049677726.db2.gz SFQSSCVJJOORNN-APWZRJJASA-N 1 0 313.441 4.437 20 10 DICDRO CCCOc1ncccc1C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794800926 1049696523 /nfs/dbraw/zinc/69/65/23/1049696523.db2.gz FSQYVFQOOMAUMI-QGZVFWFLSA-N 1 0 314.429 4.125 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)Oc1ccccc1F)c1ccc(C)cc1O ZINC000794799952 1049696796 /nfs/dbraw/zinc/69/67/96/1049696796.db2.gz APWPCVUIXNDNKD-PBHICJAKSA-N 1 0 317.404 4.348 20 10 DICDRO CCCOc1ncccc1C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794800924 1049697105 /nfs/dbraw/zinc/69/71/05/1049697105.db2.gz FSQYVFQOOMAUMI-KRWDZBQOSA-N 1 0 314.429 4.125 20 10 DICDRO CCc1ccc([C@@H](COC)[NH2+][C@@H](CC)c2ccc(C)cc2O)o1 ZINC000794802425 1049697476 /nfs/dbraw/zinc/69/74/76/1049697476.db2.gz ODMMYMWUDRXMHT-DLBZAZTESA-N 1 0 317.429 4.284 20 10 DICDRO CC[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(C)cc1O ZINC000794800575 1049697552 /nfs/dbraw/zinc/69/75/52/1049697552.db2.gz DTUWGWVACREORQ-WMZOPIPTSA-N 1 0 306.494 4.108 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)CCc1ccco1 ZINC001206320837 1049712362 /nfs/dbraw/zinc/71/23/62/1049712362.db2.gz MJXUIJNWXNGXAA-SJORKVTESA-N 1 0 314.473 4.196 20 10 DICDRO CCCCC[C@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001206385530 1049723596 /nfs/dbraw/zinc/72/35/96/1049723596.db2.gz WFDIUSIBMNZGRZ-IRXDYDNUSA-N 1 0 304.478 4.080 20 10 DICDRO CCC[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccccc1O ZINC000150949894 1049813279 /nfs/dbraw/zinc/81/32/79/1049813279.db2.gz OOUYHINZXBDYJK-UHFFFAOYSA-N 1 0 314.360 4.085 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC001206990795 1049817153 /nfs/dbraw/zinc/81/71/53/1049817153.db2.gz IAFZNARWGNDRNL-UYWPIULCSA-N 1 0 312.379 4.040 20 10 DICDRO CN(C)c1ccc(C[NH+]2CCC(C)(F)CC2)c(C(F)(F)F)c1 ZINC001206991847 1049819224 /nfs/dbraw/zinc/81/92/24/1049819224.db2.gz OJMMEUIXQUAHDK-UHFFFAOYSA-N 1 0 318.358 4.095 20 10 DICDRO Oc1cccc2c1C[N@H+](C[C@@H]1C[C@@H]1c1ccc(Cl)cc1)CC2 ZINC001207189303 1049856256 /nfs/dbraw/zinc/85/62/56/1049856256.db2.gz AIKMZMWNIIOXCD-DOTOQJQBSA-N 1 0 313.828 4.207 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C(C)(C)[C@H](O)c2ccccc2)c1 ZINC001207283370 1049874544 /nfs/dbraw/zinc/87/45/44/1049874544.db2.gz OOMPFCGIASGIRA-LJQANCHMSA-N 1 0 313.441 4.117 20 10 DICDRO C[C@@H]1C[N@H+](Cc2cc(Cl)c(F)cc2[O-])Cc2ccccc21 ZINC001207447254 1049894394 /nfs/dbraw/zinc/89/43/94/1049894394.db2.gz CAQQTEDHIWDMJE-LLVKDONJSA-N 1 0 305.780 4.304 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CC(Nc3ccccc3)C2)cc1Cl ZINC001207459911 1049895513 /nfs/dbraw/zinc/89/55/13/1049895513.db2.gz PDJITLVXKRSYMA-UHFFFAOYSA-N 1 0 316.832 4.087 20 10 DICDRO CC[C@H]([NH2+]CCc1nc2c(s1)CCCC2)c1ccccc1O ZINC000156571859 1049932647 /nfs/dbraw/zinc/93/26/47/1049932647.db2.gz VLGVFOHWHZNWHX-AWEZNQCLSA-N 1 0 316.470 4.011 20 10 DICDRO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC001207748664 1049934248 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CCC[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1ccccn1 ZINC000825233362 1050284553 /nfs/dbraw/zinc/28/45/53/1050284553.db2.gz BZRMZFNDGDBTGJ-HNNXBMFYSA-N 1 0 304.821 4.380 20 10 DICDRO COc1ccc(C2([NH2+]Cc3cc(Cl)c(C)cc3O)CC2)cc1 ZINC000825222785 1050286232 /nfs/dbraw/zinc/28/62/32/1050286232.db2.gz OBXPKJQBROUYRS-UHFFFAOYSA-N 1 0 317.816 4.142 20 10 DICDRO COc1cccc(C[NH2+]C2(C(C)(C)c3ccccc3)CC2)c1O ZINC000825202111 1050286548 /nfs/dbraw/zinc/28/65/48/1050286548.db2.gz PHTFTNMCQCGPTR-UHFFFAOYSA-N 1 0 311.425 4.001 20 10 DICDRO CC[C@@](C)([NH2+]Cc1cc(Cl)c(C)cc1O)c1nccs1 ZINC000825291012 1050289510 /nfs/dbraw/zinc/28/95/10/1050289510.db2.gz BVMMMKYJZXOXMN-OAHLLOKOSA-N 1 0 310.850 4.226 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOC3(CCCCC3)C2)cc1Cl ZINC000825341676 1050296485 /nfs/dbraw/zinc/29/64/85/1050296485.db2.gz QBOTXMLPVPSVIJ-OAHLLOKOSA-N 1 0 323.864 4.326 20 10 DICDRO C[N@H+](Cc1cccc(O)c1)Cc1cc(-c2ccccc2)ccc1O ZINC000771935823 1050300245 /nfs/dbraw/zinc/30/02/45/1050300245.db2.gz 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CCC(CC)[C@H]1C[C@H]([NH2+][C@@H](CC)c2ccccc2O)CCO1 ZINC000157891798 1050478326 /nfs/dbraw/zinc/47/83/26/1050478326.db2.gz NXVUERJNASUOCC-HHXXYDBFSA-N 1 0 305.462 4.417 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@H](Cc2ccccc2)C2CC2)cc1F ZINC000736647010 1050485516 /nfs/dbraw/zinc/48/55/16/1050485516.db2.gz AEGNWGUSBWOZRA-LJQANCHMSA-N 1 0 312.432 4.003 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccncc1OC)c1cc(Cl)ccc1O ZINC000783328389 1050485899 /nfs/dbraw/zinc/48/58/99/1050485899.db2.gz AHWTWXBYEXWXDC-IAQYHMDHSA-N 1 0 320.820 4.251 20 10 DICDRO C[NH2+]Cc1ccc(N(c2ccc(N)cc2)c2ccc(N)cc2)cc1 ZINC001211131415 1050490133 /nfs/dbraw/zinc/49/01/33/1050490133.db2.gz JDCPBZWPNLJBQA-UHFFFAOYSA-N 1 0 318.424 4.040 20 10 DICDRO CC[NH+](CC)Cc1ccc(NCc2cc(C)c(C)cc2O)cc1 ZINC000786827839 1050520490 /nfs/dbraw/zinc/52/04/90/1050520490.db2.gz RWDHZVGRYXKGFX-UHFFFAOYSA-N 1 0 312.457 4.463 20 10 DICDRO COc1c[nH+]ccc1N(Cc1ccccc1)c1ccc(N)cc1 ZINC001211263788 1050530669 /nfs/dbraw/zinc/53/06/69/1050530669.db2.gz JOHFTMNCUMHFLK-UHFFFAOYSA-N 1 0 305.381 4.011 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCS[C@H](c3ccccc3)C2)cc1C ZINC000738241168 1050530866 /nfs/dbraw/zinc/53/08/66/1050530866.db2.gz QPFAXZQGGDFOPQ-IBGZPJMESA-N 1 0 313.466 4.299 20 10 DICDRO c1ccc(C[C@H]2CCC[C@H]2[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000738431722 1050533693 /nfs/dbraw/zinc/53/36/93/1050533693.db2.gz VUEIKNVSSYZJEE-UYAOXDASSA-N 1 0 307.437 4.123 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(F)c(F)c1)c1cc(Cl)ccc1O ZINC000786936881 1050535601 /nfs/dbraw/zinc/53/56/01/1050535601.db2.gz CFXLPUJXISOHEV-JTQLQIEISA-N 1 0 311.759 4.217 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](c3ccc(C)cc3)C[C@H]2C)c1O ZINC000787326426 1050591741 /nfs/dbraw/zinc/59/17/41/1050591741.db2.gz DPDZPKMHQPGWLY-CRAIPNDOSA-N 1 0 311.425 4.087 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@@H](c3ccc(C)cc3)C[C@@H]2C)c1O ZINC000787326439 1050593326 /nfs/dbraw/zinc/59/33/26/1050593326.db2.gz DPDZPKMHQPGWLY-YJBOKZPZSA-N 1 0 311.425 4.087 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)cc1F ZINC000787417498 1050597656 /nfs/dbraw/zinc/59/76/56/1050597656.db2.gz OCHDTLHYBNTBRY-AWEZNQCLSA-N 1 0 318.358 4.055 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCS1)c1ccc(N2CCCCC2)cc1 ZINC000168653880 1050618830 /nfs/dbraw/zinc/61/88/30/1050618830.db2.gz QNZCWFDGUHISCU-CRAIPNDOSA-N 1 0 304.503 4.223 20 10 DICDRO Cc1cc(C[N@@H+](C)CCCOC(C)C)c(O)c(C(C)(C)C)c1 ZINC000740857847 1050632094 /nfs/dbraw/zinc/63/20/94/1050632094.db2.gz UBFHXHFHJVPOLW-UHFFFAOYSA-N 1 0 307.478 4.245 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cc2cnccc2o1)C1CCCC1 ZINC000845906071 1050632891 /nfs/dbraw/zinc/63/28/91/1050632891.db2.gz APJSZVRSQWLRLB-UHFFFAOYSA-N 1 0 322.408 4.478 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)cc(Cl)c2)c1 ZINC000845970880 1050639728 /nfs/dbraw/zinc/63/97/28/1050639728.db2.gz FAYMFKYEJJFTIL-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO CC(C)(C)c1ncc(C[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000846057301 1050649385 /nfs/dbraw/zinc/64/93/85/1050649385.db2.gz GLRQSTGGZZHGRN-UHFFFAOYSA-N 1 0 310.850 4.089 20 10 DICDRO COc1ccc(O)c(C[NH2+]C2(c3ccccc3Cl)CCC2)c1 ZINC000845995654 1050649612 /nfs/dbraw/zinc/64/96/12/1050649612.db2.gz YMIRDIIOHWHAAF-UHFFFAOYSA-N 1 0 317.816 4.223 20 10 DICDRO CCC(O)(CC)CC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000788076006 1050649846 /nfs/dbraw/zinc/64/98/46/1050649846.db2.gz CFMAGAGXLXVYAM-UHFFFAOYSA-N 1 0 313.441 4.090 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cnc(C2CCCC2)s1 ZINC000846059064 1050651072 /nfs/dbraw/zinc/65/10/72/1050651072.db2.gz XQBNCDJEJRCFGO-UHFFFAOYSA-N 1 0 322.861 4.450 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccccc1F ZINC000846044235 1050658149 /nfs/dbraw/zinc/65/81/49/1050658149.db2.gz GIDPOKDNGRMJFB-SJCJKPOMSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCc2ccccc2OC(F)F)c(O)c1 ZINC000788258733 1050660941 /nfs/dbraw/zinc/66/09/41/1050660941.db2.gz IRUHTXDRDLWXLW-ZDUSSCGKSA-N 1 0 321.367 4.195 20 10 DICDRO CC[NH+](CC)Cc1cccc(N[C@@H]2CCc3cccc(O)c32)c1 ZINC000323874210 1050665756 /nfs/dbraw/zinc/66/57/56/1050665756.db2.gz MCEJOFDNNTYZQH-GOSISDBHSA-N 1 0 310.441 4.333 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](C)c2cccc(OC)c2O)CCCC1 ZINC000846149563 1050671960 /nfs/dbraw/zinc/67/19/60/1050671960.db2.gz JMHKKXUZGXFIOB-HNNXBMFYSA-N 1 0 321.461 4.038 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1cc(F)ccc1F ZINC000846153361 1050673752 /nfs/dbraw/zinc/67/37/52/1050673752.db2.gz GLYSCOZEYOEIGF-ZBEGNZNMSA-N 1 0 321.367 4.481 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(c3ccc(Cl)cc3)CC2)c1O ZINC000846161468 1050676533 /nfs/dbraw/zinc/67/65/33/1050676533.db2.gz CWELZDLKJSOROQ-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2CC(C)(c3ccccc3)C2)c1O ZINC000846165357 1050678519 /nfs/dbraw/zinc/67/85/19/1050678519.db2.gz ZCMXNXFRGUMEPP-PCVOSPCESA-N 1 0 311.425 4.172 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)CCCC(F)(F)F)c1O ZINC000846165384 1050678584 /nfs/dbraw/zinc/67/85/84/1050678584.db2.gz KYGMQGNGYSWICP-WDEREUQCSA-N 1 0 305.340 4.173 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C2(c3cccc(Cl)c3)CC2)c1O ZINC000846164237 1050678709 /nfs/dbraw/zinc/67/87/09/1050678709.db2.gz SZDHLYPRJLYMJR-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c1O ZINC000846169634 1050679845 /nfs/dbraw/zinc/67/98/45/1050679845.db2.gz IUJAUZCKKYEOLJ-XNRPHZJLSA-N 1 0 315.388 4.137 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC[C@H]2CCc3ccccc32)c1O ZINC000846171007 1050680091 /nfs/dbraw/zinc/68/00/91/1050680091.db2.gz QGQHQLKBBFWBIA-GOEBONIOSA-N 1 0 311.425 4.172 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2OC)c1O ZINC000846138131 1050681989 /nfs/dbraw/zinc/68/19/89/1050681989.db2.gz SWOWVRGBUJVDDI-UONOGXRCSA-N 1 0 315.413 4.130 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C[C@H](c2ccccc2)C2CC2)c1O ZINC000846172579 1050682431 /nfs/dbraw/zinc/68/24/31/1050682431.db2.gz ZIKCHBFVLZHBRS-KBXCAEBGSA-N 1 0 311.425 4.245 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2cc3c(s2)CCCC3)c1O ZINC000846140969 1050682462 /nfs/dbraw/zinc/68/24/62/1050682462.db2.gz BOJSDOPQDCRVPS-LBPRGKRZSA-N 1 0 317.454 4.192 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C[C@@H](c2ccccc2)C2CC2)c1O ZINC000846172581 1050682478 /nfs/dbraw/zinc/68/24/78/1050682478.db2.gz ZIKCHBFVLZHBRS-KDOFPFPSSA-N 1 0 311.425 4.245 20 10 DICDRO COc1cccc([C@H](C)[NH2+]C[C@@H](C)Sc2ccccc2)c1O ZINC000846143036 1050683530 /nfs/dbraw/zinc/68/35/30/1050683530.db2.gz AEJIJTDGCWSTGL-KGLIPLIRSA-N 1 0 317.454 4.232 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]C[C@H](C)Sc2ccccc2)c1O ZINC000846143039 1050683941 /nfs/dbraw/zinc/68/39/41/1050683941.db2.gz AEJIJTDGCWSTGL-UONOGXRCSA-N 1 0 317.454 4.232 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(F)c(Cl)c2)c1O ZINC000846144092 1050683951 /nfs/dbraw/zinc/68/39/51/1050683951.db2.gz HYIITLKAJPYKSH-JTQLQIEISA-N 1 0 309.768 4.044 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCc2c[nH]c3cc(C)ccc23)c1O ZINC000846142713 1050684335 /nfs/dbraw/zinc/68/43/35/1050684335.db2.gz VREAHIDLSWXHOD-CQSZACIVSA-N 1 0 324.424 4.084 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCCc2c[nH]c3ccccc23)c1O ZINC000846143380 1050684502 /nfs/dbraw/zinc/68/45/02/1050684502.db2.gz FEPDBMKSNBMDOQ-CQSZACIVSA-N 1 0 324.424 4.166 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CCc2ccc(Cl)s2)c1O ZINC000846143335 1050684760 /nfs/dbraw/zinc/68/47/60/1050684760.db2.gz ZOLXRDGYSOQGQW-JTQLQIEISA-N 1 0 311.834 4.009 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccc(F)cc1F ZINC000846145278 1050685971 /nfs/dbraw/zinc/68/59/71/1050685971.db2.gz NQARCVVQGWBSDC-BZNIZROVSA-N 1 0 321.367 4.481 20 10 DICDRO CC[C@H]([NH2+][C@H](c1ccccc1F)[C@H](C)O)c1ccc(C)cc1O ZINC000846182408 1050689375 /nfs/dbraw/zinc/68/93/75/1050689375.db2.gz JOWFPCSUOYCTSM-IXDGSTSKSA-N 1 0 317.404 4.003 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2c[nH]c3ccccc23)c(O)c1 ZINC000788497526 1050693256 /nfs/dbraw/zinc/69/32/56/1050693256.db2.gz JLDZAPFQTGLFPG-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCc3ccc(O)cc32)cc1 ZINC000788543990 1050701468 /nfs/dbraw/zinc/70/14/68/1050701468.db2.gz AYTDZIKXFUQORZ-OAQYLSRUSA-N 1 0 324.468 4.406 20 10 DICDRO COc1ccc(CCC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000788563708 1050703235 /nfs/dbraw/zinc/70/32/35/1050703235.db2.gz QYUJEMGVBQYXEU-INIZCTEOSA-N 1 0 313.441 4.301 20 10 DICDRO CC1(C)CC([NH2+][C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 ZINC000788582444 1050708460 /nfs/dbraw/zinc/70/84/60/1050708460.db2.gz JUUCYHFFJCXNGM-CYBMUJFWSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1nc2ccccc2n1CC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000788646779 1050717136 /nfs/dbraw/zinc/71/71/36/1050717136.db2.gz RZBQXGLLPIACHL-OAHLLOKOSA-N 1 0 323.440 4.018 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000788618750 1050718393 /nfs/dbraw/zinc/71/83/93/1050718393.db2.gz AVVHKCQCDVIHHW-ZWKOTPCHSA-N 1 0 324.468 4.268 20 10 DICDRO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cc(F)ccc1O ZINC000788619693 1050719034 /nfs/dbraw/zinc/71/90/34/1050719034.db2.gz KRFYMZDNZMPVSG-QMMMGPOBSA-N 1 0 315.722 4.314 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)c(O)c1 ZINC000788618741 1050719068 /nfs/dbraw/zinc/71/90/68/1050719068.db2.gz AVVHKCQCDVIHHW-MSOLQXFVSA-N 1 0 324.468 4.268 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(-n3ccnc3)cc2)c(O)c1 ZINC000788638018 1050722159 /nfs/dbraw/zinc/72/21/59/1050722159.db2.gz FOGTVIIHADCUCG-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCCO[C@@H]2C(C)C)c(O)c1 ZINC000788661635 1050727412 /nfs/dbraw/zinc/72/74/12/1050727412.db2.gz BLUAZGRUOKAANY-TXPKVOOTSA-N 1 0 305.462 4.111 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)[C@H](C)c2ccccc2)c1O ZINC000761184113 1050745291 /nfs/dbraw/zinc/74/52/91/1050745291.db2.gz QEDNEEDYKHXPCH-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO Cc1cc(C)cc([C@H](O)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788820333 1050758023 /nfs/dbraw/zinc/75/80/23/1050758023.db2.gz UQHAKZBBWNSPFW-QFBILLFUSA-N 1 0 313.441 4.010 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000788969664 1050768136 /nfs/dbraw/zinc/76/81/36/1050768136.db2.gz LTEFROQASZYMCO-UHFFFAOYSA-N 1 0 312.457 4.140 20 10 DICDRO COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000788983641 1050770762 /nfs/dbraw/zinc/77/07/62/1050770762.db2.gz CVHMTMBXORTKRJ-LJQANCHMSA-N 1 0 323.436 4.142 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@H]1CCc2cc(F)ccc2C1 ZINC001168410272 1050776864 /nfs/dbraw/zinc/77/68/64/1050776864.db2.gz BRNURGQTHMHQMR-FQEVSTJZSA-N 1 0 321.395 4.332 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@@H]1C)c1ccc(N2CCOCC2)cc1Cl ZINC000772959496 1050806396 /nfs/dbraw/zinc/80/63/96/1050806396.db2.gz PXTHKWABGMWEBQ-DEYYWGMASA-N 1 0 322.880 4.016 20 10 DICDRO CN(C)c1ccc(C[N@H+](CCCCOC(C)(C)C)C2CC2)cc1 ZINC000789310963 1050812545 /nfs/dbraw/zinc/81/25/45/1050812545.db2.gz XSBDIZSFJAOMTP-UHFFFAOYSA-N 1 0 318.505 4.312 20 10 DICDRO COc1ccc(C[NH2+][C@@H]2CCCN(c3ccc(C)cc3)C2)cc1C ZINC000742380983 1050825553 /nfs/dbraw/zinc/82/55/53/1050825553.db2.gz UEZHZWHBPBTCDV-LJQANCHMSA-N 1 0 324.468 4.071 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H](C)C2CCCCC2)ccc1OC ZINC000742373963 1050834998 /nfs/dbraw/zinc/83/49/98/1050834998.db2.gz XEIMFZINHWGNHI-HNNXBMFYSA-N 1 0 305.462 4.290 20 10 DICDRO CCOCc1cc(C[NH2+]C2CCC(C)(C)CC2)ccc1OC ZINC000742373664 1050835120 /nfs/dbraw/zinc/83/51/20/1050835120.db2.gz QYZMHUHKYGGVAG-UHFFFAOYSA-N 1 0 305.462 4.290 20 10 DICDRO COc1ccc(C[NH2+]CCc2c[nH]c3c2cccc3C)cc1C ZINC000742373315 1050835955 /nfs/dbraw/zinc/83/59/55/1050835955.db2.gz JYEZUQWRIIQICJ-UHFFFAOYSA-N 1 0 308.425 4.126 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)ccc1OC ZINC000742378211 1050836745 /nfs/dbraw/zinc/83/67/45/1050836745.db2.gz DTSSPTSBFNWVQU-YQVWRLOYSA-N 1 0 317.473 4.290 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](CC2CC2)c2ccccc2)c(O)c1 ZINC000742378819 1050836765 /nfs/dbraw/zinc/83/67/65/1050836765.db2.gz ZKOTYXBWDIIPHE-LJQANCHMSA-N 1 0 311.425 4.422 20 10 DICDRO COc1ccc(C[NH2+][C@H](c2nc(C)cs2)C2CC2)cc1C ZINC000742377717 1050837308 /nfs/dbraw/zinc/83/73/08/1050837308.db2.gz QQJUDNNEFHGDQG-INIZCTEOSA-N 1 0 302.443 4.009 20 10 DICDRO Cc1cc(C)c(O)c(C[NH+]2CCC(CC(F)(F)F)CC2)c1 ZINC000789528655 1050845535 /nfs/dbraw/zinc/84/55/35/1050845535.db2.gz SXAKFJPTEPDPRN-UHFFFAOYSA-N 1 0 301.352 4.173 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)nc(Cl)c1 ZINC000789743786 1050882717 /nfs/dbraw/zinc/88/27/17/1050882717.db2.gz GMFBYNDDRNKJAN-UHFFFAOYSA-N 1 0 317.864 4.132 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1O)c1ccc(Br)cc1F ZINC000228407584 1050888219 /nfs/dbraw/zinc/88/82/19/1050888219.db2.gz XCPAJHFXOROWHG-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(-c3ccco3)cc2F)c1 ZINC000790483539 1050962628 /nfs/dbraw/zinc/96/26/28/1050962628.db2.gz HXRGLYMCYGKWCZ-UHFFFAOYSA-N 1 0 311.356 4.390 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCSC1)c1ccc(N2CCCCC2)cc1 ZINC000790498829 1050964530 /nfs/dbraw/zinc/96/45/30/1050964530.db2.gz TYLSQYOPDLDAMC-HZPDHXFCSA-N 1 0 304.503 4.081 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCSC1)c1ccc(N2CCCCCC2)cc1 ZINC000790494907 1050965509 /nfs/dbraw/zinc/96/55/09/1050965509.db2.gz GIEPWBFVLQNACN-IRXDYDNUSA-N 1 0 318.530 4.471 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@@](C)(O)C2CCCCC2)c2c1c(F)ccc2O ZINC000790704040 1050987324 /nfs/dbraw/zinc/98/73/24/1050987324.db2.gz XDLBGCXHBPVWPD-XFHNUULXSA-N 1 0 321.436 4.001 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC3(CCCCC3)O2)c(O)c1 ZINC000790716641 1050989298 /nfs/dbraw/zinc/98/92/98/1050989298.db2.gz WUJKTSXPPMRLSS-JKSUJKDBSA-N 1 0 303.446 4.233 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CC3CCC2CC3)cc1 ZINC000400142965 1051020166 /nfs/dbraw/zinc/02/01/66/1051020166.db2.gz SHENUYIQNGBWCI-KVZIAJEVSA-N 1 0 300.490 4.449 20 10 DICDRO CC[C@H](C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000773022850 1051026453 /nfs/dbraw/zinc/02/64/53/1051026453.db2.gz FFAGLOOZLSHWSZ-XHSDSOJGSA-N 1 0 322.468 4.138 20 10 DICDRO C[C@@H]([NH2+]CCC1CCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000773035300 1051031531 /nfs/dbraw/zinc/03/15/31/1051031531.db2.gz LSNCHIKCMDNDCF-CQSZACIVSA-N 1 0 322.880 4.017 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)C)c1ccc(N(C)C)cc1 ZINC000773043526 1051034057 /nfs/dbraw/zinc/03/40/57/1051034057.db2.gz CNNGDXIFDUPZDY-YSIASYRMSA-N 1 0 318.505 4.245 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)CCC1 ZINC000773061503 1051043034 /nfs/dbraw/zinc/04/30/34/1051043034.db2.gz YVFILXMQISEBIG-IBGZPJMESA-N 1 0 318.505 4.390 20 10 DICDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(N(C)CC)cc2)CCC1 ZINC000773061283 1051043245 /nfs/dbraw/zinc/04/32/45/1051043245.db2.gz VFGVKDNNHFJCHL-QGZVFWFLSA-N 1 0 318.505 4.390 20 10 DICDRO CC[N@H+](Cc1cc(Br)ccc1O)[C@H]1C=CCCC1 ZINC000743873243 1051086288 /nfs/dbraw/zinc/08/62/88/1051086288.db2.gz LDKZNUFZPJWOSO-AWEZNQCLSA-N 1 0 310.235 4.085 20 10 DICDRO Cc1cc(C[NH2+]C[C@H]2CC2(Cl)Cl)c(C)n1-c1ccccc1 ZINC000743653618 1051053146 /nfs/dbraw/zinc/05/31/46/1051053146.db2.gz RSZQTWAMYLSDFN-OAHLLOKOSA-N 1 0 323.267 4.378 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC[C@H]2CCCC[C@H]2O)cc1 ZINC000773080876 1051055293 /nfs/dbraw/zinc/05/52/93/1051055293.db2.gz NXNSJGIQPMUZTO-ILZDJORESA-N 1 0 318.505 4.125 20 10 DICDRO CC(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000773092893 1051057983 /nfs/dbraw/zinc/05/79/83/1051057983.db2.gz NOFJQHSUCMDINW-HUUCEWRRSA-N 1 0 324.896 4.262 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(C)cc(OC)c1)c1ccc(N(C)C)cc1 ZINC000773092902 1051057997 /nfs/dbraw/zinc/05/79/97/1051057997.db2.gz NSIGONLRODGUKK-FQEVSTJZSA-N 1 0 312.457 4.311 20 10 DICDRO CS[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000773090884 1051060178 /nfs/dbraw/zinc/06/01/78/1051060178.db2.gz HBXAKIKEZGBMCC-ZIAGYGMSSA-N 1 0 310.482 4.218 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)[C@H]1CCCO1 ZINC000773102628 1051062687 /nfs/dbraw/zinc/06/26/87/1051062687.db2.gz HHIBRDSTNRHKEX-FFZOFVMBSA-N 1 0 316.489 4.285 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389001 1051072825 /nfs/dbraw/zinc/07/28/25/1051072825.db2.gz RXULNRJTJHAQBR-INIZCTEOSA-N 1 0 317.379 4.050 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)c1 ZINC000792187977 1051123670 /nfs/dbraw/zinc/12/36/70/1051123670.db2.gz JIHKSDOXGXTQHO-CQSZACIVSA-N 1 0 301.352 4.111 20 10 DICDRO C[C@H]1CCSCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000792194802 1051126914 /nfs/dbraw/zinc/12/69/14/1051126914.db2.gz AGFBQFDTMUKDRT-HNNXBMFYSA-N 1 0 313.466 4.387 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1Cl ZINC000037233619 1051130100 /nfs/dbraw/zinc/13/01/00/1051130100.db2.gz SWUSYYRFUXFTTG-LBPRGKRZSA-N 1 0 306.812 4.396 20 10 DICDRO COc1ccc(Cl)c(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000792285282 1051130898 /nfs/dbraw/zinc/13/08/98/1051130898.db2.gz GRFLIIQNGFMCIQ-ZDUSSCGKSA-N 1 0 318.848 4.265 20 10 DICDRO Cc1cccc2c1CC[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)C2 ZINC001171551552 1051163537 /nfs/dbraw/zinc/16/35/37/1051163537.db2.gz QDVLNEKMPPKGBG-HXUWFJFHSA-N 1 0 320.480 4.242 20 10 DICDRO CCC(C)(C)CC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000744402675 1051171710 /nfs/dbraw/zinc/17/17/10/1051171710.db2.gz PKXXQFVQDVJYGV-KRWDZBQOSA-N 1 0 305.462 4.200 20 10 DICDRO CO[C@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)C(C)(C)C ZINC000744447769 1051178378 /nfs/dbraw/zinc/17/83/78/1051178378.db2.gz BWBKTVRNUWEJOH-LJQANCHMSA-N 1 0 313.441 4.210 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)Cc1ccccc1Cl ZINC001170288468 1051180870 /nfs/dbraw/zinc/18/08/70/1051180870.db2.gz OSAIWGYONNNOOC-AWEZNQCLSA-N 1 0 303.833 4.499 20 10 DICDRO CN(C)c1ccc(C[NH2+]Cc2ccccc2)c(C(F)(F)F)c1 ZINC000792887560 1051223413 /nfs/dbraw/zinc/22/34/13/1051223413.db2.gz AKPJNXZILPHDJU-UHFFFAOYSA-N 1 0 308.347 4.061 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC000792985118 1051234868 /nfs/dbraw/zinc/23/48/68/1051234868.db2.gz VKUMWEVGOYTHTL-QWHCGFSZSA-N 1 0 319.832 4.336 20 10 DICDRO CC[C@H](CSC)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000793038731 1051238138 /nfs/dbraw/zinc/23/81/38/1051238138.db2.gz SPYXNSFUGVIXJD-GFCCVEGCSA-N 1 0 320.424 4.003 20 10 DICDRO COC[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)c1ccco1 ZINC000747099534 1051238597 /nfs/dbraw/zinc/23/85/97/1051238597.db2.gz FKEDOESGUIATRG-GOSISDBHSA-N 1 0 323.392 4.130 20 10 DICDRO C[C@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@H](C2CC2)O1 ZINC000793214806 1051260809 /nfs/dbraw/zinc/26/08/09/1051260809.db2.gz RHKXYUZWZXHZCG-YCRPNKLZSA-N 1 0 323.436 4.059 20 10 DICDRO COc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccc(C)cc2C)C1 ZINC000793232494 1051265847 /nfs/dbraw/zinc/26/58/47/1051265847.db2.gz NAJIEFFUDQCEAE-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO CCC[C@@H]([NH2+]Cc1cc(C)c(C)cc1O)[C@H](O)c1ccccc1 ZINC000793236755 1051267838 /nfs/dbraw/zinc/26/78/38/1051267838.db2.gz DJYIYBXYQGSGPH-UYAOXDASSA-N 1 0 313.441 4.001 20 10 DICDRO CCCN(CCC)c1ccc(C[N@@H+]2CCC[C@](C)(O)CC2)cc1 ZINC000793252105 1051273633 /nfs/dbraw/zinc/27/36/33/1051273633.db2.gz XETDQIPQIGATCS-FQEVSTJZSA-N 1 0 318.505 4.050 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000793309125 1051279015 /nfs/dbraw/zinc/27/90/15/1051279015.db2.gz LAKWDWHYBNEWAW-MRXNPFEDSA-N 1 0 305.780 4.352 20 10 DICDRO Cc1ccncc1C[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000793338866 1051286273 /nfs/dbraw/zinc/28/62/73/1051286273.db2.gz HNNXZVUWMSHWHZ-UHFFFAOYSA-N 1 0 318.420 4.395 20 10 DICDRO CCCOc1ccc(C(C)(C)[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000793383578 1051294692 /nfs/dbraw/zinc/29/46/92/1051294692.db2.gz PKZHJMKHFAUBPG-UHFFFAOYSA-N 1 0 317.404 4.345 20 10 DICDRO CC[C@@H](C[NH2+][C@H](C)c1cc(OC)ccc1O)CC(F)(F)F ZINC000402560955 1051308512 /nfs/dbraw/zinc/30/85/12/1051308512.db2.gz JMLNTLFLTUWRCH-GHMZBOCLSA-N 1 0 305.340 4.030 20 10 DICDRO CC1(C)CC[C@@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000793536694 1051311357 /nfs/dbraw/zinc/31/13/57/1051311357.db2.gz ULNHCZYBWRWNOP-CJNGLKHVSA-N 1 0 324.415 4.035 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@H]1CSc2ccccc2C1 ZINC001172200032 1051326340 /nfs/dbraw/zinc/32/63/40/1051326340.db2.gz GZVSHVRGTCSUAU-GOSISDBHSA-N 1 0 321.445 4.352 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]Cc1ccc(OC2CCCC2)cc1 ZINC000793624090 1051328473 /nfs/dbraw/zinc/32/84/73/1051328473.db2.gz LGCRVZMBQJQAIA-UHFFFAOYSA-N 1 0 315.388 4.143 20 10 DICDRO CC[C@H](C)OCC[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001172314248 1051338258 /nfs/dbraw/zinc/33/82/58/1051338258.db2.gz CENUNKFGCQOUDD-MSOLQXFVSA-N 1 0 318.505 4.360 20 10 DICDRO CSC(C)(C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766362586 1051409225 /nfs/dbraw/zinc/40/92/25/1051409225.db2.gz WTLUWLUXNXRHOP-OAHLLOKOSA-N 1 0 306.519 4.469 20 10 DICDRO CC[C@@H]([NH2+]CC1(CC)CCOCC1)c1ccc(N(C)C)cc1 ZINC000766381048 1051409822 /nfs/dbraw/zinc/40/98/22/1051409822.db2.gz FYRBEVBYVOVJTD-GOSISDBHSA-N 1 0 304.478 4.000 20 10 DICDRO CCCCCC[C@@H](CCCC)[NH2+]C[C@@H](O)c1ccc(O)c(O)c1 ZINC001172510485 1051426644 /nfs/dbraw/zinc/42/66/44/1051426644.db2.gz CYHGFPHDRQYJPV-VQIMIIECSA-N 1 0 323.477 4.250 20 10 DICDRO CCCC[C@@H](CC)C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC001168802296 1051441344 /nfs/dbraw/zinc/44/13/44/1051441344.db2.gz XPEGSIWRGRRIOM-ZWKOTPCHSA-N 1 0 318.505 4.390 20 10 DICDRO COC(C)(C)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766583110 1051514441 /nfs/dbraw/zinc/51/44/41/1051514441.db2.gz BDTNTPGWYPRCHB-MRXNPFEDSA-N 1 0 304.478 4.143 20 10 DICDRO C[C@@H](Cc1c(F)cccc1Cl)[NH2+]Cc1ccc(N(C)C)cc1 ZINC001172851152 1051536997 /nfs/dbraw/zinc/53/69/97/1051536997.db2.gz GISHQYWCEIWVPK-ZDUSSCGKSA-N 1 0 320.839 4.266 20 10 DICDRO CCCOC1CCC([NH2+]Cc2cc3ccccc3cc2O)CC1 ZINC001173094625 1051599298 /nfs/dbraw/zinc/59/92/98/1051599298.db2.gz PWXFHGPNJJUAAZ-UHFFFAOYSA-N 1 0 313.441 4.373 20 10 DICDRO C[C@H](c1cccc(Br)c1)[N@H+](C)Cc1ccccc1O ZINC000766885237 1051732300 /nfs/dbraw/zinc/73/23/00/1051732300.db2.gz LDLYTORTZDKFAV-GFCCVEGCSA-N 1 0 320.230 4.348 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1cccc(Cl)c1[O-] ZINC000806136665 1051737325 /nfs/dbraw/zinc/73/73/25/1051737325.db2.gz BBNFWTMNJTYZNQ-YOEHRIQHSA-N 1 0 324.896 4.207 20 10 DICDRO CC[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc(Cl)c1[O-] ZINC000806128655 1051743880 /nfs/dbraw/zinc/74/38/80/1051743880.db2.gz VFOZXQTVOXUDPW-HNNXBMFYSA-N 1 0 324.896 4.396 20 10 DICDRO CC[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1cccc(Cl)c1[O-] ZINC000806129809 1051744227 /nfs/dbraw/zinc/74/42/27/1051744227.db2.gz KCZWSBJHQSJVBG-KRWDZBQOSA-N 1 0 324.896 4.207 20 10 DICDRO CC[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc(Cl)c1[O-] ZINC000806128656 1051744442 /nfs/dbraw/zinc/74/44/42/1051744442.db2.gz VFOZXQTVOXUDPW-OAHLLOKOSA-N 1 0 324.896 4.396 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC1(C)C)c1ccc(N2CCOCC2)cc1Cl ZINC000806169365 1051745644 /nfs/dbraw/zinc/74/56/44/1051745644.db2.gz KQJOCWJTOBVOKD-GUYCJALGSA-N 1 0 322.880 4.016 20 10 DICDRO C[C@H]([NH2+]CCC1(F)CCC1)c1cc(Br)ccc1O ZINC000806173954 1051745981 /nfs/dbraw/zinc/74/59/81/1051745981.db2.gz PMTZDNLEVVKURV-JTQLQIEISA-N 1 0 316.214 4.088 20 10 DICDRO CC[C@@H]1CC[C@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000806141089 1051748019 /nfs/dbraw/zinc/74/80/19/1051748019.db2.gz FZRLXIGEKZAWRD-CKEIUWERSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c(C)o1 ZINC000767383644 1051800074 /nfs/dbraw/zinc/80/00/74/1051800074.db2.gz QARMIXWMXXKXPV-UHFFFAOYSA-N 1 0 312.457 4.423 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)C[C@H](C)O1 ZINC000767427247 1051807490 /nfs/dbraw/zinc/80/74/90/1051807490.db2.gz XLOONKLUNQHPQP-CCWDJLKJSA-N 1 0 311.425 4.105 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)cc1Cl ZINC000767690526 1051837692 /nfs/dbraw/zinc/83/76/92/1051837692.db2.gz OQOMZGSSPXQUKK-UHFFFAOYSA-N 1 0 302.849 4.313 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2c(c1)CCCO2 ZINC000768102497 1051881157 /nfs/dbraw/zinc/88/11/57/1051881157.db2.gz RYMVRUQXJCSHBX-LJQANCHMSA-N 1 0 323.436 4.187 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2c(c1)CCCO2 ZINC000768102496 1051882252 /nfs/dbraw/zinc/88/22/52/1051882252.db2.gz RYMVRUQXJCSHBX-IBGZPJMESA-N 1 0 323.436 4.187 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2ncccc2c1 ZINC000768134072 1051888154 /nfs/dbraw/zinc/88/81/54/1051888154.db2.gz OWDFTAGGNDWYHI-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO CCc1ncc(C[N@@H+](C)Cc2ccc(N(CC)CC)cc2)s1 ZINC000768207303 1051897311 /nfs/dbraw/zinc/89/73/11/1051897311.db2.gz BKMGZNLBQNEQNU-UHFFFAOYSA-N 1 0 317.502 4.184 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(Cl)ccc2O)cc1 ZINC000768237596 1051906905 /nfs/dbraw/zinc/90/69/05/1051906905.db2.gz QYAQELHEPDBJOP-GFCCVEGCSA-N 1 0 305.805 4.247 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000768227676 1051907728 /nfs/dbraw/zinc/90/77/28/1051907728.db2.gz UZOISPHJURSHSF-GOSISDBHSA-N 1 0 315.388 4.267 20 10 DICDRO Cc1ccc(O)c(C[N@@H+](C)Cc2ccccc2C(F)(F)F)c1 ZINC000768235591 1051907976 /nfs/dbraw/zinc/90/79/76/1051907976.db2.gz ANMGJMDBSPCWGU-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccccc2F)c1 ZINC000768263397 1051912012 /nfs/dbraw/zinc/91/20/12/1051912012.db2.gz FQVDZXDKVZLQAX-CYBMUJFWSA-N 1 0 303.377 4.123 20 10 DICDRO CC[N@H+](Cc1ccc(Cl)cc1)Cc1c(O)cccc1OC ZINC000768337658 1051919402 /nfs/dbraw/zinc/91/94/02/1051919402.db2.gz HZYPPFRVDDCFFX-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)COC2 ZINC000768353406 1051922346 /nfs/dbraw/zinc/92/23/46/1051922346.db2.gz TWPVTZOVLGBZRT-UHFFFAOYSA-N 1 0 324.468 4.193 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)c1 ZINC000768425370 1051928813 /nfs/dbraw/zinc/92/88/13/1051928813.db2.gz WMPJLRMSQHBKQQ-NRFANRHFSA-N 1 0 318.420 4.107 20 10 DICDRO CCc1cccc(C[NH2+]CCCCOCc2ccccc2)c1O ZINC000691453819 1051931439 /nfs/dbraw/zinc/93/14/39/1051931439.db2.gz OAIGVFCZSYRZDK-UHFFFAOYSA-N 1 0 313.441 4.041 20 10 DICDRO COc1cc(C[N@H+](Cc2cccc(F)c2)C2CC2)c(O)cc1C ZINC000768439252 1051932463 /nfs/dbraw/zinc/93/24/63/1051932463.db2.gz DZWQVICXZLKSGN-UHFFFAOYSA-N 1 0 315.388 4.013 20 10 DICDRO Oc1cc2c(cc1C[NH+]1CCC(c3ccccn3)CC1)CCCC2 ZINC000768463985 1051933398 /nfs/dbraw/zinc/93/33/98/1051933398.db2.gz YFHDETVDOJQKJA-UHFFFAOYSA-N 1 0 322.452 4.046 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)c(F)c1)[C@H](C)c1cccc(O)c1 ZINC000768872937 1051976204 /nfs/dbraw/zinc/97/62/04/1051976204.db2.gz MDLXAZVZCIBNMX-CQSZACIVSA-N 1 0 316.420 4.180 20 10 DICDRO Cc1ccc(O)c(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000768912377 1051981196 /nfs/dbraw/zinc/98/11/96/1051981196.db2.gz XKIKJVHHUVFPJB-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CCOc1cccc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)c1O ZINC000768935594 1051984157 /nfs/dbraw/zinc/98/41/57/1051984157.db2.gz CZVXMCYNBXLBRZ-IBGZPJMESA-N 1 0 323.436 4.443 20 10 DICDRO CN(C)c1ccccc1C[N@H+](C)Cc1c(O)ccc2ccccc21 ZINC000808235708 1051990186 /nfs/dbraw/zinc/99/01/86/1051990186.db2.gz CMNLXWZQGOOTAB-UHFFFAOYSA-N 1 0 320.436 4.243 20 10 DICDRO COc1cccc(C[N@H+](C)CCc2cccc3ccccc32)c1O ZINC000769191451 1052001699 /nfs/dbraw/zinc/00/16/99/1052001699.db2.gz ASUQXLPFWWUIHD-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO COc1ccc([C@H]2CC[N@H+](Cc3c(O)cccc3Cl)C2)cc1 ZINC000769236543 1052010706 /nfs/dbraw/zinc/01/07/06/1052010706.db2.gz BKMXSDXITYXHMM-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](CC)CCC(F)(F)F)cc1 ZINC000769225086 1052010772 /nfs/dbraw/zinc/01/07/72/1052010772.db2.gz ILZPWRQWECUPDO-UHFFFAOYSA-N 1 0 302.384 4.307 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)c1O ZINC000769233855 1052011549 /nfs/dbraw/zinc/01/15/49/1052011549.db2.gz QNTQAHSLDKBFIR-MRXNPFEDSA-N 1 0 311.425 4.089 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2c3ccccc3O[C@@H]2C)cc1 ZINC000808443591 1052022437 /nfs/dbraw/zinc/02/24/37/1052022437.db2.gz GNMLRYKJIGRNPZ-QRWLVFNGSA-N 1 0 310.441 4.145 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000769319703 1052023551 /nfs/dbraw/zinc/02/35/51/1052023551.db2.gz XKQLBQHGMAEDJT-LJQANCHMSA-N 1 0 310.441 4.098 20 10 DICDRO COc1cccc(O)c1C[NH+]1CCC(c2ccccc2C)CC1 ZINC000769326713 1052024853 /nfs/dbraw/zinc/02/48/53/1052024853.db2.gz MSKYPZGIVZGTPU-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)c(O)c1 ZINC000769381447 1052037462 /nfs/dbraw/zinc/03/74/62/1052037462.db2.gz OLLVCNYYNPWSBN-GFCCVEGCSA-N 1 0 320.458 4.057 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccc(F)c(F)c2)c1O ZINC000808681509 1052058857 /nfs/dbraw/zinc/05/88/57/1052058857.db2.gz ZAFQITJOOODUAP-JTQLQIEISA-N 1 0 311.759 4.483 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cccc(N(C)C)c2)c1O ZINC000808692639 1052060521 /nfs/dbraw/zinc/06/05/21/1052060521.db2.gz SIJNQPDYVLAZDD-ZDUSSCGKSA-N 1 0 318.848 4.271 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCc3c2cccc3O)c1O ZINC000808691994 1052060793 /nfs/dbraw/zinc/06/07/93/1052060793.db2.gz MMWWFXKIOCQNCU-BZNIZROVSA-N 1 0 317.816 4.398 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3O)c1O ZINC000808691992 1052061152 /nfs/dbraw/zinc/06/11/52/1052061152.db2.gz MMWWFXKIOCQNCU-BDJLRTHQSA-N 1 0 317.816 4.398 20 10 DICDRO Cc1cc(CC[NH2+]C2CC(C(F)F)C2)c(C)n1-c1ccccc1 ZINC000769492281 1052061214 /nfs/dbraw/zinc/06/12/14/1052061214.db2.gz ZCGWJIIOKHSPCK-UHFFFAOYSA-N 1 0 318.411 4.270 20 10 DICDRO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)c1 ZINC000769461821 1052061908 /nfs/dbraw/zinc/06/19/08/1052061908.db2.gz XKKOMDHPOREIBG-LJQANCHMSA-N 1 0 310.441 4.104 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cc(F)ccc2F)c1O ZINC000808692849 1052063062 /nfs/dbraw/zinc/06/30/62/1052063062.db2.gz VLLBAJJJUXRYHK-SNVBAGLBSA-N 1 0 311.759 4.483 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CCC1 ZINC000808703322 1052066343 /nfs/dbraw/zinc/06/63/43/1052066343.db2.gz WPUCYGJZCQSKDD-ZDUSSCGKSA-N 1 0 311.853 4.211 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c1O ZINC000808706330 1052068428 /nfs/dbraw/zinc/06/84/28/1052068428.db2.gz HDILQTDRKRCGSG-UKRRQHHQSA-N 1 0 323.864 4.496 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000769499976 1052070204 /nfs/dbraw/zinc/07/02/04/1052070204.db2.gz UEEVPGUGNHTKJD-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(C)(C)[C@H](O)C(C)C)c1O ZINC000808708536 1052070820 /nfs/dbraw/zinc/07/08/20/1052070820.db2.gz MRGBGWIOHZVBCT-MLGOLLRUSA-N 1 0 313.869 4.048 20 10 DICDRO COc1cccc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)c1O ZINC000769512650 1052071141 /nfs/dbraw/zinc/07/11/41/1052071141.db2.gz MQKYEBCQVMMNIW-KRWDZBQOSA-N 1 0 315.388 4.267 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC000769532944 1052075262 /nfs/dbraw/zinc/07/52/62/1052075262.db2.gz LQUDZLMKEPHJBZ-OAHLLOKOSA-N 1 0 317.816 4.007 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c1O ZINC000808719487 1052077702 /nfs/dbraw/zinc/07/77/02/1052077702.db2.gz XDOGWXCVAXRUIS-GHMZBOCLSA-N 1 0 303.780 4.440 20 10 DICDRO C[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccccc1)c1ccc2ccccc2c1O ZINC000808720363 1052078786 /nfs/dbraw/zinc/07/87/86/1052078786.db2.gz UDZLIBHRFCVCGW-AUSJPIAWSA-N 1 0 321.420 4.318 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1ccccc1)c1cc(Cl)ccc1O ZINC000808720831 1052080138 /nfs/dbraw/zinc/08/01/38/1052080138.db2.gz ZMBMHSQNSDLYLC-IWEFOYFVSA-N 1 0 319.832 4.208 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1COc2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000808728392 1052083637 /nfs/dbraw/zinc/08/36/37/1052083637.db2.gz QXAUMYNJZIZRGV-PBHICJAKSA-N 1 0 323.436 4.098 20 10 DICDRO C[C@H]([NH2+]C[C@H]1COc2ccccc21)c1cc2c(cc1O)CCCC2 ZINC000808728396 1052084302 /nfs/dbraw/zinc/08/43/02/1052084302.db2.gz QXAUMYNJZIZRGV-YOEHRIQHSA-N 1 0 323.436 4.098 20 10 DICDRO CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000769870536 1052122136 /nfs/dbraw/zinc/12/21/36/1052122136.db2.gz AQCNIESACYAPTN-AWEZNQCLSA-N 1 0 315.461 4.242 20 10 DICDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1OCc1ccc(N)cc1 ZINC001217851016 1052156523 /nfs/dbraw/zinc/15/65/23/1052156523.db2.gz WKDBPONRZYOEIN-FQEVSTJZSA-N 1 0 324.468 4.086 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CCCC[NH2+]C1 ZINC001217970392 1052177876 /nfs/dbraw/zinc/17/78/76/1052177876.db2.gz MNGSPSYEKWTEHR-YYZBOFOMSA-N 1 0 311.385 4.329 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CCC[NH2+]CC3)cc2)C=C1 ZINC001217998579 1052183591 /nfs/dbraw/zinc/18/35/91/1052183591.db2.gz AWYSMUDRVMNFMY-QGZVFWFLSA-N 1 0 311.385 4.329 20 10 DICDRO C[C@@H]1C[C@H](Oc2ccc(/N=N/c3ccc(N(C)C)cc3)cc2)C[NH2+]1 ZINC001218048199 1052188109 /nfs/dbraw/zinc/18/81/09/1052188109.db2.gz UDKUUDPUAUKHCP-OYYKLEPFSA-N 1 0 324.428 4.297 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@@H]3CO[C@@]4(CC[NH2+]C4)C3)cc2)cc1 ZINC001218127292 1052201107 /nfs/dbraw/zinc/20/11/07/1052201107.db2.gz FWFJGFPTEIJGTO-YTCPRFGJSA-N 1 0 323.396 4.002 20 10 DICDRO c1ccc(/N=N/c2c(O[C@H]3CC[NH2+]C3)ccc3ccccc32)nc1 ZINC001218180906 1052203721 /nfs/dbraw/zinc/20/37/21/1052203721.db2.gz DODKJGGKLMZAKW-RTDLDRDPSA-N 1 0 318.380 4.391 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3C[C@H]4CC[NH2+][C@@H]4C3)cc2)C=C1 ZINC001218250416 1052212598 /nfs/dbraw/zinc/21/25/98/1052212598.db2.gz MIPUTRGGAOBTSZ-UPRAQXHNSA-N 1 0 323.396 4.327 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@H]3C[C@H]4[NH2+]CC[C@H]4C3)cc2)C=C1 ZINC001218250414 1052213020 /nfs/dbraw/zinc/21/30/20/1052213020.db2.gz MIPUTRGGAOBTSZ-MJXNMMHHSA-N 1 0 323.396 4.327 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1C[C@H]2CC[NH2+][C@@H]2C1 ZINC001218253123 1052213363 /nfs/dbraw/zinc/21/33/63/1052213363.db2.gz WWBDZUKFDXCXTO-SEABELPKSA-N 1 0 323.396 4.327 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@@H]3C[C@H]4CC[NH2+][C@H]4C3)cc2)C=C1 ZINC001218250417 1052213487 /nfs/dbraw/zinc/21/34/87/1052213487.db2.gz MIPUTRGGAOBTSZ-ZNOIYHFQSA-N 1 0 323.396 4.327 20 10 DICDRO Cc1ccc(O[C@H]2C[NH2+]CC[C@H]2F)c(/N=N/c2ccccc2)c1 ZINC001218321290 1052225827 /nfs/dbraw/zinc/22/58/27/1052225827.db2.gz DZNSJZRWYDBPAP-GEBZCHDISA-N 1 0 313.376 4.489 20 10 DICDRO CN(C)c1ccc(/N=N/c2ccc(O[C@@H]3C=CC[NH2+]C3)cc2)cc1 ZINC001218332517 1052227002 /nfs/dbraw/zinc/22/70/02/1052227002.db2.gz CSURTEKTYXQUQH-XKXPVHLMSA-N 1 0 322.412 4.075 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@@H]1C[NH2+][C@@H]1C ZINC001218392224 1052233705 /nfs/dbraw/zinc/23/37/05/1052233705.db2.gz OXMXPGWWVFWDHO-FZKQIMNGSA-N 1 0 310.401 4.189 20 10 DICDRO C[C@@H]1C[NH2+]CC[C@@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218417338 1052237786 /nfs/dbraw/zinc/23/77/86/1052237786.db2.gz VROMSNQEMRXWGD-XWEZPQROSA-N 1 0 311.385 4.184 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@@H]3CC[C@@H]4C[NH2+]C[C@@H]34)cc2)cc1 ZINC001218459929 1052242091 /nfs/dbraw/zinc/24/20/91/1052242091.db2.gz IXZMRLQVUXCXSA-OUPRIMKKSA-N 1 0 307.397 4.479 20 10 DICDRO C[C@@H]1CC[NH2+]C[C@@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218483068 1052245889 /nfs/dbraw/zinc/24/58/89/1052245889.db2.gz SASCNZLHKRDQRI-SYKDWPAJSA-N 1 0 311.385 4.184 20 10 DICDRO Cc1ccccc1/N=N/c1ccc(NC(=O)[C@@H](C)C[NH3+])c(C)c1 ZINC001219205896 1052276854 /nfs/dbraw/zinc/27/68/54/1052276854.db2.gz OKQZUPBXLWZLNZ-OXBTWTFQSA-N 1 0 310.401 4.252 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1F)c1ccc(N(C)C)cc1 ZINC000315409076 1052337895 /nfs/dbraw/zinc/33/78/95/1052337895.db2.gz IQJQZKFNJFXFKP-CHWSQXEVSA-N 1 0 304.384 4.443 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2cccc(OC(C)C)c2)c1O ZINC000237235976 1052437060 /nfs/dbraw/zinc/43/70/60/1052437060.db2.gz JBCNOWWFNOYRRZ-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO Cc1ccccc1C(C)(C)C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001649024891 1052530518 /nfs/dbraw/zinc/53/05/18/1052530518.db2.gz DKZAABZSADQBAA-UHFFFAOYSA-N 1 0 309.453 4.387 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)Cc2ccc3ccccc3c2)c1O ZINC000916568132 1052617334 /nfs/dbraw/zinc/61/73/34/1052617334.db2.gz CVDJXJFMAMBMEK-UHFFFAOYSA-N 1 0 321.420 4.494 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cc1F ZINC000763396395 1052623002 /nfs/dbraw/zinc/62/30/02/1052623002.db2.gz STWBILSCLRIEBQ-QGZVFWFLSA-N 1 0 318.823 4.322 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccc(F)cc2C)cc1 ZINC000321128840 1052634652 /nfs/dbraw/zinc/63/46/52/1052634652.db2.gz CZCFKCSSDXGUSI-UHFFFAOYSA-N 1 0 314.448 4.313 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H](OC)c2ccccc2)cc1 ZINC000918749297 1052829629 /nfs/dbraw/zinc/82/96/29/1052829629.db2.gz RUGZZWOZVRHBCY-FQEVSTJZSA-N 1 0 312.457 4.010 20 10 DICDRO CC[C@@H](C)[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000920183773 1052926341 /nfs/dbraw/zinc/92/63/41/1052926341.db2.gz WYNQFMCFTYVSJM-CABCVRRESA-N 1 0 319.449 4.109 20 10 DICDRO C[C@@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(N2CCCCC2)cc1 ZINC000180258428 1053052083 /nfs/dbraw/zinc/05/20/83/1053052083.db2.gz RIDYYBFNYYIWDU-YLJYHZDGSA-N 1 0 316.489 4.287 20 10 DICDRO C[C@@H]([NH2+]C1CCSCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000180510655 1053064516 /nfs/dbraw/zinc/06/45/16/1053064516.db2.gz XVCOYHZAWWNOKG-CQSZACIVSA-N 1 0 322.493 4.362 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1c(F)cc(F)cc1F ZINC001350944252 1053121364 /nfs/dbraw/zinc/12/13/64/1053121364.db2.gz OJWQXGLVYHFYDS-ZUZCIYMTSA-N 1 0 321.342 4.456 20 10 DICDRO C[C@@H]([NH2+]CCC1CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC001319767349 1053272013 /nfs/dbraw/zinc/27/20/13/1053272013.db2.gz VXGJGIJOERDRRA-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H](CCO)C1CCCCC1 ZINC001320124813 1053308226 /nfs/dbraw/zinc/30/82/26/1053308226.db2.gz MOSRYFVXIFNIAF-DJIMGWMZSA-N 1 0 317.473 4.170 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1CCOc2ccccc21 ZINC001320118662 1053308624 /nfs/dbraw/zinc/30/86/24/1053308624.db2.gz OQYTUQFMHVAGLS-BFYDXBDKSA-N 1 0 323.436 4.405 20 10 DICDRO CSc1cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)ccn1 ZINC001320119062 1053308687 /nfs/dbraw/zinc/30/86/87/1053308687.db2.gz VWTUZBWRUKURHT-OCCSQVGLSA-N 1 0 314.454 4.156 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)C(C)C ZINC001320119086 1053308721 /nfs/dbraw/zinc/30/87/21/1053308721.db2.gz WLLVPDFJYUNFTK-ZMSDIMECSA-N 1 0 305.462 4.290 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)cc1 ZINC001320121426 1053308865 /nfs/dbraw/zinc/30/88/65/1053308865.db2.gz AVMKENWDYXPWFP-RHSMWYFYSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@@H](C)c3c1c(O)ccc3C)CO2 ZINC001320134699 1053310218 /nfs/dbraw/zinc/31/02/18/1053310218.db2.gz ZMEWGUFRPVFHNT-FVQBIDKESA-N 1 0 309.409 4.281 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CN(C)Cc2ccccc21 ZINC001320132214 1053310938 /nfs/dbraw/zinc/31/09/38/1053310938.db2.gz IUOHLIXNPARITI-FHLIZLRMSA-N 1 0 322.452 4.025 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC001320260383 1053320087 /nfs/dbraw/zinc/32/00/87/1053320087.db2.gz UTLSQSVBKYDNLF-BZPMIXESSA-N 1 0 316.470 4.407 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC001320411888 1053334127 /nfs/dbraw/zinc/33/41/27/1053334127.db2.gz XBGYMUWJHAVLJS-IIAWOOMASA-N 1 0 313.445 4.377 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001320763266 1053360567 /nfs/dbraw/zinc/36/05/67/1053360567.db2.gz GVFJAFOUSZSHLU-SWLSCSKDSA-N 1 0 315.388 4.186 20 10 DICDRO CC1CCC(C)([NH2+]Cc2c(O)cccc2Br)CC1 ZINC001200127002 1053399950 /nfs/dbraw/zinc/39/99/50/1053399950.db2.gz NDIDQJFVUUYQFQ-UHFFFAOYSA-N 1 0 312.251 4.213 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCC2)c1cc(Cl)ccc1O ZINC001321022758 1053383074 /nfs/dbraw/zinc/38/30/74/1053383074.db2.gz IDKYAWOEDMIDCM-GFCCVEGCSA-N 1 0 301.817 4.385 20 10 DICDRO CC(C)([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccs1 ZINC001321893850 1053440755 /nfs/dbraw/zinc/44/07/55/1053440755.db2.gz CKZCOBZYUXXOOQ-UHFFFAOYSA-N 1 0 300.471 4.373 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H](C)c1c(F)cncc1F ZINC001322453024 1053506132 /nfs/dbraw/zinc/50/61/32/1053506132.db2.gz USQPVSRMPNGRCW-JTNHKYCSSA-N 1 0 318.367 4.273 20 10 DICDRO CCC[N@H+](Cc1ncc(C(C)C)s1)Cc1ccccc1O ZINC000183026860 1053569941 /nfs/dbraw/zinc/56/99/41/1053569941.db2.gz QJKDLKCOYBSBRX-UHFFFAOYSA-N 1 0 304.459 4.384 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@@H]3CCCC[C@@]32c2ccccc2)c1O ZINC001323331051 1053574685 /nfs/dbraw/zinc/57/46/85/1053574685.db2.gz NOFOLGIKWWUIDW-GHTZIAJQSA-N 1 0 323.436 4.302 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H]3CCCC[C@@]32c2ccccc2)c1O ZINC001323331065 1053574754 /nfs/dbraw/zinc/57/47/54/1053574754.db2.gz NOFOLGIKWWUIDW-WIYYLYMNSA-N 1 0 323.436 4.302 20 10 DICDRO CCOCCC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001323829888 1053603309 /nfs/dbraw/zinc/60/33/09/1053603309.db2.gz NDWLOLDSCIZYRO-LSDHHAIUSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCc1ccc(Cl)nc1 ZINC001323832262 1053605532 /nfs/dbraw/zinc/60/55/32/1053605532.db2.gz UZELXZVCLBBJMW-TZMCWYRMSA-N 1 0 316.832 4.130 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)o1 ZINC001324348101 1053645798 /nfs/dbraw/zinc/64/57/98/1053645798.db2.gz FWCLWHBVBWJZJS-JSGCOSHPSA-N 1 0 314.429 4.288 20 10 DICDRO CS[C@H]1CC[C@@H]([N@H+](C)Cc2ccc3ccccc3c2O)C1 ZINC001324337988 1053645829 /nfs/dbraw/zinc/64/58/29/1053645829.db2.gz XTDABIRCPFSYAY-CVEARBPZSA-N 1 0 301.455 4.261 20 10 DICDRO CS[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001324749111 1053677983 /nfs/dbraw/zinc/67/79/83/1053677983.db2.gz DJYLSJPXVQJKIJ-ROUUACIJSA-N 1 0 304.503 4.003 20 10 DICDRO Oc1cccc(Br)c1C[NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC001200485330 1053695147 /nfs/dbraw/zinc/69/51/47/1053695147.db2.gz CTMKEGCDVZWGCD-JHJVBQTASA-N 1 0 324.262 4.213 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC[C@H]1CCO[C@H](C)C1 ZINC001325357208 1053717330 /nfs/dbraw/zinc/71/73/30/1053717330.db2.gz PZWNMZZFSFVOHY-WCVJEAGWSA-N 1 0 303.446 4.044 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CCC3(CCOCC3)CC2)c(Cl)c1 ZINC001325580869 1053722149 /nfs/dbraw/zinc/72/21/49/1053722149.db2.gz DTMJMVXMXPUWAC-UHFFFAOYSA-N 1 0 323.864 4.183 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC(C)(C)OCC1CC1 ZINC001325572999 1053722297 /nfs/dbraw/zinc/72/22/97/1053722297.db2.gz DQUANUVQSAFOIP-UKRRQHHQSA-N 1 0 303.446 4.044 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC(C)(C)OCC1CC1 ZINC001325572997 1053722947 /nfs/dbraw/zinc/72/29/47/1053722947.db2.gz DQUANUVQSAFOIP-HIFRSBDPSA-N 1 0 303.446 4.044 20 10 DICDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001325724260 1053727217 /nfs/dbraw/zinc/72/72/17/1053727217.db2.gz WMVFNJSZOTUENY-HXUWFJFHSA-N 1 0 309.457 4.265 20 10 DICDRO CC1(C)CCC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001231465451 1053758446 /nfs/dbraw/zinc/75/84/46/1053758446.db2.gz AZWWBJAQDRNZAE-UHFFFAOYSA-N 1 0 311.425 4.346 20 10 DICDRO Oc1ccc2ccccc2c1C[N@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001231586169 1053790499 /nfs/dbraw/zinc/79/04/99/1053790499.db2.gz CMFNDUYRVMZYJP-OKILXGFUSA-N 1 0 303.352 4.023 20 10 DICDRO COc1cccc(CC[N@H+](C)Cc2c(O)ccc3ccccc32)c1 ZINC001231590063 1053792015 /nfs/dbraw/zinc/79/20/15/1053792015.db2.gz HRZAPXKJJXZVQS-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO C[N@H+](CC/C=C/c1cccnc1)Cc1c(O)ccc2ccccc21 ZINC001231591196 1053792367 /nfs/dbraw/zinc/79/23/67/1053792367.db2.gz YCGKAKWNXLASPU-QPJJXVBHSA-N 1 0 318.420 4.476 20 10 DICDRO Cc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1O ZINC001231594695 1053792659 /nfs/dbraw/zinc/79/26/59/1053792659.db2.gz NPYVWKDNXHZUHQ-KRWDZBQOSA-N 1 0 303.352 4.316 20 10 DICDRO CC[N@H+](Cc1cccc(C)c1O)[C@@H](C)Cc1ccc(OC)cc1 ZINC001231590986 1053793445 /nfs/dbraw/zinc/79/34/45/1053793445.db2.gz NCUFVZMELIMFBF-INIZCTEOSA-N 1 0 313.441 4.162 20 10 DICDRO Cc1cccc(C[NH+]2CCC(Cc3cccc(F)c3)CC2)c1O ZINC001231595304 1053795169 /nfs/dbraw/zinc/79/51/69/1053795169.db2.gz VWMPECSLDFPMCY-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC001200591435 1053796237 /nfs/dbraw/zinc/79/62/37/1053796237.db2.gz YHMQIKRLRWIMID-IEBWSBKVSA-N 1 0 304.437 4.208 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1cc(F)cnc1Cl ZINC001326621993 1053796427 /nfs/dbraw/zinc/79/64/27/1053796427.db2.gz BSDJKLUZRYJFAP-GXFFZTMASA-N 1 0 320.795 4.226 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC001200591434 1053797194 /nfs/dbraw/zinc/79/71/94/1053797194.db2.gz YHMQIKRLRWIMID-HKUYNNGSSA-N 1 0 304.437 4.208 20 10 DICDRO CC[N@H+](Cc1coc(-c2ccccc2)n1)Cc1ccccc1O ZINC001231632192 1053810986 /nfs/dbraw/zinc/81/09/86/1053810986.db2.gz HMWWDFMWLHCEGB-UHFFFAOYSA-N 1 0 308.381 4.069 20 10 DICDRO COc1ccccc1C1([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001326970890 1053815105 /nfs/dbraw/zinc/81/51/05/1053815105.db2.gz LVLUSGBZMZTSOP-UHFFFAOYSA-N 1 0 322.452 4.074 20 10 DICDRO Cc1nc(C)c(C[NH2+][C@H](C)c2ccc3ccccc3c2O)s1 ZINC000273579517 1053850185 /nfs/dbraw/zinc/85/01/85/1053850185.db2.gz MHNVGJFMVNDNSN-LLVKDONJSA-N 1 0 312.438 4.470 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CC[C@H](OC)C1)c1ccc(C(F)(F)F)cc1O ZINC001327534003 1053862071 /nfs/dbraw/zinc/86/20/71/1053862071.db2.gz VHDXCCMCJNPPIM-DYEKYZERSA-N 1 0 317.351 4.019 20 10 DICDRO COc1ccccc1[C@H]1CC[N@H+](Cc2c(C)cc(C)cc2O)C1 ZINC001231843324 1053886490 /nfs/dbraw/zinc/88/64/90/1053886490.db2.gz VWRSDXBBPGYZRU-INIZCTEOSA-N 1 0 311.425 4.007 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@H+](Cc1ccccc1)C(C)C ZINC001231849234 1053890241 /nfs/dbraw/zinc/89/02/41/1053890241.db2.gz PFKJEDVACPJBTN-UHFFFAOYSA-N 1 0 312.457 4.172 20 10 DICDRO COc1cccc([C@H]2CC[N@H+](Cc3c(C)cc(C)cc3O)C2)c1 ZINC001231850961 1053890440 /nfs/dbraw/zinc/89/04/40/1053890440.db2.gz XSHWGAYSZVXDAL-KRWDZBQOSA-N 1 0 311.425 4.007 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC001231853691 1053890527 /nfs/dbraw/zinc/89/05/27/1053890527.db2.gz ZXNYFZQJNJFCLY-IBGZPJMESA-N 1 0 310.441 4.098 20 10 DICDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1c(C)cc(C)cc1O ZINC001231849956 1053892189 /nfs/dbraw/zinc/89/21/89/1053892189.db2.gz XYHIAPGGXJLYFB-MRXNPFEDSA-N 1 0 313.441 4.081 20 10 DICDRO Cc1cc(C)c(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c(O)c1 ZINC001231846825 1053892273 /nfs/dbraw/zinc/89/22/73/1053892273.db2.gz QIQIJBLAZSVXAU-GOSISDBHSA-N 1 0 313.466 4.299 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C)C(F)(F)CC2)cc1Cl ZINC001231867515 1053895408 /nfs/dbraw/zinc/89/54/08/1053895408.db2.gz LSPMOCJNHXOGCF-NSHDSACASA-N 1 0 303.780 4.221 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CC[C@H](F)C3)CC2)cc1Cl ZINC001231870169 1053897291 /nfs/dbraw/zinc/89/72/91/1053897291.db2.gz MCNBCENNIDAPAL-AWEZNQCLSA-N 1 0 311.828 4.458 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(Cl)c(C)cc1O ZINC001231870133 1053897833 /nfs/dbraw/zinc/89/78/33/1053897833.db2.gz LBPHXAKWUVCIMU-UHFFFAOYSA-N 1 0 305.805 4.082 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC3(CCC(=O)CC3)CC2)cc1Cl ZINC001231870130 1053898849 /nfs/dbraw/zinc/89/88/49/1053898849.db2.gz KXLRALZOIVETJN-UHFFFAOYSA-N 1 0 321.848 4.079 20 10 DICDRO Oc1c(C[N@@H+]2CCc3ccc(F)cc3C2)ccc2ccccc21 ZINC001231880361 1053901402 /nfs/dbraw/zinc/90/14/02/1053901402.db2.gz CNABWUVWMDSTRT-UHFFFAOYSA-N 1 0 307.368 4.243 20 10 DICDRO O=C1CCC2(CC1)CC[NH+](Cc1ccc3ccccc3c1O)CC2 ZINC001231881769 1053904140 /nfs/dbraw/zinc/90/41/40/1053904140.db2.gz BRAQFSWEMCCGQX-UHFFFAOYSA-N 1 0 323.436 4.271 20 10 DICDRO C[N@H+](CCC(=O)c1ccccc1)Cc1ccc2ccccc2c1O ZINC001231880602 1053906214 /nfs/dbraw/zinc/90/62/14/1053906214.db2.gz KAVNBYVPOWCWMB-UHFFFAOYSA-N 1 0 319.404 4.250 20 10 DICDRO CCCC[N@H+](CCC)Cc1ccc(N2CCOCC2)c(Cl)c1 ZINC001232197753 1053986079 /nfs/dbraw/zinc/98/60/79/1053986079.db2.gz BYJSPDCDPFTAIX-UHFFFAOYSA-N 1 0 324.896 4.189 20 10 DICDRO Cc1cnc(C2CC[NH+](Cc3c(O)cccc3Cl)CC2)s1 ZINC000763675017 1053994384 /nfs/dbraw/zinc/99/43/84/1053994384.db2.gz MEPNPJWZPAGVBH-UHFFFAOYSA-N 1 0 322.861 4.190 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)cc1 ZINC001329575441 1053997307 /nfs/dbraw/zinc/99/73/07/1053997307.db2.gz ZDSJDPNXUSCYSB-JSQNDZKTSA-N 1 0 308.416 4.227 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccc(F)cc1 ZINC001329674779 1054003954 /nfs/dbraw/zinc/00/39/54/1054003954.db2.gz JVRDINPBSLSVRG-WBMJQRKESA-N 1 0 303.377 4.342 20 10 DICDRO Oc1cc(O)c(C[NH+]2CCC(c3ccccc3)CC2)cc1Cl ZINC001232257959 1054004597 /nfs/dbraw/zinc/00/45/97/1054004597.db2.gz NPYGAGZWMQSWAK-UHFFFAOYSA-N 1 0 317.816 4.131 20 10 DICDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1cc(Cl)c(O)cc1O ZINC001232262392 1054005183 /nfs/dbraw/zinc/00/51/83/1054005183.db2.gz FUKYJUHJWPFMDO-HNNXBMFYSA-N 1 0 305.805 4.334 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CCc3ccccc3[C@H]2C)cc1Cl ZINC001232267141 1054005986 /nfs/dbraw/zinc/00/59/86/1054005986.db2.gz XPHCGQBDTVVGIY-GFCCVEGCSA-N 1 0 317.816 4.174 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)c(O)cc2O)c1 ZINC001232260828 1054007856 /nfs/dbraw/zinc/00/78/56/1054007856.db2.gz RSRLHIOMDZNXGT-INIZCTEOSA-N 1 0 317.816 4.397 20 10 DICDRO C[N@H+](Cc1ccc(Cl)cc1)Cc1cc(Cl)c(O)cc1O ZINC001232268758 1054008399 /nfs/dbraw/zinc/00/83/99/1054008399.db2.gz RDDVJLACDZXQNP-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO Oc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccccc2F)cc1Cl ZINC001232268752 1054011226 /nfs/dbraw/zinc/01/12/26/1054011226.db2.gz RBUCSHLODDFYTJ-HNNXBMFYSA-N 1 0 321.779 4.227 20 10 DICDRO Cc1cc(C[NH2+]Cc2c(C)n[nH]c2C)c(C)n1-c1cccc(C)c1 ZINC001331253545 1054066928 /nfs/dbraw/zinc/06/69/28/1054066928.db2.gz QFMAWVJCDHNEDU-UHFFFAOYSA-N 1 0 322.456 4.032 20 10 DICDRO CC1([NH2+]Cc2ccc(N3CCCC3)cc2)CCC(F)(F)CC1 ZINC001331497508 1054079277 /nfs/dbraw/zinc/07/92/77/1054079277.db2.gz MSXMSEMJSZFNAJ-UHFFFAOYSA-N 1 0 308.416 4.344 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)c(O)c1 ZINC001232834054 1054127196 /nfs/dbraw/zinc/12/71/96/1054127196.db2.gz FRFOEFJJGZPCHK-IBGZPJMESA-N 1 0 310.441 4.185 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccccc1F ZINC000848556413 1054148101 /nfs/dbraw/zinc/14/81/01/1054148101.db2.gz XHTURFUCFORLTB-MLGOLLRUSA-N 1 0 303.377 4.342 20 10 DICDRO C[C@H]([NH2+][C@@H](C1CC1)[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000848558828 1054148702 /nfs/dbraw/zinc/14/87/02/1054148702.db2.gz OBXUNZVUYRIHJF-JECHBYEQSA-N 1 0 309.837 4.044 20 10 DICDRO Oc1ccccc1C[NH2+]C1(c2cccc(OC(F)(F)F)c2)CC1 ZINC000848568319 1054154764 /nfs/dbraw/zinc/15/47/64/1054154764.db2.gz FTNRWNWWBXUYEB-UHFFFAOYSA-N 1 0 323.314 4.070 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC3(CCCC3)O2)c(O)c1C ZINC000848569557 1054156934 /nfs/dbraw/zinc/15/69/34/1054156934.db2.gz BHJOCQODCBLTIF-HOTGVXAUSA-N 1 0 303.446 4.151 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC3(CCCC3)O2)c(O)c1C ZINC000848569556 1054157304 /nfs/dbraw/zinc/15/73/04/1054157304.db2.gz BHJOCQODCBLTIF-CVEARBPZSA-N 1 0 303.446 4.151 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+](CC2CC2)C(C)C)c1O ZINC001233111100 1054187622 /nfs/dbraw/zinc/18/76/22/1054187622.db2.gz ZYPOKNWDABNKAN-UHFFFAOYSA-N 1 0 312.251 4.084 20 10 DICDRO Cc1cc(Br)cc(C[NH+]2CC3CCC(CC3)C2)c1O ZINC001233109662 1054189464 /nfs/dbraw/zinc/18/94/64/1054189464.db2.gz FHFXTLQMWGUAQM-UHFFFAOYSA-N 1 0 324.262 4.085 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]C1CC2(C1)COC(C)(C)C2 ZINC001334729920 1054196112 /nfs/dbraw/zinc/19/61/12/1054196112.db2.gz HKXGWGUJDVZRJX-UAWGMYSWSA-N 1 0 315.457 4.186 20 10 DICDRO CC[N@H+](Cc1csc(C(F)(F)F)c1)Cc1ccccc1O ZINC001233178046 1054197894 /nfs/dbraw/zinc/19/78/94/1054197894.db2.gz SWRZJIGYBDCICR-UHFFFAOYSA-N 1 0 315.360 4.495 20 10 DICDRO Nc1ccc(C[NH+]2CCC(c3cc4ccccc4[nH]3)CC2)cc1 ZINC001334773882 1054199560 /nfs/dbraw/zinc/19/95/60/1054199560.db2.gz AKMCQYFGAPSQGE-UHFFFAOYSA-N 1 0 305.425 4.130 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccncc3)C2)c1 ZINC001233286093 1054221224 /nfs/dbraw/zinc/22/12/24/1054221224.db2.gz FCDWJUFRSLXWBV-MRXNPFEDSA-N 1 0 310.441 4.074 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c1 ZINC001233284427 1054221792 /nfs/dbraw/zinc/22/17/92/1054221792.db2.gz UJIHYPLJPHNILX-DOMZBBRYSA-N 1 0 309.400 4.167 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1 ZINC001233286006 1054222378 /nfs/dbraw/zinc/22/23/78/1054222378.db2.gz APLRUZOPRDKBQP-GOSISDBHSA-N 1 0 310.441 4.422 20 10 DICDRO CC[N@H+](Cc1ccccc1F)Cc1cc(Cl)cc(OC)c1O ZINC001233290010 1054224236 /nfs/dbraw/zinc/22/42/36/1054224236.db2.gz CTJWNDJSPXJVRW-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO Clc1cscc1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001336961989 1054252598 /nfs/dbraw/zinc/25/25/98/1054252598.db2.gz RCXSIUQQMBGJKR-UHFFFAOYSA-N 1 0 306.862 4.292 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](CN2CCCC2)c2ccccc2)c(O)c1 ZINC000184919736 1054266687 /nfs/dbraw/zinc/26/66/87/1054266687.db2.gz ICUXCPGAMMFKMM-XLIONFOSSA-N 1 0 324.468 4.188 20 10 DICDRO C[N@H+](CCc1ccccc1)Cc1ccc(C(F)(F)F)cc1O ZINC001233451790 1054276318 /nfs/dbraw/zinc/27/63/18/1054276318.db2.gz ZJULDBGBMBVCGY-UHFFFAOYSA-N 1 0 309.331 4.086 20 10 DICDRO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)cc2O)CCC1(F)F ZINC001233451868 1054276390 /nfs/dbraw/zinc/27/63/90/1054276390.db2.gz CDIYMTCSUGYPLI-UHFFFAOYSA-N 1 0 323.305 4.278 20 10 DICDRO Cc1ccccc1C[N@@H+](C)Cc1ccc(C(F)(F)F)cc1O ZINC001233454192 1054276776 /nfs/dbraw/zinc/27/67/76/1054276776.db2.gz KPZRRYQIDOVYEV-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC001233452429 1054277377 /nfs/dbraw/zinc/27/73/77/1054277377.db2.gz WFJFBFQSLPCLSB-CQSZACIVSA-N 1 0 321.342 4.401 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1CC(c2ccccc2)C1 ZINC001233454768 1054277630 /nfs/dbraw/zinc/27/76/30/1054277630.db2.gz JPVDMTXWYJJIKH-UHFFFAOYSA-N 1 0 307.315 4.010 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc(N(C)C)cc1C ZINC001337784567 1054285404 /nfs/dbraw/zinc/28/54/04/1054285404.db2.gz CAIBIPDGSOQBAL-YJBOKZPZSA-N 1 0 324.468 4.413 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)c1O ZINC000848892612 1054285658 /nfs/dbraw/zinc/28/56/58/1054285658.db2.gz BUHMWSAOJSJENJ-GFCCVEGCSA-N 1 0 321.367 4.407 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC001337797715 1054286271 /nfs/dbraw/zinc/28/62/71/1054286271.db2.gz BWOXDENNNWYZNI-DGCLKSJQSA-N 1 0 314.454 4.373 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1COc2ccccc2C1 ZINC001337785302 1054286442 /nfs/dbraw/zinc/28/64/42/1054286442.db2.gz KJUGHVBPBJIIGM-HLLBOEOZSA-N 1 0 323.436 4.090 20 10 DICDRO C[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)c1cc(Cl)ccc1O ZINC001337800978 1054286528 /nfs/dbraw/zinc/28/65/28/1054286528.db2.gz OWLJXBMSTHEVOJ-CYBMUJFWSA-N 1 0 323.864 4.436 20 10 DICDRO CCc1cccc(C[NH2+][C@H](c2nc3ccccc3[nH]2)C(C)C)c1O ZINC000848894891 1054287418 /nfs/dbraw/zinc/28/74/18/1054287418.db2.gz NGPPEKUPTWBPTO-SFHVURJKSA-N 1 0 323.440 4.318 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1O ZINC000848897389 1054287786 /nfs/dbraw/zinc/28/77/86/1054287786.db2.gz HXJDKKNIMXLERE-CYBMUJFWSA-N 1 0 314.385 4.022 20 10 DICDRO CCc1cccc(C[NH2+][C@H](C)c2cccc(N3CCCC3)c2)c1O ZINC000848899464 1054289663 /nfs/dbraw/zinc/28/96/63/1054289663.db2.gz ONDGHWDCRBVHPF-MRXNPFEDSA-N 1 0 324.468 4.406 20 10 DICDRO CCc1cccc(C[NH+]2CCC(c3ccc(C)nc3)CC2)c1O ZINC000848901831 1054289693 /nfs/dbraw/zinc/28/96/93/1054289693.db2.gz DPQBYSIXMFAIMS-UHFFFAOYSA-N 1 0 310.441 4.038 20 10 DICDRO Cc1cc(Br)cc([C@H](C)[NH2+]CCCC(F)F)c1O ZINC001339193527 1054329860 /nfs/dbraw/zinc/32/98/60/1054329860.db2.gz JGXBTEBUMWRFFX-VIFPVBQESA-N 1 0 322.193 4.159 20 10 DICDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)o1 ZINC001339510334 1054340281 /nfs/dbraw/zinc/34/02/81/1054340281.db2.gz UBVAGHONCCLCMN-INIZCTEOSA-N 1 0 312.457 4.299 20 10 DICDRO C[C@]1(F)CCCC[N@H+](Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233726791 1054343663 /nfs/dbraw/zinc/34/36/63/1054343663.db2.gz HWCDQIFPNWFQJW-AWEZNQCLSA-N 1 0 321.314 4.005 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)cccc1OC(F)(F)F ZINC001233761116 1054353007 /nfs/dbraw/zinc/35/30/07/1054353007.db2.gz QBFWVSUVCFCYKA-AAEUAGOBSA-N 1 0 315.335 4.055 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC1(c2ccccn2)CCC1 ZINC001340993259 1054374067 /nfs/dbraw/zinc/37/40/67/1054374067.db2.gz ZDQFNQAEPZDOAX-HZPDHXFCSA-N 1 0 322.452 4.355 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001342409739 1054420971 /nfs/dbraw/zinc/42/09/71/1054420971.db2.gz WVXDPPAGNSNDFT-LALPHHSUSA-N 1 0 314.429 4.247 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C)C1CCOCC1 ZINC001342407409 1054421631 /nfs/dbraw/zinc/42/16/31/1054421631.db2.gz QDKLNYNZIMSKTD-KBMXLJTQSA-N 1 0 303.446 4.044 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2cccc(C(F)F)c2)c(O)c1 ZINC001343279987 1054441098 /nfs/dbraw/zinc/44/10/98/1054441098.db2.gz JBDLOPPHBCQRMJ-UHFFFAOYSA-N 1 0 307.340 4.018 20 10 DICDRO CCN(CC)[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccco1 ZINC000185227815 1054482323 /nfs/dbraw/zinc/48/23/23/1054482323.db2.gz UNJBHHKFIQPOIQ-RDJZCZTQSA-N 1 0 316.445 4.027 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2nc(C(C)(C)C)cs2)c1 ZINC000185373762 1054530788 /nfs/dbraw/zinc/53/07/88/1054530788.db2.gz LLRWFGCWLNGJAY-CYBMUJFWSA-N 1 0 318.486 4.348 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@@](C)(F)CC3)c2c1 ZINC001234525414 1054542485 /nfs/dbraw/zinc/54/24/85/1054542485.db2.gz GKKVGQLFRUMNNS-LJQANCHMSA-N 1 0 317.404 4.268 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@H](C(F)F)C3)c2c1 ZINC001234552626 1054547669 /nfs/dbraw/zinc/54/76/69/1054547669.db2.gz CGWHOFPNISAMJO-ZDUSSCGKSA-N 1 0 321.367 4.031 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F)c1cc2c(cc1O)CCCC2 ZINC001346860727 1054551585 /nfs/dbraw/zinc/55/15/85/1054551585.db2.gz PPHXPXNSDSGWSB-WQFMGJDKSA-N 1 0 321.411 4.355 20 10 DICDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185501522 1054556283 /nfs/dbraw/zinc/55/62/83/1054556283.db2.gz YRLNNBWXNDJLSU-QWHCGFSZSA-N 1 0 324.424 4.432 20 10 DICDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185564586 1054583310 /nfs/dbraw/zinc/58/33/10/1054583310.db2.gz SYJLOWRNFFTIKR-ZIAGYGMSSA-N 1 0 301.430 4.400 20 10 DICDRO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185567185 1054583681 /nfs/dbraw/zinc/58/36/81/1054583681.db2.gz QFSLEAAXCYBSJR-WDEREUQCSA-N 1 0 307.340 4.091 20 10 DICDRO COC1CCN(c2ccc(C[N@H+](CC(C)C)C(C)C)cc2)CC1 ZINC001347825949 1054587871 /nfs/dbraw/zinc/58/78/71/1054587871.db2.gz PMNBHHJTXIJEQB-UHFFFAOYSA-N 1 0 318.505 4.168 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCCCC(=O)OC(C)(C)C)c1 ZINC000185597283 1054593359 /nfs/dbraw/zinc/59/33/59/1054593359.db2.gz ZRMBOUHHSYVPLH-OAHLLOKOSA-N 1 0 321.461 4.253 20 10 DICDRO CC(C)C[C@H](CCO)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185615083 1054598995 /nfs/dbraw/zinc/59/89/95/1054598995.db2.gz ZSAMJCJHMBHFDT-HOTGVXAUSA-N 1 0 315.457 4.241 20 10 DICDRO C[N@H+](CCC(F)(F)F)Cc1ccc(N2CCCCC2)cc1 ZINC000072981013 1054602199 /nfs/dbraw/zinc/60/21/99/1054602199.db2.gz CAGQGBOUJNLRGV-UHFFFAOYSA-N 1 0 300.368 4.061 20 10 DICDRO CCS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cc(OC)ccc2O)C1 ZINC000185644662 1054606663 /nfs/dbraw/zinc/60/66/63/1054606663.db2.gz LNFBVQYWVZTRJP-KCQAQPDRSA-N 1 0 309.475 4.116 20 10 DICDRO CCS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cc(OC)ccc2O)C1 ZINC000185644697 1054606781 /nfs/dbraw/zinc/60/67/81/1054606781.db2.gz LNFBVQYWVZTRJP-GZBFAFLISA-N 1 0 309.475 4.116 20 10 DICDRO COCCC1(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CCC1 ZINC000185753242 1054633382 /nfs/dbraw/zinc/63/33/82/1054633382.db2.gz MOFVQGQFHKNXAA-HNNXBMFYSA-N 1 0 317.473 4.128 20 10 DICDRO CCCO[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234993446 1054636929 /nfs/dbraw/zinc/63/69/29/1054636929.db2.gz CRIJSQBPBNLBFV-GOSISDBHSA-N 1 0 311.425 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)cccc1-c1ccccc1 ZINC001234992670 1054637044 /nfs/dbraw/zinc/63/70/44/1054637044.db2.gz QGPVMRFLRPTRDI-PXNSSMCTSA-N 1 0 323.436 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)cccc1-c1ccccc1 ZINC001234996847 1054637773 /nfs/dbraw/zinc/63/77/73/1054637773.db2.gz NJUNWOMYZYCQRX-OAHLLOKOSA-N 1 0 321.342 4.443 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)cccc1-c1ccccc1 ZINC001234992677 1054638092 /nfs/dbraw/zinc/63/80/92/1054638092.db2.gz QGPVMRFLRPTRDI-YLJYHZDGSA-N 1 0 323.436 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@]3(C2)CCCCO3)cccc1-c1ccccc1 ZINC001235002318 1054640600 /nfs/dbraw/zinc/64/06/00/1054640600.db2.gz PAPNMNDWEFPKGO-OAQYLSRUSA-N 1 0 323.436 4.204 20 10 DICDRO Oc1c(C[N@@H+]2CCc3occc3C2)cccc1-c1ccccc1 ZINC001234999598 1054641769 /nfs/dbraw/zinc/64/17/69/1054641769.db2.gz XDPILPANBCYTFY-UHFFFAOYSA-N 1 0 305.377 4.211 20 10 DICDRO C[N@H+](Cc1c[nH]c(-c2ccccc2F)c1)Cc1ccccc1O ZINC001235042465 1054645987 /nfs/dbraw/zinc/64/59/87/1054645987.db2.gz KSNDXHJVVQEWFW-UHFFFAOYSA-N 1 0 310.372 4.158 20 10 DICDRO CSc1ccccc1C[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC001473436368 1054714216 /nfs/dbraw/zinc/71/42/16/1054714216.db2.gz MDSTWAVNACPKCE-UHFFFAOYSA-N 1 0 314.498 4.415 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cc1F ZINC000921505251 1054724776 /nfs/dbraw/zinc/72/47/76/1054724776.db2.gz CWKXQLKZGPFGHK-CYBMUJFWSA-N 1 0 315.388 4.010 20 10 DICDRO CC(C)(C)c1ccc(C[NH+]2CCC3(CCCOC3)CC2)c(O)c1 ZINC001235677757 1054770215 /nfs/dbraw/zinc/77/02/15/1054770215.db2.gz HKKNEYTURBRERS-UHFFFAOYSA-N 1 0 317.473 4.082 20 10 DICDRO CCC[N@H+](Cc1ccc(C(C)(C)C)cc1O)C1CCOCC1 ZINC001235678007 1054771237 /nfs/dbraw/zinc/77/12/37/1054771237.db2.gz IIYUVKMWWUKKKA-UHFFFAOYSA-N 1 0 305.462 4.081 20 10 DICDRO CC(C)[N@H+](CCCCCO)Cc1ccc(C(C)(C)C)cc1O ZINC001235678398 1054773703 /nfs/dbraw/zinc/77/37/03/1054773703.db2.gz BHNMQNOGMMZZBC-UHFFFAOYSA-N 1 0 307.478 4.063 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c(O)c1 ZINC001235684719 1054777970 /nfs/dbraw/zinc/77/79/70/1054777970.db2.gz IOKKWJHILISKGH-SFHVURJKSA-N 1 0 310.441 4.422 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1ccc(C(C)(C)C)cc1O)C2 ZINC001235686046 1054779323 /nfs/dbraw/zinc/77/93/23/1054779323.db2.gz WTCAAKLLQROZPA-UHFFFAOYSA-N 1 0 311.425 4.214 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001235686065 1054779531 /nfs/dbraw/zinc/77/95/31/1054779531.db2.gz XAZWXJORGXWIQQ-CQSZACIVSA-N 1 0 315.379 4.464 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2OC2CCC2)c(O)c1 ZINC000186055608 1054870585 /nfs/dbraw/zinc/87/05/85/1054870585.db2.gz VOYUQRLQQXHVJF-OAHLLOKOSA-N 1 0 311.425 4.483 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC(C)(C)c3ccccc32)c1 ZINC000186138690 1054985682 /nfs/dbraw/zinc/98/56/82/1054985682.db2.gz IZCWAXQLOBVICG-UGSOOPFHSA-N 1 0 311.425 4.474 20 10 DICDRO Nc1ccc(C2CC[NH+](Cc3ccc(Cl)cc3O)CC2)cc1 ZINC001236335395 1055064249 /nfs/dbraw/zinc/06/42/49/1055064249.db2.gz OUMOLTHLPPFTNQ-UHFFFAOYSA-N 1 0 316.832 4.007 20 10 DICDRO Cc1cc(C)c(O)c(C[NH2+]C2(c3ccc(F)cc3F)CCC2)c1 ZINC000764124111 1055110756 /nfs/dbraw/zinc/11/07/56/1055110756.db2.gz PSTGPKQETMWDJG-UHFFFAOYSA-N 1 0 317.379 4.456 20 10 DICDRO C[C@@H]([NH2+]CCc1cccc2cccnc21)c1ccc(N(C)C)cc1 ZINC000325251937 1055117234 /nfs/dbraw/zinc/11/72/34/1055117234.db2.gz ZCLJHOPNGUQDFN-MRXNPFEDSA-N 1 0 319.452 4.194 20 10 DICDRO [NH3+][C@H]1CC[C@H]([N@H+](Cc2c([O-])cccc2Cl)C2CCCC2)CC1 ZINC001236571501 1055193851 /nfs/dbraw/zinc/19/38/51/1055193851.db2.gz HOCZAZJTHHYWQS-CTYIDZIISA-N 1 0 322.880 4.060 20 10 DICDRO Oc1ccc2ccccc2c1CN([C@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236652477 1055212472 /nfs/dbraw/zinc/21/24/72/1055212472.db2.gz IBTSTIONVWKQTJ-SFHVURJKSA-N 1 0 324.468 4.042 20 10 DICDRO C[C@@H]([NH2+]CCc1ccco1)c1ccc(N2CCCCC2)c(F)c1 ZINC000764588117 1055215976 /nfs/dbraw/zinc/21/59/76/1055215976.db2.gz DJGHSFRQALWSHU-OAHLLOKOSA-N 1 0 316.420 4.302 20 10 DICDRO Oc1cc2ccccc2cc1CN([C@@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236662112 1055217082 /nfs/dbraw/zinc/21/70/82/1055217082.db2.gz HVPRAPUIWXKFJL-HXUWFJFHSA-N 1 0 324.468 4.042 20 10 DICDRO CCCC[N@H+](CC)Cc1cc(C)cc(Br)c1[O-] ZINC001236674259 1055220065 /nfs/dbraw/zinc/22/00/65/1055220065.db2.gz XETXHODEUFDQMI-UHFFFAOYSA-N 1 0 300.240 4.085 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CCc1ccco1)c1ccc(N(C)C)cc1 ZINC000764610355 1055220929 /nfs/dbraw/zinc/22/09/29/1055220929.db2.gz YYWWAPCRKMTCBB-DNVCBOLYSA-N 1 0 300.446 4.408 20 10 DICDRO COc1ccc2sc(C[N@H+](C)Cc3ccccc3O)cc2c1 ZINC001236666327 1055221239 /nfs/dbraw/zinc/22/12/39/1055221239.db2.gz DLPCHNMYNDXVGE-UHFFFAOYSA-N 1 0 313.422 4.248 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 ZINC000764636605 1055226219 /nfs/dbraw/zinc/22/62/19/1055226219.db2.gz WHLPHRYEKNKRTE-HXUWFJFHSA-N 1 0 312.457 4.392 20 10 DICDRO CCC(CC)[N@H+](Cc1cc(Cl)ccc1[O-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782917 1055257134 /nfs/dbraw/zinc/25/71/34/1055257134.db2.gz MNLWWBKIJRXGFJ-JCNLHEQBSA-N 1 0 324.896 4.306 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)c(Cl)c1 ZINC001236799641 1055267531 /nfs/dbraw/zinc/26/75/31/1055267531.db2.gz UJMNMYMOXPWSSA-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO COc1ccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c([O-])c1Cl ZINC001236804016 1055268718 /nfs/dbraw/zinc/26/87/18/1055268718.db2.gz WUVOIYRVMVSJIB-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO COc1ccc(C[N@@H+]2CCC3(C2)CCCCC3)c([O-])c1Cl ZINC001236818161 1055270364 /nfs/dbraw/zinc/27/03/64/1055270364.db2.gz JCDPRJRSQAIJNK-UHFFFAOYSA-N 1 0 309.837 4.210 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1cc3ccccc3cc1O)CC2 ZINC001236827087 1055278717 /nfs/dbraw/zinc/27/87/17/1055278717.db2.gz OUTBYLBNUVUMGY-UHFFFAOYSA-N 1 0 319.404 4.112 20 10 DICDRO COc1ccc(CC[N@H+](C)Cc2cc3ccccc3cc2O)cc1 ZINC001236832917 1055282792 /nfs/dbraw/zinc/28/27/92/1055282792.db2.gz MHNUOACZXLASNC-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC001236842481 1055287845 /nfs/dbraw/zinc/28/78/45/1055287845.db2.gz VTDBOXDYVOJIGL-IBGZPJMESA-N 1 0 304.393 4.278 20 10 DICDRO CC[C@@H](Cc1cccs1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000764902749 1055289899 /nfs/dbraw/zinc/28/98/99/1055289899.db2.gz QCKDFNQTLGQOCN-KRWDZBQOSA-N 1 0 314.498 4.459 20 10 DICDRO Oc1cc2ccccc2cc1C[NH+]1CCc2ccccc2CC1 ZINC001236841596 1055290012 /nfs/dbraw/zinc/29/00/12/1055290012.db2.gz LQURGKHZJHJTMJ-UHFFFAOYSA-N 1 0 303.405 4.146 20 10 DICDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)o1 ZINC000764921649 1055295750 /nfs/dbraw/zinc/29/57/50/1055295750.db2.gz UKHFZQKZMMCECO-KRWDZBQOSA-N 1 0 312.457 4.472 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCSC1)c1ccc2ccccc2c1O ZINC000384179972 1055323013 /nfs/dbraw/zinc/32/30/13/1055323013.db2.gz WMCCOKGKBLOIIC-KGLIPLIRSA-N 1 0 301.455 4.339 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc3c(c2)COC3)cc1 ZINC000765107337 1055331321 /nfs/dbraw/zinc/33/13/21/1055331321.db2.gz SHHHEXYLVOKVKN-MRXNPFEDSA-N 1 0 324.468 4.414 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)COC3)cc1 ZINC000765107336 1055331637 /nfs/dbraw/zinc/33/16/37/1055331637.db2.gz SHHHEXYLVOKVKN-INIZCTEOSA-N 1 0 324.468 4.414 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCSC(F)(F)F)cc1 ZINC000765240876 1055342262 /nfs/dbraw/zinc/34/22/62/1055342262.db2.gz YQZXVSUJOWYRFU-NSHDSACASA-N 1 0 306.397 4.046 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001237041029 1055345228 /nfs/dbraw/zinc/34/52/28/1055345228.db2.gz AONZNGWGZSAZQP-QGZVFWFLSA-N 1 0 311.425 4.171 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(C)cc2)c(O)c1 ZINC001237042555 1055351383 /nfs/dbraw/zinc/35/13/83/1055351383.db2.gz XPSFFOMIYCILHU-LJQANCHMSA-N 1 0 311.425 4.436 20 10 DICDRO C[C@H](c1cccc(Br)c1)[N@H+](C)Cc1ccc(N)cc1 ZINC001237055174 1055353786 /nfs/dbraw/zinc/35/37/86/1055353786.db2.gz AQHPLRCHRIPFJS-GFCCVEGCSA-N 1 0 319.246 4.224 20 10 DICDRO C[C@@H](c1cccc(Br)c1)[N@H+](C)Cc1ccc(N)cc1 ZINC001237055175 1055353918 /nfs/dbraw/zinc/35/39/18/1055353918.db2.gz AQHPLRCHRIPFJS-LBPRGKRZSA-N 1 0 319.246 4.224 20 10 DICDRO CC(C)c1ccc(C[N@@H+]2CCN(C)[C@H](c3ccccc3)C2)c(O)c1 ZINC001237054292 1055354582 /nfs/dbraw/zinc/35/45/82/1055354582.db2.gz VCKSKJGLNBSOSK-FQEVSTJZSA-N 1 0 324.468 4.004 20 10 DICDRO CC(C)c1ccc(C[NH+]2CCC(c3ccncc3)CC2)c(O)c1 ZINC001237054000 1055355347 /nfs/dbraw/zinc/35/53/47/1055355347.db2.gz SKDHEXTWGODSCX-UHFFFAOYSA-N 1 0 310.441 4.290 20 10 DICDRO Oc1cc(OCC(F)(F)F)ccc1C[NH+]1CCCCCCC1 ZINC001237055186 1055356001 /nfs/dbraw/zinc/35/60/01/1055356001.db2.gz ASDVCYXOSJCDHH-UHFFFAOYSA-N 1 0 317.351 4.099 20 10 DICDRO CC[C@@H]1CCCC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001237060528 1055358412 /nfs/dbraw/zinc/35/84/12/1055358412.db2.gz VCJBZFYJROHNKE-CYBMUJFWSA-N 1 0 317.351 4.098 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 ZINC000765301259 1055358595 /nfs/dbraw/zinc/35/85/95/1055358595.db2.gz TYXLQULYQXRTFX-KURKYZTESA-N 1 0 316.489 4.000 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC000765306409 1055362031 /nfs/dbraw/zinc/36/20/31/1055362031.db2.gz CYBYJVWUUJSEBO-SJORKVTESA-N 1 0 316.489 4.080 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@H]3CCC[C@H](C)C3)CC2)cc1 ZINC000765306408 1055362672 /nfs/dbraw/zinc/36/26/72/1055362672.db2.gz CYBYJVWUUJSEBO-IRXDYDNUSA-N 1 0 316.489 4.080 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1COc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000765333863 1055365160 /nfs/dbraw/zinc/36/51/60/1055365160.db2.gz LYTPGUZGXFLMLJ-UZLBHIALSA-N 1 0 324.468 4.045 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 ZINC000765342484 1055366528 /nfs/dbraw/zinc/36/65/28/1055366528.db2.gz FVVJMEBQRAWFAD-JENIJYKNSA-N 1 0 316.489 4.000 20 10 DICDRO Cc1cccc2c1CN(Cc1c(O)cccc1OC(F)(F)F)C2 ZINC001237120747 1055374962 /nfs/dbraw/zinc/37/49/62/1055374962.db2.gz RNZAGJPNCVBURC-UHFFFAOYSA-N 1 0 323.314 4.115 20 10 DICDRO C[C@@]1(F)CCCCN(Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120078 1055375461 /nfs/dbraw/zinc/37/54/61/1055375461.db2.gz LRMOTPLLLMKDFF-CQSZACIVSA-N 1 0 321.314 4.005 20 10 DICDRO Oc1cccc(OC(F)(F)F)c1C[NH+]1CCC2(CCC2)CC1 ZINC001237114741 1055376930 /nfs/dbraw/zinc/37/69/30/1055376930.db2.gz DJPRHZJVCBIGOO-UHFFFAOYSA-N 1 0 315.335 4.057 20 10 DICDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001237127395 1055377352 /nfs/dbraw/zinc/37/73/52/1055377352.db2.gz ZFWVEZRDXUFEOU-GFCCVEGCSA-N 1 0 323.770 4.313 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2c(O)ccc(F)c2Cl)cc1 ZINC001237126110 1055379821 /nfs/dbraw/zinc/37/98/21/1055379821.db2.gz JFIHSFLZFFZXBI-NSHDSACASA-N 1 0 323.795 4.386 20 10 DICDRO CC1(C)C[N@H+](Cc2cc(C(F)(F)F)ccc2O)CCC1(F)F ZINC001237137113 1055380711 /nfs/dbraw/zinc/38/07/11/1055380711.db2.gz MGJQZZPTWZUZSW-UHFFFAOYSA-N 1 0 323.305 4.278 20 10 DICDRO CC1(C)C[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C(C)(C)O1 ZINC000765447366 1055391889 /nfs/dbraw/zinc/39/18/89/1055391889.db2.gz BMPBIPJDFNRSMQ-SFHVURJKSA-N 1 0 316.489 4.113 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cc2ccccc2o1 ZINC000765475367 1055399457 /nfs/dbraw/zinc/39/94/57/1055399457.db2.gz TWCGLWJISWEZFI-CYBMUJFWSA-N 1 0 312.388 4.489 20 10 DICDRO CCc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC000765473076 1055401147 /nfs/dbraw/zinc/40/11/47/1055401147.db2.gz BOKKQOKBSIHBQB-LBPRGKRZSA-N 1 0 306.450 4.366 20 10 DICDRO C[C@H]([NH2+][C@@H](CO)C1CCCCC1)c1ccc2ccccc2c1O ZINC000386213626 1055435470 /nfs/dbraw/zinc/43/54/70/1055435470.db2.gz UIGLGKWTAAOFOZ-LIRRHRJNSA-N 1 0 313.441 4.137 20 10 DICDRO C[C@@H](c1ccc(Br)cc1)[N@H+](C)Cc1ccc(N)cc1 ZINC001237463656 1055456737 /nfs/dbraw/zinc/45/67/37/1055456737.db2.gz NSPLBNGDNJARJQ-LBPRGKRZSA-N 1 0 319.246 4.224 20 10 DICDRO CC[N@H+](Cc1c(C)cccc1O)[C@@H](C)Cc1ccc(OC)cc1 ZINC001237483920 1055459594 /nfs/dbraw/zinc/45/95/94/1055459594.db2.gz VTJNPAKGZQEJHW-INIZCTEOSA-N 1 0 313.441 4.162 20 10 DICDRO Cc1cc(C[N@H+](Cc2ccccc2)Cc2c(C)cccc2O)on1 ZINC001237491130 1055460921 /nfs/dbraw/zinc/46/09/21/1055460921.db2.gz GVZOAOFTNWAOLK-UHFFFAOYSA-N 1 0 322.408 4.199 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC(c2ccc(F)cc2F)CC1 ZINC001237494644 1055461091 /nfs/dbraw/zinc/46/10/91/1055461091.db2.gz KDJTVYWKBJTAEA-UHFFFAOYSA-N 1 0 317.379 4.358 20 10 DICDRO COc1ccc(C2CC[NH+](Cc3c(C)cccc3O)CC2)cc1 ZINC001237490182 1055461951 /nfs/dbraw/zinc/46/19/51/1055461951.db2.gz QXUZBHXTJWCMJF-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001237492432 1055461997 /nfs/dbraw/zinc/46/19/97/1055461997.db2.gz PQLWHYPRYZZBFA-MRXNPFEDSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccccc2O)C2CCCCC2)cn1 ZINC000765565927 1055465336 /nfs/dbraw/zinc/46/53/36/1055465336.db2.gz OMAMNTINEFHBEX-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO COCC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765574895 1055479224 /nfs/dbraw/zinc/47/92/24/1055479224.db2.gz NIUHCVMTDIBULM-IAGOWNOFSA-N 1 0 304.478 4.143 20 10 DICDRO CN(Cc1ccccc1O)Cc1c(Cl)cc(F)cc1Cl ZINC001237597996 1055481982 /nfs/dbraw/zinc/48/19/82/1055481982.db2.gz GSJDFJHZSUIGPV-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO CC[N@H+](Cc1ccccc1F)Cc1cc(Cl)cc(F)c1[O-] ZINC001237621594 1055484338 /nfs/dbraw/zinc/48/43/38/1055484338.db2.gz CUWHFIQJFXNRGF-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001237620228 1055486327 /nfs/dbraw/zinc/48/63/27/1055486327.db2.gz LDVHCUAVRKXGSM-LLVKDONJSA-N 1 0 323.770 4.313 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CC(C)(C)C2CCCC2)cc1F ZINC001620863567 1055491889 /nfs/dbraw/zinc/49/18/89/1055491889.db2.gz UWGIILJITCEQPL-UHFFFAOYSA-N 1 0 310.432 4.337 20 10 DICDRO Cc1cc(O)c(C[NH+](C(C)C)C(C)C)cc1Br ZINC001237678427 1055503001 /nfs/dbraw/zinc/50/30/01/1055503001.db2.gz YZVLVDFEKGLABB-UHFFFAOYSA-N 1 0 300.240 4.082 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CCCC3(CC(F)C3)CC2)c1O ZINC001237687391 1055504691 /nfs/dbraw/zinc/50/46/91/1055504691.db2.gz ZYPIBBRQZMORCZ-UHFFFAOYSA-N 1 0 311.828 4.458 20 10 DICDRO Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccc3c(c1)CCO3)CCCO2 ZINC000765609977 1055513184 /nfs/dbraw/zinc/51/31/84/1055513184.db2.gz SHZPHQHSCANTMZ-LJQANCHMSA-N 1 0 323.436 4.242 20 10 DICDRO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765610068 1055513398 /nfs/dbraw/zinc/51/33/98/1055513398.db2.gz UQVABPDWQVVXOQ-GFCCVEGCSA-N 1 0 316.470 4.361 20 10 DICDRO C[C@@H]([NH2+]CCc1ccccc1O)c1ccc(N2CCCCC2)cc1 ZINC000765621442 1055524180 /nfs/dbraw/zinc/52/41/80/1055524180.db2.gz TZPMCDGMYNKPCI-QGZVFWFLSA-N 1 0 324.468 4.276 20 10 DICDRO CCO[C@H](C[NH2+]Cc1c(C)c2ccccc2n1C)c1ccccc1 ZINC001620919466 1055540747 /nfs/dbraw/zinc/54/07/47/1055540747.db2.gz DSBYHDLGGGQAST-OAQYLSRUSA-N 1 0 322.452 4.354 20 10 DICDRO CC[C@H]([NH2+]C1CCN(c2ccc(OC)cc2)CC1)C1CCCC1 ZINC001620936039 1055549222 /nfs/dbraw/zinc/54/92/22/1055549222.db2.gz OTYHOWUGCXWOCB-FQEVSTJZSA-N 1 0 316.489 4.222 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2cc(F)c(Cl)cc2[O-])cc1 ZINC001237948296 1055564631 /nfs/dbraw/zinc/56/46/31/1055564631.db2.gz CDUZGZHLLBNOGS-NSHDSACASA-N 1 0 323.795 4.386 20 10 DICDRO c1ccc([C@H]2CCC[C@@H]2C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001620950295 1055565122 /nfs/dbraw/zinc/56/51/22/1055565122.db2.gz WDPMYZNBKZBNOA-WOJBJXKFSA-N 1 0 307.437 4.295 20 10 DICDRO c1ccc([C@H]2CCC[C@H]2C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001620950294 1055565735 /nfs/dbraw/zinc/56/57/35/1055565735.db2.gz WDPMYZNBKZBNOA-VQTJNVASSA-N 1 0 307.437 4.295 20 10 DICDRO c1c2ccccc2sc1CC[NH2+]Cc1ccc2c(c1)CCO2 ZINC001620950960 1055566685 /nfs/dbraw/zinc/56/66/85/1055566685.db2.gz SRKHVLUQOSNAED-UHFFFAOYSA-N 1 0 309.434 4.169 20 10 DICDRO Cc1cc(F)cc(C[NH+]2CCC(c3cccs3)CC2)c1O ZINC001238061795 1055598351 /nfs/dbraw/zinc/59/83/51/1055598351.db2.gz INBRCPNYYWVCSP-UHFFFAOYSA-N 1 0 305.418 4.281 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cncc(C2CC2)c1 ZINC001238184929 1055614885 /nfs/dbraw/zinc/61/48/85/1055614885.db2.gz MMVUATSMZMAUNK-UHFFFAOYSA-N 1 0 321.468 4.191 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cncc(C2CC2)c1 ZINC001238194269 1055617378 /nfs/dbraw/zinc/61/73/78/1055617378.db2.gz LWIAKSURSIDEEL-UHFFFAOYSA-N 1 0 309.457 4.047 20 10 DICDRO C[N@H+](Cc1ccc(F)c(-c2ccncc2)c1)Cc1ccccc1O ZINC001238558479 1055686540 /nfs/dbraw/zinc/68/65/40/1055686540.db2.gz OIONZEJAQUWFMW-UHFFFAOYSA-N 1 0 322.383 4.225 20 10 DICDRO CC[N@H+](Cc1ccccc1O)Cc1cc(Cl)c(OC)cc1F ZINC001238794449 1055751771 /nfs/dbraw/zinc/75/17/71/1055751771.db2.gz QKAQPCJNGMRDCX-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO CCN(CC)C[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765764833 1055769637 /nfs/dbraw/zinc/76/96/37/1055769637.db2.gz BJEUSICOJYWETE-QZTJIDSGSA-N 1 0 317.521 4.058 20 10 DICDRO Cc1sccc1C[NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C ZINC001620974226 1055810821 /nfs/dbraw/zinc/81/08/21/1055810821.db2.gz GJXQWSQULHIWEB-AWEZNQCLSA-N 1 0 302.487 4.152 20 10 DICDRO Cc1ccc(F)c(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)c1 ZINC001620974420 1055813176 /nfs/dbraw/zinc/81/31/76/1055813176.db2.gz MJWKQKOVIPMMMK-MRXNPFEDSA-N 1 0 314.448 4.229 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)cc1 ZINC000765770102 1055914279 /nfs/dbraw/zinc/91/42/79/1055914279.db2.gz WJKCWCBNRDPZCJ-HOTGVXAUSA-N 1 0 312.457 4.130 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2ccc(F)c(Cl)c2)cc1 ZINC001620761260 1055933738 /nfs/dbraw/zinc/93/37/38/1055933738.db2.gz QQQIMZNHADDYDI-ONEGZZNKSA-N 1 0 318.823 4.348 20 10 DICDRO COc1ccc(N2CCC([NH2+]CC3CCCCCC3)CC2)cc1 ZINC001620762825 1055935927 /nfs/dbraw/zinc/93/59/27/1055935927.db2.gz PHVNHCOOCJFVPN-UHFFFAOYSA-N 1 0 316.489 4.224 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC(C)(C)c2ccccc2)c(Cl)c1 ZINC001620998768 1055967803 /nfs/dbraw/zinc/96/78/03/1055967803.db2.gz MWXLEYULVZCNQU-UHFFFAOYSA-N 1 0 303.833 4.421 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCc2ccccc2)c(C(F)(F)F)c1 ZINC001620695302 1055981511 /nfs/dbraw/zinc/98/15/11/1055981511.db2.gz FKDWBQZKFWUTKR-UHFFFAOYSA-N 1 0 322.374 4.104 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCO[C@H]1CCCC[C@H]1C ZINC001620721074 1055986853 /nfs/dbraw/zinc/98/68/53/1055986853.db2.gz FUWPNEGDCWXLKK-QRWLVFNGSA-N 1 0 314.473 4.172 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1F ZINC001620804537 1055999099 /nfs/dbraw/zinc/99/90/99/1055999099.db2.gz MRVINKKOVLMTCF-KRWDZBQOSA-N 1 0 322.374 4.411 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2O)cc(C)c1OC(F)F ZINC001621052674 1056011313 /nfs/dbraw/zinc/01/13/13/1056011313.db2.gz HJPGVICLELJDRH-ZDUSSCGKSA-N 1 0 321.367 4.461 20 10 DICDRO Cc1ccc(C[NH2+]C[C@@H](C)Oc2ccc(C(C)C)cc2)c(O)c1 ZINC001621320817 1056028032 /nfs/dbraw/zinc/02/80/32/1056028032.db2.gz KURHCUHJCZSICP-MRXNPFEDSA-N 1 0 313.441 4.381 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)C1(CC)CC ZINC001620819614 1056132719 /nfs/dbraw/zinc/13/27/19/1056132719.db2.gz XHGOIPRQVSPIDI-JKSUJKDBSA-N 1 0 311.853 4.119 20 10 DICDRO C[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)Cc1cccs1 ZINC001620821405 1056224671 /nfs/dbraw/zinc/22/46/71/1056224671.db2.gz VUYQIOYZSGBXQS-LEXSJLIMSA-N 1 0 314.498 4.296 20 10 DICDRO CCN(C)c1ccc(C[N@H+](Cc2ccccc2OC)C2CC2)cc1 ZINC001615200846 1056476652 /nfs/dbraw/zinc/47/66/52/1056476652.db2.gz NRCLCLQBIBRIEW-UHFFFAOYSA-N 1 0 324.468 4.316 20 10 DICDRO CCC[N@H+](C)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC001615285148 1056487101 /nfs/dbraw/zinc/48/71/01/1056487101.db2.gz AKNRUUKXXDLRKZ-UHFFFAOYSA-N 1 0 310.401 4.382 20 10 DICDRO CC[C@@](C)([NH2+]Cc1ccc2c(c1)CCCO2)c1nc(C)cs1 ZINC000921782306 1056487032 /nfs/dbraw/zinc/48/70/32/1056487032.db2.gz QHWDIZMAQQWCTE-GOSISDBHSA-N 1 0 316.470 4.192 20 10 DICDRO FC(F)c1ccc(C[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC000922001318 1056724020 /nfs/dbraw/zinc/72/40/20/1056724020.db2.gz PPPJYGOKSAUEQQ-UHFFFAOYSA-N 1 0 303.352 4.239 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CCC3(CCOCC3)CC2)c1O ZINC001143112094 1056779333 /nfs/dbraw/zinc/77/93/33/1056779333.db2.gz JVUIOFSGKDNQQE-UHFFFAOYSA-N 1 0 317.473 4.082 20 10 DICDRO CC[NH+](CC)Cc1ccncc1C1=CCN(c2ccccc2)CC1 ZINC001241359901 1057026338 /nfs/dbraw/zinc/02/63/38/1057026338.db2.gz FVZWCJYNUNQWRP-UHFFFAOYSA-N 1 0 321.468 4.217 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)c2nc(C)cs2)cc1 ZINC000186575563 1057057149 /nfs/dbraw/zinc/05/71/49/1057057149.db2.gz GUGLUIUNYMPCGO-UKRRQHHQSA-N 1 0 317.502 4.362 20 10 DICDRO c1cnc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000922883411 1057073291 /nfs/dbraw/zinc/07/32/91/1057073291.db2.gz SCLLWSLNRJMOJF-FQEVSTJZSA-N 1 0 321.468 4.239 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2cc(Cl)ccc21 ZINC000766027962 1057128349 /nfs/dbraw/zinc/12/83/49/1057128349.db2.gz BSMLYOPFSGYVTI-IBGZPJMESA-N 1 0 314.860 4.492 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccccc1OC ZINC000766028850 1057128444 /nfs/dbraw/zinc/12/84/44/1057128444.db2.gz HMNHPUDZSZXTES-IBGZPJMESA-N 1 0 312.457 4.311 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1cccc(OC)c1 ZINC000766030772 1057131490 /nfs/dbraw/zinc/13/14/90/1057131490.db2.gz XKVRKTSZNRTIDJ-FQEVSTJZSA-N 1 0 312.457 4.311 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccc2ccccc2n1 ZINC000766030760 1057131500 /nfs/dbraw/zinc/13/15/00/1057131500.db2.gz XDNNMDHYZPIZOE-INIZCTEOSA-N 1 0 319.452 4.460 20 10 DICDRO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000766030624 1057131643 /nfs/dbraw/zinc/13/16/43/1057131643.db2.gz VEGYBLBRRZAWDI-AWEZNQCLSA-N 1 0 316.420 4.060 20 10 DICDRO C[C@@H]([NH2+]C[C@H](O)CC(C)(C)C)c1ccc(N2CCCCC2)cc1 ZINC000766062162 1057266543 /nfs/dbraw/zinc/26/65/43/1057266543.db2.gz VJCYFFWYXXYGQK-VQIMIIECSA-N 1 0 318.505 4.125 20 10 DICDRO CO[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@H](C)C1 ZINC000282522658 1057281380 /nfs/dbraw/zinc/28/13/80/1057281380.db2.gz ZTJLTPCGRLBZDQ-BEFAXECRSA-N 1 0 311.425 4.059 20 10 DICDRO CC[C@H]([NH2+]CCCSc1nccs1)c1cccc(OC)c1 ZINC000766074240 1057285877 /nfs/dbraw/zinc/28/58/77/1057285877.db2.gz VAIRMZOLNDWVNE-HNNXBMFYSA-N 1 0 322.499 4.375 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+]CCCSc2nccs2)c1 ZINC000766072783 1057286187 /nfs/dbraw/zinc/28/61/87/1057286187.db2.gz MSMFKJJVBILSIU-CYBMUJFWSA-N 1 0 322.499 4.375 20 10 DICDRO Cc1ccc2c(c1)[C@H]([NH2+]CCCSc1nccs1)CC2 ZINC000766072357 1057286284 /nfs/dbraw/zinc/28/62/84/1057286284.db2.gz HBNPTALHJBVLMU-OAHLLOKOSA-N 1 0 304.484 4.211 20 10 DICDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000766117724 1057348497 /nfs/dbraw/zinc/34/84/97/1057348497.db2.gz LXEJCOOLAXCJRT-LBPRGKRZSA-N 1 0 309.331 4.320 20 10 DICDRO CC[C@H]([NH2+]Cc1c(O)cccc1Br)c1ccccc1 ZINC000706821677 1057481354 /nfs/dbraw/zinc/48/13/54/1057481354.db2.gz LNEXBKIUXPYMJU-HNNXBMFYSA-N 1 0 320.230 4.396 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(O)cccc1Br)c1ccccc1 ZINC000706821678 1057481777 /nfs/dbraw/zinc/48/17/77/1057481777.db2.gz LNEXBKIUXPYMJU-OAHLLOKOSA-N 1 0 320.230 4.396 20 10 DICDRO CCc1onc(C)c1C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000922987715 1057519980 /nfs/dbraw/zinc/51/99/80/1057519980.db2.gz ISJGRJPWKYSGQO-UHFFFAOYSA-N 1 0 322.408 4.208 20 10 DICDRO c1cc2cccc(C[NH2+]Cc3ccc(N4CCCCC4)cc3)c2[nH]1 ZINC000727467768 1057655483 /nfs/dbraw/zinc/65/54/83/1057655483.db2.gz CTNJJVWKIMFOCE-UHFFFAOYSA-N 1 0 319.452 4.448 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(F)cc1 ZINC000727643277 1057662385 /nfs/dbraw/zinc/66/23/85/1057662385.db2.gz FKCYFAQBUBYZKS-LJQANCHMSA-N 1 0 312.432 4.449 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1ccccc1OC(F)F ZINC000727830745 1057676957 /nfs/dbraw/zinc/67/69/57/1057676957.db2.gz LLSOFONALFOUAL-UHFFFAOYSA-N 1 0 321.367 4.406 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C)c(F)c2)cc1F ZINC000731452520 1057743567 /nfs/dbraw/zinc/74/35/67/1057743567.db2.gz BQBFUETWCKSOMZ-UHFFFAOYSA-N 1 0 318.411 4.409 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CCCC2(CCCCC2)C1 ZINC000732190713 1057769622 /nfs/dbraw/zinc/76/96/22/1057769622.db2.gz LBVCDVMYAXBBNN-UHFFFAOYSA-N 1 0 310.441 4.487 20 10 DICDRO COc1ccccc1C(C)(C)C[NH2+]Cc1c(O)cccc1Cl ZINC000733326111 1057813157 /nfs/dbraw/zinc/81/31/57/1057813157.db2.gz JPGHPEUHCIVTCG-UHFFFAOYSA-N 1 0 319.832 4.122 20 10 DICDRO COc1ccc(C[NH2+]CCc2ccc(F)cc2Cl)cc1C ZINC000733330401 1057813846 /nfs/dbraw/zinc/81/38/46/1057813846.db2.gz XEAZKXZLPQHPST-UHFFFAOYSA-N 1 0 307.796 4.128 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CC1CCSCC1 ZINC000733329868 1057813964 /nfs/dbraw/zinc/81/39/64/1057813964.db2.gz BUGSOCAHPBTAAF-UHFFFAOYSA-N 1 0 313.466 4.292 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(OC3CCCC3)c2)c1 ZINC000733328120 1057814162 /nfs/dbraw/zinc/81/41/62/1057814162.db2.gz HWHBUCOWYBKIGX-UHFFFAOYSA-N 1 0 311.425 4.312 20 10 DICDRO Oc1ccccc1C[N@H+](C[C@@H]1CC1(Cl)Cl)C1CCCC1 ZINC000733613181 1057827094 /nfs/dbraw/zinc/82/70/94/1057827094.db2.gz CAWPHDANMNMEFB-ZDUSSCGKSA-N 1 0 314.256 4.331 20 10 DICDRO Cc1ccc(C)n1-c1ccc(-c2cccc(C[NH+](C)C)c2F)cn1 ZINC001244865504 1058059817 /nfs/dbraw/zinc/05/98/17/1058059817.db2.gz UEVAJJWAMMNIID-UHFFFAOYSA-N 1 0 323.415 4.357 20 10 DICDRO C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]Cc1ccc(N)cc1 ZINC001246169593 1058713783 /nfs/dbraw/zinc/71/37/83/1058713783.db2.gz IGGRUMOJIWNOJO-LLVKDONJSA-N 1 0 324.802 4.311 20 10 DICDRO Nc1ccc(CC[NH2+]C2CCC3(CCc4ccccc43)CC2)cc1 ZINC001246466550 1058953032 /nfs/dbraw/zinc/95/30/32/1058953032.db2.gz OQCOSFJAMHZPIQ-UHFFFAOYSA-N 1 0 320.480 4.228 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N2CCCCC2)c(C)c1)[C@H]1CCCO1 ZINC001559738031 1059570481 /nfs/dbraw/zinc/57/04/81/1059570481.db2.gz UHDOAVMJQSDPGY-AZUAARDMSA-N 1 0 316.489 4.033 20 10 DICDRO COc1ccc(N(CC2CC2)C[C@H]2CCCC[N@@H+]2C(C)C)cc1 ZINC001559848700 1059673674 /nfs/dbraw/zinc/67/36/74/1059673674.db2.gz ZQKIWZIOJSAHDT-LJQANCHMSA-N 1 0 316.489 4.175 20 10 DICDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)CCc2ccc(F)cc21 ZINC001559959290 1059768655 /nfs/dbraw/zinc/76/86/55/1059768655.db2.gz YABRJNNWPIDEMI-OAHLLOKOSA-N 1 0 312.432 4.054 20 10 DICDRO Cc1cc(C[N@H+](C)[C@@H]2CCc3ccccc3C2)ccc1N(C)C ZINC001560220591 1059996823 /nfs/dbraw/zinc/99/68/23/1059996823.db2.gz RTCNUBTVADXNCU-HXUWFJFHSA-N 1 0 308.469 4.050 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCc2c[nH]c3ccccc23)cc1 ZINC001560249537 1060016764 /nfs/dbraw/zinc/01/67/64/1060016764.db2.gz PEKLJQJFCXMHTJ-WAYWQWQTSA-N 1 0 319.452 4.079 20 10 DICDRO C[C@@H](OCCC[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC001560253542 1060021805 /nfs/dbraw/zinc/02/18/05/1060021805.db2.gz UQEMQZUCCUQHTR-CQSZACIVSA-N 1 0 319.832 4.303 20 10 DICDRO c1ccc(C2(C[NH2+]Cc3ccc(N4CCCC4)cc3)CC2)cc1 ZINC001560263127 1060030939 /nfs/dbraw/zinc/03/09/39/1060030939.db2.gz ORBIPXQYZXQGER-UHFFFAOYSA-N 1 0 306.453 4.108 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(Cl)c(C)n1 ZINC001248872294 1060032299 /nfs/dbraw/zinc/03/22/99/1060032299.db2.gz OTLVSYZBMIPJPB-UHFFFAOYSA-N 1 0 317.864 4.132 20 10 DICDRO CSCC[N@H+](C)Cc1cc(Cl)c(C(C)(C)C)cc1O ZINC001248885297 1060041370 /nfs/dbraw/zinc/04/13/70/1060041370.db2.gz QZJZPXUIBQKVMM-UHFFFAOYSA-N 1 0 301.883 4.138 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001560269077 1060042510 /nfs/dbraw/zinc/04/25/10/1060042510.db2.gz NYXLDVAMOWYFDM-UHFFFAOYSA-N 1 0 304.437 4.265 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cc(C)ccc2OC)cc1C ZINC001560296867 1060081338 /nfs/dbraw/zinc/08/13/38/1060081338.db2.gz LXIQTHQKQJLSMM-UHFFFAOYSA-N 1 0 313.441 4.391 20 10 DICDRO Cc1ccc(OCCC[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC001560300464 1060086276 /nfs/dbraw/zinc/08/62/76/1060086276.db2.gz BNVHEOSMLZVACA-XQRVVYSFSA-N 1 0 324.468 4.133 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc2c(c1)CCCC2 ZINC001560327947 1060115789 /nfs/dbraw/zinc/11/57/89/1060115789.db2.gz ALASRRKRMRTABS-UHFFFAOYSA-N 1 0 308.469 4.230 20 10 DICDRO CCCOc1cccc(C[NH2+]CCCSc2nccs2)c1 ZINC001560348283 1060135759 /nfs/dbraw/zinc/13/57/59/1060135759.db2.gz SRUGXQXYIIAKNU-UHFFFAOYSA-N 1 0 322.499 4.204 20 10 DICDRO Cc1cccc([C@H](C)C[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC001560348241 1060136175 /nfs/dbraw/zinc/13/61/75/1060136175.db2.gz QSSIODRINQELDV-CQSZACIVSA-N 1 0 318.411 4.233 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCc2cccc3[nH]ccc32)c(Cl)c1 ZINC001560452976 1060242703 /nfs/dbraw/zinc/24/27/03/1060242703.db2.gz WNMGIPJOWGPLBD-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560466079 1060258646 /nfs/dbraw/zinc/25/86/46/1060258646.db2.gz SKYNBSJTWGBTAF-UZLBHIALSA-N 1 0 306.453 4.137 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+][C@@H]3CCCC(C)(C)C3)C2)cc1 ZINC001560512303 1060309768 /nfs/dbraw/zinc/30/97/68/1060309768.db2.gz QKKRPOYQCJZTNC-IAGOWNOFSA-N 1 0 316.489 4.080 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+]C[C@H]3CCCC(C)(C)C3)C2)cc1 ZINC001560529171 1060329577 /nfs/dbraw/zinc/32/95/77/1060329577.db2.gz UKLUKIIMEJBABJ-DLBZAZTESA-N 1 0 316.489 4.080 20 10 DICDRO COc1cc(C[NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC001560534874 1060336525 /nfs/dbraw/zinc/33/65/25/1060336525.db2.gz WPUUEFNOSMTJFS-KEYYUXOJSA-N 1 0 317.473 4.224 20 10 DICDRO COc1cc(C[NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)c(O)c(C(C)(C)C)c1 ZINC001560534872 1060336850 /nfs/dbraw/zinc/33/68/50/1060336850.db2.gz WPUUEFNOSMTJFS-GRDNDAEWSA-N 1 0 317.473 4.224 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@]2(C)CC2(F)F)cc1 ZINC001560535779 1060339235 /nfs/dbraw/zinc/33/92/35/1060339235.db2.gz KBRIVTNSMPSGQD-QGZVFWFLSA-N 1 0 310.432 4.448 20 10 DICDRO COc1cc(C[NH2+]C(C)(C2CC2)C2CC2)c(O)c(C(C)(C)C)c1 ZINC001560539616 1060347686 /nfs/dbraw/zinc/34/76/86/1060347686.db2.gz JMGZTUONQUFGDL-UHFFFAOYSA-N 1 0 317.473 4.367 20 10 DICDRO C[C@H]([NH2+]C1CCC2(COC(C)(C)C2)CC1)c1ccccc1O ZINC001560575985 1060387651 /nfs/dbraw/zinc/38/76/51/1060387651.db2.gz YGQGIUFXGBQGSY-XVTSOASTSA-N 1 0 303.446 4.171 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(Cl)c1 ZINC001560627214 1060437607 /nfs/dbraw/zinc/43/76/07/1060437607.db2.gz SNSAJRMFMYWHPL-UHFFFAOYSA-N 1 0 302.849 4.346 20 10 DICDRO COc1ccc(-n2c(C)cc(C[N@H+](C)CC3(C)CC3)c2C)cc1 ZINC001560639326 1060454763 /nfs/dbraw/zinc/45/47/63/1060454763.db2.gz UCSTWSMRUXVPMZ-UHFFFAOYSA-N 1 0 312.457 4.335 20 10 DICDRO CN(Cc1cccs1)c1ccc(C[N@H+](C)CC2CC2)cc1 ZINC001560647956 1060471390 /nfs/dbraw/zinc/47/13/90/1060471390.db2.gz HBNVAPSKWABSHZ-UHFFFAOYSA-N 1 0 300.471 4.226 20 10 DICDRO COc1cc(C[N@@H+]2CC[C@H](C(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC001560648784 1060474601 /nfs/dbraw/zinc/47/46/01/1060474601.db2.gz UNRWIVINRTUFRR-AWEZNQCLSA-N 1 0 305.462 4.176 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2CC(C)C)c1O ZINC001560667359 1060492529 /nfs/dbraw/zinc/49/25/29/1060492529.db2.gz GKKGNVLJEGHVEY-OAHLLOKOSA-N 1 0 311.853 4.455 20 10 DICDRO COc1ccc(C[N@@H+]2CCCCC[C@H]2CC(C)C)c(O)c1OC ZINC001560677811 1060517952 /nfs/dbraw/zinc/51/79/52/1060517952.db2.gz LSCRDZPSNOLGEO-INIZCTEOSA-N 1 0 321.461 4.200 20 10 DICDRO C[C@@H]1c2ccccc2OCC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001560680502 1060520212 /nfs/dbraw/zinc/52/02/12/1060520212.db2.gz CIXDUNBNMNEVBI-JTGQJZMRSA-N 1 0 322.452 4.221 20 10 DICDRO Cc1cccc(OCC[N@@H+](C)Cc2ccc3ccccc3c2O)c1 ZINC001560680023 1060524311 /nfs/dbraw/zinc/52/43/11/1060524311.db2.gz IDMIXRBYRSTFFQ-UHFFFAOYSA-N 1 0 321.420 4.365 20 10 DICDRO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(C(C)C)ccc2O)on1 ZINC001560693674 1060544284 /nfs/dbraw/zinc/54/42/84/1060544284.db2.gz FHMCBDIEMRWMCJ-MRXNPFEDSA-N 1 0 300.402 4.149 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001560708807 1060563345 /nfs/dbraw/zinc/56/33/45/1060563345.db2.gz SCJDVVAPWIGPFM-GOSISDBHSA-N 1 0 315.363 4.396 20 10 DICDRO CCc1cccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1O ZINC001560716666 1060572445 /nfs/dbraw/zinc/57/24/45/1060572445.db2.gz LSFGQNDTBYXYEK-SFHVURJKSA-N 1 0 313.466 4.245 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC001560728524 1060595386 /nfs/dbraw/zinc/59/53/86/1060595386.db2.gz WFOLGIKRLACYQB-NRFANRHFSA-N 1 0 308.469 4.268 20 10 DICDRO COc1cc(C)c(C[N@H+](Cc2cccc(F)c2)C2CC2)c(O)c1 ZINC001560729412 1060597556 /nfs/dbraw/zinc/59/75/56/1060597556.db2.gz JGJNFGPBLREKOJ-UHFFFAOYSA-N 1 0 315.388 4.013 20 10 DICDRO C[N@H+](Cc1cc(Cl)c(F)cc1[O-])CC1(c2ccccc2)CC1 ZINC001560757443 1060622907 /nfs/dbraw/zinc/62/29/07/1060622907.db2.gz OJYZNGDJOIDXBI-UHFFFAOYSA-N 1 0 319.807 4.348 20 10 DICDRO CC(C)(COCc1ccccc1)[NH2+]Cc1ccc(Cl)cc1O ZINC001560784169 1060645268 /nfs/dbraw/zinc/64/52/68/1060645268.db2.gz JRVPTXHXFZDQNV-UHFFFAOYSA-N 1 0 319.832 4.131 20 10 DICDRO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001560786534 1060646716 /nfs/dbraw/zinc/64/67/16/1060646716.db2.gz XAYRFPBAGIDSGL-GOSISDBHSA-N 1 0 319.807 4.425 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C(C)(C)C)C2)c1O ZINC001560785032 1060647362 /nfs/dbraw/zinc/64/73/62/1060647362.db2.gz CBEUEWFTGIVKOJ-CYBMUJFWSA-N 1 0 311.853 4.312 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2coc3ccccc23)cc1Cl ZINC001560846472 1060702441 /nfs/dbraw/zinc/70/24/41/1060702441.db2.gz JIUAJUDYHWPHRD-UHFFFAOYSA-N 1 0 301.773 4.390 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC3(CCCC3)[C@H]2C(C)C)c1O ZINC001560884026 1060745292 /nfs/dbraw/zinc/74/52/92/1060745292.db2.gz MKJBQAACASREBN-GOSISDBHSA-N 1 0 303.446 4.110 20 10 DICDRO CCCC[C@H](C)[C@@H](C)[NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001560927878 1060790722 /nfs/dbraw/zinc/79/07/22/1060790722.db2.gz DNDIKOICXYRIOI-GVDBMIGSSA-N 1 0 304.478 4.078 20 10 DICDRO COc1cc(C)c(C[NH2+]Cc2cc3cc(C)ccc3o2)c(O)c1 ZINC001560933068 1060794419 /nfs/dbraw/zinc/79/44/19/1060794419.db2.gz CLZPMDICKDPGIL-UHFFFAOYSA-N 1 0 311.381 4.054 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC([C@@H]3CCCCO3)CC2)c(Cl)c1 ZINC001560934177 1060797499 /nfs/dbraw/zinc/79/74/99/1060797499.db2.gz KNKHZZCLRUHOJC-SFHVURJKSA-N 1 0 323.864 4.135 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]CC1(C(F)(F)F)CCCC1 ZINC001560954904 1060818981 /nfs/dbraw/zinc/81/89/81/1060818981.db2.gz GCBINKSWJXLRKC-UHFFFAOYSA-N 1 0 314.395 4.273 20 10 DICDRO Oc1cc(F)c(Cl)cc1CNc1ccc2c([nH+]1)CCCC2 ZINC001560997053 1060857229 /nfs/dbraw/zinc/85/72/29/1060857229.db2.gz JQWFFXFTCOOPCN-UHFFFAOYSA-N 1 0 306.768 4.071 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+]CC1(c2cccc(F)c2)CCC1 ZINC001561001079 1060861862 /nfs/dbraw/zinc/86/18/62/1060861862.db2.gz KELMXKKAGYQPID-UHFFFAOYSA-N 1 0 319.807 4.396 20 10 DICDRO Cc1ccc(C[N@@H+]2Cc3ccccc3OC3(CCC3)C2)c(O)c1 ZINC001561006101 1060866227 /nfs/dbraw/zinc/86/62/27/1060866227.db2.gz XZGXRROAFZPQJE-UHFFFAOYSA-N 1 0 309.409 4.018 20 10 DICDRO Cc1cccc(C2=CC[N@H+](Cc3cc(F)ccc3O)CC2)c1C ZINC001561043511 1060895399 /nfs/dbraw/zinc/89/53/99/1060895399.db2.gz ZMDSUWVXQMKVLP-UHFFFAOYSA-N 1 0 311.400 4.437 20 10 DICDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001462134388 1060954092 /nfs/dbraw/zinc/95/40/92/1060954092.db2.gz BYJLGBATKYOKEJ-DYVFJYSZSA-N 1 0 305.462 4.319 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](OC)C1CCCCC1 ZINC001473196590 1060954922 /nfs/dbraw/zinc/95/49/22/1060954922.db2.gz ZPHCKKJHLRRCAK-IBGZPJMESA-N 1 0 305.462 4.200 20 10 DICDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001462134392 1060955045 /nfs/dbraw/zinc/95/50/45/1060955045.db2.gz BYJLGBATKYOKEJ-GUYCJALGSA-N 1 0 305.462 4.319 20 10 DICDRO Oc1ccc(F)cc1C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC001462152009 1060975408 /nfs/dbraw/zinc/97/54/08/1060975408.db2.gz UYVCDNVKJLMZTL-IDHPPYADSA-N 1 0 311.400 4.442 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]CCCc1cccc(Cl)c1 ZINC001462176643 1060995841 /nfs/dbraw/zinc/99/58/41/1060995841.db2.gz PTIYQYBQMMTNCG-UHFFFAOYSA-N 1 0 316.876 4.437 20 10 DICDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001462204278 1061023925 /nfs/dbraw/zinc/02/39/25/1061023925.db2.gz UIRGINSDXOTXFH-HIFRSBDPSA-N 1 0 305.462 4.461 20 10 DICDRO CC(C)[C@@H]1[N@H+](Cc2c(O)cccc2Br)CC1(C)C ZINC001462291895 1061083688 /nfs/dbraw/zinc/08/36/88/1061083688.db2.gz HTRXABCBULOILJ-AWEZNQCLSA-N 1 0 312.251 4.021 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@H](C(C)(C)C)C[C@H]2C)cc1OC ZINC001462315176 1061100944 /nfs/dbraw/zinc/10/09/44/1061100944.db2.gz NKGMWSURHYLTBL-HIFRSBDPSA-N 1 0 321.461 4.056 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](CC(C)(C)C)C2(C)C)c1 ZINC001462334330 1061110876 /nfs/dbraw/zinc/11/08/76/1061110876.db2.gz LWHFRRXAYJFLRL-OAHLLOKOSA-N 1 0 305.462 4.438 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC001462355544 1061126388 /nfs/dbraw/zinc/12/63/88/1061126388.db2.gz KZBYEEWXQUSRIN-JHDROBOHSA-N 1 0 302.506 4.406 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]C1(c2cccc(F)c2)CCC1 ZINC001462368545 1061132617 /nfs/dbraw/zinc/13/26/17/1061132617.db2.gz NFJYRGAELDNYDS-UHFFFAOYSA-N 1 0 312.432 4.369 20 10 DICDRO COc1ccc(N2CC[C@@H](C[NH2+][C@@H](C)CC3CCCC3)C2)cc1 ZINC001462374741 1061136665 /nfs/dbraw/zinc/13/66/65/1061136665.db2.gz NTHAWJFFMODNRM-WMZOPIPTSA-N 1 0 316.489 4.080 20 10 DICDRO CCc1cccc(CN2CCc3sc(Cl)cc3C2)c1O ZINC001462388470 1061143856 /nfs/dbraw/zinc/14/38/56/1061143856.db2.gz NOOFPBODKLCFMP-UHFFFAOYSA-N 1 0 307.846 4.228 20 10 DICDRO CC1(C)C[N@H+](Cc2ccc(Cl)cc2O)CCc2ccccc21 ZINC001462422653 1061164252 /nfs/dbraw/zinc/16/42/52/1061164252.db2.gz VQOBTLWMZNYSSB-UHFFFAOYSA-N 1 0 315.844 4.382 20 10 DICDRO COc1ccc(N2CC[C@@H]([NH2+]CCCC3CCCCC3)C2)cc1 ZINC001462423102 1061164645 /nfs/dbraw/zinc/16/46/45/1061164645.db2.gz ZPVHFFYAXGOLOQ-GOSISDBHSA-N 1 0 316.489 4.224 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]Cc1c(Cl)oc2ccccc21 ZINC001462428746 1061168166 /nfs/dbraw/zinc/16/81/66/1061168166.db2.gz YENAQCPKLAZLDJ-UHFFFAOYSA-N 1 0 305.736 4.221 20 10 DICDRO C[NH+](C)Cc1ccc2[nH]c(-c3ccc(-n4cccc4)cc3)nc2c1 ZINC001250999527 1061175613 /nfs/dbraw/zinc/17/56/13/1061175613.db2.gz RHZBJMUYMALNDC-UHFFFAOYSA-N 1 0 316.408 4.082 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]12 ZINC001462444372 1061178171 /nfs/dbraw/zinc/17/81/71/1061178171.db2.gz KMCBWUDESASCRB-USXIJHARSA-N 1 0 320.219 4.127 20 10 DICDRO Cc1cccc(CC2C[NH+](Cc3cc(Cl)c(C)cc3O)C2)c1 ZINC001462453845 1061183475 /nfs/dbraw/zinc/18/34/75/1061183475.db2.gz NKQUGTGONORCIT-UHFFFAOYSA-N 1 0 315.844 4.337 20 10 DICDRO C[C@@H]([NH2+][C@@H]1C[C@H](Oc2ccccc2)C1(C)C)c1ccccc1O ZINC001462510341 1061219920 /nfs/dbraw/zinc/21/99/20/1061219920.db2.gz FLQGGBKUJMLRFJ-ZMYBRWDISA-N 1 0 311.425 4.289 20 10 DICDRO Cc1ccc(C[NH2+]Cc2cc(C(C)C)ccc2O)c(Cl)n1 ZINC001462549584 1061253417 /nfs/dbraw/zinc/25/34/17/1061253417.db2.gz ULOBADABXYPESU-UHFFFAOYSA-N 1 0 304.821 4.162 20 10 DICDRO CCc1cccc(C[NH2+]Cc2cccc(OC(C)(C)C)c2)c1O ZINC001462561385 1061263187 /nfs/dbraw/zinc/26/31/87/1061263187.db2.gz IMWNACWLIIBJGN-UHFFFAOYSA-N 1 0 313.441 4.422 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1Oc1cccnc1)c1ccccc1O ZINC001473722116 1061371551 /nfs/dbraw/zinc/37/15/51/1061371551.db2.gz FECQLMYVVINZNF-HNNXBMFYSA-N 1 0 320.392 4.430 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)CC2)cc1 ZINC001473888887 1061449491 /nfs/dbraw/zinc/44/94/91/1061449491.db2.gz XUTCHOHJUNOXNC-NRFANRHFSA-N 1 0 324.468 4.106 20 10 DICDRO CCc1ccc2c(c1)C[N@@H+](Cc1ccc(N(C)C)c(C)c1)CC2 ZINC001473904585 1061454946 /nfs/dbraw/zinc/45/49/46/1061454946.db2.gz DAONOXRBZLJXTH-UHFFFAOYSA-N 1 0 308.469 4.182 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(OC)cc1 ZINC001473915122 1061463137 /nfs/dbraw/zinc/46/31/37/1061463137.db2.gz HHJBPCKDXDBVQA-LJQANCHMSA-N 1 0 311.425 4.261 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H](C)Cc2ccccc2F)c(Cl)c1 ZINC001473952020 1061493835 /nfs/dbraw/zinc/49/38/35/1061493835.db2.gz JRXLUZOJGQBFPG-LBPRGKRZSA-N 1 0 307.796 4.214 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCCOc1ccc(C)cc1 ZINC001473969193 1061512477 /nfs/dbraw/zinc/51/24/77/1061512477.db2.gz PEFFQPCZBMMRER-UHFFFAOYSA-N 1 0 322.452 4.354 20 10 DICDRO Cc1cc(C)c(/C=C/C[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC001473970367 1061516474 /nfs/dbraw/zinc/51/64/74/1061516474.db2.gz QBNAGZOAOQYPSG-SNAWJCMRSA-N 1 0 307.437 4.350 20 10 DICDRO COc1ccc(Cl)cc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC001473995026 1061537597 /nfs/dbraw/zinc/53/75/97/1061537597.db2.gz BVXBJOULIWAPBX-UHFFFAOYSA-N 1 0 318.848 4.013 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2sccc2OC)cc1F ZINC001473995953 1061540674 /nfs/dbraw/zinc/54/06/74/1061540674.db2.gz UNSQREHFSITGIO-UHFFFAOYSA-N 1 0 322.449 4.032 20 10 DICDRO CSCCC[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001474011938 1061551331 /nfs/dbraw/zinc/55/13/31/1061551331.db2.gz RLPAETGUJXSPIC-UHFFFAOYSA-N 1 0 320.527 4.227 20 10 DICDRO Cc1[nH+]c2cc(NC/C=C\c3ccc(N(C)C)cc3)ccc2n1C ZINC001474051637 1061597280 /nfs/dbraw/zinc/59/72/80/1061597280.db2.gz IURBKACUKARZPQ-WAYWQWQTSA-N 1 0 320.440 4.073 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC001474069334 1061616336 /nfs/dbraw/zinc/61/63/36/1061616336.db2.gz RTLOYLOSSDVDEI-MRXNPFEDSA-N 1 0 312.457 4.068 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)cc(OC)c2)cc1 ZINC001474081400 1061629874 /nfs/dbraw/zinc/62/98/74/1061629874.db2.gz WPJLCRQCWMSHNQ-UHFFFAOYSA-N 1 0 312.457 4.140 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H](CC)[C@@H]2CCCO2)cc1 ZINC001474099236 1061645592 /nfs/dbraw/zinc/64/55/92/1061645592.db2.gz IEILFENISWDFNO-UXHICEINSA-N 1 0 318.505 4.360 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCCc3sccc32)cc1 ZINC001474102764 1061650435 /nfs/dbraw/zinc/65/04/35/1061650435.db2.gz OAXZNEVQJZMNEL-WRFKIARRSA-N 1 0 312.482 4.495 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC001474118202 1061665492 /nfs/dbraw/zinc/66/54/92/1061665492.db2.gz HVQFIPHYPRBLET-UHFFFAOYSA-N 1 0 322.452 4.004 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@H]2CSc3ccccc32)c(Cl)c1 ZINC001474157857 1061698448 /nfs/dbraw/zinc/69/84/48/1061698448.db2.gz QIOVIVKPZUNJBL-LBPRGKRZSA-N 1 0 319.857 4.333 20 10 DICDRO CC/C=C/C[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001474160696 1061703376 /nfs/dbraw/zinc/70/33/76/1061703376.db2.gz NMJUFNIFCRELRM-SNAWJCMRSA-N 1 0 300.471 4.440 20 10 DICDRO CCc1ccccc1C[NH2+][C@H](C)Cc1ccc(N(C)C)cc1C ZINC001474184493 1061733438 /nfs/dbraw/zinc/73/34/38/1061733438.db2.gz FGYSSBVUDZIZJR-QGZVFWFLSA-N 1 0 310.485 4.344 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCC3(CCCC3)O2)cc1 ZINC001474195070 1061744874 /nfs/dbraw/zinc/74/48/74/1061744874.db2.gz KHDGPHZMTIYATJ-LJQANCHMSA-N 1 0 316.489 4.114 20 10 DICDRO CCOc1ccc([C@@H]2C[C@H]2[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001474211222 1061765442 /nfs/dbraw/zinc/76/54/42/1061765442.db2.gz IPCWLTQCMTXCLV-VQTJNVASSA-N 1 0 323.436 4.056 20 10 DICDRO CCSc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC001474247997 1061815215 /nfs/dbraw/zinc/81/52/15/1061815215.db2.gz MQWPYYOADOOVOB-UHFFFAOYSA-N 1 0 318.461 4.294 20 10 DICDRO CSC1CCC(C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001474267193 1061831884 /nfs/dbraw/zinc/83/18/84/1061831884.db2.gz NQDSPPIMDBWOTJ-UHFFFAOYSA-N 1 0 318.530 4.298 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1C[C@H]1Cc1ccccc1 ZINC001474299889 1061870945 /nfs/dbraw/zinc/87/09/45/1061870945.db2.gz OSEUXTLLKDHVFS-MOPGFXCFSA-N 1 0 318.464 4.455 20 10 DICDRO CC[C@H](C)[C@@H](C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)OC ZINC001474307584 1061872667 /nfs/dbraw/zinc/87/26/67/1061872667.db2.gz ORFOAAOGSABXQU-FXAWDEMLSA-N 1 0 318.505 4.170 20 10 DICDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001474309836 1061875754 /nfs/dbraw/zinc/87/57/54/1061875754.db2.gz MLVUGHRSFBQVQL-CYBMUJFWSA-N 1 0 300.368 4.146 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCOc3ccccc3[C@@H]2C)cc1Cl ZINC001474363755 1061993472 /nfs/dbraw/zinc/99/34/72/1061993472.db2.gz KZRNDPYDEOXYSO-ZDUSSCGKSA-N 1 0 317.816 4.310 20 10 DICDRO CCC[N@H+](CCc1ccc(F)cc1F)Cc1ccccc1O ZINC001474367840 1062000774 /nfs/dbraw/zinc/00/07/74/1062000774.db2.gz CGJDQXXEXIBHJL-UHFFFAOYSA-N 1 0 305.368 4.125 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cc(F)ccc1N(C)C ZINC001474368629 1062002157 /nfs/dbraw/zinc/00/21/57/1062002157.db2.gz SXEOUWFBBOGZJQ-UHFFFAOYSA-N 1 0 316.420 4.010 20 10 DICDRO CC[C@H]1CCC[C@H](CN(C)c2ccc(OCC[NH+](C)C)cc2)C1 ZINC001474421998 1062095054 /nfs/dbraw/zinc/09/50/54/1062095054.db2.gz PNHRKVNEBFDVDH-ROUUACIJSA-N 1 0 318.505 4.280 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2CCc2ccccc2)cc1 ZINC001459336041 1062096462 /nfs/dbraw/zinc/09/64/62/1062096462.db2.gz MDQOEEVOGJYCCC-OAQYLSRUSA-N 1 0 308.469 4.350 20 10 DICDRO C[C@H]([NH2+]C1CCc2ccccc2CC1)c1ccc(N(C)C)cc1 ZINC001254455099 1062116425 /nfs/dbraw/zinc/11/64/25/1062116425.db2.gz WKBMALZWJSSWTA-INIZCTEOSA-N 1 0 308.469 4.351 20 10 DICDRO Oc1cccc(Br)c1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001474451816 1062129952 /nfs/dbraw/zinc/12/99/52/1062129952.db2.gz IJXTWEBOUSFWMO-UHFFFAOYSA-N 1 0 324.262 4.311 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001474477838 1062158477 /nfs/dbraw/zinc/15/84/77/1062158477.db2.gz ZPWIOAGGAJVCCQ-SFHVURJKSA-N 1 0 312.432 4.190 20 10 DICDRO COc1ccc(O)c(C[NH2+]CC[C@H]2C[C@@H](C)CC(C)(C)C2)c1 ZINC001474484026 1062164707 /nfs/dbraw/zinc/16/47/07/1062164707.db2.gz MECPCIMOAXBGCI-CABCVRRESA-N 1 0 305.462 4.343 20 10 DICDRO CCCN(CCc1ccc(F)cc1Cl)c1ccc(C[NH3+])cc1 ZINC001474495703 1062176039 /nfs/dbraw/zinc/17/60/39/1062176039.db2.gz OMUZKRGIKYLABP-UHFFFAOYSA-N 1 0 320.839 4.397 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)[C@@H](OC)c1ccccc1 ZINC001474496235 1062176122 /nfs/dbraw/zinc/17/61/22/1062176122.db2.gz RUOFOAHIZFBBRP-OXJNMPFZSA-N 1 0 312.457 4.138 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(=Cc2cccc(F)c2)CC1 ZINC001474499074 1062178688 /nfs/dbraw/zinc/17/86/88/1062178688.db2.gz JCKJQNBQSXPNPF-UHFFFAOYSA-N 1 0 315.363 4.350 20 10 DICDRO CCC[N@H+](Cc1ccc(C)c(Cl)n1)Cc1ccccc1O ZINC001459554414 1062205253 /nfs/dbraw/zinc/20/52/53/1062205253.db2.gz KPADKINHRPBEDM-UHFFFAOYSA-N 1 0 304.821 4.161 20 10 DICDRO CCC[N@H+](Cc1ccc(Cl)c(OC)c1)Cc1ccccc1O ZINC001459557865 1062207854 /nfs/dbraw/zinc/20/78/54/1062207854.db2.gz SPYMOWBFGMFOFX-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCc2ccccc2CC1 ZINC001474528724 1062213057 /nfs/dbraw/zinc/21/30/57/1062213057.db2.gz VBUNTKKVUQQHFR-UHFFFAOYSA-N 1 0 301.817 4.037 20 10 DICDRO C[C@@H]1C[C@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001474544402 1062235582 /nfs/dbraw/zinc/23/55/82/1062235582.db2.gz GOSBLXJFHGJQNX-IGCXYCKISA-N 1 0 317.379 4.437 20 10 DICDRO COc1ccc(O)c(C[NH2+]C[C@@H]2CCC[C@@H]2c2ccccc2)c1 ZINC001474544547 1062238676 /nfs/dbraw/zinc/23/86/76/1062238676.db2.gz RCEWCKLMQHHDHR-QFBILLFUSA-N 1 0 311.425 4.074 20 10 DICDRO CCC(CC)[N@@H+](Cc1ccc(N2CCOCC2)cc1)CC(C)C ZINC001459602411 1062239643 /nfs/dbraw/zinc/23/96/43/1062239643.db2.gz HFQCHEFZPCTTFY-UHFFFAOYSA-N 1 0 318.505 4.170 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(Br)cc1O)[C@@H]1CC1(C)C ZINC001474587268 1062295488 /nfs/dbraw/zinc/29/54/88/1062295488.db2.gz PSJRGQQQKZDJHZ-STQMWFEESA-N 1 0 312.251 4.069 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc2cccc(OC)c2o1)c1ccccc1O ZINC001255175422 1062347242 /nfs/dbraw/zinc/34/72/42/1062347242.db2.gz LBZDHOKDXNTTGM-MRXNPFEDSA-N 1 0 311.381 4.388 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)COc1ccccc1F)c1ccccc1O ZINC001255175413 1062348812 /nfs/dbraw/zinc/34/88/12/1062348812.db2.gz LAONNKRSIATCRE-CZUORRHYSA-N 1 0 303.377 4.040 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H](C)CCc2c[nH]c3ccccc23)c1 ZINC001474634199 1062356330 /nfs/dbraw/zinc/35/63/30/1062356330.db2.gz CJOKVPKQPNPYNP-OAHLLOKOSA-N 1 0 308.425 4.293 20 10 DICDRO Cc1cc(O)c(C[NH+]2CC(Cc3ccsc3)C2)c(Cl)c1 ZINC001474643323 1062367444 /nfs/dbraw/zinc/36/74/44/1062367444.db2.gz PZYRNUAWSBQLJB-UHFFFAOYSA-N 1 0 307.846 4.090 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C2(CO)CCCCCCC2)c1 ZINC001474673715 1062406073 /nfs/dbraw/zinc/40/60/73/1062406073.db2.gz MMGMZMKZOSKFHV-UHFFFAOYSA-N 1 0 305.462 4.081 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1c2ccccc2CC[C@H]1F ZINC001474680214 1062409827 /nfs/dbraw/zinc/40/98/27/1062409827.db2.gz VGUXPAVQYLEZKW-UXHICEINSA-N 1 0 312.432 4.176 20 10 DICDRO COc1ccc(N(C[C@H]2CCCC[N@@H+]2C(C)C)C(C)C)cc1F ZINC001459802112 1062410138 /nfs/dbraw/zinc/41/01/38/1062410138.db2.gz RLCWAKNYNKPCJW-QGZVFWFLSA-N 1 0 322.468 4.312 20 10 DICDRO COc1ccc(N(C[C@@H]2CCCC[N@@H+]2C(C)C)C(C)C)cc1F ZINC001459802111 1062410833 /nfs/dbraw/zinc/41/08/33/1062410833.db2.gz RLCWAKNYNKPCJW-KRWDZBQOSA-N 1 0 322.468 4.312 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1CCOC(C)(C)C1 ZINC001255534671 1062475175 /nfs/dbraw/zinc/47/51/75/1062475175.db2.gz GYUIVBUCZNUKHW-RDTXWAMCSA-N 1 0 317.473 4.180 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC001255719223 1062536874 /nfs/dbraw/zinc/53/68/74/1062536874.db2.gz CHORTTDCINTCLH-ZBFHGGJFSA-N 1 0 314.395 4.306 20 10 DICDRO C[C@@H]([NH2+]C[C@H]1CCCC12CCOCC2)c1ccc(N(C)C)cc1 ZINC001459979003 1062541113 /nfs/dbraw/zinc/54/11/13/1062541113.db2.gz HJHGGXIYUZXYIM-SJLPKXTDSA-N 1 0 316.489 4.000 20 10 DICDRO C[C@H](CSc1ccc(F)cc1)[NH2+][C@@H](C)c1ccccc1O ZINC001255729402 1062549917 /nfs/dbraw/zinc/54/99/17/1062549917.db2.gz HKXNVDYIINDGOE-OLZOCXBDSA-N 1 0 305.418 4.363 20 10 DICDRO C[C@H](CSc1ccc(F)cc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001255728296 1062550651 /nfs/dbraw/zinc/55/06/51/1062550651.db2.gz QDDWSQHZBUXEKH-CYBMUJFWSA-N 1 0 317.429 4.031 20 10 DICDRO Cc1cc(C)c(C[NH2+][C@@H](C)CSc2ccc(F)cc2)c(O)c1 ZINC001255735864 1062557693 /nfs/dbraw/zinc/55/76/93/1062557693.db2.gz OXJFUHIZUKUOEQ-AWEZNQCLSA-N 1 0 319.445 4.419 20 10 DICDRO Cc1cc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)ccc1N(C)C ZINC001460024584 1062578696 /nfs/dbraw/zinc/57/86/96/1062578696.db2.gz XGLSFTGZYLCXHN-HXUWFJFHSA-N 1 0 312.432 4.132 20 10 DICDRO Cc1ccc(C[C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC001255774060 1062597279 /nfs/dbraw/zinc/59/72/79/1062597279.db2.gz UWKKXNDSTAPHDU-SFHVURJKSA-N 1 0 308.469 4.316 20 10 DICDRO Cc1ccc(SC[C@H](C)[N@H+](C)Cc2ccccc2O)cc1 ZINC001255772336 1062598009 /nfs/dbraw/zinc/59/80/09/1062598009.db2.gz ZBPJILPOZGWMBR-HNNXBMFYSA-N 1 0 301.455 4.313 20 10 DICDRO C[C@H](Cc1ccccc1F)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001255829023 1062614955 /nfs/dbraw/zinc/61/49/55/1062614955.db2.gz DCQQIPIKTNELGX-MRXNPFEDSA-N 1 0 312.432 4.147 20 10 DICDRO C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001255834285 1062617619 /nfs/dbraw/zinc/61/76/19/1062617619.db2.gz HACVETCOXCHTLT-CABCVRRESA-N 1 0 300.421 4.174 20 10 DICDRO Cc1cc(C[N@@H+](C)[C@H](C)Cc2cccc(F)c2)ccc1N(C)C ZINC001460220317 1062703535 /nfs/dbraw/zinc/70/35/35/1062703535.db2.gz IMBQPXXOGWXGIT-MRXNPFEDSA-N 1 0 314.448 4.263 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H](C)Cc1ccncc1 ZINC001256732261 1062955309 /nfs/dbraw/zinc/95/53/09/1062955309.db2.gz CXISUKYXBHLBCJ-FOIQADDNSA-N 1 0 324.468 4.248 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC001256819613 1062998645 /nfs/dbraw/zinc/99/86/45/1062998645.db2.gz DOKLIQCILTYKCC-QUCCMNQESA-N 1 0 311.425 4.134 20 10 DICDRO Oc1cc2ccccc2cc1C[NH2+][C@H]1CCCN(C2CCCC2)C1 ZINC001256905483 1063040476 /nfs/dbraw/zinc/04/04/76/1063040476.db2.gz RWXPKAHTBKBRMF-IBGZPJMESA-N 1 0 324.468 4.042 20 10 DICDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2ccc(F)cc2F)cc1 ZINC001460776851 1063054421 /nfs/dbraw/zinc/05/44/21/1063054421.db2.gz GDYZDFHIHSRAJQ-UHFFFAOYSA-N 1 0 304.384 4.056 20 10 DICDRO Cc1cc(C[N@H+](CCc2ccccc2)C2CC2)ccc1N(C)C ZINC001460837600 1063089149 /nfs/dbraw/zinc/08/91/49/1063089149.db2.gz XCUISCUPJJKRHS-UHFFFAOYSA-N 1 0 308.469 4.268 20 10 DICDRO c1ccc2c(c1)CCC[C@@H]2C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001461018146 1063192182 /nfs/dbraw/zinc/19/21/82/1063192182.db2.gz BTWRCHFDDOVLEH-LJQANCHMSA-N 1 0 307.437 4.221 20 10 DICDRO COc1cc(C[NH2+][C@@H]2CCC[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC001461042246 1063209769 /nfs/dbraw/zinc/20/97/69/1063209769.db2.gz WPGPAHGWIVYCOE-DZGCQCFKSA-N 1 0 305.462 4.367 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCO[C@H]2CCCC[C@@H]2C)c(Cl)c1 ZINC001461053843 1063220855 /nfs/dbraw/zinc/22/08/55/1063220855.db2.gz PITWCFYQFLMSHJ-GUYCJALGSA-N 1 0 311.853 4.039 20 10 DICDRO CC(C)Oc1cccc(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001461061865 1063223640 /nfs/dbraw/zinc/22/36/40/1063223640.db2.gz HZJHTKKQVTWSSV-UHFFFAOYSA-N 1 0 311.425 4.089 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCOc2c(C)cccc2C)c(Cl)c1 ZINC001461080123 1063238015 /nfs/dbraw/zinc/23/80/15/1063238015.db2.gz YTLLXPSOIKYMTH-UHFFFAOYSA-N 1 0 319.832 4.139 20 10 DICDRO CCCCCC1CCC([NH2+]CCc2ccc(O)c(O)c2)CC1 ZINC001257370207 1063239506 /nfs/dbraw/zinc/23/95/06/1063239506.db2.gz FIQOMLGCUCAQQM-UHFFFAOYSA-N 1 0 305.462 4.369 20 10 DICDRO C[C@H](Cc1ccsc1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001461091261 1063248905 /nfs/dbraw/zinc/24/89/05/1063248905.db2.gz JJNDYTMVICJHRD-MBVDDHJVSA-N 1 0 300.471 4.048 20 10 DICDRO COc1ccc(C[NH2+][C@H](c2ccccc2)[C@H]2CCCO2)cc1C ZINC001461118256 1063267038 /nfs/dbraw/zinc/26/70/38/1063267038.db2.gz ZRGANVWIMPXYAZ-WOJBJXKFSA-N 1 0 311.425 4.014 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2cccc3cccnc32)cc1 ZINC001461121331 1063271175 /nfs/dbraw/zinc/27/11/75/1063271175.db2.gz PNIZWUYYFNRGIG-GQCTYLIASA-N 1 0 317.436 4.104 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2cccc(C)c2)cc1F ZINC001461136082 1063285199 /nfs/dbraw/zinc/28/51/99/1063285199.db2.gz GQLPVGMGOSPDBO-UHFFFAOYSA-N 1 0 314.448 4.313 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(C)cc1 ZINC001461155333 1063298806 /nfs/dbraw/zinc/29/88/06/1063298806.db2.gz LYHQYKDNHGAVHA-GOSISDBHSA-N 1 0 300.421 4.441 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C)Cc2ccc(O)cc2)cc1C ZINC001461170412 1063307699 /nfs/dbraw/zinc/30/76/99/1063307699.db2.gz PDCCWUDBOWPPHR-MRXNPFEDSA-N 1 0 313.441 4.210 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](C)Cc2ccc(O)cc2)cc1C ZINC001461170408 1063309367 /nfs/dbraw/zinc/30/93/67/1063309367.db2.gz PDCCWUDBOWPPHR-INIZCTEOSA-N 1 0 313.441 4.210 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCOC1CCCCCC1 ZINC001461203115 1063329774 /nfs/dbraw/zinc/32/97/74/1063329774.db2.gz FLTDBCLBHPAHCB-UHFFFAOYSA-N 1 0 314.473 4.316 20 10 DICDRO CCCCCC(CCCCC)[NH2+]CCc1cc(O)c(O)cc1O ZINC001257549630 1063330185 /nfs/dbraw/zinc/33/01/85/1063330185.db2.gz AIJKKGQDSKXPSD-UHFFFAOYSA-N 1 0 323.477 4.465 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@H]2Cc2ccccc2)c(Cl)c1 ZINC001461219793 1063343349 /nfs/dbraw/zinc/34/33/49/1063343349.db2.gz CBKYUWOBAPUMAF-RHSMWYFYSA-N 1 0 301.817 4.075 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@@H]2Cc2ccccc2)cc1 ZINC001461221818 1063343770 /nfs/dbraw/zinc/34/37/70/1063343770.db2.gz JYVIOKFLBGIQCB-PZJWPPBQSA-N 1 0 308.469 4.254 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2C[C@](C)(OC)C2(C)C)cc1C ZINC001461239091 1063358701 /nfs/dbraw/zinc/35/87/01/1063358701.db2.gz OBNQCVIZKCGRKR-MJGOQNOKSA-N 1 0 305.462 4.077 20 10 DICDRO Cc1cc(C)cc(C[C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC001461251027 1063365470 /nfs/dbraw/zinc/36/54/70/1063365470.db2.gz KOKPYGZFQXVKHQ-INIZCTEOSA-N 1 0 314.448 4.229 20 10 DICDRO Cc1cc(C)cc(C[C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC001461251028 1063367559 /nfs/dbraw/zinc/36/75/59/1063367559.db2.gz KOKPYGZFQXVKHQ-MRXNPFEDSA-N 1 0 314.448 4.229 20 10 DICDRO CCO[C@H](CC[NH2+]Cc1c(C)c2ccccc2n1C)C(C)C ZINC001461269483 1063381476 /nfs/dbraw/zinc/38/14/76/1063381476.db2.gz SFOBKIWKTJBTRZ-LJQANCHMSA-N 1 0 302.462 4.028 20 10 DICDRO Cc1cccc(C)c1CC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001461285629 1063392175 /nfs/dbraw/zinc/39/21/75/1063392175.db2.gz GVAVQTAVGVMBEL-TWGQIWQCSA-N 1 0 308.469 4.215 20 10 DICDRO Oc1ccccc1C[NH2+]C1CCC(OCc2ccccc2)CC1 ZINC001257821141 1063392754 /nfs/dbraw/zinc/39/27/54/1063392754.db2.gz DRRDKMHBAYLOTE-UHFFFAOYSA-N 1 0 311.425 4.010 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H](COC)c2ccccc2)cc1C ZINC001461359356 1063442838 /nfs/dbraw/zinc/44/28/38/1063442838.db2.gz LUSJOKAFWMSYPA-IBGZPJMESA-N 1 0 313.441 4.261 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@@H](OC)C2(CC)CC)cc1 ZINC001461372960 1063455635 /nfs/dbraw/zinc/45/56/35/1063455635.db2.gz HWTYZVPMTIXARL-RTBURBONSA-N 1 0 318.505 4.216 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCc3ccccc3C2)c(Cl)c1 ZINC001461393278 1063470267 /nfs/dbraw/zinc/47/02/67/1063470267.db2.gz QXLXNSQQWAPBHL-CQSZACIVSA-N 1 0 315.844 4.249 20 10 DICDRO CC(C)C[C@H](C)C[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001258052522 1063485376 /nfs/dbraw/zinc/48/53/76/1063485376.db2.gz QGCOOPDEQNOKJH-ZWKOTPCHSA-N 1 0 318.505 4.074 20 10 DICDRO CC(C)C[C@@H](C)C[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001258052518 1063485736 /nfs/dbraw/zinc/48/57/36/1063485736.db2.gz QGCOOPDEQNOKJH-QZTJIDSGSA-N 1 0 318.505 4.074 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)cc1C ZINC001461427364 1063495103 /nfs/dbraw/zinc/49/51/03/1063495103.db2.gz VNALZHUVEUEOFZ-WOJBJXKFSA-N 1 0 317.473 4.079 20 10 DICDRO C[C@H](CC[NH2+]Cc1ccc(N2CCOCC2)cc1)CC(C)(C)C ZINC001461432905 1063499150 /nfs/dbraw/zinc/49/91/50/1063499150.db2.gz DYSFBAIALCVHFF-QGZVFWFLSA-N 1 0 318.505 4.075 20 10 DICDRO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC001461439254 1063505192 /nfs/dbraw/zinc/50/51/92/1063505192.db2.gz BHBRJZQINOYQGF-JTGQJZMRSA-N 1 0 323.484 4.183 20 10 DICDRO COc1cc(C[NH2+][C@@H]2C[C@H]2CC(C)C)c(O)c(C(C)(C)C)c1 ZINC001461565559 1063581762 /nfs/dbraw/zinc/58/17/62/1063581762.db2.gz CUUVNQYSECDDPN-CXAGYDPISA-N 1 0 305.462 4.223 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@H]2CCC[C@H]2C2CC2)ccc1OC ZINC001461577981 1063590305 /nfs/dbraw/zinc/59/03/05/1063590305.db2.gz FHJVJOGOLAYZFH-MJGOQNOKSA-N 1 0 317.473 4.148 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CC2(Cl)Cl)cc1 ZINC001461652000 1063636988 /nfs/dbraw/zinc/63/69/88/1063636988.db2.gz GYSGXABSTGEFNS-CQSZACIVSA-N 1 0 315.288 4.206 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc(O)c(Cl)c1 ZINC001461730368 1063684262 /nfs/dbraw/zinc/68/42/62/1063684262.db2.gz LMQIIDYWIDPKHW-UHFFFAOYSA-N 1 0 314.816 4.136 20 10 DICDRO CCCCC[C@@H](CCC)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001258660886 1063730016 /nfs/dbraw/zinc/73/00/16/1063730016.db2.gz AJNADVISBZDRIN-LJQANCHMSA-N 1 0 318.505 4.362 20 10 DICDRO Oc1cc(Cl)ccc1C[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC001461838824 1063742807 /nfs/dbraw/zinc/74/28/07/1063742807.db2.gz QEROUKLULJKGAI-UHFFFAOYSA-N 1 0 305.780 4.349 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H](C)Cc1cccc(Cl)c1 ZINC001258751132 1063797082 /nfs/dbraw/zinc/79/70/82/1063797082.db2.gz IFZKEBBEDKOMGO-CQSZACIVSA-N 1 0 303.833 4.499 20 10 DICDRO CCCC[C@@H](CCC)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258762936 1063806363 /nfs/dbraw/zinc/80/63/63/1063806363.db2.gz FRYVGIVKJGNYRV-LJQANCHMSA-N 1 0 318.505 4.314 20 10 DICDRO CC[C@H](C[C@@H](C)CC)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001258795495 1063830807 /nfs/dbraw/zinc/83/08/07/1063830807.db2.gz RSFCWHKWFITGLS-PKOBYXMFSA-N 1 0 318.505 4.170 20 10 DICDRO CC[C@@H](C)C[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001461975569 1063850120 /nfs/dbraw/zinc/85/01/20/1063850120.db2.gz QKHAPFRDJBBAGS-GFCCVEGCSA-N 1 0 302.384 4.249 20 10 DICDRO COCCCC[N@H+](Cc1ccccc1)Cc1ccc(C)cc1O ZINC001461982348 1063857619 /nfs/dbraw/zinc/85/76/19/1063857619.db2.gz LMRSRRAVHPPNRN-UHFFFAOYSA-N 1 0 313.441 4.129 20 10 DICDRO CC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001258838084 1063860018 /nfs/dbraw/zinc/86/00/18/1063860018.db2.gz MGZRLKVVCKECRT-HXUWFJFHSA-N 1 0 308.469 4.398 20 10 DICDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001462005779 1063873995 /nfs/dbraw/zinc/87/39/95/1063873995.db2.gz BSDISAGLJFJOCO-CHWSQXEVSA-N 1 0 314.395 4.249 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+](C)CCc1ccc(Cl)cc1 ZINC001462013350 1063878443 /nfs/dbraw/zinc/87/84/43/1063878443.db2.gz KSZFEOQPXPVWHY-UHFFFAOYSA-N 1 0 316.876 4.389 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1COc2ccccc21 ZINC001261139648 1063909920 /nfs/dbraw/zinc/90/99/20/1063909920.db2.gz UJFQQMOTWWDOTI-IJEWVQPXSA-N 1 0 309.409 4.015 20 10 DICDRO CS[C@H](C[NH2+]Cc1cc(Cl)c(C)cc1O)C(C)(C)C ZINC001462081688 1063918561 /nfs/dbraw/zinc/91/85/61/1063918561.db2.gz BBIHLXJZGVLPBH-CQSZACIVSA-N 1 0 301.883 4.221 20 10 DICDRO COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2Cc2ccc(C)cc2O)c1 ZINC001462086901 1063922287 /nfs/dbraw/zinc/92/22/87/1063922287.db2.gz KYXTZWFWTQBABC-BEFAXECRSA-N 1 0 311.425 4.292 20 10 DICDRO CCC1(CC)CCC[N@H+](Cc2ccc(OC)c(OC)c2O)CC1 ZINC001462095888 1063926092 /nfs/dbraw/zinc/92/60/92/1063926092.db2.gz UQDNAZDVVQMIAP-UHFFFAOYSA-N 1 0 321.461 4.202 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC(C)(C)[C@@H]1CCCCO1 ZINC001261850076 1063950011 /nfs/dbraw/zinc/95/00/11/1063950011.db2.gz YNZWGDXGYMFMBH-INMHGKMJSA-N 1 0 317.473 4.434 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)c1ccc(Br)cc1O ZINC001332341537 1064113526 /nfs/dbraw/zinc/11/35/26/1064113526.db2.gz WVQQFBJCRHHDRH-MVWJERBFSA-N 1 0 316.214 4.086 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCOCc1ccccc1 ZINC000390060863 1064146031 /nfs/dbraw/zinc/14/60/31/1064146031.db2.gz TXZCMYFHCOSHIH-DOTOQJQBSA-N 1 0 311.425 4.055 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCOCc1ccccc1 ZINC000390060865 1064146106 /nfs/dbraw/zinc/14/61/06/1064146106.db2.gz TXZCMYFHCOSHIH-RDJZCZTQSA-N 1 0 311.425 4.055 20 10 DICDRO COCc1ccccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000390973533 1064177065 /nfs/dbraw/zinc/17/70/65/1064177065.db2.gz PWNSFPITLTZMCY-WMLDXEAASA-N 1 0 311.425 4.185 20 10 DICDRO CC(C)C[N@H+](CCc1ccccc1)Cc1ccc(N(C)C)cc1 ZINC001307431405 1065391313 /nfs/dbraw/zinc/39/13/13/1065391313.db2.gz IUHMTYIKGZAKQJ-UHFFFAOYSA-N 1 0 310.485 4.453 20 10 DICDRO CC1(C)CC[C@@H](C[N@H+](Cc2ccccc2O)C2CCCC2)OC1 ZINC001307461054 1065413732 /nfs/dbraw/zinc/41/37/32/1065413732.db2.gz BSZIHPCJKRCUPX-SFHVURJKSA-N 1 0 317.473 4.342 20 10 DICDRO CC(C)C[C@H](C)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC001307566733 1065486158 /nfs/dbraw/zinc/48/61/58/1065486158.db2.gz LSSSYKRWGLPQCL-FUHWJXTLSA-N 1 0 305.462 4.055 20 10 DICDRO CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(F)cc(C(C)=O)c1O ZINC001307657299 1065547725 /nfs/dbraw/zinc/54/77/25/1065547725.db2.gz MGQQOAKFDKWUKO-DYVFJYSZSA-N 1 0 307.409 4.182 20 10 DICDRO COc1ccc2c(c1)C[C@H](C(C)C)CN2C[C@@H]1CCO[C@@H](C)C1 ZINC001307864137 1065657778 /nfs/dbraw/zinc/65/77/78/1065657778.db2.gz PHKLZGCEPDBODL-JZXOWHBKSA-N 1 0 317.473 4.145 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)Cc2ccccc2C2CC2)cc1 ZINC001307897440 1065671402 /nfs/dbraw/zinc/67/14/02/1065671402.db2.gz QEGRDAZBISJXAT-UHFFFAOYSA-N 1 0 324.468 4.141 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3ccccc3[C@H](C)C2)ccc1N(C)C ZINC001307905977 1065676639 /nfs/dbraw/zinc/67/66/39/1065676639.db2.gz TVBOBKVHDXWFMG-QGZVFWFLSA-N 1 0 308.469 4.223 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCc3ccccc3C(C)(C)C2)cc1 ZINC001307923730 1065684829 /nfs/dbraw/zinc/68/48/29/1065684829.db2.gz DUWDPOYGDZBNSP-UHFFFAOYSA-N 1 0 322.496 4.479 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c(Cl)c1 ZINC001308207958 1065814396 /nfs/dbraw/zinc/81/43/96/1065814396.db2.gz JLMLONHOCOFCPX-AAEUAGOBSA-N 1 0 305.805 4.360 20 10 DICDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001308232833 1065838279 /nfs/dbraw/zinc/83/82/79/1065838279.db2.gz VSTXFPWGIQRPJO-OAHLLOKOSA-N 1 0 311.425 4.261 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)CCO1 ZINC001308232714 1065839659 /nfs/dbraw/zinc/83/96/59/1065839659.db2.gz ZXGSBWOTRGFKSC-WMZOPIPTSA-N 1 0 316.489 4.113 20 10 DICDRO C/C(=C\c1ccc(Cl)cc1)C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001308235670 1065842523 /nfs/dbraw/zinc/84/25/23/1065842523.db2.gz HTPJXHNNRPJGPW-GXDHUFHOSA-N 1 0 313.828 4.468 20 10 DICDRO CCO[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N(CC)CC)c(F)c2)C1 ZINC001308261517 1065862695 /nfs/dbraw/zinc/86/26/95/1065862695.db2.gz UHYVLVVYOXFIBY-SJORKVTESA-N 1 0 322.468 4.109 20 10 DICDRO CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N(CC)CC)c(F)c2)C1 ZINC001308261515 1065863148 /nfs/dbraw/zinc/86/31/48/1065863148.db2.gz UHYVLVVYOXFIBY-IAGOWNOFSA-N 1 0 322.468 4.109 20 10 DICDRO Cc1cc(C)cc(CC[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC001308276606 1065877130 /nfs/dbraw/zinc/87/71/30/1065877130.db2.gz WLSAIRAOZNLCHD-WAYWQWQTSA-N 1 0 308.469 4.215 20 10 DICDRO CCCC[C@@H](CCC)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC001308299486 1065894264 /nfs/dbraw/zinc/89/42/64/1065894264.db2.gz BIUJBPUAQJRNKF-QGZVFWFLSA-N 1 0 322.468 4.111 20 10 DICDRO CC(C)CC1(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)CCC1 ZINC001308329215 1065917598 /nfs/dbraw/zinc/91/75/98/1065917598.db2.gz SSZFYCTVEOZROE-UHFFFAOYSA-N 1 0 310.432 4.337 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCC[C@@H]2C2CC2)cc1 ZINC001308436861 1065987221 /nfs/dbraw/zinc/98/72/21/1065987221.db2.gz WFEVAAFESQOBLP-UYAOXDASSA-N 1 0 300.490 4.449 20 10 DICDRO CS[C@@H]1CCCC[C@H]1[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001308453186 1065998856 /nfs/dbraw/zinc/99/88/56/1065998856.db2.gz HLUFDRMCDOEVNG-XXCOWLKOSA-N 1 0 304.503 4.030 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCS[C@@H]2C)cc1 ZINC001308458441 1066001345 /nfs/dbraw/zinc/00/13/45/1066001345.db2.gz WSSMXEQCFBJMAO-QAPCUYQASA-N 1 0 306.519 4.297 20 10 DICDRO C[C@H](CC1CCC1)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001308480734 1066019132 /nfs/dbraw/zinc/01/91/32/1066019132.db2.gz BYNZQIJLHNKDGF-GFCCVEGCSA-N 1 0 314.395 4.440 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(C)cn2)c(C)n1-c1cccc(C)c1 ZINC001308488033 1066023088 /nfs/dbraw/zinc/02/30/88/1066023088.db2.gz IAQPVHUXKRYGOZ-UHFFFAOYSA-N 1 0 319.452 4.396 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CCCC2(F)F)c(Cl)c1 ZINC001308502507 1066032597 /nfs/dbraw/zinc/03/25/97/1066032597.db2.gz SSKJAMMUSXSKJW-LLVKDONJSA-N 1 0 303.780 4.269 20 10 DICDRO COc1cc(C[NH2+]C[C@@H]2C[C@@H]2[C@@H]2C[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308521366 1066042572 /nfs/dbraw/zinc/04/25/72/1066042572.db2.gz BQEYUHVGPHVFLL-CLROSIBMSA-N 1 0 317.473 4.080 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCSC3(CCC3)C2)cc1 ZINC001308540635 1066057592 /nfs/dbraw/zinc/05/75/92/1066057592.db2.gz NQLBWQAHJDPLMY-RCFWFJCLSA-N 1 0 316.514 4.174 20 10 DICDRO CC[N@H+](Cc1c(C)cc(OC)cc1O)[C@H](C)c1ccc(F)cc1 ZINC001308591377 1066103678 /nfs/dbraw/zinc/10/36/78/1066103678.db2.gz DFQMXIMURUPSKQ-CQSZACIVSA-N 1 0 317.404 4.431 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)c(O)c1 ZINC001308621462 1066123056 /nfs/dbraw/zinc/12/30/56/1066123056.db2.gz LUHGZIFTMWODRO-HNNXBMFYSA-N 1 0 317.816 4.007 20 10 DICDRO Cc1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)c(O)c1 ZINC001308621463 1066123304 /nfs/dbraw/zinc/12/33/04/1066123304.db2.gz LUHGZIFTMWODRO-OAHLLOKOSA-N 1 0 317.816 4.007 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2cccc(F)c2[C@H]1C ZINC001308624383 1066123615 /nfs/dbraw/zinc/12/36/15/1066123615.db2.gz MBISIFOTCZOSRL-OAHLLOKOSA-N 1 0 312.432 4.319 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1C)[C@@H](C)c1cccc(O)c1 ZINC001308625874 1066125124 /nfs/dbraw/zinc/12/51/24/1066125124.db2.gz YIARPCCXBMPNGB-INIZCTEOSA-N 1 0 312.457 4.350 20 10 DICDRO CN(C)c1cc(F)c(C[N@H+](C)[C@@H]2CCc3ccccc32)cc1F ZINC001308661140 1066142317 /nfs/dbraw/zinc/14/23/17/1066142317.db2.gz YFDCFWGQOORJBV-GOSISDBHSA-N 1 0 316.395 4.150 20 10 DICDRO COc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c(C)c1 ZINC001308662753 1066143641 /nfs/dbraw/zinc/14/36/41/1066143641.db2.gz KJVMBGMJGUELBC-UHFFFAOYSA-N 1 0 324.468 4.234 20 10 DICDRO Cc1cccc([C@H]2CC[N@H+](Cc3cccc(Cl)c3[O-])C2)c1 ZINC001308683347 1066153860 /nfs/dbraw/zinc/15/38/60/1066153860.db2.gz BMYFWXIHCQECGJ-HNNXBMFYSA-N 1 0 301.817 4.344 20 10 DICDRO C[C@@H]1COc2ccccc2C[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001308686055 1066154958 /nfs/dbraw/zinc/15/49/58/1066154958.db2.gz XWOKAMZAFZKAEI-DKRLNXSXSA-N 1 0 322.452 4.049 20 10 DICDRO CCC1(CC)CCC[N@H+](Cc2cc(OC)c(OC)cc2O)CC1 ZINC001308690828 1066182802 /nfs/dbraw/zinc/18/28/02/1066182802.db2.gz FQZDAAFXWXWMOQ-UHFFFAOYSA-N 1 0 321.461 4.202 20 10 DICDRO CC[C@@H]1CC[N@H+](Cc2cc(Br)cc(C)c2O)[C@H]1C ZINC001308704186 1066189736 /nfs/dbraw/zinc/18/97/36/1066189736.db2.gz NIIPFUJIJDENOP-NWDGAFQWSA-N 1 0 312.251 4.084 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc(Cl)cc1O)[C@@H](O)c1ccccc1 ZINC001308735983 1066212157 /nfs/dbraw/zinc/21/21/57/1066212157.db2.gz NBLFNTPPPJUWSQ-AEFFLSMTSA-N 1 0 319.832 4.038 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)C1CCC2(CSC2)CC1 ZINC001308741060 1066217020 /nfs/dbraw/zinc/21/70/20/1066217020.db2.gz RQKSIWGASSTCKA-UHFFFAOYSA-N 1 0 304.503 4.038 20 10 DICDRO COc1cc(C)c(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2)c(O)c1 ZINC001308753234 1066227323 /nfs/dbraw/zinc/22/73/23/1066227323.db2.gz MOBDIDUZNXQABI-AUUYWEPGSA-N 1 0 311.425 4.292 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)c1 ZINC001308778813 1066251000 /nfs/dbraw/zinc/25/10/00/1066251000.db2.gz KTFVQIAPZIDQKP-IBGZPJMESA-N 1 0 310.441 4.494 20 10 DICDRO COc1cc(C[N@@H+]2CCC[C@](C)(F)C2)c(O)c(C(C)(C)C)c1 ZINC001308781527 1066255634 /nfs/dbraw/zinc/25/56/34/1066255634.db2.gz HDVPWRCWNVJETD-SFHVURJKSA-N 1 0 309.425 4.022 20 10 DICDRO CC(C)[C@H]1[N@H+](Cc2c(O)cccc2Br)CC12CCC2 ZINC001308791492 1066265888 /nfs/dbraw/zinc/26/58/88/1066265888.db2.gz OPNUUHAHOWPDMQ-OAHLLOKOSA-N 1 0 324.262 4.165 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2Cc3ccccc3O[C@@H](C)C2)c(Cl)c1 ZINC001308791394 1066266317 /nfs/dbraw/zinc/26/63/17/1066266317.db2.gz FALWXVHUQCWOQZ-ZDUSSCGKSA-N 1 0 317.816 4.137 20 10 DICDRO CC1([NH2+]Cc2ccc(OCc3ccccc3)cc2O)CC=CC1 ZINC001308839662 1066315067 /nfs/dbraw/zinc/31/50/67/1066315067.db2.gz BGBBEKBOPCMEJX-UHFFFAOYSA-N 1 0 309.409 4.170 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]C1CC2(CCC2)C1 ZINC001308844352 1066320239 /nfs/dbraw/zinc/32/02/39/1066320239.db2.gz SKCUFPBUEXNFCE-UHFFFAOYSA-N 1 0 323.436 4.394 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCC[C@@H](C2CCOCC2)C1 ZINC001308846577 1066323693 /nfs/dbraw/zinc/32/36/93/1066323693.db2.gz UBSXRMFNJFXQNQ-PBHICJAKSA-N 1 0 323.864 4.121 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCCC[C@H]2C2CCC2)cc1F ZINC001308849519 1066327035 /nfs/dbraw/zinc/32/70/35/1066327035.db2.gz DQYZUUACMSUFMD-KRWDZBQOSA-N 1 0 308.416 4.185 20 10 DICDRO Oc1ccc(F)cc1C[NH2+]Cc1ccnc(Oc2ccccc2)c1 ZINC001308852699 1066334998 /nfs/dbraw/zinc/33/49/98/1066334998.db2.gz YZYVMSVNRIRBAB-UHFFFAOYSA-N 1 0 324.355 4.008 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@@H]3CC(C)(C)CC[C@@H]3C)C2)cc1 ZINC001308861492 1066340102 /nfs/dbraw/zinc/34/01/02/1066340102.db2.gz YKGFZWRNOIYMPD-TXPKVOOTSA-N 1 0 316.489 4.078 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)cc1Cl ZINC001308863015 1066341303 /nfs/dbraw/zinc/34/13/03/1066341303.db2.gz CYSHPIYFKQKFOQ-RDTXWAMCSA-N 1 0 323.864 4.135 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001308887505 1066367914 /nfs/dbraw/zinc/36/79/14/1066367914.db2.gz IAUHKVCJXLLWDC-HNNXBMFYSA-N 1 0 308.208 4.476 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1O ZINC001308896999 1066376102 /nfs/dbraw/zinc/37/61/02/1066376102.db2.gz WYQYBUOBADBXMP-KRWDZBQOSA-N 1 0 301.817 4.385 20 10 DICDRO Cc1ccc(C[NH2+]Cc2ccc(Cl)cc2OC(C)C)c(O)c1 ZINC001308921250 1066399509 /nfs/dbraw/zinc/39/95/09/1066399509.db2.gz IZDIRQADAHFSSR-UHFFFAOYSA-N 1 0 319.832 4.431 20 10 DICDRO Cc1cc(Br)cc(C[NH2+]C2CCC=CCC2)c1O ZINC001308943558 1066411956 /nfs/dbraw/zinc/41/19/56/1066411956.db2.gz OHRRVGXWRKRVKV-UHFFFAOYSA-N 1 0 310.235 4.052 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(OC(F)F)c1 ZINC000079249392 185162223 /nfs/dbraw/zinc/16/22/23/185162223.db2.gz CNWMJWCYSRGPBY-LBPRGKRZSA-N 1 0 319.351 4.074 20 10 DICDRO CC[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(N(C)C)cc1 ZINC000090459393 185297817 /nfs/dbraw/zinc/29/78/17/185297817.db2.gz HGWHBDLZARRTGK-MRXNPFEDSA-N 1 0 315.486 4.327 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2CCSc3ccccc32)c1O ZINC000236934309 202079323 /nfs/dbraw/zinc/07/93/23/202079323.db2.gz GSMSIGOLOMPKTF-HNNXBMFYSA-N 1 0 315.438 4.118 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c1 ZINC000021011901 182259882 /nfs/dbraw/zinc/25/98/82/182259882.db2.gz UJHLLIQRNRAUTN-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c1 ZINC000021011899 182259976 /nfs/dbraw/zinc/25/99/76/182259976.db2.gz UJHLLIQRNRAUTN-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccccc2Cl)c1O ZINC000021014656 182260858 /nfs/dbraw/zinc/26/08/58/182260858.db2.gz QTWSPHCPRCVWSB-LBPRGKRZSA-N 1 0 305.805 4.295 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H]2CCCc3sccc32)c1O ZINC000061359825 184168743 /nfs/dbraw/zinc/16/87/43/184168743.db2.gz LULYGQYZVQKSKP-CQSZACIVSA-N 1 0 303.427 4.020 20 10 DICDRO CCOc1cccc(C[NH2+][C@H]2CCCc3sccc32)c1O ZINC000061359826 184169062 /nfs/dbraw/zinc/16/90/62/184169062.db2.gz LULYGQYZVQKSKP-AWEZNQCLSA-N 1 0 303.427 4.020 20 10 DICDRO Cc1cnccc1CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000273352994 130109094 /nfs/dbraw/zinc/10/90/94/130109094.db2.gz CCFWWCNFWHVKIS-HNNXBMFYSA-N 1 0 306.409 4.142 20 10 DICDRO C[C@@H]([NH2+]C1CCN(C2CCC2)CC1)c1ccc2ccccc2c1O ZINC000273366817 130113241 /nfs/dbraw/zinc/11/32/41/130113241.db2.gz BRBMRGZGPLLGEM-OAHLLOKOSA-N 1 0 324.468 4.213 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273426055 130120911 /nfs/dbraw/zinc/12/09/11/130120911.db2.gz UDSLMQTZPGEYJD-INIZCTEOSA-N 1 0 313.441 4.396 20 10 DICDRO COc1cccc(C2([NH2+][C@H](C)c3ccc(C)c(C)c3O)CC2)c1 ZINC000273526935 130132234 /nfs/dbraw/zinc/13/22/34/130132234.db2.gz VKVIITWDCNFLCP-OAHLLOKOSA-N 1 0 311.425 4.358 20 10 DICDRO COc1cc(F)cc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000273530952 130133266 /nfs/dbraw/zinc/13/32/66/130133266.db2.gz WISLYZLSLJJOAK-ZDUSSCGKSA-N 1 0 303.377 4.008 20 10 DICDRO CC(C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2O)[nH]1 ZINC000273542906 130135587 /nfs/dbraw/zinc/13/55/87/130135587.db2.gz YROHFMNGTPUWRT-QWHCGFSZSA-N 1 0 324.428 4.199 20 10 DICDRO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273571659 130138430 /nfs/dbraw/zinc/13/84/30/130138430.db2.gz KVJKCTCRMWWQMJ-OLZOCXBDSA-N 1 0 320.458 4.024 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2-n2cccn2)c(O)c1C ZINC000273588483 130140337 /nfs/dbraw/zinc/14/03/37/130140337.db2.gz ONNXXPFJKTVHCK-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO CSCc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000285813312 131203113 /nfs/dbraw/zinc/20/31/13/131203113.db2.gz WPVDUIBDUVODLU-LBPRGKRZSA-N 1 0 305.418 4.245 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)c(O)c1 ZINC000286888167 131254047 /nfs/dbraw/zinc/25/40/47/131254047.db2.gz CWFDUMPWBRNQML-HZPDHXFCSA-N 1 0 321.424 4.298 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(OC)c(OC)c1 ZINC000287539952 131286301 /nfs/dbraw/zinc/28/63/01/131286301.db2.gz PFNIVAKUNSNXRR-BBRMVZONSA-N 1 0 315.413 4.211 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(F)c1)c1cccc(Cl)c1[O-] ZINC000287618764 131291767 /nfs/dbraw/zinc/29/17/67/131291767.db2.gz JRLJQSGLPQACBG-OAHLLOKOSA-N 1 0 323.795 4.434 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1CCCOC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000287654326 131293582 /nfs/dbraw/zinc/29/35/82/131293582.db2.gz LJRSEPMQFUSCMP-HZMBPMFUSA-N 1 0 318.244 4.166 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(F)cccc2SC)c1 ZINC000287711451 131296437 /nfs/dbraw/zinc/29/64/37/131296437.db2.gz XPHBLHOEHFCMPR-NSHDSACASA-N 1 0 321.417 4.113 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cc(F)cnc2Cl)c(O)c1 ZINC000297376918 132012637 /nfs/dbraw/zinc/01/26/37/132012637.db2.gz QUCWPJDFRBIUCI-NSHDSACASA-N 1 0 308.784 4.047 20 10 DICDRO CSc1cccc(F)c1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297394555 132013472 /nfs/dbraw/zinc/01/34/72/132013472.db2.gz SBFQYHHJSIAESU-CQSZACIVSA-N 1 0 303.402 4.030 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)cc1C ZINC000079080836 331680920 /nfs/dbraw/zinc/68/09/20/331680920.db2.gz QJJLWXGDRNHNCS-ZDUSSCGKSA-N 1 0 321.367 4.456 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc(C(F)F)cc2)c1 ZINC000185180156 333204944 /nfs/dbraw/zinc/20/49/44/333204944.db2.gz NTSMJCXXEHFFQJ-UHFFFAOYSA-N 1 0 307.340 4.018 20 10 DICDRO COCc1cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)ccc1F ZINC000185495454 333209267 /nfs/dbraw/zinc/20/92/67/333209267.db2.gz OEFLVGJBKKZFHP-NSHDSACASA-N 1 0 323.795 4.182 20 10 DICDRO COCc1cc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)ccc1F ZINC000185495474 333209294 /nfs/dbraw/zinc/20/92/94/333209294.db2.gz OEFLVGJBKKZFHP-LLVKDONJSA-N 1 0 323.795 4.182 20 10 DICDRO COC[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccccc1 ZINC000186034292 333216524 /nfs/dbraw/zinc/21/65/24/333216524.db2.gz YWMRGMLRZIWBLY-BLLLJJGKSA-N 1 0 305.805 4.084 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273464452 334047543 /nfs/dbraw/zinc/04/75/43/334047543.db2.gz IROPIQJTPQUEHB-DGCLKSJQSA-N 1 0 302.418 4.068 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c(O)c1 ZINC000285331969 334147179 /nfs/dbraw/zinc/14/71/79/334147179.db2.gz UHOWWBFCMCLGJW-HZPDHXFCSA-N 1 0 303.446 4.151 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1nccc2ccccc21 ZINC000289873486 334169060 /nfs/dbraw/zinc/16/90/60/334169060.db2.gz SFFSPDIXSSMQIT-AWEZNQCLSA-N 1 0 323.415 4.291 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C3CC3)ccc2F)c1 ZINC000295197755 334220523 /nfs/dbraw/zinc/22/05/23/334220523.db2.gz YELXDEXKSPZZDM-LBPRGKRZSA-N 1 0 315.388 4.268 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(C)cc1O ZINC000297401255 334241206 /nfs/dbraw/zinc/24/12/06/334241206.db2.gz SMQXKRPXMHBULQ-CQSZACIVSA-N 1 0 308.784 4.129 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCC12CCOCC2)c1ccc(C)cc1O ZINC000370185446 336879258 /nfs/dbraw/zinc/87/92/58/336879258.db2.gz QPBPTFPJGROIIN-SJLPKXTDSA-N 1 0 303.446 4.091 20 10 DICDRO C[C@H]([NH2+][C@@H](c1ccccc1)C1CCOCC1)c1ccccc1O ZINC000374677402 336994784 /nfs/dbraw/zinc/99/47/84/336994784.db2.gz JAEQSWZQUSRWER-YWZLYKJASA-N 1 0 311.425 4.211 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3cnn(C(C)C)c32)c1 ZINC000375171308 337005131 /nfs/dbraw/zinc/00/51/31/337005131.db2.gz OCMLDNRTERCULZ-PBHICJAKSA-N 1 0 313.445 4.206 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccccc1O ZINC000183450723 337191743 /nfs/dbraw/zinc/19/17/43/337191743.db2.gz NATYWRNDXBSRIU-FOIQADDNSA-N 1 0 304.393 4.227 20 10 DICDRO Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183549790 337192105 /nfs/dbraw/zinc/19/21/05/337192105.db2.gz NACDJHNZKFNHHG-CABCVRRESA-N 1 0 321.424 4.298 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1cc(F)ccc1O ZINC000185153128 337202429 /nfs/dbraw/zinc/20/24/29/337202429.db2.gz NSFBLJUVAJXLFM-JLTOFOAXSA-N 1 0 322.383 4.367 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2-n2cccn2)c(O)c1 ZINC000185742179 337250916 /nfs/dbraw/zinc/25/09/16/337250916.db2.gz GNVWEBGBMVDKGS-JKSUJKDBSA-N 1 0 321.424 4.298 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccccc2-n2cccn2)c1 ZINC000185741672 337250945 /nfs/dbraw/zinc/25/09/45/337250945.db2.gz FFSBCVPXPOYACN-HZPDHXFCSA-N 1 0 321.424 4.298 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(-c2ccccn2)c1)c1cc(F)ccc1O ZINC000186150377 337254110 /nfs/dbraw/zinc/25/41/10/337254110.db2.gz UVMSDRDSSIBTLY-AWEZNQCLSA-N 1 0 322.383 4.444 20 10 DICDRO COc1ccc(C[NH2+]C(C)(C)c2ccc(OC)c(F)c2)cc1C ZINC000527780065 337763695 /nfs/dbraw/zinc/76/36/95/337763695.db2.gz BKFABQUDRPLKDP-UHFFFAOYSA-N 1 0 317.404 4.176 20 10 DICDRO C[C@H]([NH2+][C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@@H]21)c1cc(F)ccc1O ZINC000527941353 337773410 /nfs/dbraw/zinc/77/34/10/337773410.db2.gz FXPIZWJAHKAUKS-DOVOCXTESA-N 1 0 317.791 4.174 20 10 DICDRO C[C@H]([NH2+][C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]12)c1cc(F)ccc1O ZINC000527941355 337773487 /nfs/dbraw/zinc/77/34/87/337773487.db2.gz FXPIZWJAHKAUKS-KAFUJRNTSA-N 1 0 317.791 4.174 20 10 DICDRO COc1cc(C[NH2+]Cc2c(C)c3ccccc3n2C)ccc1C ZINC000475199740 339441232 /nfs/dbraw/zinc/44/12/32/339441232.db2.gz XCVAYHDSWVJESZ-UHFFFAOYSA-N 1 0 308.425 4.094 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccc2c(c1)COC2 ZINC000479452063 339535728 /nfs/dbraw/zinc/53/57/28/339535728.db2.gz HSBGPHZABHJDRV-HNNXBMFYSA-N 1 0 320.436 4.368 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1O ZINC000529641277 340766206 /nfs/dbraw/zinc/76/62/06/340766206.db2.gz CLPVVDDNCDINMJ-QGZVFWFLSA-N 1 0 316.832 4.380 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)Cc2c(C)noc2C)cc1 ZINC000152092559 520286729 /nfs/dbraw/zinc/28/67/29/520286729.db2.gz XEBMIZCKSBZJTG-UONOGXRCSA-N 1 0 315.461 4.029 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cccnc2Cl)cc1 ZINC000178228432 520909075 /nfs/dbraw/zinc/90/90/75/520909075.db2.gz OQXLHXQGNSJQHB-AWEZNQCLSA-N 1 0 317.864 4.432 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1O ZINC000156145616 522696000 /nfs/dbraw/zinc/69/60/00/522696000.db2.gz RYXLPUQXBCAFOL-KXBFYZLASA-N 1 0 321.424 4.380 20 10 DICDRO CC[C@@H]([NH2+]Cc1cccc(COC)c1)c1ccc(N(C)C)cc1 ZINC000158535404 522880596 /nfs/dbraw/zinc/88/05/96/522880596.db2.gz BUAHCQNDDIMTJE-HXUWFJFHSA-N 1 0 312.457 4.140 20 10 DICDRO CC[C@@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1ccc(N(C)C)cc1 ZINC000156447551 522922622 /nfs/dbraw/zinc/92/26/22/522922622.db2.gz FXBPAFLISDMQES-MSOLQXFVSA-N 1 0 316.445 4.082 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3ccc(F)cc32)c1 ZINC000182381158 524774260 /nfs/dbraw/zinc/77/42/60/524774260.db2.gz BWXDMOAIWPFLHC-KPZWWZAWSA-N 1 0 315.388 4.268 20 10 DICDRO C[C@H]([NH2+]CCc1nccs1)c1ccc(N2CCCCC2)cc1 ZINC000127825655 525372484 /nfs/dbraw/zinc/37/24/84/525372484.db2.gz CJRSMNMMFBUXGB-HNNXBMFYSA-N 1 0 315.486 4.027 20 10 DICDRO C[C@H]([NH2+]C[C@@H](c1ccco1)N(C)C)c1ccc2ccccc2c1O ZINC000192914105 525383511 /nfs/dbraw/zinc/38/35/11/525383511.db2.gz AGFJHTHISHINMR-KSSFIOAISA-N 1 0 324.424 4.092 20 10 DICDRO C[C@H]([NH2+]Cc1ccn(C)c1)c1ccc(N2CCCCCC2)cc1 ZINC000158526748 525467329 /nfs/dbraw/zinc/46/73/29/525467329.db2.gz HSTGKVCKHNSXGT-KRWDZBQOSA-N 1 0 311.473 4.256 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccc(N(C)C)cc1 ZINC000180716287 525626536 /nfs/dbraw/zinc/62/65/36/525626536.db2.gz ZUWHVLUJTOLMSE-UGSOOPFHSA-N 1 0 314.404 4.066 20 10 DICDRO C[C@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1cc(Cl)ccc1O ZINC000188043417 525627474 /nfs/dbraw/zinc/62/74/74/525627474.db2.gz IJVMATBBFZJJPF-BONVTDFDSA-N 1 0 321.779 4.359 20 10 DICDRO C[C@@H]([NH2+][C@H](C)c1cccnc1)c1ccc(N2CCCCC2)cc1 ZINC000158551698 525664827 /nfs/dbraw/zinc/66/48/27/525664827.db2.gz GAGJYJAOWWGIHD-IAGOWNOFSA-N 1 0 309.457 4.484 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)CCC2 ZINC000364950813 527109505 /nfs/dbraw/zinc/10/95/05/527109505.db2.gz KAAVFIHVPCPQHU-FZMZJTMJSA-N 1 0 302.443 4.194 20 10 DICDRO COCC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(C)o1 ZINC000273422426 536810233 /nfs/dbraw/zinc/81/02/33/536810233.db2.gz JPBDMIKHOLKXRM-GDBMZVCRSA-N 1 0 303.402 4.030 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1O)c1cccc(OC(F)(F)F)c1 ZINC000175755087 1035778611 /nfs/dbraw/zinc/77/86/11/1035778611.db2.gz XLKUBCPJCFQBMU-LLVKDONJSA-N 1 0 311.303 4.142 20 10 DICDRO C[N@H+](Cc1c(O)ccc2ccncc21)[C@@H]1CCCc2ccccc21 ZINC000023611987 1036413152 /nfs/dbraw/zinc/41/31/52/1036413152.db2.gz OUJHCIRXJAKYKG-HXUWFJFHSA-N 1 0 318.420 4.450 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc3c(c2)C[C@H](C)O3)cc1 ZINC001648832960 1036612871 /nfs/dbraw/zinc/61/28/71/1036612871.db2.gz UZWYPZUCUSOZQI-INIZCTEOSA-N 1 0 324.468 4.146 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CCOc1c(C)cccc1C ZINC001648876923 1036667495 /nfs/dbraw/zinc/66/74/95/1036667495.db2.gz VRKKLWWCSRPTPP-UHFFFAOYSA-N 1 0 322.452 4.272 20 10 DICDRO Cc1ccc(O)c(C[NH2+][C@H]2CCSc3ccc(F)cc32)c1 ZINC000071407398 1036689754 /nfs/dbraw/zinc/68/97/54/1036689754.db2.gz FGXGULWJPABQGP-HNNXBMFYSA-N 1 0 303.402 4.166 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccc(C#N)cc1 ZINC000075755705 1036701109 /nfs/dbraw/zinc/70/11/09/1036701109.db2.gz RYNXIPJTWYPQJU-QGZVFWFLSA-N 1 0 319.452 4.399 20 10 DICDRO Cc1ccsc1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000078358629 1036707028 /nfs/dbraw/zinc/70/70/28/1036707028.db2.gz UAXDCEZSLYXYEU-UHFFFAOYSA-N 1 0 300.471 4.337 20 10 DICDRO CN1CCCc2cc(C[NH2+]Cc3ccc(Cl)cc3)ccc21 ZINC000050266797 1037175292 /nfs/dbraw/zinc/17/52/92/1037175292.db2.gz KZECXGBNFAOJIK-UHFFFAOYSA-N 1 0 300.833 4.012 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000160533789 1037186330 /nfs/dbraw/zinc/18/63/30/1037186330.db2.gz BUFXTWCJVZHKOY-INIZCTEOSA-N 1 0 311.473 4.060 20 10 DICDRO C[C@@H]1CC[C@@H]([NH2+]Cc2c(O)cccc2Br)C[C@H]1C ZINC000706843702 1037503382 /nfs/dbraw/zinc/50/33/82/1037503382.db2.gz WTLKAFWGNQEHJP-IJLUTSLNSA-N 1 0 312.251 4.069 20 10 DICDRO CCC1([NH2+]Cc2c(O)cccc2Br)CCCCC1 ZINC000706868362 1037519167 /nfs/dbraw/zinc/51/91/67/1037519167.db2.gz JQUVUVTWTMOYPW-UHFFFAOYSA-N 1 0 312.251 4.357 20 10 DICDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(Cl)cc2O)cc1 ZINC001140465617 1038137215 /nfs/dbraw/zinc/13/72/15/1038137215.db2.gz OHMZDZCWEZFEBK-LBPRGKRZSA-N 1 0 305.805 4.247 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001140467246 1038166357 /nfs/dbraw/zinc/16/63/57/1038166357.db2.gz RNCVEBLCVJMUNJ-INIZCTEOSA-N 1 0 319.857 4.336 20 10 DICDRO C[C@H]([NH2+]C1CC(F)(F)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000277003410 1038349317 /nfs/dbraw/zinc/34/93/17/1038349317.db2.gz ATGBNAOBITUUMA-LBPRGKRZSA-N 1 0 312.379 4.264 20 10 DICDRO CN1CCCc2cc(C[NH2+][C@@H]3CCCOc4ccccc43)ccc21 ZINC000171382183 1038408080 /nfs/dbraw/zinc/40/80/80/1038408080.db2.gz RXUJTEWGOKUKTM-LJQANCHMSA-N 1 0 322.452 4.073 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1ccccc1 ZINC000173331326 1038712742 /nfs/dbraw/zinc/71/27/42/1038712742.db2.gz MDIPZYGOJXYPOS-INIZCTEOSA-N 1 0 312.482 4.091 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2(c3cccc(Cl)c3)CC2)cc1C ZINC000174424558 1038934683 /nfs/dbraw/zinc/93/46/83/1038934683.db2.gz XEHQMQJKQDJKAH-UHFFFAOYSA-N 1 0 301.817 4.441 20 10 DICDRO COc1cccc(CNc2cc(C)[nH+]c3ccc(F)cc23)c1O ZINC000091479195 1038976038 /nfs/dbraw/zinc/97/60/38/1038976038.db2.gz CTPFPBGHVVUQIR-UHFFFAOYSA-N 1 0 312.344 4.009 20 10 DICDRO CC1(C)CCc2cc(N3C(C)(C)CC([NH3+])CC3(C)C)ccc2O1 ZINC001167626616 1038979299 /nfs/dbraw/zinc/97/92/99/1038979299.db2.gz PKWWRUWAUKEUOI-UHFFFAOYSA-N 1 0 316.489 4.275 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)Cc2cc3ccccc3[nH]2)cc1Cl ZINC001204607898 1039343529 /nfs/dbraw/zinc/34/35/29/1039343529.db2.gz AGXDWWREUZASPV-UHFFFAOYSA-N 1 0 314.816 4.467 20 10 DICDRO C[C@]1(F)CCC[N@H+](Cc2cccc(C(F)(F)F)c2[O-])CC1 ZINC001233416130 1039414475 /nfs/dbraw/zinc/41/44/75/1039414475.db2.gz WYJKJMYPCTUGSW-AWEZNQCLSA-N 1 0 305.315 4.125 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2)c1O ZINC000162211978 1039772880 /nfs/dbraw/zinc/77/28/80/1039772880.db2.gz AJXOMQDXCLOTIC-UHFFFAOYSA-N 1 0 323.392 4.196 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)CCC[NH+](CC)CC)c1ccc(F)cc1[O-] ZINC000796663669 1040211114 /nfs/dbraw/zinc/21/11/14/1040211114.db2.gz OKDYAPFCELMUNP-RHSMWYFYSA-N 1 0 310.457 4.083 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1O ZINC000309943576 1040355868 /nfs/dbraw/zinc/35/58/68/1040355868.db2.gz PEXDVUFPRVSJDN-UYAOXDASSA-N 1 0 324.468 4.098 20 10 DICDRO CCOc1cccc(C[NH2+][C@@H](c2cccs2)C2CC2)c1O ZINC000725844481 1040631647 /nfs/dbraw/zinc/63/16/47/1040631647.db2.gz ZIDMCRQAUKXOFN-MRXNPFEDSA-N 1 0 303.427 4.093 20 10 DICDRO COCCCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000178108857 1040924929 /nfs/dbraw/zinc/92/49/29/1040924929.db2.gz JHWDLZALYNLJIW-QGZVFWFLSA-N 1 0 304.478 4.144 20 10 DICDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808699735 1041009430 /nfs/dbraw/zinc/00/94/30/1041009430.db2.gz OUKRPBMADDDDIW-VIFPVBQESA-N 1 0 310.850 4.278 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)Cc2ccncc2)c1O ZINC000808701480 1041011097 /nfs/dbraw/zinc/01/10/97/1041011097.db2.gz ZBKPFFONPKJZPY-STQMWFEESA-N 1 0 304.821 4.031 20 10 DICDRO Cc1noc(C)c1CCC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808701986 1041011623 /nfs/dbraw/zinc/01/16/23/1041011623.db2.gz OTCIJNTWOOKSIG-NSHDSACASA-N 1 0 322.836 4.242 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c1O ZINC000809694768 1041216256 /nfs/dbraw/zinc/21/62/56/1041216256.db2.gz STVPDAGMRCCPBI-OTWHNJEPSA-N 1 0 323.436 4.169 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)c(Cl)c2)c1 ZINC000053150105 1041222070 /nfs/dbraw/zinc/22/20/70/1041222070.db2.gz MIVZGDWUYHVRBA-SNVBAGLBSA-N 1 0 309.768 4.044 20 10 DICDRO Cc1cc(Cl)cc(C[NH+]2CCC(c3ccncc3)CC2)c1O ZINC000809730357 1041227209 /nfs/dbraw/zinc/22/72/09/1041227209.db2.gz KTILQLMRHMIOMB-UHFFFAOYSA-N 1 0 316.832 4.129 20 10 DICDRO CCC[N@H+](CCc1ccccn1)Cc1cc(Cl)cc(C)c1O ZINC000809735119 1041228747 /nfs/dbraw/zinc/22/87/47/1041228747.db2.gz XOQHGAUCAFLFOD-UHFFFAOYSA-N 1 0 318.848 4.204 20 10 DICDRO Oc1ccc(C[N@@H+](Cc2c(O)cccc2Cl)CC2CC2)cc1 ZINC000809738131 1041239772 /nfs/dbraw/zinc/23/97/72/1041239772.db2.gz QJZASDUKNTWWNE-UHFFFAOYSA-N 1 0 317.816 4.163 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)c1O ZINC000809739716 1041240595 /nfs/dbraw/zinc/24/05/95/1041240595.db2.gz BWGLWGUCMVMCLC-ZWKOTPCHSA-N 1 0 311.425 4.217 20 10 DICDRO Cc1cc(O)c(C[N@@H+](Cc2ccc(O)cc2)CC2CC2)cc1C ZINC000809738373 1041241119 /nfs/dbraw/zinc/24/11/19/1041241119.db2.gz WNNLPRJITASXNF-UHFFFAOYSA-N 1 0 311.425 4.127 20 10 DICDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000809764368 1041250889 /nfs/dbraw/zinc/25/08/89/1041250889.db2.gz DVDBEIDDVCLYAW-MRXNPFEDSA-N 1 0 304.821 4.332 20 10 DICDRO CCOc1cccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1O ZINC000809782773 1041254061 /nfs/dbraw/zinc/25/40/61/1041254061.db2.gz GTMFPTUXUUYDJR-KRWDZBQOSA-N 1 0 317.454 4.436 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)ccc1OC ZINC000255960679 1041257819 /nfs/dbraw/zinc/25/78/19/1041257819.db2.gz SPUSKLWFTXIYDZ-HDMKZQKVSA-N 1 0 305.462 4.146 20 10 DICDRO CC[C@@H](CCO)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000166803266 1041328331 /nfs/dbraw/zinc/32/83/31/1041328331.db2.gz KNAHYTPXCFHNGV-ROUUACIJSA-N 1 0 318.505 4.126 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2ccc3sccc3c2)c(O)c1 ZINC000810160225 1041328757 /nfs/dbraw/zinc/32/87/57/1041328757.db2.gz YSFAUVLVGOXCED-UHFFFAOYSA-N 1 0 313.422 4.295 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CSC)c1ccc(C(F)(F)F)cc1O ZINC000810217780 1041338419 /nfs/dbraw/zinc/33/84/19/1041338419.db2.gz BHHAFWHYEBKPQO-CABZTGNLSA-N 1 0 307.381 4.203 20 10 DICDRO CC[C@@H]([NH2+]C[C@@]1(C)CCCO1)c1ccc(C(F)(F)F)cc1O ZINC000810222162 1041339302 /nfs/dbraw/zinc/33/93/02/1041339302.db2.gz OHWGJTDZXXFZKJ-UKRRQHHQSA-N 1 0 317.351 4.021 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCCSC1)c1ccc(C(F)(F)F)cc1O ZINC000810221147 1041340271 /nfs/dbraw/zinc/34/02/71/1041340271.db2.gz LQSHGXXNCPBAND-AAEUAGOBSA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCCS1)c1ccc(C(F)(F)F)cc1O ZINC000810223677 1041341162 /nfs/dbraw/zinc/34/11/62/1041341162.db2.gz NYVSKRXILWTRDU-WCQYABFASA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCCS1)c1ccc(C(F)(F)F)cc1O ZINC000810223678 1041342039 /nfs/dbraw/zinc/34/20/39/1041342039.db2.gz NYVSKRXILWTRDU-YPMHNXCESA-N 1 0 319.392 4.347 20 10 DICDRO CC[C@@H](O)CCC[NH2+][C@@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000810227345 1041342330 /nfs/dbraw/zinc/34/23/30/1041342330.db2.gz VUNOAHDLJDBICP-OCCSQVGLSA-N 1 0 319.367 4.003 20 10 DICDRO CC[C@@H]([NH2+]CCCCCCO)c1ccc(C(F)(F)F)cc1O ZINC000810229245 1041344156 /nfs/dbraw/zinc/34/41/56/1041344156.db2.gz AXELUEHSTSVDLA-CQSZACIVSA-N 1 0 319.367 4.004 20 10 DICDRO CC[C@H]([NH2+]CCOC1CCC1)c1ccc(C(F)(F)F)cc1O ZINC000810233075 1041345414 /nfs/dbraw/zinc/34/54/14/1041345414.db2.gz QDXMIHJDDVHFQB-AWEZNQCLSA-N 1 0 317.351 4.021 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000168203466 1041346027 /nfs/dbraw/zinc/34/60/27/1041346027.db2.gz GFJSLUDEBWVTMB-YVEFUNNKSA-N 1 0 301.434 4.159 20 10 DICDRO CC[C@@H]([NH2+]CC1(OC)CCC1)c1ccc(C(F)(F)F)cc1O ZINC000810234269 1041346095 /nfs/dbraw/zinc/34/60/95/1041346095.db2.gz BEWJEVHQWZQMBE-CYBMUJFWSA-N 1 0 317.351 4.021 20 10 DICDRO COc1cccc(C2(C[NH2+][C@H](C)c3ccc(C)cc3O)CC2)c1 ZINC000810240274 1041355692 /nfs/dbraw/zinc/35/56/92/1041355692.db2.gz UIGYYYITBXYHFN-OAHLLOKOSA-N 1 0 311.425 4.092 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CSC[C@@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000810241777 1041356277 /nfs/dbraw/zinc/35/62/77/1041356277.db2.gz YOJJHAVATBJBAV-TVYUQYBPSA-N 1 0 319.392 4.203 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[C@@H](c3ccccc3)O2)c(O)c1 ZINC000810250604 1041358347 /nfs/dbraw/zinc/35/83/47/1041358347.db2.gz NLRYMCAQSTXHLA-VPWXQRGCSA-N 1 0 311.425 4.272 20 10 DICDRO C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(N2CCCCCC2)cc1 ZINC000178315857 1041413749 /nfs/dbraw/zinc/41/37/49/1041413749.db2.gz IIQNMUGLZPAKGF-XLNTUCKNSA-N 1 0 314.473 4.038 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2C)c1 ZINC000926896598 1041473331 /nfs/dbraw/zinc/47/33/31/1041473331.db2.gz BAEWXIPZMVAVKC-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2cc(C)sc2C)c1O ZINC000182755273 1041573267 /nfs/dbraw/zinc/57/32/67/1041573267.db2.gz RZILQIGFPZTDHY-SNVBAGLBSA-N 1 0 321.417 4.263 20 10 DICDRO Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1[O-])CCC2 ZINC000363868867 1041585755 /nfs/dbraw/zinc/58/57/55/1041585755.db2.gz OWWURVILADNJEU-ZANVPECISA-N 1 0 306.406 4.024 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccc2ccccc2c1O ZINC000185377939 1041611851 /nfs/dbraw/zinc/61/18/51/1041611851.db2.gz BDDKMHZLRKXWOL-CYBMUJFWSA-N 1 0 320.367 4.407 20 10 DICDRO CCc1nc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)cs1 ZINC000185397248 1041612085 /nfs/dbraw/zinc/61/20/85/1041612085.db2.gz FBFSAZNPQSAURF-LBPRGKRZSA-N 1 0 316.470 4.141 20 10 DICDRO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185567149 1041616754 /nfs/dbraw/zinc/61/67/54/1041616754.db2.gz QFSLEAAXCYBSJR-QWRGUYRKSA-N 1 0 307.340 4.091 20 10 DICDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)c1 ZINC001141160239 1041650334 /nfs/dbraw/zinc/65/03/34/1041650334.db2.gz UQLYGIANMPDXNH-LBPRGKRZSA-N 1 0 309.818 4.150 20 10 DICDRO C[C@@H]([NH2+]Cc1cncc(C(F)(F)F)c1)c1ccc(N(C)C)cc1 ZINC000812835085 1041654267 /nfs/dbraw/zinc/65/42/67/1041654267.db2.gz LJESCCLBGSKRSR-GFCCVEGCSA-N 1 0 323.362 4.017 20 10 DICDRO CCSc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000813791127 1041732483 /nfs/dbraw/zinc/73/24/83/1041732483.db2.gz UQQIZPHIHNPKQO-UHFFFAOYSA-N 1 0 307.846 4.447 20 10 DICDRO C[C@H]([NH2+]CC1CC(F)(F)C1)c1ccc(N2CCCCC2)cc1 ZINC000813872363 1041740461 /nfs/dbraw/zinc/74/04/61/1041740461.db2.gz DHPRRLAQEGNCHR-AWEZNQCLSA-N 1 0 308.416 4.373 20 10 DICDRO CCSc1cccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)c1 ZINC000813885142 1041742426 /nfs/dbraw/zinc/74/24/26/1041742426.db2.gz QJFODVHJKPRFMV-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CC3(CCC3)[C@@H]2C(C)C)c1O ZINC000814171253 1041779366 /nfs/dbraw/zinc/77/93/66/1041779366.db2.gz MOKWIBXKUBZAAJ-INIZCTEOSA-N 1 0 309.837 4.065 20 10 DICDRO COC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(Cl)cc1 ZINC000194257479 1041785863 /nfs/dbraw/zinc/78/58/63/1041785863.db2.gz POACJERWKACJGF-CXAGYDPISA-N 1 0 319.832 4.392 20 10 DICDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(Cl)cc1 ZINC000756608464 1041788088 /nfs/dbraw/zinc/78/80/88/1041788088.db2.gz CDJUZOMADLSEHS-UGSOOPFHSA-N 1 0 319.832 4.392 20 10 DICDRO CC1(C)C[N@H+](Cc2cc3c(cc2O)CCCC3)[C@@H]1c1ccncc1 ZINC000814227045 1041794263 /nfs/dbraw/zinc/79/42/63/1041794263.db2.gz AMNWIVDCNQTQJG-HXUWFJFHSA-N 1 0 322.452 4.249 20 10 DICDRO COCc1ccccc1/C=C(\C)C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000814289094 1041803557 /nfs/dbraw/zinc/80/35/57/1041803557.db2.gz ITMOUAZTGYTYCJ-GHRIWEEISA-N 1 0 324.468 4.092 20 10 DICDRO COc1ccccc1[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815052607 1041906587 /nfs/dbraw/zinc/90/65/87/1041906587.db2.gz UTNPJGMYQONKLZ-SFHVURJKSA-N 1 0 324.468 4.059 20 10 DICDRO Cc1cc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)ccc1N(C)C ZINC000815036227 1041908113 /nfs/dbraw/zinc/90/81/13/1041908113.db2.gz TZGZJLXUKYRVEV-NRFANRHFSA-N 1 0 324.468 4.025 20 10 DICDRO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000815093152 1041917948 /nfs/dbraw/zinc/91/79/48/1041917948.db2.gz CJZGIKZTERIQJS-OAHLLOKOSA-N 1 0 311.473 4.430 20 10 DICDRO COc1ccc(N2CCC([NH2+]C[C@@H]3CCCC3(C)C)CC2)cc1 ZINC000815162028 1041921931 /nfs/dbraw/zinc/92/19/31/1041921931.db2.gz AKKIRGNWVZZQFJ-INIZCTEOSA-N 1 0 316.489 4.080 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+]C(C)(C)c2ccccc2C)c1O ZINC000815149351 1041928054 /nfs/dbraw/zinc/92/80/54/1041928054.db2.gz JRTNSGDXIUJQER-UHFFFAOYSA-N 1 0 315.388 4.067 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCOc3ccccc32)c(O)c1 ZINC000815578338 1041966055 /nfs/dbraw/zinc/96/60/55/1041966055.db2.gz MIUSZAQCYHLVEI-CVEARBPZSA-N 1 0 311.425 4.226 20 10 DICDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]CCCSc1nccs1 ZINC000815581303 1041966433 /nfs/dbraw/zinc/96/64/33/1041966433.db2.gz BRMIDHSJSZCZCP-GFCCVEGCSA-N 1 0 310.463 4.424 20 10 DICDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@H]1CCSC1 ZINC000815595243 1041969448 /nfs/dbraw/zinc/96/94/48/1041969448.db2.gz LNCBGRCUZHWNDT-FUHWJXTLSA-N 1 0 313.466 4.161 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)C[C@H](O)c2ccccc2)c(O)c1 ZINC000815589635 1041969496 /nfs/dbraw/zinc/96/94/96/1041969496.db2.gz YVLFSOBGUDGVNB-RYRKJORJSA-N 1 0 313.441 4.172 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C2CCC(OC(C)C)CC2)c(O)c1 ZINC000815598202 1041970680 /nfs/dbraw/zinc/97/06/80/1041970680.db2.gz PAJWBVYIDOYJKF-KLAILNCOSA-N 1 0 305.462 4.396 20 10 DICDRO Cc1cc(C)c([C@H](C)Nc2ccc(C[NH+](C)C)c(F)c2)c(O)c1 ZINC000815613492 1041973428 /nfs/dbraw/zinc/97/34/28/1041973428.db2.gz OUFYKWZOYOXTJD-AWEZNQCLSA-N 1 0 316.420 4.383 20 10 DICDRO CC(C)OCC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815616771 1041974915 /nfs/dbraw/zinc/97/49/15/1041974915.db2.gz XWXCPBMRNYKYEX-IBGZPJMESA-N 1 0 313.441 4.081 20 10 DICDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCCCF ZINC000815627576 1041977060 /nfs/dbraw/zinc/97/70/60/1041977060.db2.gz DJTCJDGEYDAKIV-SFHVURJKSA-N 1 0 301.405 4.405 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c(O)c1 ZINC000815623884 1041977122 /nfs/dbraw/zinc/97/71/22/1041977122.db2.gz JUMWIDFAPJUATO-YYIAUSFCSA-N 1 0 305.462 4.253 20 10 DICDRO CCCc1nc(C)c(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)o1 ZINC000815629125 1041978147 /nfs/dbraw/zinc/97/81/47/1041978147.db2.gz VDJRVGFYXNDEBJ-CQSZACIVSA-N 1 0 302.418 4.109 20 10 DICDRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1cc(F)ccc1O ZINC000815632164 1041979962 /nfs/dbraw/zinc/97/99/62/1041979962.db2.gz FHBMTZTUUSVBPH-AXAPSJFSSA-N 1 0 303.352 4.267 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(Cl)c(OC)c1)c1ccccc1O ZINC000815657307 1041980406 /nfs/dbraw/zinc/98/04/06/1041980406.db2.gz VUQCNIUPISIGIZ-MRXNPFEDSA-N 1 0 319.832 4.338 20 10 DICDRO CO[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1ccccc1Cl ZINC000756757753 1041982009 /nfs/dbraw/zinc/98/20/09/1041982009.db2.gz BRHDLWYISVAXGR-DIFFPNOSSA-N 1 0 323.795 4.223 20 10 DICDRO CC[C@@H]([NH2+]CCC1(COC)CCC1)c1ccc(N(C)C)cc1 ZINC000815642637 1041983338 /nfs/dbraw/zinc/98/33/38/1041983338.db2.gz IJRXSQDRSAZAAH-GOSISDBHSA-N 1 0 304.478 4.000 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2c(F)cc(F)cc2F)c(O)c1 ZINC000815649752 1041985641 /nfs/dbraw/zinc/98/56/41/1041985641.db2.gz XYSMPBNDDQVVOF-LLVKDONJSA-N 1 0 309.331 4.277 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)C(C)(C)O ZINC000815652060 1041985744 /nfs/dbraw/zinc/98/57/44/1041985744.db2.gz NRIYKZVPECUXIS-KBXCAEBGSA-N 1 0 322.468 4.016 20 10 DICDRO c1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc(N3CCCCC3)cc1)C2 ZINC000104862197 1042057977 /nfs/dbraw/zinc/05/79/77/1042057977.db2.gz GYZLLSMDGAQFQT-NRFANRHFSA-N 1 0 320.480 4.324 20 10 DICDRO Fc1ccccc1CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000104861186 1042057984 /nfs/dbraw/zinc/05/79/84/1042057984.db2.gz RUADCLBVGIHCQI-UHFFFAOYSA-N 1 0 312.432 4.148 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2ccc3ccccc3c2O)cc1 ZINC000816539527 1042063162 /nfs/dbraw/zinc/06/31/62/1042063162.db2.gz JSEFOVGCBLLHOG-UHFFFAOYSA-N 1 0 307.393 4.234 20 10 DICDRO Oc1c(C[NH2+][C@@H]2C[C@H]2Cc2ccccc2)ccc2ccccc21 ZINC000816551489 1042064325 /nfs/dbraw/zinc/06/43/25/1042064325.db2.gz CWRGNWQKKHDKCD-UYAOXDASSA-N 1 0 303.405 4.266 20 10 DICDRO CS[C@H]1CCC[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816549952 1042065139 /nfs/dbraw/zinc/06/51/39/1042065139.db2.gz DBVBYKOMCYRIFO-CVEARBPZSA-N 1 0 301.455 4.309 20 10 DICDRO Oc1c(C[NH2+]C[C@H]2CCOc3ccccc32)ccc2ccccc21 ZINC000816549141 1042065166 /nfs/dbraw/zinc/06/51/66/1042065166.db2.gz FWCKFDIYNHPKAB-MRXNPFEDSA-N 1 0 319.404 4.201 20 10 DICDRO Oc1c(C[NH2+][C@@H]2CCOc3ccc(F)cc32)ccc2ccccc21 ZINC000816584291 1042066403 /nfs/dbraw/zinc/06/64/03/1042066403.db2.gz HBXJPSYSUZWIKE-GOSISDBHSA-N 1 0 323.367 4.298 20 10 DICDRO Oc1c(C[NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)ccc2ccccc21 ZINC000816556149 1042066896 /nfs/dbraw/zinc/06/68/96/1042066896.db2.gz BIPLTKWUDXHWDB-NJDAHSKKSA-N 1 0 315.416 4.221 20 10 DICDRO Oc1c(C[NH2+][C@@H]2CCOC3(CCCC3)C2)ccc2ccccc21 ZINC000816556441 1042067108 /nfs/dbraw/zinc/06/71/08/1042067108.db2.gz IXHCVOJUFFEPHE-QGZVFWFLSA-N 1 0 311.425 4.127 20 10 DICDRO CC(C)(C[NH2+]Cc1ccc2ccccc2c1O)[C@@H]1CCCCO1 ZINC000816556427 1042067899 /nfs/dbraw/zinc/06/78/99/1042067899.db2.gz IRVXLZAIANXSGD-SFHVURJKSA-N 1 0 313.441 4.230 20 10 DICDRO CC(C)C[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816560676 1042068642 /nfs/dbraw/zinc/06/86/42/1042068642.db2.gz XGBZDIWYSFZPIJ-MSOLQXFVSA-N 1 0 313.441 4.229 20 10 DICDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816559625 1042068658 /nfs/dbraw/zinc/06/86/58/1042068658.db2.gz PSHSQNGKIKDQLM-AEFFLSMTSA-N 1 0 313.441 4.229 20 10 DICDRO COc1cccc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1O ZINC000816631527 1042070374 /nfs/dbraw/zinc/07/03/74/1042070374.db2.gz VIGFHNWWBHEUCA-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO Oc1c(C[N@@H+]2CCC=C(Br)C2)ccc2ccccc21 ZINC000816599262 1042071913 /nfs/dbraw/zinc/07/19/13/1042071913.db2.gz HNFFZPCTIPAZFC-UHFFFAOYSA-N 1 0 318.214 4.030 20 10 DICDRO C[C@]12CC[N@H+](Cc3ccc4ccccc4c3O)C[C@H]1C2(F)F ZINC000816617153 1042072877 /nfs/dbraw/zinc/07/28/77/1042072877.db2.gz POUCRBCKRRVHID-WBVHZDCISA-N 1 0 303.352 4.023 20 10 DICDRO CCCc1nc(C)c(C[NH2+]Cc2ccc3ccccc3c2O)o1 ZINC000816616896 1042072922 /nfs/dbraw/zinc/07/29/22/1042072922.db2.gz JBBBWVPIGHKIPZ-UHFFFAOYSA-N 1 0 310.397 4.084 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@H]2c2cccnc2)ccc2ccccc21 ZINC000816610575 1042073364 /nfs/dbraw/zinc/07/33/64/1042073364.db2.gz PPBTYUQFAHTICK-IBGZPJMESA-N 1 0 304.393 4.278 20 10 DICDRO CCC[N@H+](CCc1ccccn1)Cc1ccc2ccccc2c1O ZINC000816610673 1042073426 /nfs/dbraw/zinc/07/34/26/1042073426.db2.gz UDLJONRGCQUDLU-UHFFFAOYSA-N 1 0 320.436 4.395 20 10 DICDRO C[C@@H]([NH2+]CC1SCCS1)c1ccc2ccccc2c1O ZINC000692856748 1042077072 /nfs/dbraw/zinc/07/70/72/1042077072.db2.gz RGGYLKCDLVGLHO-LLVKDONJSA-N 1 0 305.468 4.002 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000816632176 1042077270 /nfs/dbraw/zinc/07/72/70/1042077270.db2.gz XDFMTZBRSAAMAZ-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO C[C@@H]([NH2+]CCCOCC1CC1)c1ccc(N2CCCCC2)cc1 ZINC000162886886 1042094223 /nfs/dbraw/zinc/09/42/23/1042094223.db2.gz LYMCQVYRAHVRBT-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO CCOCCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000165144947 1042099445 /nfs/dbraw/zinc/09/94/45/1042099445.db2.gz CMDCURRDEBDFQL-KRWDZBQOSA-N 1 0 304.478 4.144 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1C ZINC000817365616 1042106411 /nfs/dbraw/zinc/10/64/11/1042106411.db2.gz QXMOIIRSOOGCKH-ZDUSSCGKSA-N 1 0 301.352 4.173 20 10 DICDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000817408489 1042106928 /nfs/dbraw/zinc/10/69/28/1042106928.db2.gz IUQVEDJNEWRTSQ-HNNXBMFYSA-N 1 0 321.779 4.188 20 10 DICDRO CC[C@@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000817415485 1042108216 /nfs/dbraw/zinc/10/82/16/1042108216.db2.gz UCXMTTYMGAJHBP-RTBURBONSA-N 1 0 311.425 4.106 20 10 DICDRO Oc1c(C[NH2+]C[C@@H]2CC23CCSCC3)ccc2ccccc21 ZINC000817411733 1042108416 /nfs/dbraw/zinc/10/84/16/1042108416.db2.gz UVWHQMMSUUIGFK-INIZCTEOSA-N 1 0 313.466 4.168 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccncc1Cl ZINC000817576896 1042116313 /nfs/dbraw/zinc/11/63/13/1042116313.db2.gz ZVFSOVRZMSWUEO-AWEZNQCLSA-N 1 0 315.848 4.186 20 10 DICDRO CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CCO1 ZINC000817585584 1042118242 /nfs/dbraw/zinc/11/82/42/1042118242.db2.gz GUYLNJWGZLBTKM-ILZDJORESA-N 1 0 316.489 4.285 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CC23CCSCC3)c(O)c1 ZINC000817588519 1042118642 /nfs/dbraw/zinc/11/86/42/1042118642.db2.gz GVWVOFKSYREVTF-CABCVRRESA-N 1 0 305.487 4.193 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CC12CCSCC2)c1cc(Cl)ccc1O ZINC000817588070 1042119362 /nfs/dbraw/zinc/11/93/62/1042119362.db2.gz BRXNSOBWQCQDFQ-NWDGAFQWSA-N 1 0 311.878 4.230 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CC12CCSCC2)c1ccc(C)cc1O ZINC000817588793 1042119451 /nfs/dbraw/zinc/11/94/51/1042119451.db2.gz KGKBUFCFOWKLKE-GDBMZVCRSA-N 1 0 305.487 4.275 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000817955986 1042131183 /nfs/dbraw/zinc/13/11/83/1042131183.db2.gz MYIPAMNFNHZSAQ-GFCCVEGCSA-N 1 0 324.346 4.061 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](N)c2ccc(C(C)C)cc2)c1 ZINC000817952211 1042131347 /nfs/dbraw/zinc/13/13/47/1042131347.db2.gz CUCBOXZABXQAIA-HNAYVOBHSA-N 1 0 312.457 4.175 20 10 DICDRO C[C@H]1C[C@H]([NH2+]CCc2ccc(N)cc2)c2ccsc2S1 ZINC000817955433 1042131653 /nfs/dbraw/zinc/13/16/53/1042131653.db2.gz AQDMJDWRHQUBOH-NHYWBVRUSA-N 1 0 304.484 4.088 20 10 DICDRO CC[C@H]([NH2+]CCC[NH2+]C(C)C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817953944 1042131786 /nfs/dbraw/zinc/13/17/86/1042131786.db2.gz SITWTPVRXKNMCG-ZDUSSCGKSA-N 1 0 319.276 4.128 20 10 DICDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000817957161 1042132516 /nfs/dbraw/zinc/13/25/16/1042132516.db2.gz JRGGIRUBBACSHA-QFBILLFUSA-N 1 0 314.860 4.391 20 10 DICDRO CCOc1cccc2cc([C@@H](C)[NH2+]CCc3ccc(N)cc3)oc21 ZINC000817958742 1042132956 /nfs/dbraw/zinc/13/29/56/1042132956.db2.gz XSZKIOLWQMONRS-CQSZACIVSA-N 1 0 324.424 4.307 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000817976708 1042134592 /nfs/dbraw/zinc/13/45/92/1042134592.db2.gz RZOKANNIIWOFNS-GWCFXTLKSA-N 1 0 319.276 4.257 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccc(C)cc1O ZINC000817977612 1042134675 /nfs/dbraw/zinc/13/46/75/1042134675.db2.gz LKQZWHGVNQLJAZ-SFHVURJKSA-N 1 0 310.441 4.300 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(Cl)cc(Cl)c1[O-] ZINC000817976082 1042134849 /nfs/dbraw/zinc/13/48/49/1042134849.db2.gz FNJKQOCZDGBKTL-HZMBPMFUSA-N 1 0 319.276 4.257 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc3c2CCCN3)cc1 ZINC000817975201 1042135261 /nfs/dbraw/zinc/13/52/61/1042135261.db2.gz KBIQUYJNYSLVDL-MRXNPFEDSA-N 1 0 323.484 4.352 20 10 DICDRO Cc1cc(N)cc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)c1 ZINC000817981614 1042135978 /nfs/dbraw/zinc/13/59/78/1042135978.db2.gz UBOAUURZNQEJCG-CQSZACIVSA-N 1 0 310.441 4.012 20 10 DICDRO Cc1cc(N)cc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)c1 ZINC000817981612 1042136179 /nfs/dbraw/zinc/13/61/79/1042136179.db2.gz UBOAUURZNQEJCG-AWEZNQCLSA-N 1 0 310.441 4.012 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cccc(Cl)c2C1)c1ccccc1O ZINC001170901223 1042148276 /nfs/dbraw/zinc/14/82/76/1042148276.db2.gz CDPRSNDJKAUPPM-GXTWGEPZSA-N 1 0 301.817 4.254 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cccc(Cl)c2C1)c1ccccc1O ZINC001170901225 1042148579 /nfs/dbraw/zinc/14/85/79/1042148579.db2.gz CDPRSNDJKAUPPM-OCCSQVGLSA-N 1 0 301.817 4.254 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)cc1 ZINC000165885537 1042189929 /nfs/dbraw/zinc/18/99/29/1042189929.db2.gz AOVWEWXXBDGPGF-ZWKOTPCHSA-N 1 0 324.468 4.243 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000310156514 1042194396 /nfs/dbraw/zinc/19/43/96/1042194396.db2.gz HELAYVPAJJJTDL-QKLQHJQFSA-N 1 0 324.468 4.014 20 10 DICDRO CCOC[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000318308345 1042268987 /nfs/dbraw/zinc/26/89/87/1042268987.db2.gz QBLASHXLGJTRLN-RDTXWAMCSA-N 1 0 301.430 4.257 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1Br)c1cc(F)ccc1O ZINC000094617853 1042324803 /nfs/dbraw/zinc/32/48/03/1042324803.db2.gz JHNOFSREJUOFQU-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO C[C@H](CCCO)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000237444371 1042377335 /nfs/dbraw/zinc/37/73/35/1042377335.db2.gz XEVPNUGLUHMIGL-CQSZACIVSA-N 1 0 321.505 4.238 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1-n1cccn1)c1ccc(C)cc1O ZINC000279935265 1042385861 /nfs/dbraw/zinc/38/58/61/1042385861.db2.gz AXMXCILRZXITPP-GOSISDBHSA-N 1 0 321.424 4.127 20 10 DICDRO CCN(CC)c1ccc(CNc2cccc(C[NH+](C)C)c2)cc1 ZINC000236938398 1042417575 /nfs/dbraw/zinc/41/75/75/1042417575.db2.gz KRJMMJOKYQTLQE-UHFFFAOYSA-N 1 0 311.473 4.207 20 10 DICDRO CCc1ccc([C@@H]([NH2+]Cc2cccc(OC)c2O)C(C)C)cc1 ZINC000236967996 1042439062 /nfs/dbraw/zinc/43/90/62/1042439062.db2.gz LMUSDPUEFAUGJU-IBGZPJMESA-N 1 0 313.441 4.450 20 10 DICDRO CCS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cc(OC)ccc2O)C1 ZINC000248496915 1042441827 /nfs/dbraw/zinc/44/18/27/1042441827.db2.gz LNFBVQYWVZTRJP-UMVBOHGHSA-N 1 0 309.475 4.116 20 10 DICDRO COc1cc(C)cc(C[NH2+][C@H]2CCSc3ccccc32)c1O ZINC000894144003 1042470914 /nfs/dbraw/zinc/47/09/14/1042470914.db2.gz YXRXBQJUISAZJQ-HNNXBMFYSA-N 1 0 315.438 4.036 20 10 DICDRO CC[C@@H]([NH2+][C@@H](CCOC)c1ccc(C)o1)c1ccc(C)cc1O ZINC000280272582 1042569138 /nfs/dbraw/zinc/56/91/38/1042569138.db2.gz YACQZRAZGCDAQV-SJORKVTESA-N 1 0 317.429 4.421 20 10 DICDRO COc1cc(C)cc(C[NH2+]Cc2oc3ccccc3c2C)c1O ZINC000894265266 1042662044 /nfs/dbraw/zinc/66/20/44/1042662044.db2.gz AYFGNYUKLXKNAK-UHFFFAOYSA-N 1 0 311.381 4.054 20 10 DICDRO Cc1cc(N2CCCC2)ccc1NCc1ccc(N(C)C)cc1 ZINC000237135520 1042762412 /nfs/dbraw/zinc/76/24/12/1042762412.db2.gz FATDHCSLWVJPEM-UHFFFAOYSA-N 1 0 309.457 4.273 20 10 DICDRO COc1cc(C)cc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)c1O ZINC000894325166 1042845703 /nfs/dbraw/zinc/84/57/03/1042845703.db2.gz OGLKJOKOAQIOLQ-UHFFFAOYSA-N 1 0 321.367 4.012 20 10 DICDRO CC(C)(CC[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1)C1CC1 ZINC001167982636 1042975514 /nfs/dbraw/zinc/97/55/14/1042975514.db2.gz FNAYYTLLUXRDGO-GOSISDBHSA-N 1 0 317.473 4.200 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(F)c(COC)c1)c1ccc(C)cc1O ZINC000794804862 1043048685 /nfs/dbraw/zinc/04/86/85/1043048685.db2.gz VQXHIDFKBXXYIU-GOSISDBHSA-N 1 0 317.404 4.227 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccc(C)cc1O ZINC000794805286 1043049168 /nfs/dbraw/zinc/04/91/68/1043049168.db2.gz GJCBYEHZYDZQBR-QAPCUYQASA-N 1 0 311.425 4.308 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(F)c(COC)c1)c1ccc(C)cc1O ZINC000794804863 1043049466 /nfs/dbraw/zinc/04/94/66/1043049466.db2.gz VQXHIDFKBXXYIU-SFHVURJKSA-N 1 0 317.404 4.227 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)CCc1ccc(O)cc1)c1ccc(C)cc1O ZINC000794805423 1043049875 /nfs/dbraw/zinc/04/98/75/1043049875.db2.gz GNGYKDIZRUYKBF-HNAYVOBHSA-N 1 0 313.441 4.468 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)CCc1ccc(O)cc1)c1ccc(C)cc1O ZINC000794805425 1043049886 /nfs/dbraw/zinc/04/98/86/1043049886.db2.gz GNGYKDIZRUYKBF-KXBFYZLASA-N 1 0 313.441 4.468 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccc(C)cc1O ZINC000794805277 1043050128 /nfs/dbraw/zinc/05/01/28/1043050128.db2.gz GJCBYEHZYDZQBR-CRAIPNDOSA-N 1 0 311.425 4.308 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](CC)c2ccc(C)cc2O)C12CCC2 ZINC000794803693 1043051277 /nfs/dbraw/zinc/05/12/77/1043051277.db2.gz RVOPETLYQMYWJF-CGTJXYLNSA-N 1 0 303.446 4.089 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc(OC)c(F)c1)c1ccc(C)cc1O ZINC000794807737 1043056937 /nfs/dbraw/zinc/05/69/37/1043056937.db2.gz LGQKUVAAMIBPOV-QGZVFWFLSA-N 1 0 317.404 4.132 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)c1ccc(C)cc1O ZINC000794813979 1043058821 /nfs/dbraw/zinc/05/88/21/1043058821.db2.gz GENNDULHCLYJDK-JTJHWIPRSA-N 1 0 307.437 4.327 20 10 DICDRO CC[C@@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1ccc(C)cc1O ZINC000794818458 1043062820 /nfs/dbraw/zinc/06/28/20/1043062820.db2.gz XDHNJWFWHRRRQE-MJGOQNOKSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@@H]([NH2+]CCc1cccc(C)n1)c1cc(Cl)ccc1O ZINC000794826791 1043066283 /nfs/dbraw/zinc/06/62/83/1043066283.db2.gz DUFQJXSYWDXICV-MRXNPFEDSA-N 1 0 304.821 4.032 20 10 DICDRO Cc1cccc(CC[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000794830076 1043067024 /nfs/dbraw/zinc/06/70/24/1043067024.db2.gz YEFGECNRZUXVLD-GOSISDBHSA-N 1 0 323.484 4.274 20 10 DICDRO CCC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)[C@@H](O)c1ccccc1 ZINC000794831278 1043068487 /nfs/dbraw/zinc/06/84/87/1043068487.db2.gz PNFKCWSVOUIRCN-FMEYXAORSA-N 1 0 317.404 4.084 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc3ccccc32)c1 ZINC000120488881 1043080634 /nfs/dbraw/zinc/08/06/34/1043080634.db2.gz QLRWOFFNHJESBD-AWEZNQCLSA-N 1 0 307.393 4.405 20 10 DICDRO C[C@@H]([NH2+]CC1CCOCC1)c1ccc(N2CCCCCC2)cc1 ZINC000178280675 1043125185 /nfs/dbraw/zinc/12/51/85/1043125185.db2.gz IFZARFKNUJVBAY-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000179194897 1043143076 /nfs/dbraw/zinc/14/30/76/1043143076.db2.gz VBSQPERPZCPYQP-KRWDZBQOSA-N 1 0 309.457 4.265 20 10 DICDRO CCOCc1cc(C[NH2+]Cc2cccc3[nH]ccc32)ccc1OC ZINC000865870389 1043144211 /nfs/dbraw/zinc/14/42/11/1043144211.db2.gz UQYSBLNPFNCBJN-UHFFFAOYSA-N 1 0 324.424 4.003 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000183344503 1043161436 /nfs/dbraw/zinc/16/14/36/1043161436.db2.gz DLROPBSSJAFUDY-WBVHZDCISA-N 1 0 320.452 4.036 20 10 DICDRO COc1cc(C)c([C@H](C)[NH2+][C@H](C)c2ccccc2O)cc1OC ZINC000183418681 1043162958 /nfs/dbraw/zinc/16/29/58/1043162958.db2.gz DSWRJVVBWXMSIA-KGLIPLIRSA-N 1 0 315.413 4.130 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccccc1O ZINC000183397162 1043163265 /nfs/dbraw/zinc/16/32/65/1043163265.db2.gz PGXJGZUYLPEUBB-UONOGXRCSA-N 1 0 324.424 4.153 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccccc1O ZINC000183644899 1043168193 /nfs/dbraw/zinc/16/81/93/1043168193.db2.gz WTVSTJUTSZMUPB-PZPSRYQVSA-N 1 0 317.816 4.226 20 10 DICDRO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000183608702 1043168442 /nfs/dbraw/zinc/16/84/42/1043168442.db2.gz KFHICRIYDBARNV-KBPBESRZSA-N 1 0 309.413 4.174 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOc2cc(F)ccc21)c1ccccc1O ZINC000183671574 1043168875 /nfs/dbraw/zinc/16/88/75/1043168875.db2.gz SREDYOHMWHHSAW-BLLLJJGKSA-N 1 0 301.361 4.096 20 10 DICDRO CCOCc1ccccc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000184932318 1043192300 /nfs/dbraw/zinc/19/23/00/1043192300.db2.gz ZVGHESHYVCXPSY-ZDUSSCGKSA-N 1 0 319.832 4.433 20 10 DICDRO COCc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1 ZINC000184941707 1043192683 /nfs/dbraw/zinc/19/26/83/1043192683.db2.gz WOWAVYKYMFHJKJ-LBPRGKRZSA-N 1 0 305.805 4.043 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC000185004921 1043193108 /nfs/dbraw/zinc/19/31/08/1043193108.db2.gz MOCFJWLEGXDARR-MRXNPFEDSA-N 1 0 310.441 4.152 20 10 DICDRO COCc1ccccc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000184925796 1043193455 /nfs/dbraw/zinc/19/34/55/1043193455.db2.gz BBKOOSGUSNXKJJ-GFCCVEGCSA-N 1 0 305.805 4.043 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3cc(Cl)ccc32)c1 ZINC000185215802 1043195885 /nfs/dbraw/zinc/19/58/85/1043195885.db2.gz DPGMSVONEIEFPN-DIFFPNOSSA-N 1 0 317.816 4.392 20 10 DICDRO CCC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccnc1 ZINC000185233539 1043197381 /nfs/dbraw/zinc/19/73/81/1043197381.db2.gz DGTLSSILLXHYOB-LJQANCHMSA-N 1 0 309.457 4.095 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)c1 ZINC000185288919 1043198632 /nfs/dbraw/zinc/19/86/32/1043198632.db2.gz YFDCKDOEXJVZGE-DOTOQJQBSA-N 1 0 317.429 4.358 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2oc3ccccc3c2C)c1 ZINC000185456878 1043200445 /nfs/dbraw/zinc/20/04/45/1043200445.db2.gz NEZNPLJZYUZIML-ZDUSSCGKSA-N 1 0 311.381 4.306 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1F ZINC000185382936 1043201126 /nfs/dbraw/zinc/20/11/26/1043201126.db2.gz RBKZVPHVQJSHGD-ZDUSSCGKSA-N 1 0 303.377 4.089 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000185374177 1043201240 /nfs/dbraw/zinc/20/12/40/1043201240.db2.gz GQZIDBQDTCRBOM-LBPRGKRZSA-N 1 0 304.459 4.305 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3cccnc3c2)c(O)c1C ZINC000866431657 1043201451 /nfs/dbraw/zinc/20/14/51/1043201451.db2.gz ZBZDCNBJZNNSOP-OAHLLOKOSA-N 1 0 306.409 4.408 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3cccnc3c2)c2c1c(F)ccc2O ZINC000866431537 1043201655 /nfs/dbraw/zinc/20/16/55/1043201655.db2.gz VZQKCZAWDFCWRG-YVEFUNNKSA-N 1 0 322.383 4.418 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000866455239 1043204623 /nfs/dbraw/zinc/20/46/23/1043204623.db2.gz KHBBRJLBFAWEMD-RYUDHWBXSA-N 1 0 316.470 4.448 20 10 DICDRO Cc1ncc([C@H](C)[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)s1 ZINC000866454615 1043205320 /nfs/dbraw/zinc/20/53/20/1043205320.db2.gz FILBYDIEJHEEOH-AUTRQRHGSA-N 1 0 306.406 4.195 20 10 DICDRO C[C@@H]([NH2+]Cc1ccnc(F)c1)c1ccc(N2CCCCC2)cc1 ZINC000866473619 1043206800 /nfs/dbraw/zinc/20/68/00/1043206800.db2.gz FHJGZKOQRXHACZ-OAHLLOKOSA-N 1 0 313.420 4.062 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2noc3ccc(F)cc32)c(O)c1 ZINC000866512301 1043215521 /nfs/dbraw/zinc/21/55/21/1043215521.db2.gz XGWCZEBKRGWERW-LBPRGKRZSA-N 1 0 314.360 4.140 20 10 DICDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000186157436 1043216374 /nfs/dbraw/zinc/21/63/74/1043216374.db2.gz MCSSMXWAFLTKMO-VHSXEESVSA-N 1 0 308.809 4.105 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCOc2cc(F)ccc21)c1cc(F)ccc1O ZINC000186374633 1043222418 /nfs/dbraw/zinc/22/24/18/1043222418.db2.gz BJYBKBWDHXSQHU-BZNIZROVSA-N 1 0 319.351 4.235 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOc2cc(F)ccc21)c1cc(F)ccc1O ZINC000186374581 1043222594 /nfs/dbraw/zinc/22/25/94/1043222594.db2.gz BJYBKBWDHXSQHU-MEDUHNTESA-N 1 0 319.351 4.235 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCOc2cc(F)ccc21)c1cc(F)ccc1O ZINC000186374599 1043223104 /nfs/dbraw/zinc/22/31/04/1043223104.db2.gz BJYBKBWDHXSQHU-BDJLRTHQSA-N 1 0 319.351 4.235 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C(C)(C)C)o2)c1O ZINC000866573404 1043227067 /nfs/dbraw/zinc/22/70/67/1043227067.db2.gz IVSJDNIRDNRKDZ-GFCCVEGCSA-N 1 0 303.402 4.142 20 10 DICDRO Cc1cnc([C@H](C)C[NH2+][C@H](C)c2cc(Cl)ccc2O)s1 ZINC000186766131 1043233540 /nfs/dbraw/zinc/23/35/40/1043233540.db2.gz AKLPEFKDBTZGSE-MWLCHTKSSA-N 1 0 310.850 4.265 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]Cc2cccc3[nH]ccc32)c2c1c(F)ccc2O ZINC000866632250 1043239468 /nfs/dbraw/zinc/23/94/68/1043239468.db2.gz WDFIDOPZOIGGER-BZNIZROVSA-N 1 0 310.372 4.351 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)c1 ZINC000191857461 1043262823 /nfs/dbraw/zinc/26/28/23/1043262823.db2.gz GINFAWFGXFQVJN-SYNHAJSKSA-N 1 0 311.425 4.129 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)c(O)c1 ZINC000191854569 1043263066 /nfs/dbraw/zinc/26/30/66/1043263066.db2.gz FIKFIQGPVNRQFW-SYNHAJSKSA-N 1 0 311.425 4.129 20 10 DICDRO COCCCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000122617653 1043318130 /nfs/dbraw/zinc/31/81/30/1043318130.db2.gz VBFHUQWPHPTDSL-QGZVFWFLSA-N 1 0 304.478 4.144 20 10 DICDRO COCCCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000122639661 1043318239 /nfs/dbraw/zinc/31/82/39/1043318239.db2.gz ACGUCHGHCDACBV-MRXNPFEDSA-N 1 0 322.468 4.283 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccc(Cl)nc2)cc1 ZINC000122713328 1043323673 /nfs/dbraw/zinc/32/36/73/1043323673.db2.gz ASEHQRUBIFSTHF-AWEZNQCLSA-N 1 0 317.864 4.084 20 10 DICDRO CC[C@H]([NH2+]CCc1ccc(Cl)nc1)c1ccc(N(C)C)cc1 ZINC000122762406 1043327929 /nfs/dbraw/zinc/32/79/29/1043327929.db2.gz OSERCNWTDTXIOE-KRWDZBQOSA-N 1 0 317.864 4.084 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1ccc(N2CCCCC2)cc1 ZINC000271527201 1043432612 /nfs/dbraw/zinc/43/26/12/1043432612.db2.gz QIROGHJPWYCCAN-KXBFYZLASA-N 1 0 324.472 4.128 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(OC(C)C)cc2)c1 ZINC000271671355 1043447030 /nfs/dbraw/zinc/44/70/30/1043447030.db2.gz GOFLCBFFDUHOGO-AWEZNQCLSA-N 1 0 315.413 4.039 20 10 DICDRO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000872133339 1043475850 /nfs/dbraw/zinc/47/58/50/1043475850.db2.gz LWIBJRFZCVHJCQ-NVXWUHKLSA-N 1 0 324.472 4.187 20 10 DICDRO CSC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001138219838 1043488966 /nfs/dbraw/zinc/48/89/66/1043488966.db2.gz QEESCRLBJPZOEM-UHFFFAOYSA-N 1 0 304.503 4.004 20 10 DICDRO CC(=O)C1CC[NH+](Cc2cc3oc4ccccc4c3cc2O)CC1 ZINC000872797817 1043508185 /nfs/dbraw/zinc/50/81/85/1043508185.db2.gz CQEWSUKMKZWISB-UHFFFAOYSA-N 1 0 323.392 4.093 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2ccc(Cl)cn2)cc1C ZINC000873101288 1043515774 /nfs/dbraw/zinc/51/57/74/1043515774.db2.gz QZFREHVBDSAJRJ-UHFFFAOYSA-N 1 0 304.821 4.122 20 10 DICDRO CCCOc1ccc(C[NH2+]C(C)(C)c2c(C)noc2C)cc1C ZINC000873126344 1043516878 /nfs/dbraw/zinc/51/68/78/1043516878.db2.gz FWFQWYBOVDZWKZ-UHFFFAOYSA-N 1 0 316.445 4.414 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(O)cc1)c1ccc2ccccc2c1O ZINC000320191385 1043609101 /nfs/dbraw/zinc/60/91/01/1043609101.db2.gz GHJGRJUKWQSPDN-AWEZNQCLSA-N 1 0 307.393 4.144 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1[C@@H](c2ccccc2)C1(F)F)c1cc(F)ccc1O ZINC000926971927 1043663514 /nfs/dbraw/zinc/66/35/14/1043663514.db2.gz AFLYRWWEKSDMKC-RGYTYGDFSA-N 1 0 321.342 4.231 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1cc(Cl)ccc1O ZINC000927060716 1043675031 /nfs/dbraw/zinc/67/50/31/1043675031.db2.gz FIAZZNCUJUNEFM-XHDPSFHLSA-N 1 0 302.805 4.169 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1cc2c(cc1O)CCCC2 ZINC000927060451 1043675736 /nfs/dbraw/zinc/67/57/36/1043675736.db2.gz CDSGDSIFFAQPSC-IFXJQAMLSA-N 1 0 322.452 4.394 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1cc(Cl)ccc1O ZINC000927063533 1043677214 /nfs/dbraw/zinc/67/72/14/1043677214.db2.gz FIAZZNCUJUNEFM-ABAIWWIYSA-N 1 0 302.805 4.169 20 10 DICDRO C[C@H]([NH2+]Cc1cc(C2CC2)nn1C)c1ccc2ccccc2c1O ZINC000927101782 1043687463 /nfs/dbraw/zinc/68/74/63/1043687463.db2.gz OJNNPIXPKWWZSE-ZDUSSCGKSA-N 1 0 321.424 4.007 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)c(O)c1 ZINC000876984084 1043731547 /nfs/dbraw/zinc/73/15/47/1043731547.db2.gz DOTBZBCIAQWHIX-GOSISDBHSA-N 1 0 309.413 4.064 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc3ccc(C)cc3[nH]2)c1 ZINC000825933617 1043739714 /nfs/dbraw/zinc/73/97/14/1043739714.db2.gz BLIMBMOSPBLOHQ-ZDUSSCGKSA-N 1 0 310.397 4.041 20 10 DICDRO Cc1ccc(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)c(O)c1 ZINC000877590253 1043778888 /nfs/dbraw/zinc/77/88/88/1043778888.db2.gz XMLWBOLCOOKYNH-HXUWFJFHSA-N 1 0 323.436 4.054 20 10 DICDRO C[C@@H]([NH2+]C1CCC(OC2CCCC2)CC1)c1ccccc1O ZINC000877755662 1043792060 /nfs/dbraw/zinc/79/20/60/1043792060.db2.gz KREMFCTVJGPHRP-HPUBIQBYSA-N 1 0 303.446 4.313 20 10 DICDRO C[C@@H]([NH2+]Cc1cscc1C(F)(F)F)c1ccccc1O ZINC000877755837 1043792427 /nfs/dbraw/zinc/79/24/27/1043792427.db2.gz OKQDZVVHOGKIRC-SECBINFHSA-N 1 0 301.333 4.323 20 10 DICDRO C[C@@H]([NH2+]Cc1cn(C)nc1C1CCCCC1)c1ccccc1O ZINC000877755995 1043793241 /nfs/dbraw/zinc/79/32/41/1043793241.db2.gz XNCBKGZCUAJCIT-CQSZACIVSA-N 1 0 313.445 4.024 20 10 DICDRO Cc1nn(-c2cccc(C)c2)cc1C[NH2+][C@@H](C)c1ccccc1O ZINC000877758134 1043793649 /nfs/dbraw/zinc/79/36/49/1043793649.db2.gz KFQSTJDNLRZSGM-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO CC[C@H]([NH2+]CCCn1ccc2ccccc21)c1ccccc1O ZINC000320273468 1043854325 /nfs/dbraw/zinc/85/43/25/1043854325.db2.gz FMOFKRNLALQXNS-SFHVURJKSA-N 1 0 308.425 4.478 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](C)c2nccn2-c2ccccc2)cc1C ZINC000290179758 1043927233 /nfs/dbraw/zinc/92/72/33/1043927233.db2.gz RSIRMCKFYKHCGN-MRXNPFEDSA-N 1 0 321.424 4.046 20 10 DICDRO CC[N@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H](C)c1cccnc1 ZINC000290473481 1043953307 /nfs/dbraw/zinc/95/33/07/1043953307.db2.gz NRGALBAGBDWQOZ-LBPRGKRZSA-N 1 0 320.820 4.032 20 10 DICDRO COc1ccc(C[N@H+](Cc2cc(C)c(C)cc2O)C2CC2)cc1 ZINC000023850169 1044025071 /nfs/dbraw/zinc/02/50/71/1044025071.db2.gz JRLKAEAEOYHGLY-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO Cc1nc(C[NH2+][C@@H](C)c2ccccc2O)sc1C(C)(C)C ZINC000931554034 1044043158 /nfs/dbraw/zinc/04/31/58/1044043158.db2.gz KGOSSKFCRLFOGX-NSHDSACASA-N 1 0 304.459 4.305 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2ccc(C3CC3)cc2F)c1O ZINC000291725478 1044099999 /nfs/dbraw/zinc/09/99/99/1044099999.db2.gz NERFUYBMFDKAQK-UHFFFAOYSA-N 1 0 315.388 4.097 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CCCc3sc(Cl)cc32)c1O ZINC000291815719 1044106189 /nfs/dbraw/zinc/10/61/89/1044106189.db2.gz YQCSMVXHDBMDGV-GFCCVEGCSA-N 1 0 323.845 4.283 20 10 DICDRO COc1cccc(C[NH2+][C@H]2CCCc3sc(Cl)cc32)c1O ZINC000291815723 1044106457 /nfs/dbraw/zinc/10/64/57/1044106457.db2.gz YQCSMVXHDBMDGV-LBPRGKRZSA-N 1 0 323.845 4.283 20 10 DICDRO CC[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccc1O ZINC000281233963 1044108280 /nfs/dbraw/zinc/10/82/80/1044108280.db2.gz VYAXHRRDYHKMLC-ZDUSSCGKSA-N 1 0 313.294 4.190 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000358987499 1044117946 /nfs/dbraw/zinc/11/79/46/1044117946.db2.gz MSLXEPBZUGWKTJ-HNNXBMFYSA-N 1 0 310.445 4.115 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000358987505 1044118111 /nfs/dbraw/zinc/11/81/11/1044118111.db2.gz MSLXEPBZUGWKTJ-OAHLLOKOSA-N 1 0 310.445 4.115 20 10 DICDRO CCC(CC)[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000778119711 1044158344 /nfs/dbraw/zinc/15/83/44/1044158344.db2.gz XWBGVTRLWVCJIU-DYVFJYSZSA-N 1 0 311.853 4.119 20 10 DICDRO Cc1csc(C[N@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000130812508 1044217137 /nfs/dbraw/zinc/21/71/37/1044217137.db2.gz ZRQBRBIFHIJFJG-UHFFFAOYSA-N 1 0 302.443 4.102 20 10 DICDRO CC1(C)CC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)O1 ZINC000778208824 1044217302 /nfs/dbraw/zinc/21/73/02/1044217302.db2.gz UBCFVLKSASHJQL-SFHVURJKSA-N 1 0 311.425 4.106 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc(C(C)(F)F)cc2)c1 ZINC000293007509 1044239629 /nfs/dbraw/zinc/23/96/29/1044239629.db2.gz PJTLGIGQUVPMRI-UHFFFAOYSA-N 1 0 321.367 4.192 20 10 DICDRO CCOCc1cc(C[NH2+]CC(C)(C)CC(F)F)ccc1OC ZINC000883251881 1044246085 /nfs/dbraw/zinc/24/60/85/1044246085.db2.gz HNSXPFWDVHBYSS-UHFFFAOYSA-N 1 0 315.404 4.003 20 10 DICDRO CO[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000883269142 1044256288 /nfs/dbraw/zinc/25/62/88/1044256288.db2.gz ABGBGUGPLBHIOJ-ZWOKBUDYSA-N 1 0 316.489 4.143 20 10 DICDRO CCOc1cccc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)c1O ZINC000131568865 1044278031 /nfs/dbraw/zinc/27/80/31/1044278031.db2.gz YIBZHZVYUYOOGF-GFCCVEGCSA-N 1 0 321.367 4.262 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C1CCC2(COC2)CC1 ZINC000883391798 1044302165 /nfs/dbraw/zinc/30/21/65/1044302165.db2.gz RUKKYAMJZBDBRV-UHFFFAOYSA-N 1 0 323.436 4.108 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc3cccnc32)c(O)c1 ZINC000293615561 1044305469 /nfs/dbraw/zinc/30/54/69/1044305469.db2.gz GWBBJYSOBABVNM-HNNXBMFYSA-N 1 0 306.409 4.408 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)c1 ZINC000192744575 1044305351 /nfs/dbraw/zinc/30/53/51/1044305351.db2.gz MXIMNUHZWVPMAK-GFCCVEGCSA-N 1 0 307.340 4.153 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc2ncccc2c1 ZINC000475191464 1044306257 /nfs/dbraw/zinc/30/62/57/1044306257.db2.gz DCWLGHUVROPJQW-UHFFFAOYSA-N 1 0 315.420 4.325 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)c1 ZINC000192724530 1044306636 /nfs/dbraw/zinc/30/66/36/1044306636.db2.gz RTBXUXPUDDZATP-GHMZBOCLSA-N 1 0 307.340 4.091 20 10 DICDRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000192809895 1044316088 /nfs/dbraw/zinc/31/60/88/1044316088.db2.gz XSVDBJHGFSFOFA-CHWSQXEVSA-N 1 0 303.377 4.260 20 10 DICDRO Cc1csc(C2([NH2+]Cc3cc(C)cc(C)c3O)CCCC2)n1 ZINC000132353906 1044321120 /nfs/dbraw/zinc/32/11/20/1044321120.db2.gz DAVHSSJKRZRZEQ-UHFFFAOYSA-N 1 0 316.470 4.333 20 10 DICDRO CCc1noc(C)c1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000293772665 1044327835 /nfs/dbraw/zinc/32/78/35/1044327835.db2.gz SGBOYRZGUUNMHJ-GFCCVEGCSA-N 1 0 310.397 4.255 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](C)CCOC)c1ccc(C(F)(F)F)cc1O ZINC000840836497 1044356960 /nfs/dbraw/zinc/35/69/60/1044356960.db2.gz ZEXRLHCGMNMQLQ-FZMZJTMJSA-N 1 0 319.367 4.124 20 10 DICDRO CSCCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000133579960 1044420746 /nfs/dbraw/zinc/42/07/46/1044420746.db2.gz CHDJUARPKMSNRU-MRXNPFEDSA-N 1 0 306.519 4.471 20 10 DICDRO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000133651110 1044433178 /nfs/dbraw/zinc/43/31/78/1044433178.db2.gz WVCUPTZFCPZOKE-GOSISDBHSA-N 1 0 324.468 4.025 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccccc1O ZINC000295124239 1044491966 /nfs/dbraw/zinc/49/19/66/1044491966.db2.gz XARULIIOSQWAIZ-CYBMUJFWSA-N 1 0 310.319 4.047 20 10 DICDRO CC[C@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccccc1O ZINC000295124241 1044492241 /nfs/dbraw/zinc/49/22/41/1044492241.db2.gz XARULIIOSQWAIZ-ZDUSSCGKSA-N 1 0 310.319 4.047 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(OC)c(Cl)c1)c1ccccc1O ZINC000121093889 1044517278 /nfs/dbraw/zinc/51/72/78/1044517278.db2.gz XDIKPZMNINKNDW-HNNXBMFYSA-N 1 0 305.805 4.295 20 10 DICDRO COc1ccc([C@H]([NH2+][C@@H]2CCc3cccc(O)c32)C2CC2)cc1 ZINC000296017547 1044581820 /nfs/dbraw/zinc/58/18/20/1044581820.db2.gz PDQMHPIVKIGVTB-YLJYHZDGSA-N 1 0 309.409 4.129 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCCOc3c(F)cccc31)CC2 ZINC000296335777 1044609870 /nfs/dbraw/zinc/60/98/70/1044609870.db2.gz GPVSQYSLKJIGQT-CVEARBPZSA-N 1 0 313.372 4.022 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1N1CCCCC1)CC2 ZINC000296572297 1044629401 /nfs/dbraw/zinc/62/94/01/1044629401.db2.gz VFQPOSFKBLSRQC-SFHVURJKSA-N 1 0 322.452 4.160 20 10 DICDRO COC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc(Cl)cc1 ZINC000296575124 1044629419 /nfs/dbraw/zinc/62/94/19/1044629419.db2.gz VLBFKZHRULKLHF-HOTGVXAUSA-N 1 0 317.816 4.010 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1)CC2 ZINC000296933137 1044652975 /nfs/dbraw/zinc/65/29/75/1044652975.db2.gz QBRJCKLIUUQUPW-IPELMVKDSA-N 1 0 323.436 4.137 20 10 DICDRO CC1CCN(c2ccc(C[NH2+][C@H]3CCc4cccnc43)cc2)CC1 ZINC000886525150 1044654970 /nfs/dbraw/zinc/65/49/70/1044654970.db2.gz YLDGVOMOLJJTKG-FQEVSTJZSA-N 1 0 321.468 4.095 20 10 DICDRO Oc1c(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)ccc2ccccc21 ZINC000816481718 1044690030 /nfs/dbraw/zinc/69/00/30/1044690030.db2.gz GSVGBPRGZNXWJQ-CQSZACIVSA-N 1 0 309.331 4.320 20 10 DICDRO CC[C@@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1ccccc1O ZINC000886773797 1044695419 /nfs/dbraw/zinc/69/54/19/1044695419.db2.gz BEKAEKOQVFQVLE-AEFFLSMTSA-N 1 0 303.446 4.172 20 10 DICDRO CC[C@H]([NH2+][C@@H](COCC(C)C)c1ccco1)c1ccccc1O ZINC000155538672 1044702381 /nfs/dbraw/zinc/70/23/81/1044702381.db2.gz VVGSWZCYJJQYSU-IRXDYDNUSA-N 1 0 317.429 4.440 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1OCC1CC1)c1ccccc1O ZINC000155955454 1044746069 /nfs/dbraw/zinc/74/60/69/1044746069.db2.gz BHZIPGWWLPTLRH-GOSISDBHSA-N 1 0 311.425 4.422 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2cccc3ccccc32)c1O ZINC000140402662 1044760490 /nfs/dbraw/zinc/76/04/90/1044760490.db2.gz ZNSUBYPSVCDYPB-CQSZACIVSA-N 1 0 307.393 4.405 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1COC)c1ccc(N(C)C)cc1 ZINC000122067470 1044768680 /nfs/dbraw/zinc/76/86/80/1044768680.db2.gz NPNQDAGHWVIPDZ-HXUWFJFHSA-N 1 0 312.457 4.140 20 10 DICDRO CC[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1O ZINC000368415112 1044775446 /nfs/dbraw/zinc/77/54/46/1044775446.db2.gz YJZXKBNNXVSVMU-QGZVFWFLSA-N 1 0 303.446 4.172 20 10 DICDRO CCC[C@@H](C)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000157722129 1044942129 /nfs/dbraw/zinc/94/21/29/1044942129.db2.gz CTJPOWHLSIRBCI-CYBMUJFWSA-N 1 0 312.404 4.035 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000134910160 1044969455 /nfs/dbraw/zinc/96/94/55/1044969455.db2.gz OSSKPCNRABXOPA-ZIAGYGMSSA-N 1 0 315.461 4.372 20 10 DICDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000134918060 1044972447 /nfs/dbraw/zinc/97/24/47/1044972447.db2.gz OHKGRUNDSQMVEF-OLZOCXBDSA-N 1 0 301.434 4.064 20 10 DICDRO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000153165982 1045052322 /nfs/dbraw/zinc/05/23/22/1045052322.db2.gz KCUYSCAJOGVVGZ-ZWKOTPCHSA-N 1 0 324.468 4.243 20 10 DICDRO Cn1c2ccccc2nc1[C@H]1CCCC[N@@H+]1Cc1ccccc1O ZINC000778998042 1045112186 /nfs/dbraw/zinc/11/21/86/1045112186.db2.gz GGAYCTZPGWLFRR-GOSISDBHSA-N 1 0 321.424 4.006 20 10 DICDRO Cc1cc(Br)cc([C@H](C)[NH2+]C(C2CC2)C2CC2)c1O ZINC000779008125 1045122914 /nfs/dbraw/zinc/12/29/14/1045122914.db2.gz FHSLLZJBSXVDLJ-JTQLQIEISA-N 1 0 324.262 4.302 20 10 DICDRO CC1CCC(OC2CC[NH+](Cc3cc(F)ccc3O)CC2)CC1 ZINC000779012632 1045126969 /nfs/dbraw/zinc/12/69/69/1045126969.db2.gz FRNPTIAYYLKTBM-UHFFFAOYSA-N 1 0 321.436 4.091 20 10 DICDRO Cc1occc1C[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC000779013030 1045130895 /nfs/dbraw/zinc/13/08/95/1045130895.db2.gz XRBWTGUZNKZGJD-SNVBAGLBSA-N 1 0 324.218 4.215 20 10 DICDRO CC(C)C[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)N(C)C ZINC000320729513 1045185511 /nfs/dbraw/zinc/18/55/11/1045185511.db2.gz XBVUGKANPOEPBL-DOTOQJQBSA-N 1 0 314.473 4.172 20 10 DICDRO Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2cc(F)ccc2O)c1C ZINC000779071841 1045243595 /nfs/dbraw/zinc/24/35/95/1045243595.db2.gz GSTMCBRWHGPSKN-UHFFFAOYSA-N 1 0 312.388 4.228 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1ccc(N2CCCCC2)cc1 ZINC000779079020 1045252717 /nfs/dbraw/zinc/25/27/17/1045252717.db2.gz JVHQVOXCSOSPJA-APWZRJJASA-N 1 0 316.489 4.285 20 10 DICDRO CCOc1ccc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c(O)c1 ZINC000527795444 1045263817 /nfs/dbraw/zinc/26/38/17/1045263817.db2.gz OIGHNESZJYXXCS-KRWDZBQOSA-N 1 0 317.816 4.221 20 10 DICDRO Cc1ccc(C[NH2+]Cc2cc(F)ccc2O)c(OC(C)(C)C)c1 ZINC000779092582 1045267555 /nfs/dbraw/zinc/26/75/55/1045267555.db2.gz JIGQKFQAVVAURI-UHFFFAOYSA-N 1 0 317.404 4.307 20 10 DICDRO COCCC1CC[NH+]([C@@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000527936619 1045287208 /nfs/dbraw/zinc/28/72/08/1045287208.db2.gz PXXLHLGXXDLWQB-ZDUSSCGKSA-N 1 0 311.853 4.164 20 10 DICDRO COc1cnccc1[C@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000188796045 1045339508 /nfs/dbraw/zinc/33/95/08/1045339508.db2.gz UPDCFVVZQQTGEB-UONOGXRCSA-N 1 0 322.408 4.361 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)[C@@H](C)c2ccccc2)c1O ZINC000779197441 1045368573 /nfs/dbraw/zinc/36/85/73/1045368573.db2.gz APJNUCWIONQAKS-CHWSQXEVSA-N 1 0 315.388 4.016 20 10 DICDRO C[N@H+](Cc1ccsc1C(F)(F)F)Cc1ccccc1O ZINC000529525165 1045490440 /nfs/dbraw/zinc/49/04/40/1045490440.db2.gz PWXKXRAEDPJNGJ-UHFFFAOYSA-N 1 0 301.333 4.105 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(c3cccc(Cl)c3)CC2)cc1 ZINC000077467878 1045523406 /nfs/dbraw/zinc/52/34/06/1045523406.db2.gz IFBXBEUJXMKHQI-UHFFFAOYSA-N 1 0 300.833 4.185 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCCCOCc1ccccc1 ZINC000113331327 1045561036 /nfs/dbraw/zinc/56/10/36/1045561036.db2.gz UOBZLCNZOYOFGL-UHFFFAOYSA-N 1 0 319.832 4.132 20 10 DICDRO C[C@H]1CCCN(c2ccc(C[NH2+]Cc3cc[nH]c3)cc2Cl)C1 ZINC000800276246 1045601375 /nfs/dbraw/zinc/60/13/75/1045601375.db2.gz LOQFUPBAZNOBOM-AWEZNQCLSA-N 1 0 317.864 4.194 20 10 DICDRO C[C@@H]1CCCN(c2ccc(C[NH2+]Cc3ccco3)cc2Cl)C1 ZINC000800276596 1045601532 /nfs/dbraw/zinc/60/15/32/1045601532.db2.gz OZQZDHRKXNRMMM-CQSZACIVSA-N 1 0 318.848 4.459 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccccc2SC)c(O)c1 ZINC000800285886 1045605693 /nfs/dbraw/zinc/60/56/93/1045605693.db2.gz DTKJKVMCEKEGJD-CYBMUJFWSA-N 1 0 317.454 4.364 20 10 DICDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000751600131 1045620163 /nfs/dbraw/zinc/62/01/63/1045620163.db2.gz GXKABYRFLJOWRQ-MAUKXSAKSA-N 1 0 318.420 4.318 20 10 DICDRO CC[C@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccccc1O ZINC000800495435 1045631788 /nfs/dbraw/zinc/63/17/88/1045631788.db2.gz NRUYAERKLMFEES-RDJZCZTQSA-N 1 0 301.817 4.254 20 10 DICDRO Cc1cc(Cl)nc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)c1 ZINC000800493339 1045632158 /nfs/dbraw/zinc/63/21/58/1045632158.db2.gz WUVRKYIMXQMIKB-MFKMUULPSA-N 1 0 320.795 4.226 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CCCC23CCOCC3)c2c1c(F)ccc2O ZINC000800498445 1045635290 /nfs/dbraw/zinc/63/52/90/1045635290.db2.gz KJCMPHRVWNGOFH-XPKDYRNWSA-N 1 0 319.420 4.019 20 10 DICDRO C[C@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccc(N(C)C)cc1 ZINC000800500372 1045635669 /nfs/dbraw/zinc/63/56/69/1045635669.db2.gz CDZJIWXIERDXNO-HNNXBMFYSA-N 1 0 307.441 4.127 20 10 DICDRO COc1ccc(C[NH2+]C[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1C ZINC000752266992 1045669201 /nfs/dbraw/zinc/66/92/01/1045669201.db2.gz UPKBWVAGFNEWSR-DZGCQCFKSA-N 1 0 315.379 4.462 20 10 DICDRO CC[C@H]([NH2+]C[C@H](O)c1cc(C)cc(C)c1)c1ccc(C)cc1O ZINC000800991362 1045678379 /nfs/dbraw/zinc/67/83/79/1045678379.db2.gz FXQPQDFRSUVTEA-ICSRJNTNSA-N 1 0 313.441 4.092 20 10 DICDRO Cc1cc(C)cc([C@H](O)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000800991212 1045678398 /nfs/dbraw/zinc/67/83/98/1045678398.db2.gz BQKQIJKNXUYQFE-VQIMIIECSA-N 1 0 313.441 4.010 20 10 DICDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@H](C)c1ccc(C)cc1O ZINC000800994771 1045679542 /nfs/dbraw/zinc/67/95/42/1045679542.db2.gz XHLHLCQQMDMOHC-SJKOYZFVSA-N 1 0 315.388 4.186 20 10 DICDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)c1cc(C)ccc1O ZINC000800994861 1045680590 /nfs/dbraw/zinc/68/05/90/1045680590.db2.gz YEMQWKPCQACEAH-PXAZEXFGSA-N 1 0 315.388 4.186 20 10 DICDRO Cc1cc(C[NH+]2CCC3(CC(F)(F)C3)CC2)ccc1N(C)C ZINC001139670130 1045745851 /nfs/dbraw/zinc/74/58/51/1045745851.db2.gz IRHCTUCDCLZJMB-UHFFFAOYSA-N 1 0 308.416 4.072 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H](O)c1ccc(C)cc1 ZINC000801595112 1045749053 /nfs/dbraw/zinc/74/90/53/1045749053.db2.gz IGPCJYUWMDMBEQ-FQEVSTJZSA-N 1 0 313.441 4.036 20 10 DICDRO CCCC[N@H+](CCc1scnc1C)Cc1ccccc1O ZINC000801596391 1045749614 /nfs/dbraw/zinc/74/96/14/1045749614.db2.gz XWTYVRRIZFHBAG-UHFFFAOYSA-N 1 0 304.459 4.002 20 10 DICDRO C[C@H]([NH2+]CCCNc1ccccc1F)c1ccc(N(C)C)cc1 ZINC000753765303 1045800378 /nfs/dbraw/zinc/80/03/78/1045800378.db2.gz BCDHQPZXFDPIRX-HNNXBMFYSA-N 1 0 315.436 4.045 20 10 DICDRO C[C@H]([NH2+]CC[C@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000753762582 1045801819 /nfs/dbraw/zinc/80/18/19/1045801819.db2.gz WRDCTWISMJNGLP-ROUUACIJSA-N 1 0 316.489 4.144 20 10 DICDRO COc1ccc(O)c(C[NH2+]C/C(C)=C/c2ccc(Cl)cc2)c1 ZINC000753854593 1045810752 /nfs/dbraw/zinc/81/07/52/1045810752.db2.gz UTNHMPAOSJYTAY-UKTHLTGXSA-N 1 0 317.816 4.247 20 10 DICDRO C[N@H+](CC[C@H]1CCCCO1)Cc1ccc(N2CCCCC2)cc1 ZINC000753999776 1045831840 /nfs/dbraw/zinc/83/18/40/1045831840.db2.gz QMEVINBCLKFEMW-HXUWFJFHSA-N 1 0 316.489 4.068 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000754099844 1045845100 /nfs/dbraw/zinc/84/51/00/1045845100.db2.gz HDKQCDGVWPRBKV-AEFFLSMTSA-N 1 0 311.425 4.217 20 10 DICDRO C[C@@H]1CSCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000754156322 1045857293 /nfs/dbraw/zinc/85/72/93/1045857293.db2.gz POMRMEYTRGJPDO-HNNXBMFYSA-N 1 0 313.466 4.244 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H]2c2cccs2)c1O ZINC000192536764 1045860697 /nfs/dbraw/zinc/86/06/97/1045860697.db2.gz IXOLRGBLKHLWNS-AWEZNQCLSA-N 1 0 303.427 4.108 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H]2c2cccs2)ccc1N(C)C ZINC001139670995 1045877814 /nfs/dbraw/zinc/87/78/14/1045877814.db2.gz KEUAWOLQMYXFBF-KRWDZBQOSA-N 1 0 300.471 4.460 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H]2c2ccc(C)cc2)c1O ZINC000754723505 1045918656 /nfs/dbraw/zinc/91/86/56/1045918656.db2.gz MZPHSDQMVOGZBB-SFHVURJKSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cc(C)cc(C[N@H+](Cc2ccccc2C)C2CC2)c1O ZINC000754719573 1045918761 /nfs/dbraw/zinc/91/87/61/1045918761.db2.gz DNJVJVBIMHRSBG-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@H]2c2ccc(C)cc2)c1O ZINC000754723504 1045918993 /nfs/dbraw/zinc/91/89/93/1045918993.db2.gz MZPHSDQMVOGZBB-GOSISDBHSA-N 1 0 311.425 4.355 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c1O ZINC000754725862 1045920255 /nfs/dbraw/zinc/92/02/55/1045920255.db2.gz COEXCDRTPVDPQR-IBGZPJMESA-N 1 0 301.430 4.032 20 10 DICDRO COc1cc(C)cc(C[NH2+]C2(c3ccc(F)cc3)CCC2)c1O ZINC000754730566 1045921231 /nfs/dbraw/zinc/92/12/31/1045921231.db2.gz SCBIKIZRPUUUTI-UHFFFAOYSA-N 1 0 315.388 4.017 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1O ZINC000754740923 1045922902 /nfs/dbraw/zinc/92/29/02/1045922902.db2.gz JNOMEUQVMALMDI-INIZCTEOSA-N 1 0 317.816 4.310 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](C3CCOCC3)C2)cc1C(C)C ZINC000754782653 1045924816 /nfs/dbraw/zinc/92/48/16/1045924816.db2.gz KESBGGPBKSHTBF-KRWDZBQOSA-N 1 0 317.473 4.073 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2ccccn2)ccc1N1CCCCC1 ZINC000828770624 1045932303 /nfs/dbraw/zinc/93/23/03/1045932303.db2.gz BJAPABXGVGTPDP-KRWDZBQOSA-N 1 0 309.457 4.231 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)cc1F ZINC000192796147 1045935469 /nfs/dbraw/zinc/93/54/69/1045935469.db2.gz PFJZKRHSMPQJHP-OLZOCXBDSA-N 1 0 303.377 4.260 20 10 DICDRO CC[C@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1ccc(C)cc1O ZINC000802309306 1045951127 /nfs/dbraw/zinc/95/11/27/1045951127.db2.gz QQEOAPJNNKIWTA-RKVPGOIHSA-N 1 0 305.462 4.335 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c2c1c(F)ccc2O ZINC000802309696 1045952303 /nfs/dbraw/zinc/95/23/03/1045952303.db2.gz UDUAQDGRYVZGNP-XYFZXANASA-N 1 0 321.436 4.263 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c(O)c1C ZINC000802310312 1045952666 /nfs/dbraw/zinc/95/26/66/1045952666.db2.gz ZKLJXBGZTRFSRE-FSDCSDTHSA-N 1 0 305.462 4.253 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)c(O)c1C ZINC000802310311 1045952756 /nfs/dbraw/zinc/95/27/56/1045952756.db2.gz ZKLJXBGZTRFSRE-FMKPAKJESA-N 1 0 305.462 4.253 20 10 DICDRO CCOc1cccc(C[NH2+]Cc2ccc(C3CCC3)cc2)c1O ZINC000755222308 1045964068 /nfs/dbraw/zinc/96/40/68/1045964068.db2.gz BCEUXJCZXNAVAP-UHFFFAOYSA-N 1 0 311.425 4.348 20 10 DICDRO CCN(Cc1ccccc1O)Cc1c(F)ccc(Cl)c1F ZINC001137883958 1045999920 /nfs/dbraw/zinc/99/99/20/1045999920.db2.gz CKBDQTSOJHBYQY-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO CCCC[N@H+](Cc1cn(C(C)C)nc1C)Cc1ccccc1O ZINC000802657584 1046026261 /nfs/dbraw/zinc/02/62/61/1046026261.db2.gz JLWDKMJACWRYAD-UHFFFAOYSA-N 1 0 315.461 4.280 20 10 DICDRO CCCC[N@H+](Cc1ccc2c(c1)ncn2C)Cc1ccccc1O ZINC000802657533 1046028499 /nfs/dbraw/zinc/02/84/99/1046028499.db2.gz HURRTCDWHVFSOY-UHFFFAOYSA-N 1 0 323.440 4.081 20 10 DICDRO CCCC[N@H+](Cc1nc2c(s1)CCC2)Cc1ccccc1O ZINC000802657822 1046029112 /nfs/dbraw/zinc/02/91/12/1046029112.db2.gz VBZWEHRDZDIWPZ-UHFFFAOYSA-N 1 0 316.470 4.140 20 10 DICDRO COc1cccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c1O ZINC000802658289 1046029243 /nfs/dbraw/zinc/02/92/43/1046029243.db2.gz RVKJTVRAMTUQEV-REPLKXPHSA-N 1 0 323.436 4.311 20 10 DICDRO C=Cn1cc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)cn1 ZINC000193587105 1046043165 /nfs/dbraw/zinc/04/31/65/1046043165.db2.gz ZKBHTDIWESLFFE-UHFFFAOYSA-N 1 0 311.429 4.024 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCc2c[nH]c3ccccc23)c(O)c1C ZINC000756343507 1046066578 /nfs/dbraw/zinc/06/65/78/1046066578.db2.gz MYPOSKMPNOOAHF-OAHLLOKOSA-N 1 0 308.425 4.384 20 10 DICDRO C[C@H]([NH2+]CCCOC1CCCCC1)c1cc(Cl)ccc1O ZINC000756361442 1046070555 /nfs/dbraw/zinc/07/05/55/1046070555.db2.gz ZICUMABRYKNRPD-ZDUSSCGKSA-N 1 0 311.853 4.436 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2cccs2)N(C)C)c(O)c1C ZINC000756374198 1046072325 /nfs/dbraw/zinc/07/23/25/1046072325.db2.gz YSIMCXNXJPPWJU-ZBFHGGJFSA-N 1 0 318.486 4.024 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)Cc1ccco1)c1ccc(Br)cc1O ZINC000756381104 1046074465 /nfs/dbraw/zinc/07/44/65/1046074465.db2.gz WXBDPWFXNMETLX-WDEREUQCSA-N 1 0 324.218 4.030 20 10 DICDRO COCc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)cc1 ZINC000756384887 1046075190 /nfs/dbraw/zinc/07/51/90/1046075190.db2.gz PTCSQLZNWWLGNM-WBMJQRKESA-N 1 0 315.388 4.016 20 10 DICDRO CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000756398841 1046076136 /nfs/dbraw/zinc/07/61/36/1046076136.db2.gz ZMFKIPVPEXBVQE-LLVKDONJSA-N 1 0 319.276 4.080 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3occc32)c2c1c(F)ccc2O ZINC000756402546 1046076661 /nfs/dbraw/zinc/07/66/61/1046076661.db2.gz UVOROPHXCPRZBO-SWHYSGLUSA-N 1 0 301.361 4.340 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccnc2OC(C)C)c(O)c1C ZINC000756422784 1046078799 /nfs/dbraw/zinc/07/87/99/1046078799.db2.gz ODUBKCQXHQJROE-OAHLLOKOSA-N 1 0 314.429 4.042 20 10 DICDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1cc(F)ccc1O ZINC000756418744 1046080134 /nfs/dbraw/zinc/08/01/34/1046080134.db2.gz QITVFPNKHLSUKH-GFCCVEGCSA-N 1 0 303.352 4.053 20 10 DICDRO CCOc1ccccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756442652 1046080912 /nfs/dbraw/zinc/08/09/12/1046080912.db2.gz FRWQHMMNCDCSMV-DOMZBBRYSA-N 1 0 315.388 4.268 20 10 DICDRO Cc1[nH]c2ccc(C[NH2+][C@H](C)c3cc(F)ccc3O)cc2c1C ZINC000756463725 1046083814 /nfs/dbraw/zinc/08/38/14/1046083814.db2.gz CFSZXBKPOFOISR-CYBMUJFWSA-N 1 0 312.388 4.480 20 10 DICDRO C[C@H](Cc1ccsc1)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756457987 1046084183 /nfs/dbraw/zinc/08/41/83/1046084183.db2.gz ITAGEDFZBUYRPY-JTNHKYCSSA-N 1 0 305.418 4.362 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CCC(C)(C)c2ccccc2)c1 ZINC000756455178 1046084467 /nfs/dbraw/zinc/08/44/67/1046084467.db2.gz PPVWTNOBHCKQAL-OAHLLOKOSA-N 1 0 313.441 4.419 20 10 DICDRO CC(C)COc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000756455393 1046084625 /nfs/dbraw/zinc/08/46/25/1046084625.db2.gz SKLFVAYDLKJDIC-CQSZACIVSA-N 1 0 317.404 4.417 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)COc2ccc(F)cc2F)c(O)c1 ZINC000756453371 1046084925 /nfs/dbraw/zinc/08/49/25/1046084925.db2.gz GDCVOAVCPPWNHZ-STQMWFEESA-N 1 0 321.367 4.097 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)c1 ZINC000756464837 1046085533 /nfs/dbraw/zinc/08/55/33/1046085533.db2.gz HZRFCEFBQCLLOK-AWEZNQCLSA-N 1 0 324.424 4.350 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(Br)cc1O ZINC000756473656 1046087237 /nfs/dbraw/zinc/08/72/37/1046087237.db2.gz DKQUJBQXMAWUNP-NWDGAFQWSA-N 1 0 310.235 4.162 20 10 DICDRO CCCOc1cccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)c1 ZINC000756477031 1046087821 /nfs/dbraw/zinc/08/78/21/1046087821.db2.gz WHEYELKSWXLTAH-CQSZACIVSA-N 1 0 315.413 4.040 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2ccn(-c3ccccc3)n2)c(O)c1C ZINC000756491072 1046089165 /nfs/dbraw/zinc/08/91/65/1046089165.db2.gz SLZRMGYBBUWVII-INIZCTEOSA-N 1 0 321.424 4.046 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc3c(s2)CCCC3)c(O)c1 ZINC000756483318 1046089582 /nfs/dbraw/zinc/08/95/82/1046089582.db2.gz MBPVGFHNSLJZCO-CYBMUJFWSA-N 1 0 301.455 4.492 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCCOc2ccc(F)cc21)c1cc(F)ccc1O ZINC000756483776 1046089846 /nfs/dbraw/zinc/08/98/46/1046089846.db2.gz XMFDJVHTSVRLPO-MEDUHNTESA-N 1 0 319.351 4.235 20 10 DICDRO COc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000756502426 1046091996 /nfs/dbraw/zinc/09/19/96/1046091996.db2.gz HVIBDCKGMLPFAB-HOTGVXAUSA-N 1 0 313.441 4.381 20 10 DICDRO C[C@H]([NH2+]CCc1cc(F)cc(F)c1)c1cc(Cl)ccc1O ZINC000756510123 1046093511 /nfs/dbraw/zinc/09/35/11/1046093511.db2.gz HFXIBOQVEJAKBX-JTQLQIEISA-N 1 0 311.759 4.217 20 10 DICDRO C[C@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1cc(F)ccc1O ZINC000756510724 1046094886 /nfs/dbraw/zinc/09/48/86/1046094886.db2.gz UPANYXCRKHTRFS-NSHDSACASA-N 1 0 316.351 4.045 20 10 DICDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756536350 1046096183 /nfs/dbraw/zinc/09/61/83/1046096183.db2.gz VCBNCJITSQFJBU-OZVIIMIRSA-N 1 0 315.388 4.006 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2(c3ccccc3C)CC2)c1 ZINC000756529652 1046096416 /nfs/dbraw/zinc/09/64/16/1046096416.db2.gz VCSUUNPZDQULCK-OAHLLOKOSA-N 1 0 311.425 4.092 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)c(O)c1C ZINC000756528568 1046097261 /nfs/dbraw/zinc/09/72/61/1046097261.db2.gz NQUKKJAISFQSTL-AWEZNQCLSA-N 1 0 321.424 4.111 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1cc(Cl)ccc1O ZINC000756554282 1046098056 /nfs/dbraw/zinc/09/80/56/1046098056.db2.gz ORIJQTBEPUZFBH-STQMWFEESA-N 1 0 317.816 4.263 20 10 DICDRO C[C@H]([NH2+]CCCc1c[nH]c2ccccc12)c1cc(F)ccc1O ZINC000756548711 1046098181 /nfs/dbraw/zinc/09/81/81/1046098181.db2.gz CRTUNUBGBFYMQW-ZDUSSCGKSA-N 1 0 312.388 4.296 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)C(C)(C)c2ccccc2)c1 ZINC000756539532 1046098856 /nfs/dbraw/zinc/09/88/56/1046098856.db2.gz PTXUGEXCSYEIML-GJZGRUSLSA-N 1 0 313.441 4.418 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756555053 1046099256 /nfs/dbraw/zinc/09/92/56/1046099256.db2.gz RMGNLTQDQZOERN-ZDUSSCGKSA-N 1 0 318.848 4.353 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H]2c2ccccc2)c1 ZINC000756568681 1046100618 /nfs/dbraw/zinc/10/06/18/1046100618.db2.gz HQVVGQHUAUSNGU-UCLAIMLFSA-N 1 0 311.425 4.388 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](Nc2ccccc2)C(C)C)c1 ZINC000756555609 1046100751 /nfs/dbraw/zinc/10/07/51/1046100751.db2.gz LHEJLROITGLYNT-APWZRJJASA-N 1 0 312.457 4.488 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](Nc2ccccc2)C(C)C)c1 ZINC000756555619 1046100783 /nfs/dbraw/zinc/10/07/83/1046100783.db2.gz LHEJLROITGLYNT-VQIMIIECSA-N 1 0 312.457 4.488 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c1 ZINC000756568678 1046101082 /nfs/dbraw/zinc/10/10/82/1046101082.db2.gz HQVVGQHUAUSNGU-POZUXBRTSA-N 1 0 311.425 4.388 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCc2cccc(F)c2)c1 ZINC000756583414 1046104883 /nfs/dbraw/zinc/10/48/83/1046104883.db2.gz NNSYEQIUVCTNCA-UONOGXRCSA-N 1 0 317.404 4.212 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2c[nH]c3c2cccc3C)c1 ZINC000756598261 1046106138 /nfs/dbraw/zinc/10/61/38/1046106138.db2.gz QULBXHSYWSWOMU-HNNXBMFYSA-N 1 0 308.425 4.384 20 10 DICDRO CCCC(O)(CCC)C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756594921 1046106262 /nfs/dbraw/zinc/10/62/62/1046106262.db2.gz QLZIXMQFHBPBBQ-GXTWGEPZSA-N 1 0 309.425 4.001 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2SC)c(O)c1 ZINC000799344619 1046106429 /nfs/dbraw/zinc/10/64/29/1046106429.db2.gz DTKJKVMCEKEGJD-ZDUSSCGKSA-N 1 0 317.454 4.364 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)c1ccncc1 ZINC000756608669 1046108450 /nfs/dbraw/zinc/10/84/50/1046108450.db2.gz QOQHYGDHNWEKRF-CQDKDKBSSA-N 1 0 300.377 4.216 20 10 DICDRO Cc1cccc(F)c1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756608349 1046108628 /nfs/dbraw/zinc/10/86/28/1046108628.db2.gz KUDJSRXIBBEJED-ABAIWWIYSA-N 1 0 303.352 4.317 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(Cl)cc1 ZINC000756614712 1046110193 /nfs/dbraw/zinc/11/01/93/1046110193.db2.gz UXLYFEROBDYUPH-SCLBCKFNSA-N 1 0 319.832 4.392 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)C12CCC2 ZINC000756613721 1046110677 /nfs/dbraw/zinc/11/06/77/1046110677.db2.gz QJYYNJFVLNNRLD-XABYNWHXSA-N 1 0 319.420 4.017 20 10 DICDRO CCC1(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CCOCC1 ZINC000756628353 1046111582 /nfs/dbraw/zinc/11/15/82/1046111582.db2.gz LJDRGJZLTVUMKC-OAHLLOKOSA-N 1 0 317.473 4.128 20 10 DICDRO CCC(CC)(CCO)C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756629300 1046111725 /nfs/dbraw/zinc/11/17/25/1046111725.db2.gz OYVGPPLHCWQPMG-OAHLLOKOSA-N 1 0 319.489 4.110 20 10 DICDRO C[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccc(F)cc1F ZINC000756620799 1046111914 /nfs/dbraw/zinc/11/19/14/1046111914.db2.gz NCLIRUYSFPEPQJ-MNOVXSKESA-N 1 0 309.331 4.264 20 10 DICDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(C)ccc2O)C12CCCC2 ZINC000756619944 1046112221 /nfs/dbraw/zinc/11/22/21/1046112221.db2.gz ZBZJZQJFVPAOAD-ZTFGCOKTSA-N 1 0 303.446 4.089 20 10 DICDRO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3cc(Cl)ccc3O)nc2c1 ZINC000756629203 1046112425 /nfs/dbraw/zinc/11/24/25/1046112425.db2.gz OOHNOTHLSDQILM-LLVKDONJSA-N 1 0 315.804 4.081 20 10 DICDRO C[C@@H]([NH2+]CCCC(F)(F)F)c1cc2c(cc1O)CCCC2 ZINC000756625898 1046112525 /nfs/dbraw/zinc/11/25/25/1046112525.db2.gz NMKQCQGEOCYMGI-LLVKDONJSA-N 1 0 301.352 4.264 20 10 DICDRO CC[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Oc1ccccc1F ZINC000756638212 1046113980 /nfs/dbraw/zinc/11/39/80/1046113980.db2.gz NPUSCXQLKTUCAA-JSGCOSHPSA-N 1 0 321.367 4.179 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ccc(F)cc2F)c(O)c1C ZINC000756636699 1046114120 /nfs/dbraw/zinc/11/41/20/1046114120.db2.gz GFHQOBAPZUDDTK-CYBMUJFWSA-N 1 0 321.367 4.017 20 10 DICDRO CCO[C@H](CC[NH2+][C@@H](C)c1cc(F)ccc1O)C1CCCC1 ZINC000756638093 1046114223 /nfs/dbraw/zinc/11/42/23/1046114223.db2.gz RNNFNSRUESHHAB-SCLBCKFNSA-N 1 0 309.425 4.167 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2SCCc3ccccc32)c1 ZINC000756634236 1046114616 /nfs/dbraw/zinc/11/46/16/1046114616.db2.gz MGAVVZJVUBCZKD-AUUYWEPGSA-N 1 0 313.466 4.382 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1SCCc2ccccc21)c1cc(F)ccc1O ZINC000756636864 1046114817 /nfs/dbraw/zinc/11/48/17/1046114817.db2.gz XENVZSBXXHFASO-SGTLLEGYSA-N 1 0 317.429 4.213 20 10 DICDRO COC1CCC(C[NH2+][C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000756643167 1046116273 /nfs/dbraw/zinc/11/62/73/1046116273.db2.gz SSJVQMDKXFDXAL-HPUBIQBYSA-N 1 0 313.441 4.401 20 10 DICDRO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000756645710 1046116611 /nfs/dbraw/zinc/11/66/11/1046116611.db2.gz JGSPPLRZKCTFKL-RDTXWAMCSA-N 1 0 311.425 4.356 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(O)c1C ZINC000756658250 1046117880 /nfs/dbraw/zinc/11/78/80/1046117880.db2.gz IIRZMPPOPIFIJL-ZDUSSCGKSA-N 1 0 304.459 4.440 20 10 DICDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CCO1 ZINC000756665989 1046118056 /nfs/dbraw/zinc/11/80/56/1046118056.db2.gz XYLHPJLFZOQLNC-VHFSOBRXSA-N 1 0 317.473 4.125 20 10 DICDRO COc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000756683686 1046119645 /nfs/dbraw/zinc/11/96/45/1046119645.db2.gz UBAJBVOUJDBTTL-HNNXBMFYSA-N 1 0 313.441 4.338 20 10 DICDRO c1ccc2c(c1)CC[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC001138213932 1046120778 /nfs/dbraw/zinc/12/07/78/1046120778.db2.gz HUXLJWIBDYZZDO-UHFFFAOYSA-N 1 0 306.453 4.235 20 10 DICDRO c1cc([C@@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)ccn1 ZINC001138220058 1046121182 /nfs/dbraw/zinc/12/11/82/1046121182.db2.gz YJZXTLXEICIMCT-HXUWFJFHSA-N 1 0 321.468 4.061 20 10 DICDRO COc1cccc(C[C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000756706906 1046122493 /nfs/dbraw/zinc/12/24/93/1046122493.db2.gz ITUWPQGAMXZFLY-CHWSQXEVSA-N 1 0 319.832 4.336 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)Cc2ccccc2)c1 ZINC000756713961 1046122617 /nfs/dbraw/zinc/12/26/17/1046122617.db2.gz WXBVGTJYZOGVLW-HNNXBMFYSA-N 1 0 313.441 4.320 20 10 DICDRO C[C@H]([NH2+]CCc1cccc(F)c1F)c1cc(Cl)ccc1O ZINC000756713528 1046122674 /nfs/dbraw/zinc/12/26/74/1046122674.db2.gz VISQJEQKYYPISV-JTQLQIEISA-N 1 0 311.759 4.217 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)Cc2ccccc2)c1 ZINC000756713964 1046122720 /nfs/dbraw/zinc/12/27/20/1046122720.db2.gz WXBVGTJYZOGVLW-OAHLLOKOSA-N 1 0 313.441 4.320 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCO[C@H]2C(C)C)c(O)c1C ZINC000756736903 1046123871 /nfs/dbraw/zinc/12/38/71/1046123871.db2.gz POCRNVLXESNKOC-BXWFABGCSA-N 1 0 305.462 4.111 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCO[C@@H]2C(C)C)c(O)c1C ZINC000756736909 1046124567 /nfs/dbraw/zinc/12/45/67/1046124567.db2.gz POCRNVLXESNKOC-TXPKVOOTSA-N 1 0 305.462 4.111 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1N(C)C)c1cc2c(cc1O)CCCC2 ZINC000756730876 1046124652 /nfs/dbraw/zinc/12/46/52/1046124652.db2.gz UDXVNNMTMRKSPS-HNNXBMFYSA-N 1 0 324.468 4.188 20 10 DICDRO C[C@H]([NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12)c1cc(Cl)ccc1O ZINC000756757396 1046126122 /nfs/dbraw/zinc/12/61/22/1046126122.db2.gz BNOFCTZVCNKJSR-GIYVSIDVSA-N 1 0 313.828 4.282 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)c1 ZINC000756757379 1046126402 /nfs/dbraw/zinc/12/64/02/1046126402.db2.gz MZTKWMZULLVBDM-IAQYHMDHSA-N 1 0 303.789 4.138 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)c(O)c1 ZINC000756757481 1046126546 /nfs/dbraw/zinc/12/65/46/1046126546.db2.gz OGQYBXKUZQWCAI-IAQYHMDHSA-N 1 0 303.789 4.138 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+]CC(C)(C)[C@H]2CCCCO2)c2c1c(F)ccc2O ZINC000756757221 1046126577 /nfs/dbraw/zinc/12/65/77/1046126577.db2.gz MHUGQYYRXFIDCU-XNRPHZJLSA-N 1 0 321.436 4.265 20 10 DICDRO COc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)c(C)c1 ZINC000756757702 1046127480 /nfs/dbraw/zinc/12/74/80/1046127480.db2.gz APRUYFMZOAPSOL-LRDDRELGSA-N 1 0 315.388 4.186 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1Cl ZINC000756757751 1046127956 /nfs/dbraw/zinc/12/79/56/1046127956.db2.gz BRHDLWYISVAXGR-APPDUMDISA-N 1 0 323.795 4.223 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CC2(Cc3ccccc3)CC2)c1 ZINC000756762008 1046128079 /nfs/dbraw/zinc/12/80/79/1046128079.db2.gz SEGFHLCLVFAVKT-HNNXBMFYSA-N 1 0 311.425 4.074 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)c(O)c1C ZINC000756757799 1046128661 /nfs/dbraw/zinc/12/86/61/1046128661.db2.gz CDCWDGCVDVNKGH-LRDDRELGSA-N 1 0 317.816 4.447 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@H]2c2ccccn2)c2ccccc2n1C ZINC001138256658 1046128974 /nfs/dbraw/zinc/12/89/74/1046128974.db2.gz FPZUWFBTTXZQGA-FQEVSTJZSA-N 1 0 305.425 4.219 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c2c1c(F)ccc2O ZINC000756763139 1046129609 /nfs/dbraw/zinc/12/96/09/1046129609.db2.gz UVSAXVORPHMVAI-DXGVKTBASA-N 1 0 323.411 4.255 20 10 DICDRO CC(C)[C@@H](O)C(C)(C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000756769282 1046129735 /nfs/dbraw/zinc/12/97/35/1046129735.db2.gz DONOWSKAMPCJHT-AUUYWEPGSA-N 1 0 315.457 4.239 20 10 DICDRO Cc1c(C[NH+]2CCC(OC3CCC3)CC2)c2ccccc2n1C ZINC001138252291 1046129795 /nfs/dbraw/zinc/12/97/95/1046129795.db2.gz ASTCFTOCAGXVAH-UHFFFAOYSA-N 1 0 312.457 4.020 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCOCc2ccc(Cl)cc2)c(O)c1 ZINC000756771345 1046130020 /nfs/dbraw/zinc/13/00/20/1046130020.db2.gz VUVDUSZPTJWPMO-CQSZACIVSA-N 1 0 319.832 4.221 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)c2c1c(F)ccc2O ZINC000756763144 1046130038 /nfs/dbraw/zinc/13/00/38/1046130038.db2.gz UVSAXVORPHMVAI-OTLTYQLQSA-N 1 0 323.411 4.255 20 10 DICDRO Cc1c(C[N@H+](C)CCC(=O)c2ccccc2)c2ccccc2n1C ZINC001138258525 1046131379 /nfs/dbraw/zinc/13/13/79/1046131379.db2.gz UOSYGKOGGPXQAS-UHFFFAOYSA-N 1 0 320.436 4.192 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000756781596 1046131702 /nfs/dbraw/zinc/13/17/02/1046131702.db2.gz HIWAQZKUZXOPDI-KSMMKXTCSA-N 1 0 317.404 4.267 20 10 DICDRO Cc1c(C[N@@H+]2CCOC3(CCCCC3)C2)c2ccccc2n1C ZINC001138257979 1046132402 /nfs/dbraw/zinc/13/24/02/1046132402.db2.gz GHIRYXINWGUUDY-UHFFFAOYSA-N 1 0 312.457 4.022 20 10 DICDRO Cc1c(C[N@@H+]2CCC[C@H]2Cc2ccccn2)c2ccccc2n1C ZINC001138256773 1046132616 /nfs/dbraw/zinc/13/26/16/1046132616.db2.gz KCJUQLXSGYBDRL-SFHVURJKSA-N 1 0 319.452 4.089 20 10 DICDRO COc1ccc(C[C@@H](C)C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000756783655 1046133183 /nfs/dbraw/zinc/13/31/83/1046133183.db2.gz GUUOIMCQNWVQQO-HZPDHXFCSA-N 1 0 313.441 4.239 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@H](c2cccnc2)C2CC2)c2c1c(F)ccc2O ZINC000756784007 1046133412 /nfs/dbraw/zinc/13/34/12/1046133412.db2.gz JUHTVLQEZBWLIC-VWCVUJCZSA-N 1 0 312.388 4.216 20 10 DICDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756782445 1046133987 /nfs/dbraw/zinc/13/39/87/1046133987.db2.gz RBHBOXPYWLYMOO-PZROIBLQSA-N 1 0 321.367 4.097 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C)[C@H]2c2ccccc2)c(O)c1C ZINC000756784021 1046134131 /nfs/dbraw/zinc/13/41/31/1046134131.db2.gz KBRAQCMAKBITRD-VDGAXYAQSA-N 1 0 324.468 4.105 20 10 DICDRO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000756786112 1046134154 /nfs/dbraw/zinc/13/41/54/1046134154.db2.gz XNFCYOZZQBFCBM-LHSJRXKWSA-N 1 0 322.452 4.468 20 10 DICDRO C[C@H]([NH2+]C1CCC(F)(F)CC1)c1cc2c(cc1O)CCCC2 ZINC000756784010 1046134176 /nfs/dbraw/zinc/13/41/76/1046134176.db2.gz JUNNWCQMRSQVOI-LBPRGKRZSA-N 1 0 309.400 4.500 20 10 DICDRO COc1ccc(C[C@H](C)C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000756785028 1046134193 /nfs/dbraw/zinc/13/41/93/1046134193.db2.gz RRBBQKOINSTQRS-UONOGXRCSA-N 1 0 317.404 4.069 20 10 DICDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000756790342 1046135207 /nfs/dbraw/zinc/13/52/07/1046135207.db2.gz MTPOCXSHKRPMHE-NJSLBKSFSA-N 1 0 317.404 4.267 20 10 DICDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756790912 1046135269 /nfs/dbraw/zinc/13/52/69/1046135269.db2.gz PROBXYMJAARSTB-IUUKEHGRSA-N 1 0 321.367 4.097 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1cc2c(cc1O)CCCC2 ZINC000756790099 1046135611 /nfs/dbraw/zinc/13/56/11/1046135611.db2.gz LQTHSBWZVBXNNU-NSHDSACASA-N 1 0 305.805 4.368 20 10 DICDRO COc1ccc(C2([NH2+][C@@H](C)c3ccc(C)c(C)c3O)CC2)cc1 ZINC000756817667 1046140130 /nfs/dbraw/zinc/14/01/30/1046140130.db2.gz MNIDCPGZJGZLMR-HNNXBMFYSA-N 1 0 311.425 4.358 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(c3ccc(Cl)cc3)CC2)c1 ZINC000756826702 1046140219 /nfs/dbraw/zinc/14/02/19/1046140219.db2.gz JOQINJVCTWYPCY-GFCCVEGCSA-N 1 0 317.816 4.394 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C2(c3ccc(F)cc3)CC2)c2c1c(F)ccc2O ZINC000756827375 1046140281 /nfs/dbraw/zinc/14/02/81/1046140281.db2.gz SHBXLCLZNHEQKX-ABAIWWIYSA-N 1 0 315.363 4.498 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CC(c3ccccc3F)C2)c1 ZINC000756818709 1046140408 /nfs/dbraw/zinc/14/04/08/1046140408.db2.gz QXFAGUNNGDSGMN-IYXRBSQSSA-N 1 0 315.388 4.137 20 10 DICDRO Cc1cc(O)c(C[N@H+](CCC(F)(F)F)CC2CC2)cc1C ZINC000084482038 1046141493 /nfs/dbraw/zinc/14/14/93/1046141493.db2.gz UKHMZRZBHUYDCC-UHFFFAOYSA-N 1 0 301.352 4.173 20 10 DICDRO CC(C)C[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(Cl)ccc2O)CCO1 ZINC000756873751 1046147766 /nfs/dbraw/zinc/14/77/66/1046147766.db2.gz JKKBQHWYWLTMFZ-VHDGCEQUSA-N 1 0 311.853 4.290 20 10 DICDRO CN1CCCc2cc(C[NH+]3CCC4(CC[C@@H](F)C4)CC3)ccc21 ZINC001138355791 1046155510 /nfs/dbraw/zinc/15/55/10/1046155510.db2.gz CZGNEONSIVUWSP-GOSISDBHSA-N 1 0 316.464 4.173 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC23CCCC3)c(OC)c1 ZINC001138386224 1046161494 /nfs/dbraw/zinc/16/14/94/1046161494.db2.gz KGWCBRYMCXNEGT-UHFFFAOYSA-N 1 0 302.462 4.060 20 10 DICDRO C[C@H](c1ccccc1)[N@H+](Cc1ccno1)Cc1ccccc1O ZINC000757273793 1046171676 /nfs/dbraw/zinc/17/16/76/1046171676.db2.gz GFKQRSDMLVFNJO-OAHLLOKOSA-N 1 0 308.381 4.144 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccc(N(C)C)cc2C)ccc1Cl ZINC000779980015 1046186011 /nfs/dbraw/zinc/18/60/11/1046186011.db2.gz XRPVRADPKYYQFH-UHFFFAOYSA-N 1 0 302.849 4.313 20 10 DICDRO Cc1ccc(O)c([C@H](C)Nc2ccc(C[NH+](C)C)c(F)c2)c1 ZINC000757613550 1046194103 /nfs/dbraw/zinc/19/41/03/1046194103.db2.gz MNLIUZQVRWLQMV-ZDUSSCGKSA-N 1 0 302.393 4.074 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CC[C@@H]1CCCCO1 ZINC000780015447 1046195677 /nfs/dbraw/zinc/19/56/77/1046195677.db2.gz SMNGRNKTGXTUFW-IBGZPJMESA-N 1 0 311.425 4.108 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(F)c(F)c2F)c1 ZINC000757657031 1046197524 /nfs/dbraw/zinc/19/75/24/1046197524.db2.gz UFRCXCIJXANTNS-NSHDSACASA-N 1 0 309.331 4.011 20 10 DICDRO C[C@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1cc2c(cc1O)CCCC2 ZINC000757655822 1046198041 /nfs/dbraw/zinc/19/80/41/1046198041.db2.gz HBJDLSKKPDNHFM-PMPSAXMXSA-N 1 0 317.473 4.127 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000757674155 1046199916 /nfs/dbraw/zinc/19/99/16/1046199916.db2.gz QILLJAKPVARMGO-BREBYQMCSA-N 1 0 320.433 4.238 20 10 DICDRO Cc1csc([C@H](C)C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC000757674160 1046200057 /nfs/dbraw/zinc/20/00/57/1046200057.db2.gz QILLJAKPVARMGO-OPQQBVKSSA-N 1 0 320.433 4.238 20 10 DICDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(OC)c2O)cc1C ZINC000903235693 1046202757 /nfs/dbraw/zinc/20/27/57/1046202757.db2.gz ZTNSXRVCSUMNID-KGLIPLIRSA-N 1 0 315.413 4.130 20 10 DICDRO C[C@@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1ccc2ccccc2c1O ZINC000903262313 1046210677 /nfs/dbraw/zinc/21/06/77/1046210677.db2.gz CQLGYBWIMKPMOY-ALKREAHSSA-N 1 0 313.441 4.137 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+][C@@H](CC(F)(F)F)C(C)C)c1O ZINC000783739599 1046229374 /nfs/dbraw/zinc/22/93/74/1046229374.db2.gz BGUGVXRMUAYBEH-LBPRGKRZSA-N 1 0 309.759 4.421 20 10 DICDRO C[C@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)c1cncs1 ZINC000903310470 1046232339 /nfs/dbraw/zinc/23/23/39/1046232339.db2.gz JOBMRUNGUAHSHQ-RYUDHWBXSA-N 1 0 302.443 4.139 20 10 DICDRO COc1ccc(O)c(C[NH2+]C2(Cc3ccccc3)CCCC2)c1 ZINC000757979788 1046234120 /nfs/dbraw/zinc/23/41/20/1046234120.db2.gz XKGDPCCVIBXIFN-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO Cc1cccnc1[C@H]([NH2+][C@H]1CCc2cccc(O)c21)C(C)(C)C ZINC000903327925 1046240979 /nfs/dbraw/zinc/24/09/79/1046240979.db2.gz BJJQNZMEUCRBSC-KXBFYZLASA-N 1 0 310.441 4.460 20 10 DICDRO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccn2)C2CC2)c2c1c(F)ccc2O ZINC000903335909 1046249437 /nfs/dbraw/zinc/24/94/37/1046249437.db2.gz UPHWRILDPCMNOP-VZMUKZCBSA-N 1 0 312.388 4.216 20 10 DICDRO C[C@]1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CCCS1 ZINC000758489031 1046274413 /nfs/dbraw/zinc/27/44/13/1046274413.db2.gz ZPTFNNHQFXJTNF-LJQANCHMSA-N 1 0 313.466 4.435 20 10 DICDRO C[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccc(Cl)cc1O ZINC000903427837 1046276638 /nfs/dbraw/zinc/27/66/38/1046276638.db2.gz AAZAKQQPDVKYEV-DIFFPNOSSA-N 1 0 302.805 4.243 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1ccsc1Cl ZINC001202859212 1046279780 /nfs/dbraw/zinc/27/97/80/1046279780.db2.gz DBKZSVBPEMCTGE-CYBMUJFWSA-N 1 0 322.905 4.497 20 10 DICDRO CCc1ccc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)cc1 ZINC001202860834 1046283028 /nfs/dbraw/zinc/28/30/28/1046283028.db2.gz UYRIKQFTBMSYIQ-KRWDZBQOSA-N 1 0 310.485 4.344 20 10 DICDRO CCc1ccc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)cc1 ZINC001202860836 1046284548 /nfs/dbraw/zinc/28/45/48/1046284548.db2.gz UYRIKQFTBMSYIQ-QGZVFWFLSA-N 1 0 310.485 4.344 20 10 DICDRO CC[C@H]([NH2+][C@@H](COC)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000089668344 1046295833 /nfs/dbraw/zinc/29/58/33/1046295833.db2.gz XYCVSJHSCTZCAJ-PMACEKPBSA-N 1 0 312.457 4.181 20 10 DICDRO CC(C)Oc1ccc(Cl)cc1C[N@H+](C)Cc1ccccc1O ZINC001138961273 1046341246 /nfs/dbraw/zinc/34/12/46/1046341246.db2.gz ATBKCCFZYPOULV-UHFFFAOYSA-N 1 0 319.832 4.465 20 10 DICDRO Cc1cc(O)c(C[N@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1C ZINC000246470175 1046359503 /nfs/dbraw/zinc/35/95/03/1046359503.db2.gz MOAWCKLDTOYNJN-KBXCAEBGSA-N 1 0 317.454 4.033 20 10 DICDRO CC[N@H+](CCC(F)(F)F)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000748296453 1046366437 /nfs/dbraw/zinc/36/64/37/1046366437.db2.gz OCEOLRDDWXOQEB-UHFFFAOYSA-N 1 0 319.367 4.170 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)cc1 ZINC000246567017 1046375989 /nfs/dbraw/zinc/37/59/89/1046375989.db2.gz BOXCUWBNNRNSOW-WMZOPIPTSA-N 1 0 316.489 4.285 20 10 DICDRO C[C@H]([NH2+]CCCn1ccc2ccccc21)c1cc(F)ccc1O ZINC000321730909 1046380387 /nfs/dbraw/zinc/38/03/87/1046380387.db2.gz OIDVAZNBBPAWIF-AWEZNQCLSA-N 1 0 312.388 4.227 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2c1ccn2C ZINC001139163360 1046400448 /nfs/dbraw/zinc/40/04/48/1046400448.db2.gz KNCVVTMIXCJRIC-UHFFFAOYSA-N 1 0 321.468 4.266 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2cccnc2c1 ZINC001139170687 1046401865 /nfs/dbraw/zinc/40/18/65/1046401865.db2.gz INCCQRDMFNAMNW-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO C[N@H+](Cc1ccc(Oc2ccccc2)o1)Cc1ccccc1O ZINC000780756178 1046403855 /nfs/dbraw/zinc/40/38/55/1046403855.db2.gz BZUXMRAHPHTQJS-UHFFFAOYSA-N 1 0 309.365 4.410 20 10 DICDRO CCCCc1nc(Cl)c(CN(CC)Cc2ccccc2O)[nH]1 ZINC001139179904 1046404302 /nfs/dbraw/zinc/40/43/02/1046404302.db2.gz YLORGKHUJJJALB-UHFFFAOYSA-N 1 0 321.852 4.133 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)c1O ZINC000780792088 1046405171 /nfs/dbraw/zinc/40/51/71/1046405171.db2.gz STHQXKJNCRMFMG-SQVRQVGWSA-N 1 0 309.409 4.079 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)c1O ZINC000780792086 1046405237 /nfs/dbraw/zinc/40/52/37/1046405237.db2.gz STHQXKJNCRMFMG-QFQMRYFISA-N 1 0 309.409 4.079 20 10 DICDRO COc1ccc(N2CC[C@H](C[NH2+][C@@H]3CCC[C@H](C)CC3)C2)cc1 ZINC001202914366 1046420957 /nfs/dbraw/zinc/42/09/57/1046420957.db2.gz ZFHJENRLAFFKOG-RCCFBDPRSA-N 1 0 316.489 4.080 20 10 DICDRO C[N@H+](Cc1ccc(-c2ccsc2)nc1)Cc1ccccc1O ZINC001139505734 1046457958 /nfs/dbraw/zinc/45/79/58/1046457958.db2.gz VFEYYIZSYBWTCF-UHFFFAOYSA-N 1 0 310.422 4.148 20 10 DICDRO CC[N@H+](Cc1ccc(-c2ccccc2)nc1)Cc1ccccc1O ZINC001139519273 1046461892 /nfs/dbraw/zinc/46/18/92/1046461892.db2.gz QJWLDRWXMMJJNM-UHFFFAOYSA-N 1 0 318.420 4.476 20 10 DICDRO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc(N(C)C)c(C)c2)cc1 ZINC001139672693 1046496389 /nfs/dbraw/zinc/49/63/89/1046496389.db2.gz BNINQRKSCPGGLU-MRXNPFEDSA-N 1 0 312.457 4.263 20 10 DICDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)c(C)c2)cc1 ZINC001139672251 1046496606 /nfs/dbraw/zinc/49/66/06/1046496606.db2.gz UVWGOTSUGXLZQW-NRFANRHFSA-N 1 0 324.468 4.407 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)[C@H](O)c1ccc(C)cc1 ZINC001202963586 1046503691 /nfs/dbraw/zinc/50/36/91/1046503691.db2.gz CBBHXOXLUODCCO-IERDGZPVSA-N 1 0 322.452 4.007 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)[C@H](O)c1ccc(C)cc1 ZINC001202963589 1046504405 /nfs/dbraw/zinc/50/44/05/1046504405.db2.gz CBBHXOXLUODCCO-KKSFZXQISA-N 1 0 322.452 4.007 20 10 DICDRO Cc1cc(O)cc(C)c1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001139713013 1046504939 /nfs/dbraw/zinc/50/49/39/1046504939.db2.gz ANWBNFALAZEBHI-UHFFFAOYSA-N 1 0 324.468 4.241 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](Cc3ccncc3)C2)cc1C(C)C ZINC000782288550 1046513888 /nfs/dbraw/zinc/51/38/88/1046513888.db2.gz FYARJMYYFNGICG-SFHVURJKSA-N 1 0 324.468 4.284 20 10 DICDRO CSCc1cccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000782535585 1046534925 /nfs/dbraw/zinc/53/49/25/1046534925.db2.gz QXSJUEXCUZPYSG-UHFFFAOYSA-N 1 0 318.461 4.045 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2CC[C@](C)(c3ccccc3)C2)c1 ZINC000783251288 1046569845 /nfs/dbraw/zinc/56/98/45/1046569845.db2.gz JNPBUSVKRRHPBV-XLIONFOSSA-N 1 0 311.425 4.001 20 10 DICDRO CN(Cc1cc(F)ccc1O)Cc1c(Cl)cccc1Cl ZINC001140055051 1046578262 /nfs/dbraw/zinc/57/82/62/1046578262.db2.gz FRPCQGQGCIXVTN-UHFFFAOYSA-N 1 0 314.187 4.470 20 10 DICDRO Oc1ccc(F)cc1C[NH+]1CCC(Cc2ccccc2F)CC1 ZINC001140054962 1046579135 /nfs/dbraw/zinc/57/91/35/1046579135.db2.gz BMPAMBKLNXQHAF-UHFFFAOYSA-N 1 0 317.379 4.125 20 10 DICDRO COc1c(Cl)cccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001140062818 1046582032 /nfs/dbraw/zinc/58/20/32/1046582032.db2.gz IEKLXCKOIAJTHF-UHFFFAOYSA-N 1 0 318.848 4.047 20 10 DICDRO C[C@H]([NH2+]CCc1ccccc1C(F)(F)F)c1ccccc1O ZINC000783505438 1046602250 /nfs/dbraw/zinc/60/22/50/1046602250.db2.gz WUEPEKXXCPQBEA-LBPRGKRZSA-N 1 0 309.331 4.304 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(N2CCCCC2)cc1)c1ccccc1O ZINC000783505855 1046602454 /nfs/dbraw/zinc/60/24/54/1046602454.db2.gz XTRFJBFXCFDPOF-QGZVFWFLSA-N 1 0 324.468 4.276 20 10 DICDRO CC[C@H](C[NH2+][C@H](C)c1ccccc1O)Oc1cccc(F)c1 ZINC000783519482 1046603571 /nfs/dbraw/zinc/60/35/71/1046603571.db2.gz LKGBJRYHAJEQIL-UKRRQHHQSA-N 1 0 303.377 4.040 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1Cl ZINC000783520752 1046603713 /nfs/dbraw/zinc/60/37/13/1046603713.db2.gz YNLAGJKKSHLLQG-YVEFUNNKSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@@H]([NH2+]CC1(c2cccc(Cl)c2)CC1)c1ccccc1O ZINC000783514790 1046603891 /nfs/dbraw/zinc/60/38/91/1046603891.db2.gz UBBPGWZXYRBRMA-CYBMUJFWSA-N 1 0 301.817 4.428 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1O ZINC000783518531 1046604024 /nfs/dbraw/zinc/60/40/24/1046604024.db2.gz DENKISZWCIEVCB-RHSMWYFYSA-N 1 0 309.409 4.489 20 10 DICDRO C[C@H]([NH2+][C@H]1COc2c1ccc(Cl)c2Cl)c1ccccc1O ZINC000783519283 1046604273 /nfs/dbraw/zinc/60/42/73/1046604273.db2.gz RBVHPOPWDQXEHK-ZANVPECISA-N 1 0 324.207 4.483 20 10 DICDRO CC[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1cccc(F)c1 ZINC000783519483 1046604399 /nfs/dbraw/zinc/60/43/99/1046604399.db2.gz LKGBJRYHAJEQIL-ZFWWWQNUSA-N 1 0 303.377 4.040 20 10 DICDRO COc1cc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)ccc1C ZINC001140159536 1046604578 /nfs/dbraw/zinc/60/45/78/1046604578.db2.gz HOKRTCQNJHPQTL-UHFFFAOYSA-N 1 0 324.468 4.236 20 10 DICDRO Cc1ccc(C)c(C[N@H+](C)CCc2ccc(Cl)cc2)c1O ZINC001140182084 1046609401 /nfs/dbraw/zinc/60/94/01/1046609401.db2.gz IDALDTPGQAAZTC-UHFFFAOYSA-N 1 0 303.833 4.337 20 10 DICDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)c1O ZINC001140179046 1046609924 /nfs/dbraw/zinc/60/99/24/1046609924.db2.gz FURQYWMAMOPAKM-SFHVURJKSA-N 1 0 311.425 4.052 20 10 DICDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(C)ccc(C)c2O)c1 ZINC001140181406 1046610348 /nfs/dbraw/zinc/61/03/48/1046610348.db2.gz APQOBUSUWLRAKI-IBGZPJMESA-N 1 0 311.425 4.355 20 10 DICDRO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841747861 1046613547 /nfs/dbraw/zinc/61/35/47/1046613547.db2.gz FFFZITQXIUBTCV-VXGBXAGGSA-N 1 0 304.821 4.415 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(C)cc2O)CCO1 ZINC000248499579 1046619316 /nfs/dbraw/zinc/61/93/16/1046619316.db2.gz MVZNZROZESCWKE-ALKREAHSSA-N 1 0 305.462 4.335 20 10 DICDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(N(C)C)cc2)s1 ZINC000093274657 1046620024 /nfs/dbraw/zinc/62/00/24/1046620024.db2.gz QKOFTRPFPIBAPT-ZDUSSCGKSA-N 1 0 303.475 4.019 20 10 DICDRO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1cc(Cl)ccc1O)CCC2 ZINC000093365000 1046624857 /nfs/dbraw/zinc/62/48/57/1046624857.db2.gz NLSRDPFBVXUMSH-CQSZACIVSA-N 1 0 322.861 4.320 20 10 DICDRO CC(C)OCc1ccccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834535003 1046627166 /nfs/dbraw/zinc/62/71/66/1046627166.db2.gz WVZFEFWAHQXEBG-GOSISDBHSA-N 1 0 311.425 4.094 20 10 DICDRO CCC(C)(C)[C@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000834558839 1046632270 /nfs/dbraw/zinc/63/22/70/1046632270.db2.gz QJWJQPLGTPDXCS-HNNXBMFYSA-N 1 0 304.478 4.078 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]CCCc1c[nH]c3ccccc13)CC2 ZINC000834576214 1046633971 /nfs/dbraw/zinc/63/39/71/1046633971.db2.gz UOLWIINMFWEHRS-GOSISDBHSA-N 1 0 306.409 4.083 20 10 DICDRO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1ccc2ccccc2c1O ZINC000248732962 1046634174 /nfs/dbraw/zinc/63/41/74/1046634174.db2.gz PCEUOLMTUHQXTA-DIHFKTGWSA-N 1 0 323.436 4.154 20 10 DICDRO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1ccc2ccccc2c1O ZINC000248732965 1046634244 /nfs/dbraw/zinc/63/42/44/1046634244.db2.gz PCEUOLMTUHQXTA-KORVSZGISA-N 1 0 323.436 4.154 20 10 DICDRO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(C)ccc2O)s1 ZINC000093612586 1046635471 /nfs/dbraw/zinc/63/54/71/1046635471.db2.gz RPAKFHKQNGTYJT-CYBMUJFWSA-N 1 0 304.459 4.221 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1OC1CCC1)CC2 ZINC000834654833 1046645223 /nfs/dbraw/zinc/64/52/23/1046645223.db2.gz SVWARVQFTHHGGZ-QGZVFWFLSA-N 1 0 309.409 4.101 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC([C@H]3CCOC3)CC2)cc1C(C)C ZINC000784006032 1046650497 /nfs/dbraw/zinc/65/04/97/1046650497.db2.gz CPWPGNLDPGCIRK-KRWDZBQOSA-N 1 0 317.473 4.073 20 10 DICDRO Cc1ccc([C@@H]2CC[N@H+](Cc3c(O)ccc4ccncc43)C2)cc1 ZINC000784023715 1046651997 /nfs/dbraw/zinc/65/19/97/1046651997.db2.gz RQNDWKGATZSWJJ-GOSISDBHSA-N 1 0 318.420 4.238 20 10 DICDRO CC(C)(C)Oc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000834714204 1046654804 /nfs/dbraw/zinc/65/48/04/1046654804.db2.gz RFNLQSBELNZPDZ-KRWDZBQOSA-N 1 0 311.425 4.347 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]C1(c3ccc(F)cc3F)CCC1)CC2 ZINC000834733299 1046658233 /nfs/dbraw/zinc/65/82/33/1046658233.db2.gz CWSCKPXLLJXKHV-MRXNPFEDSA-N 1 0 315.363 4.327 20 10 DICDRO CC[N@H+](Cc1cccc(OC)c1)Cc1c(O)cccc1Cl ZINC001140341583 1046667594 /nfs/dbraw/zinc/66/75/94/1046667594.db2.gz XHNXGPWZDKVMTA-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000834769919 1046667696 /nfs/dbraw/zinc/66/76/96/1046667696.db2.gz QRUINDHMEHJTBQ-SJORKVTESA-N 1 0 311.473 4.210 20 10 DICDRO COc1cccc([C@@H]2CC[N@H+](Cc3c(O)cccc3Cl)C2)c1 ZINC001140342709 1046667920 /nfs/dbraw/zinc/66/79/20/1046667920.db2.gz VIBUEELSSCPEOX-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCc2c(F)cc(F)cc21)c1ccccc1O ZINC000834814096 1046674415 /nfs/dbraw/zinc/67/44/15/1046674415.db2.gz FCASJHXRIGMDGZ-DIFFPNOSSA-N 1 0 303.352 4.399 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCCc3c(F)cc(F)cc31)CC2 ZINC000834814181 1046674725 /nfs/dbraw/zinc/67/47/25/1046674725.db2.gz FZHSPAMZTJXKIK-SJORKVTESA-N 1 0 315.363 4.325 20 10 DICDRO CC(C)Cn1cc[nH+]c1NCc1ccc(N2CCCCC2)cc1 ZINC000795806434 1046678922 /nfs/dbraw/zinc/67/89/22/1046678922.db2.gz ZCTMFMYRJZCVIO-UHFFFAOYSA-N 1 0 312.461 4.142 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000795793861 1046679128 /nfs/dbraw/zinc/67/91/28/1046679128.db2.gz BPHRUTRLKKBVNQ-FQEVSTJZSA-N 1 0 309.457 4.087 20 10 DICDRO C[C@@H]([NH2+]Cc1cccc(Br)c1)c1cc(F)ccc1O ZINC000094617852 1046679262 /nfs/dbraw/zinc/67/92/62/1046679262.db2.gz BNWOIWNCALJMIA-SNVBAGLBSA-N 1 0 324.193 4.145 20 10 DICDRO c1csc(SCCC[NH2+][C@@H](c2cccnc2)C2CCC2)n1 ZINC000795798650 1046680955 /nfs/dbraw/zinc/68/09/55/1046680955.db2.gz WQYLCQMWUGHAOG-OAHLLOKOSA-N 1 0 319.499 4.151 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1cc(Cl)ccc1O ZINC000834850800 1046686367 /nfs/dbraw/zinc/68/63/67/1046686367.db2.gz PJPJWBHZHXYXTL-GFCCVEGCSA-N 1 0 304.821 4.069 20 10 DICDRO Cc1ncsc1CC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000834881676 1046694895 /nfs/dbraw/zinc/69/48/95/1046694895.db2.gz VEAVTBNRDJPGCP-JTQLQIEISA-N 1 0 310.850 4.012 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCCC[C@H]1CC(F)(F)F)CC2 ZINC000834879337 1046695419 /nfs/dbraw/zinc/69/54/19/1046695419.db2.gz YCWVJUAXQCQDTJ-IHRRRGAJSA-N 1 0 313.363 4.480 20 10 DICDRO CC[C@@H]([NH2+][C@H]1COCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000841762544 1046696090 /nfs/dbraw/zinc/69/60/90/1046696090.db2.gz XHUULARMYSQVHL-UXHICEINSA-N 1 0 310.441 4.065 20 10 DICDRO CC[C@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000834882265 1046696403 /nfs/dbraw/zinc/69/64/03/1046696403.db2.gz IFVYJXKNNGHSSV-BBRMVZONSA-N 1 0 323.864 4.436 20 10 DICDRO Cc1cccnc1CCC[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000834882472 1046696905 /nfs/dbraw/zinc/69/69/05/1046696905.db2.gz ATVPXYHTPBNOFF-CQSZACIVSA-N 1 0 318.848 4.341 20 10 DICDRO CC[C@@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1ccc(F)cc1[O-] ZINC000834885266 1046698903 /nfs/dbraw/zinc/69/89/03/1046698903.db2.gz UOZFPDYIHGYAIX-DGCLKSJQSA-N 1 0 306.208 4.156 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)cc1 ZINC000834883975 1046698343 /nfs/dbraw/zinc/69/83/43/1046698343.db2.gz VMHVERWCJSMLJN-IRXDYDNUSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CC2(Cl)Cl)c2c1c(F)ccc2O ZINC000834885750 1046698892 /nfs/dbraw/zinc/69/88/92/1046698892.db2.gz XSTADHQXNVPXOW-IPURGOFSSA-N 1 0 318.219 4.253 20 10 DICDRO CCOC1CC(CN(c2ccc(OC)cc2)[C@H](C)C2CC2)C1 ZINC000795955733 1046701538 /nfs/dbraw/zinc/70/15/38/1046701538.db2.gz KDIIOQAHZKXKSP-TZGCNFNXSA-N 1 0 303.446 4.115 20 10 DICDRO CC(C)[N@H+](Cc1ccccc1)Cc1c(O)ccc2ccncc21 ZINC000834890197 1046702362 /nfs/dbraw/zinc/70/23/62/1046702362.db2.gz YLQCTOVQJNEWNS-UHFFFAOYSA-N 1 0 306.409 4.351 20 10 DICDRO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000834897248 1046706781 /nfs/dbraw/zinc/70/67/81/1046706781.db2.gz ZBQYJMYQMABLNV-KBPBESRZSA-N 1 0 309.413 4.174 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1O ZINC000834896016 1046706796 /nfs/dbraw/zinc/70/67/96/1046706796.db2.gz GYIXWOJSCMNNCE-RNCFNFMXSA-N 1 0 307.315 4.148 20 10 DICDRO CCCc1ncc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)o1 ZINC000834901071 1046711675 /nfs/dbraw/zinc/71/16/75/1046711675.db2.gz WJEQISUHHJTWCX-AWEZNQCLSA-N 1 0 308.809 4.227 20 10 DICDRO CCc1ncc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)o1 ZINC000834901171 1046711823 /nfs/dbraw/zinc/71/18/23/1046711823.db2.gz XVRWNVAAYHSEMG-OAHLLOKOSA-N 1 0 313.445 4.078 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCN(C)c3ccccc32)c1 ZINC000834903699 1046713780 /nfs/dbraw/zinc/71/37/80/1046713780.db2.gz LMAYWYXMLFVKPN-CRAIPNDOSA-N 1 0 310.441 4.323 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000834908820 1046716257 /nfs/dbraw/zinc/71/62/57/1046716257.db2.gz HMLCIVDTDTYWGY-IUODEOHRSA-N 1 0 311.853 4.292 20 10 DICDRO CC[N@H+](Cc1cccc(OC)c1)Cc1ccc(Cl)cc1O ZINC001140464895 1046739045 /nfs/dbraw/zinc/73/90/45/1046739045.db2.gz FNZWFBCMVQNSSZ-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO COc1cccc(CCC[N@H+](C)Cc2ccc(Cl)cc2O)c1 ZINC001140465172 1046739141 /nfs/dbraw/zinc/73/91/41/1046739141.db2.gz HSNAFYAHUANNJB-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO Cc1csc(C(C)(C)[NH2+]C/C=C\c2ccc(N(C)C)cc2)n1 ZINC000835039781 1046746207 /nfs/dbraw/zinc/74/62/07/1046746207.db2.gz LKVWWXYRKSQVGR-SREVYHEPSA-N 1 0 315.486 4.056 20 10 DICDRO CC[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1nc(C)cs1 ZINC000835039125 1046747812 /nfs/dbraw/zinc/74/78/12/1046747812.db2.gz WNDUZFOBRLAEMI-TUYSUELWSA-N 1 0 315.486 4.272 20 10 DICDRO CCc1ccc([C@@H](O)C[NH2+][C@@H](CC)c2ccc(C)cc2O)cc1 ZINC000797014675 1046771728 /nfs/dbraw/zinc/77/17/28/1046771728.db2.gz CCUSEDGHONXMGD-ICSRJNTNSA-N 1 0 313.441 4.037 20 10 DICDRO Cc1cccc(CCC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000797015044 1046773181 /nfs/dbraw/zinc/77/31/81/1046773181.db2.gz GHMAVCMYWNGKCR-WBMJQRKESA-N 1 0 314.404 4.005 20 10 DICDRO C[C@H]([NH2+][C@@H]1CSC[C@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000797066222 1046785289 /nfs/dbraw/zinc/78/52/89/1046785289.db2.gz QCNOHCNTAKDFIW-JKIFEVAISA-N 1 0 322.493 4.218 20 10 DICDRO CC[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccc(N(C)C)cc1 ZINC000797072264 1046786475 /nfs/dbraw/zinc/78/64/75/1046786475.db2.gz YATSZRJSGIHIOG-AWEZNQCLSA-N 1 0 300.368 4.136 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(c3ccccn3)CCC2)cc1 ZINC000797102442 1046791920 /nfs/dbraw/zinc/79/19/20/1046791920.db2.gz ZTOUEJPRTXZBDV-KRWDZBQOSA-N 1 0 323.484 4.310 20 10 DICDRO Cc1ccc(O)c(C[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)c1 ZINC001140623151 1046815683 /nfs/dbraw/zinc/81/56/83/1046815683.db2.gz HDWOMDAYQOSYKA-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Cc1ccc(O)c(C[N@H+](C)CCc2ccc(C(F)(F)F)cc2)c1 ZINC001140624326 1046817023 /nfs/dbraw/zinc/81/70/23/1046817023.db2.gz QVIQXKVAAKICPQ-UHFFFAOYSA-N 1 0 323.358 4.394 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)c(O)c(C)c1 ZINC001140659923 1046840311 /nfs/dbraw/zinc/84/03/11/1046840311.db2.gz ZEBLTGMXWTXFHQ-UHFFFAOYSA-N 1 0 312.457 4.097 20 10 DICDRO COc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c(C)c1 ZINC001140678056 1046847006 /nfs/dbraw/zinc/84/70/06/1046847006.db2.gz MJNCVKKFLIFJRU-UHFFFAOYSA-N 1 0 324.468 4.236 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1O ZINC001140747383 1046884201 /nfs/dbraw/zinc/88/42/01/1046884201.db2.gz AXCFBFLPNKJGTG-AWEZNQCLSA-N 1 0 317.816 4.049 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1O ZINC001140748164 1046884829 /nfs/dbraw/zinc/88/48/29/1046884829.db2.gz SUBUAITYFWKDNV-HNNXBMFYSA-N 1 0 319.351 4.022 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1O ZINC001140747384 1046885474 /nfs/dbraw/zinc/88/54/74/1046885474.db2.gz AXCFBFLPNKJGTG-CQSZACIVSA-N 1 0 317.816 4.049 20 10 DICDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)c1O ZINC001140748849 1046885598 /nfs/dbraw/zinc/88/55/98/1046885598.db2.gz MERCJHVWVWINIM-QGZVFWFLSA-N 1 0 311.425 4.176 20 10 DICDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)c(OC)c1 ZINC000320008461 1046899327 /nfs/dbraw/zinc/89/93/27/1046899327.db2.gz HTNTXOYMTONCKT-KGLIPLIRSA-N 1 0 315.413 4.130 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCCN1C1CCCCC1)c1ccccc1O ZINC000798002302 1046920752 /nfs/dbraw/zinc/92/07/52/1046920752.db2.gz CVKWPZYNQOQGJG-IEBWSBKVSA-N 1 0 316.489 4.230 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c(O)c1 ZINC001140850840 1046928722 /nfs/dbraw/zinc/92/87/22/1046928722.db2.gz WLKWUDBHOAFATA-SFHVURJKSA-N 1 0 324.468 4.228 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(F)cc2)c(O)c1 ZINC001140851989 1046931501 /nfs/dbraw/zinc/93/15/01/1046931501.db2.gz XGDGKTDRYONHTG-UHFFFAOYSA-N 1 0 316.420 4.010 20 10 DICDRO COc1cc(C)cc(C[N@H+]2CC=C(c3ccc(C)cc3)CC2)c1O ZINC000798191012 1046935011 /nfs/dbraw/zinc/93/50/11/1046935011.db2.gz XWZDWHRXLFPFCJ-UHFFFAOYSA-N 1 0 323.436 4.307 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)cc1C ZINC000798211203 1046935800 /nfs/dbraw/zinc/93/58/00/1046935800.db2.gz CYIJBQCDHYGUCI-UHFFFAOYSA-N 1 0 309.409 4.004 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)c(O)c1 ZINC001140950208 1046959421 /nfs/dbraw/zinc/95/94/21/1046959421.db2.gz VLOACQRDGGHCAL-UHFFFAOYSA-N 1 0 318.420 4.298 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)c(O)c1 ZINC001140951109 1046959563 /nfs/dbraw/zinc/95/95/63/1046959563.db2.gz ZEPPBUSPCRUUQB-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccccn2)C2CCCCC2)c(O)c1 ZINC001140950894 1046959995 /nfs/dbraw/zinc/95/99/95/1046959995.db2.gz NQGSSLPNERSLBZ-UHFFFAOYSA-N 1 0 310.441 4.431 20 10 DICDRO COc1cccc([C@H]2CCC[N@H+](Cc3ccc(C)cc3O)C2)c1 ZINC001140953610 1046960832 /nfs/dbraw/zinc/96/08/32/1046960832.db2.gz DMUHODZWSOPRAW-KRWDZBQOSA-N 1 0 311.425 4.089 20 10 DICDRO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(C)cc1O ZINC001140954779 1046962774 /nfs/dbraw/zinc/96/27/74/1046962774.db2.gz YXSMVPQWCLPGKI-SFHVURJKSA-N 1 0 311.425 4.184 20 10 DICDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c(O)c1 ZINC001140958209 1046963196 /nfs/dbraw/zinc/96/31/96/1046963196.db2.gz TYUYUKZDQRSYBV-MRXNPFEDSA-N 1 0 303.352 4.316 20 10 DICDRO COC1CCN(c2ccc(C[N@H+](C)[C@H](C)C(C)(C)C)cc2)CC1 ZINC000827401069 1046963305 /nfs/dbraw/zinc/96/33/05/1046963305.db2.gz XGJADGNHPPWLSP-MRXNPFEDSA-N 1 0 318.505 4.168 20 10 DICDRO Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000798925588 1046985716 /nfs/dbraw/zinc/98/57/16/1046985716.db2.gz BWTUHPALGQLKNC-RTBURBONSA-N 1 0 322.452 4.141 20 10 DICDRO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000799149210 1047003348 /nfs/dbraw/zinc/00/33/48/1047003348.db2.gz QAVDZNVIVYUWPN-IBGZPJMESA-N 1 0 321.424 4.006 20 10 DICDRO CCC[N@H+](CCCc1cccc(OC)c1)Cc1ccccc1O ZINC000303899946 1047003640 /nfs/dbraw/zinc/00/36/40/1047003640.db2.gz LGAUSCXZZBTRIZ-UHFFFAOYSA-N 1 0 313.441 4.246 20 10 DICDRO Oc1ccc(O)c(C[N@H+](Cc2ccccc2)C2CCCCC2)c1 ZINC001141156330 1047030050 /nfs/dbraw/zinc/03/00/50/1047030050.db2.gz JOHHIWYZMZGCHZ-UHFFFAOYSA-N 1 0 311.425 4.433 20 10 DICDRO CSc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(O)ccc1O ZINC001141162588 1047031866 /nfs/dbraw/zinc/03/18/66/1047031866.db2.gz WPKQXACKAZHXLU-MRXNPFEDSA-N 1 0 315.438 4.157 20 10 DICDRO C[N@H+](Cc1ccc2c(c1)CCC(C)(C)O2)Cc1ccccc1O ZINC001141184535 1047037200 /nfs/dbraw/zinc/03/72/00/1047037200.db2.gz CYFNNZIOYUXUFU-UHFFFAOYSA-N 1 0 311.425 4.128 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c(F)c1 ZINC001141194630 1047041661 /nfs/dbraw/zinc/04/16/61/1047041661.db2.gz GTHRPRVJJDMJJT-UHFFFAOYSA-N 1 0 312.432 4.366 20 10 DICDRO C[C@@H]1C[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)c2c1c(F)ccc2O ZINC000799729984 1047058550 /nfs/dbraw/zinc/05/85/50/1047058550.db2.gz XFQTUBBTMRPNJF-PXAZEXFGSA-N 1 0 324.399 4.393 20 10 DICDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000799728853 1047059476 /nfs/dbraw/zinc/05/94/76/1047059476.db2.gz FOODPVYKNWXYCK-UXPWSPDFSA-N 1 0 316.489 4.285 20 10 DICDRO CC[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1ccc(C)cc1O ZINC000799727825 1047059650 /nfs/dbraw/zinc/05/96/50/1047059650.db2.gz ACEHSSYMYUKKCK-GOSISDBHSA-N 1 0 308.425 4.465 20 10 DICDRO COC1CCN(c2ccc(C[NH+]3[C@@H](C)CCC[C@@H]3C)cc2)CC1 ZINC000827778317 1047154249 /nfs/dbraw/zinc/15/42/49/1047154249.db2.gz UEGFTBPFQNKCRR-IRXDYDNUSA-N 1 0 316.489 4.065 20 10 DICDRO COC1CCN(c2ccc(C[NH+]3[C@H](C)CCC[C@H]3C)cc2)CC1 ZINC000827778316 1047154408 /nfs/dbraw/zinc/15/44/08/1047154408.db2.gz UEGFTBPFQNKCRR-IAGOWNOFSA-N 1 0 316.489 4.065 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc(Cl)nc1 ZINC001116565197 1047156359 /nfs/dbraw/zinc/15/63/59/1047156359.db2.gz KOUDCMXHWPRJSP-DGCLKSJQSA-N 1 0 302.805 4.087 20 10 DICDRO C[C@H]([NH2+][C@H]1CCCC[C@H]1N(C)C)c1ccc2ccccc2c1O ZINC001116565394 1047158125 /nfs/dbraw/zinc/15/81/25/1047158125.db2.gz QUZYJHVAVZPLLM-ZOCIIQOWSA-N 1 0 312.457 4.069 20 10 DICDRO COCCC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CCCC1 ZINC001116584378 1047160355 /nfs/dbraw/zinc/16/03/55/1047160355.db2.gz FDHPZJGQGDOQKU-JKSUJKDBSA-N 1 0 317.473 4.435 20 10 DICDRO Cc1csc(CCC[NH2+][C@H](C)c2ccc(C)c(C)c2O)n1 ZINC001116584710 1047160633 /nfs/dbraw/zinc/16/06/33/1047160633.db2.gz KFHDFQYCOBVEGW-CQSZACIVSA-N 1 0 304.459 4.057 20 10 DICDRO COC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CCCCC1 ZINC001116651086 1047165648 /nfs/dbraw/zinc/16/56/48/1047165648.db2.gz MBNJKIHKHYIBJS-CABCVRRESA-N 1 0 303.446 4.188 20 10 DICDRO Cc1csc(CCC[NH2+][C@H](C)c2c(C)cc(C)cc2O)n1 ZINC001117061468 1047193608 /nfs/dbraw/zinc/19/36/08/1047193608.db2.gz XKBOCJHIRFXHTB-CQSZACIVSA-N 1 0 304.459 4.057 20 10 DICDRO Cc1csc(CC[NH2+][C@H](C)c2ccc3ccccc3c2O)n1 ZINC000387767468 1047284657 /nfs/dbraw/zinc/28/46/57/1047284657.db2.gz BLJXBVOSQQDSCH-CYBMUJFWSA-N 1 0 312.438 4.204 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1C(F)(F)F)c1cc(F)ccc1O ZINC000388692050 1047289941 /nfs/dbraw/zinc/28/99/41/1047289941.db2.gz WSDQBZLGYGXKDO-SNVBAGLBSA-N 1 0 313.294 4.401 20 10 DICDRO Cc1cccc(CCC[NH2+]Cc2ccc(N3CCCCC3)cc2)n1 ZINC000796450943 1047291598 /nfs/dbraw/zinc/29/15/98/1047291598.db2.gz YNMHWPUUMYHAMJ-UHFFFAOYSA-N 1 0 323.484 4.103 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)COCc2ccccc2)c1 ZINC000389900074 1047292416 /nfs/dbraw/zinc/29/24/16/1047292416.db2.gz BIJMNIPICJXIKH-IRXDYDNUSA-N 1 0 313.441 4.204 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)COCc2ccccc2)c1 ZINC000389900073 1047292433 /nfs/dbraw/zinc/29/24/33/1047292433.db2.gz BIJMNIPICJXIKH-IAGOWNOFSA-N 1 0 313.441 4.204 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](C)COCc1ccccc1)c1ccccc1O ZINC000389902843 1047293458 /nfs/dbraw/zinc/29/34/58/1047293458.db2.gz DIYMYHGICAGFFQ-QFBILLFUSA-N 1 0 313.441 4.286 20 10 DICDRO C[C@H]([NH2+][C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccc2ccccc2c1O ZINC001118428518 1047296052 /nfs/dbraw/zinc/29/60/52/1047296052.db2.gz UQCZTXRFGMAUHH-SPGJAERMSA-N 1 0 303.352 4.240 20 10 DICDRO C[C@H](CN1CCCCC1)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000390350935 1047297703 /nfs/dbraw/zinc/29/77/03/1047297703.db2.gz YSTKAEWRXMYJMO-CVEARBPZSA-N 1 0 312.457 4.070 20 10 DICDRO CCN(CC)[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000390364171 1047297831 /nfs/dbraw/zinc/29/78/31/1047297831.db2.gz RVGQXSUYRXALDY-QFBILLFUSA-N 1 0 312.457 4.126 20 10 DICDRO C[C@@H]([NH2+]C[C@H](C)N1CCCCC1)c1ccc2ccccc2c1O ZINC000390933136 1047302290 /nfs/dbraw/zinc/30/22/90/1047302290.db2.gz MWKPSOHDDMJIEG-JKSUJKDBSA-N 1 0 312.457 4.070 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@H](c2cccs2)C2CC2)c1 ZINC000725844506 1047319037 /nfs/dbraw/zinc/31/90/37/1047319037.db2.gz ZSTQTRNFHVABKW-QGZVFWFLSA-N 1 0 303.427 4.093 20 10 DICDRO Cc1cc(C[NH2+]Cc2ccccc2O)c(C)n1-c1cccc(C)c1 ZINC000725851002 1047320406 /nfs/dbraw/zinc/32/04/06/1047320406.db2.gz GCHFJKDKDYDMBG-UHFFFAOYSA-N 1 0 320.436 4.398 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]C[C@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000725848186 1047320443 /nfs/dbraw/zinc/32/04/43/1047320443.db2.gz LAPUYSHLXXIMEB-CQSZACIVSA-N 1 0 319.489 4.113 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]CCCSc2nccs2)c(C)c1 ZINC000840722803 1047321082 /nfs/dbraw/zinc/32/10/82/1047321082.db2.gz LHALAIZTFQJLGC-CYBMUJFWSA-N 1 0 322.499 4.293 20 10 DICDRO COc1ccc(CC[C@H](C)[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000725849446 1047321428 /nfs/dbraw/zinc/32/14/28/1047321428.db2.gz NMKPVWQGHZYODD-ZDUSSCGKSA-N 1 0 319.832 4.165 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cnn(CC2CCC2)c1)c1ccccc1O ZINC000898181546 1047326521 /nfs/dbraw/zinc/32/65/21/1047326521.db2.gz JQQPNAPGYYZMEG-KDOFPFPSSA-N 1 0 313.445 4.191 20 10 DICDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)[C@H]1CCCOC1 ZINC001119345606 1047329994 /nfs/dbraw/zinc/32/99/94/1047329994.db2.gz XLLCGDGXSGCOSH-YHUYYLMFSA-N 1 0 303.446 4.044 20 10 DICDRO CCOCc1ccccc1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840876273 1047350220 /nfs/dbraw/zinc/35/02/20/1047350220.db2.gz UIFKVNBDJWAOQS-UHFFFAOYSA-N 1 0 319.832 4.180 20 10 DICDRO CC[C@H]([NH2+]C1CCC(COC)CC1)c1cc(Cl)ccc1O ZINC000840875636 1047351910 /nfs/dbraw/zinc/35/19/10/1047351910.db2.gz HZKXHWVYSDRGNM-PXCJXSSVSA-N 1 0 311.853 4.292 20 10 DICDRO CCOc1ccccc1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840883684 1047352847 /nfs/dbraw/zinc/35/28/47/1047352847.db2.gz HJHCFPZHSZTTPA-UHFFFAOYSA-N 1 0 305.805 4.043 20 10 DICDRO C[C@@H]([NH2+]CC(C)(C)c1cccnc1)c1cc(Cl)ccc1O ZINC000840891488 1047354317 /nfs/dbraw/zinc/35/43/17/1047354317.db2.gz HUNSMGGVNDCIOG-GFCCVEGCSA-N 1 0 304.821 4.069 20 10 DICDRO COc1cccc([C@@H]2C[C@H]2C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000840888696 1047354592 /nfs/dbraw/zinc/35/45/92/1047354592.db2.gz NEGBDYFACFVJQU-QOKNQOGYSA-N 1 0 311.425 4.164 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOc3c(C)cccc32)c(Cl)c1 ZINC000840887365 1047355653 /nfs/dbraw/zinc/35/56/53/1047355653.db2.gz LIWWWVKSWUAKPD-MRXNPFEDSA-N 1 0 317.816 4.276 20 10 DICDRO Cc1cncc([C@@H](C)[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)c1 ZINC000840892713 1047356324 /nfs/dbraw/zinc/35/63/24/1047356324.db2.gz CBHAOPCGBAACOG-IAGOWNOFSA-N 1 0 311.473 4.046 20 10 DICDRO Cc1ncc([C@@H](C)[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)s1 ZINC000840892919 1047356580 /nfs/dbraw/zinc/35/65/80/1047356580.db2.gz DXCBUIHRBCIHQO-ZIAGYGMSSA-N 1 0 317.502 4.108 20 10 DICDRO Cc1cncc([C@H](C)[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)c1 ZINC000840892714 1047357035 /nfs/dbraw/zinc/35/70/35/1047357035.db2.gz CBHAOPCGBAACOG-IRXDYDNUSA-N 1 0 311.473 4.046 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)c(Cl)c1 ZINC000840906418 1047359650 /nfs/dbraw/zinc/35/96/50/1047359650.db2.gz HCHMNSQWKCECIE-BLLLJJGKSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(N(C)C)ccc1CNc1ccc(C[NH+](C)C)c(C)c1 ZINC000840951823 1047362139 /nfs/dbraw/zinc/36/21/39/1047362139.db2.gz CAOKXQUBWUUVBQ-UHFFFAOYSA-N 1 0 311.473 4.043 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000840948265 1047362732 /nfs/dbraw/zinc/36/27/32/1047362732.db2.gz SNBVFPPUARQRPK-LJQANCHMSA-N 1 0 309.457 4.039 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000840939935 1047363384 /nfs/dbraw/zinc/36/33/84/1047363384.db2.gz ZUDIWFCMGFZQGM-GOSISDBHSA-N 1 0 316.489 4.033 20 10 DICDRO COc1c2ccccc2oc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840942049 1047364352 /nfs/dbraw/zinc/36/43/52/1047364352.db2.gz QNCHTEUJCRPZHG-UHFFFAOYSA-N 1 0 324.424 4.106 20 10 DICDRO COc1ccc(C2CCC([NH2+]CCc3ccc(N)cc3)CC2)cc1 ZINC000841036530 1047372663 /nfs/dbraw/zinc/37/26/63/1047372663.db2.gz UFXZJBHWTHPVAB-UHFFFAOYSA-N 1 0 324.468 4.136 20 10 DICDRO CC[NH2+]Cc1ccccc1NCc1ccc(N2CCCCC2)cc1 ZINC000841043232 1047375462 /nfs/dbraw/zinc/37/54/62/1047375462.db2.gz OFWTXNKPFJBNPZ-UHFFFAOYSA-N 1 0 323.484 4.399 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc3c(c2)CCCN3)c1O ZINC000841069909 1047378723 /nfs/dbraw/zinc/37/87/23/1047378723.db2.gz HHKUSWWUZYGWMV-UHFFFAOYSA-N 1 0 316.832 4.002 20 10 DICDRO CO[C@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccccc1 ZINC000841744486 1047447206 /nfs/dbraw/zinc/44/72/06/1047447206.db2.gz HYWOCFKLFIQXJM-SJKOYZFVSA-N 1 0 305.805 4.084 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(Cl)cc1[O-] ZINC000841748200 1047448063 /nfs/dbraw/zinc/44/80/63/1047448063.db2.gz IHRXTRSAYCCMLL-TZMCWYRMSA-N 1 0 309.837 4.188 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000841745648 1047448298 /nfs/dbraw/zinc/44/82/98/1047448298.db2.gz RTNCSZVWWYSTLC-GFCCVEGCSA-N 1 0 305.805 4.295 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1O ZINC000841750880 1047450011 /nfs/dbraw/zinc/45/00/11/1047450011.db2.gz KAXHMYJPMZWAIR-WDEREUQCSA-N 1 0 320.776 4.366 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)CO2 ZINC000841751124 1047450322 /nfs/dbraw/zinc/45/03/22/1047450322.db2.gz KVVQIWWRHBFGIO-NHYWBVRUSA-N 1 0 303.789 4.138 20 10 DICDRO C[C@@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccc(Cl)cc1O ZINC000841755257 1047452226 /nfs/dbraw/zinc/45/22/26/1047452226.db2.gz YKRYONTYFFCBAJ-LLVKDONJSA-N 1 0 322.811 4.419 20 10 DICDRO CSc1cc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)ccn1 ZINC000841760159 1047453213 /nfs/dbraw/zinc/45/32/13/1047453213.db2.gz RIMJTVZFIVFGQF-SNVBAGLBSA-N 1 0 308.834 4.013 20 10 DICDRO CSc1cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)ccn1 ZINC000841760158 1047453575 /nfs/dbraw/zinc/45/35/75/1047453575.db2.gz RIMJTVZFIVFGQF-JTQLQIEISA-N 1 0 308.834 4.013 20 10 DICDRO CC[C@H]([NH2+][C@@H]1COCc2ccccc21)c1cc(Cl)ccc1O ZINC000841758219 1047453634 /nfs/dbraw/zinc/45/36/34/1047453634.db2.gz ABMBTAMHNZWALI-DLBZAZTESA-N 1 0 317.816 4.358 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1O ZINC000841758003 1047453670 /nfs/dbraw/zinc/45/36/70/1047453670.db2.gz QXHOGJHTYPQFHN-WDEREUQCSA-N 1 0 320.776 4.366 20 10 DICDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841757281 1047453680 /nfs/dbraw/zinc/45/36/80/1047453680.db2.gz NCLWZBAMKHKDKT-SNUQEOBHSA-N 1 0 319.832 4.127 20 10 DICDRO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841760598 1047453704 /nfs/dbraw/zinc/45/37/04/1047453704.db2.gz SYCCRRZIVDXZAP-BZNIZROVSA-N 1 0 317.816 4.392 20 10 DICDRO CCN(C)c1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841758501 1047453714 /nfs/dbraw/zinc/45/37/14/1047453714.db2.gz GUFQRWDBJGNQIW-ZDUSSCGKSA-N 1 0 318.848 4.353 20 10 DICDRO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841762970 1047455137 /nfs/dbraw/zinc/45/51/37/1047455137.db2.gz LBHMKRJONVARIC-NEPJUHHUSA-N 1 0 307.825 4.235 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2COCc3ccccc32)c1O ZINC000841762070 1047455766 /nfs/dbraw/zinc/45/57/66/1047455766.db2.gz USQLQKMKIIPREZ-SJCJKPOMSA-N 1 0 317.816 4.276 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2[C@@H]2CCCOC2)cc1C(C)C ZINC000842612843 1047492780 /nfs/dbraw/zinc/49/27/80/1047492780.db2.gz PFXDFUZGRPAVNC-APWZRJJASA-N 1 0 317.473 4.215 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](c3cccnc3)C2)cc1C(C)C ZINC000842621439 1047492792 /nfs/dbraw/zinc/49/27/92/1047492792.db2.gz GEEOYRLWSMVRHW-QGZVFWFLSA-N 1 0 310.441 4.209 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]C2(c3ccccc3OC)CC2)cc1 ZINC000842900093 1047512230 /nfs/dbraw/zinc/51/22/30/1047512230.db2.gz FHSSBRHZEAVPSA-MRXNPFEDSA-N 1 0 324.468 4.491 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(CO)cc1)c1ccc(N2CCCCC2)cc1 ZINC000842892864 1047512730 /nfs/dbraw/zinc/51/27/30/1047512730.db2.gz HHJWYVNNUGUIOS-KRWDZBQOSA-N 1 0 324.468 4.020 20 10 DICDRO C[N@H+](CCOc1ccccc1)Cc1cccc(C(C)(C)C)c1O ZINC001143110858 1047532081 /nfs/dbraw/zinc/53/20/81/1047532081.db2.gz RRDPSAQIQQTLSW-UHFFFAOYSA-N 1 0 313.441 4.201 20 10 DICDRO C[N@H+](Cc1ccc(Cl)nc1)Cc1cccc(C(C)(C)C)c1O ZINC001143112749 1047532138 /nfs/dbraw/zinc/53/21/38/1047532138.db2.gz YPGGXRJQPTVQCI-UHFFFAOYSA-N 1 0 318.848 4.370 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CCC3(CCCOC3)CC2)c1O ZINC001143112524 1047532549 /nfs/dbraw/zinc/53/25/49/1047532549.db2.gz VLRYHUCACWMGMW-UHFFFAOYSA-N 1 0 317.473 4.082 20 10 DICDRO CC(C)(C)c1cccc(C[NH+]2CCC(c3ccccn3)CC2)c1O ZINC001143110458 1047532574 /nfs/dbraw/zinc/53/25/74/1047532574.db2.gz HDCKILHXIRXFOS-UHFFFAOYSA-N 1 0 324.468 4.464 20 10 DICDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H]2c2nccs2)c1O ZINC001143111508 1047532578 /nfs/dbraw/zinc/53/25/78/1047532578.db2.gz CFOLJGRDYOHUGJ-OAHLLOKOSA-N 1 0 316.470 4.483 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC001204381222 1047620898 /nfs/dbraw/zinc/62/08/98/1047620898.db2.gz ATAOWSCICDBIPA-KRWDZBQOSA-N 1 0 319.807 4.392 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCS[C@H](C)C1)c1ccc2ccccc2c1O ZINC000927035074 1047764690 /nfs/dbraw/zinc/76/46/90/1047764690.db2.gz ZYUUVIWTHYTHJX-NFAWXSAZSA-N 1 0 301.455 4.480 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2C[C@@H](OC(C)(C)C)C23CCC3)c1O ZINC001182902602 1047859405 /nfs/dbraw/zinc/85/94/05/1047859405.db2.gz OCCNRKOIXOLUJN-DLBZAZTESA-N 1 0 317.473 4.171 20 10 DICDRO C[N@H+](Cc1ccc(O)c(O)c1)Cc1cc(Cl)cc(Cl)c1 ZINC001203883386 1047875884 /nfs/dbraw/zinc/87/58/84/1047875884.db2.gz JQGDIGBNKMQULK-UHFFFAOYSA-N 1 0 312.196 4.037 20 10 DICDRO CN(C)c1ccc(C[N@H+](C)C[C@H]2CC2(C)C)c(C(F)(F)F)c1 ZINC001183075145 1047880963 /nfs/dbraw/zinc/88/09/63/1047880963.db2.gz OXPVFAZPULUKDV-CYBMUJFWSA-N 1 0 314.395 4.249 20 10 DICDRO CC[C@@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccc(F)cn1 ZINC000479443629 1047893497 /nfs/dbraw/zinc/89/34/97/1047893497.db2.gz ZCSSBDAMIRRRCI-MRXNPFEDSA-N 1 0 311.404 4.262 20 10 DICDRO Cc1cc(CC[NH2+][C@@H]2CC[C@@H]2C2CC2)c(C)n1-c1ccccc1 ZINC001183180580 1047901520 /nfs/dbraw/zinc/90/15/20/1047901520.db2.gz PFPLKCVLNJSMJS-NHCUHLMSSA-N 1 0 308.469 4.415 20 10 DICDRO Oc1ccc([C@H]2CC[N@H+](Cc3ccc4ccccc4c3O)C2)cc1 ZINC001183157045 1047903331 /nfs/dbraw/zinc/90/33/31/1047903331.db2.gz QQDVFBFWMSTJEE-KRWDZBQOSA-N 1 0 319.404 4.241 20 10 DICDRO Nc1ccc(N(c2ccccc2)c2ccc3c(c2)CC[NH2+]C3)cc1 ZINC001159703421 1047905396 /nfs/dbraw/zinc/90/53/96/1047905396.db2.gz IJNOOQVIKPVSDD-UHFFFAOYSA-N 1 0 315.420 4.384 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)cc1 ZINC001198271960 1047943130 /nfs/dbraw/zinc/94/31/30/1047943130.db2.gz YXQXMLWJOGCAOD-XISXUPMFSA-N 1 0 306.453 4.430 20 10 DICDRO Cc1cc(C[N@@H+]2CCC3(CCCC3)C2)c(O)cc1Br ZINC001250129019 1047963749 /nfs/dbraw/zinc/96/37/49/1047963749.db2.gz UPNUJAZXSCILCL-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO CC(C)Oc1cc[nH+]c(NCc2cc3ccccc3cc2O)c1 ZINC001160207465 1047997448 /nfs/dbraw/zinc/99/74/48/1047997448.db2.gz SBIMDBMMDODHCE-UHFFFAOYSA-N 1 0 308.381 4.340 20 10 DICDRO Nc1ccc(Nc2ccc3c(c2)CC[C@H]([NH+]2CCCC2)CC3)cc1 ZINC001160358307 1048038831 /nfs/dbraw/zinc/03/88/31/1048038831.db2.gz HLIGHYCQJJMWBF-OAQYLSRUSA-N 1 0 321.468 4.356 20 10 DICDRO CCC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCCc2cccnc21 ZINC000775996660 1048079932 /nfs/dbraw/zinc/07/99/32/1048079932.db2.gz QJABTXUWUPZKAP-HXUWFJFHSA-N 1 0 323.484 4.437 20 10 DICDRO Cc1cc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)ccc1N(C)C ZINC001174983544 1048080675 /nfs/dbraw/zinc/08/06/75/1048080675.db2.gz IUGUPORGJDBLFY-LJQANCHMSA-N 1 0 309.457 4.039 20 10 DICDRO CCOCCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000776003604 1048084349 /nfs/dbraw/zinc/08/43/49/1048084349.db2.gz JRQFOHJLACIJID-KRWDZBQOSA-N 1 0 313.441 4.382 20 10 DICDRO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000776013666 1048088564 /nfs/dbraw/zinc/08/85/64/1048088564.db2.gz MXCBWDZYUQZNPQ-YPMHNXCESA-N 1 0 318.358 4.055 20 10 DICDRO Cc1cccc(C[NH+]2CCC(c3ccc(N(C)C)cc3)CC2)c1O ZINC000776014970 1048089134 /nfs/dbraw/zinc/08/91/34/1048089134.db2.gz SVLAQDQKDPKMGS-UHFFFAOYSA-N 1 0 324.468 4.146 20 10 DICDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c1O ZINC000776023919 1048102088 /nfs/dbraw/zinc/10/20/88/1048102088.db2.gz LQIYZYORVIKRTM-MEBBXXQBSA-N 1 0 305.805 4.360 20 10 DICDRO Cc1cccc(C[NH2+]CCc2c[nH]c3cc(Cl)ccc23)c1O ZINC000776121770 1048151250 /nfs/dbraw/zinc/15/12/50/1048151250.db2.gz YGEYXYYDCMJTHB-UHFFFAOYSA-N 1 0 314.816 4.168 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000809782688 1048202343 /nfs/dbraw/zinc/20/23/43/1048202343.db2.gz DJXVKXZYEANBHI-KRWDZBQOSA-N 1 0 317.454 4.436 20 10 DICDRO CCOc1cccc(CC[NH2+]Cc2c(C)c3ccccc3n2C)c1 ZINC001201535635 1048299601 /nfs/dbraw/zinc/29/96/01/1048299601.db2.gz GUYNZXQXHSBGAL-UHFFFAOYSA-N 1 0 322.452 4.218 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H](c2ccccc2)O1)c1ccccc1O ZINC001175418915 1048301548 /nfs/dbraw/zinc/30/15/48/1048301548.db2.gz PWNJAZLTHSKGLR-RIFZZMRRSA-N 1 0 311.425 4.353 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@H]2CCC[C@H]2OC)cc1 ZINC001201715062 1048353519 /nfs/dbraw/zinc/35/35/19/1048353519.db2.gz UUOVTUALZOKRDL-UYAOXDASSA-N 1 0 318.505 4.218 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCCOc3c(F)cccc32)cc1C ZINC001201733749 1048372526 /nfs/dbraw/zinc/37/25/26/1048372526.db2.gz AIVCGRZPIVDSSF-KRWDZBQOSA-N 1 0 315.388 4.146 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCC2Cc3ccccc3C2)cc1 ZINC001202009851 1048417066 /nfs/dbraw/zinc/41/70/66/1048417066.db2.gz LHMBLTIEKQYYTK-UHFFFAOYSA-N 1 0 322.496 4.428 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cc1 ZINC000775134068 1048417389 /nfs/dbraw/zinc/41/73/89/1048417389.db2.gz BPEPTUQOCFUWTO-HNNXBMFYSA-N 1 0 314.395 4.307 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)c1O ZINC000775137568 1048424697 /nfs/dbraw/zinc/42/46/97/1048424697.db2.gz PCVOAIZTJFVVIV-JTQLQIEISA-N 1 0 307.743 4.128 20 10 DICDRO CCCN(Cc1cc(Cl)cc(F)c1O)c1ccc(C[NH3+])cc1 ZINC000775139705 1048428300 /nfs/dbraw/zinc/42/83/00/1048428300.db2.gz FFUHPLQBMLSCKQ-UHFFFAOYSA-N 1 0 322.811 4.060 20 10 DICDRO CCCN(Cc1cc(F)cc2cccnc21)c1ccc(C[NH3+])cc1 ZINC000775139454 1048428964 /nfs/dbraw/zinc/42/89/64/1048428964.db2.gz BARBZASBLZAYEN-UHFFFAOYSA-N 1 0 323.415 4.249 20 10 DICDRO CCCN(Cc1csc(C(C)(C)C)n1)c1ccc(C[NH3+])cc1 ZINC000775140645 1048431032 /nfs/dbraw/zinc/43/10/32/1048431032.db2.gz OHISWRUFNVBPJX-UHFFFAOYSA-N 1 0 317.502 4.316 20 10 DICDRO Cc1ccc(C)n1-c1ccc(N[C@@H]2C[NH2+]Cc3ccsc32)cc1 ZINC001163227902 1048440744 /nfs/dbraw/zinc/44/07/44/1048440744.db2.gz FFEQZDVFXIJUHN-GOSISDBHSA-N 1 0 323.465 4.412 20 10 DICDRO Cc1cccc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)c1O ZINC000776251416 1048465582 /nfs/dbraw/zinc/46/55/82/1048465582.db2.gz WMRBXABFZURNCI-QGZVFWFLSA-N 1 0 309.409 4.237 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCc3cc(F)ccc3[C@H]2C)cc1 ZINC001175882725 1048471222 /nfs/dbraw/zinc/47/12/22/1048471222.db2.gz KLMCQDYMEOVTPU-OAHLLOKOSA-N 1 0 312.432 4.401 20 10 DICDRO C[C@]1(CC[NH2+]Cc2ccc3c(c2)CCCO3)CC1(Cl)Cl ZINC001202417956 1048545237 /nfs/dbraw/zinc/54/52/37/1048545237.db2.gz PPUVSVNJCVUBLC-HNNXBMFYSA-N 1 0 314.256 4.075 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1O)c1nc(-c2ccccc2)cs1 ZINC000107321742 1048579487 /nfs/dbraw/zinc/57/94/87/1048579487.db2.gz VWQQWTVFKGLYRT-CYBMUJFWSA-N 1 0 310.422 4.367 20 10 DICDRO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000780747333 1048589097 /nfs/dbraw/zinc/58/90/97/1048589097.db2.gz XDVIBUVQIUBXGH-JENIJYKNSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccc(N(C)C)cc1 ZINC000237508055 1048606883 /nfs/dbraw/zinc/60/68/83/1048606883.db2.gz SMYNCJZQFTWYRD-CYBMUJFWSA-N 1 0 320.383 4.205 20 10 DICDRO COc1cc(C[NH2+]CCCC(F)(F)F)c(O)c(C(C)(C)C)c1 ZINC000850168352 1048620224 /nfs/dbraw/zinc/62/02/24/1048620224.db2.gz PBYPTTHAWKNWAO-UHFFFAOYSA-N 1 0 319.367 4.130 20 10 DICDRO C[C@@H]([NH2+]Cc1ccccc1Br)c1ccccc1O ZINC000042419180 1048627959 /nfs/dbraw/zinc/62/79/59/1048627959.db2.gz HYQOBGDMNWRNEW-LLVKDONJSA-N 1 0 306.203 4.006 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]Cc1cccc(OC2CC2)c1F ZINC000850365517 1048640867 /nfs/dbraw/zinc/64/08/67/1048640867.db2.gz RTMRMSGFYKSIKB-UHFFFAOYSA-N 1 0 321.779 4.016 20 10 DICDRO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CCCCC3)cc1)CC2 ZINC000850387443 1048646296 /nfs/dbraw/zinc/64/62/96/1048646296.db2.gz QXXZDJMSZUXDRI-NRFANRHFSA-N 1 0 322.452 4.160 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2cc3cnccc3o2)ccc1N(C)C ZINC000850443994 1048658556 /nfs/dbraw/zinc/65/85/56/1048658556.db2.gz PGRUGCIZZMPXPZ-CQSZACIVSA-N 1 0 309.413 4.053 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc2c(c1)CCCO2 ZINC000850463604 1048666071 /nfs/dbraw/zinc/66/60/71/1048666071.db2.gz WLTDXHOMOKVXTR-JKSUJKDBSA-N 1 0 324.468 4.489 20 10 DICDRO COC1CC(CC[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000850481262 1048668454 /nfs/dbraw/zinc/66/84/54/1048668454.db2.gz IKGSIZDQMJBSPC-VXESANQCSA-N 1 0 316.489 4.143 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ccc2ccccc2c1O ZINC000850481070 1048669503 /nfs/dbraw/zinc/66/95/03/1048669503.db2.gz HEHBPUGJNUEYOD-GOEBONIOSA-N 1 0 312.457 4.069 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(F)cc2C)c1O ZINC000850495195 1048670301 /nfs/dbraw/zinc/67/03/01/1048670301.db2.gz YEEFIZNXVMXQQX-UONOGXRCSA-N 1 0 317.404 4.130 20 10 DICDRO Oc1cccc2c1[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)CC2 ZINC000850482357 1048670583 /nfs/dbraw/zinc/67/05/83/1048670583.db2.gz ROUJAUIRKXIBHP-CQSZACIVSA-N 1 0 308.208 4.476 20 10 DICDRO C[C@H](C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2)c1ccccn1 ZINC000850482967 1048671217 /nfs/dbraw/zinc/67/12/17/1048671217.db2.gz SZBFWHZRKFKMJA-HUUCEWRRSA-N 1 0 310.441 4.120 20 10 DICDRO CC[C@H]([NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)c1cccs1 ZINC000850488206 1048671436 /nfs/dbraw/zinc/67/14/36/1048671436.db2.gz LVNNYKCVGXGCGL-YOEHRIQHSA-N 1 0 316.470 4.076 20 10 DICDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccccn1)c1cc(Cl)ccc1O ZINC000850482371 1048671451 /nfs/dbraw/zinc/67/14/51/1048671451.db2.gz OVMTWXJUODDKGZ-IUODEOHRSA-N 1 0 304.821 4.285 20 10 DICDRO C[C@H]([NH2+][C@@H]1COC2(CCC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000850526781 1048680667 /nfs/dbraw/zinc/68/06/67/1048680667.db2.gz WKRFXSPUJJCLAN-WMZOPIPTSA-N 1 0 314.473 4.039 20 10 DICDRO CC[C@H]([NH2+][C@H]1C[C@@H](O)c2ccccc21)c1cc(Cl)ccc1O ZINC000850527548 1048680798 /nfs/dbraw/zinc/68/07/98/1048680798.db2.gz GUQCHYDSZQSAHG-XYJFISCASA-N 1 0 317.816 4.265 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc(Cl)cc1O ZINC000850542172 1048687338 /nfs/dbraw/zinc/68/73/38/1048687338.db2.gz ISULCAOYSQJKBY-MGPLVRAMSA-N 1 0 303.789 4.089 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)c1O ZINC000850542108 1048687559 /nfs/dbraw/zinc/68/75/59/1048687559.db2.gz HTTHMIMWCXXDEL-PIGZYNQJSA-N 1 0 317.816 4.398 20 10 DICDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(O)cc32)c2c1c(F)ccc2O ZINC000850543483 1048687673 /nfs/dbraw/zinc/68/76/73/1048687673.db2.gz KJTWDOICMNULJS-UHNFBRDESA-N 1 0 313.372 4.062 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc2ccccc2c1O ZINC000850553099 1048689420 /nfs/dbraw/zinc/68/94/20/1048689420.db2.gz RSBLZAZPVFMOCD-XHDPSFHLSA-N 1 0 305.368 4.487 20 10 DICDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2nsc3ccccc23)c1 ZINC000850559622 1048691089 /nfs/dbraw/zinc/69/10/89/1048691089.db2.gz FSAGKEHUMNTSLD-CYBMUJFWSA-N 1 0 312.438 4.204 20 10 DICDRO CC[C@H]([NH2+]CCc1nsc2ccccc12)c1ccccc1O ZINC000850559351 1048691143 /nfs/dbraw/zinc/69/11/43/1048691143.db2.gz AVIRAFZEZBUSGX-HNNXBMFYSA-N 1 0 312.438 4.285 20 10 DICDRO C[C@H]([NH2+]CCC1SCCS1)c1cc2c(cc1O)CCCC2 ZINC000850569811 1048696459 /nfs/dbraw/zinc/69/64/59/1048696459.db2.gz CAMKRJRSDCBGMY-LBPRGKRZSA-N 1 0 323.527 4.118 20 10 DICDRO C[C@@H]([NH2+]CCC1SCCS1)c1ccc2ccccc2c1O ZINC000850570836 1048697879 /nfs/dbraw/zinc/69/78/79/1048697879.db2.gz MRBXIEZQCHRQEM-GFCCVEGCSA-N 1 0 319.495 4.392 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3c(C)cccc32)c1 ZINC000850573440 1048699423 /nfs/dbraw/zinc/69/94/23/1048699423.db2.gz LXPJWXNLXBRUFK-LIRRHRJNSA-N 1 0 311.425 4.437 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCc3c(C)cccc32)c1O ZINC000850573783 1048699448 /nfs/dbraw/zinc/69/94/48/1048699448.db2.gz RATZUYIIMXFNBX-KSSFIOAISA-N 1 0 311.425 4.437 20 10 DICDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3c(C)cccc32)c1 ZINC000850573437 1048699668 /nfs/dbraw/zinc/69/96/68/1048699668.db2.gz LXPJWXNLXBRUFK-AUUYWEPGSA-N 1 0 311.425 4.437 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H](C)O)c1O ZINC000850582384 1048702109 /nfs/dbraw/zinc/70/21/09/1048702109.db2.gz FNAOVISMMXDPSC-AHIWAGSCSA-N 1 0 319.832 4.127 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c1C ZINC000850579760 1048702186 /nfs/dbraw/zinc/70/21/86/1048702186.db2.gz ZWENSTQQACTYLW-GFCCVEGCSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CC(C)(C)O2)c1ccc(N(C)C)cc1 ZINC000775364434 1048704092 /nfs/dbraw/zinc/70/40/92/1048704092.db2.gz QOHHFIHWZVPJKT-HNNXBMFYSA-N 1 0 324.468 4.317 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccsc2)ccc1N(C)C ZINC001190348636 1048721265 /nfs/dbraw/zinc/72/12/65/1048721265.db2.gz MSDBYPXLFZHSNT-SFHVURJKSA-N 1 0 300.471 4.460 20 10 DICDRO CO[C@@H](c1ccccc1F)[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000776498589 1048723134 /nfs/dbraw/zinc/72/31/34/1048723134.db2.gz OQCSGXDNVFCKGJ-PIGZYNQJSA-N 1 0 323.795 4.051 20 10 DICDRO Nc1ccc(C[NH+]2CCC(Cc3cccc(Cl)c3)CC2)cc1 ZINC001206711554 1048725350 /nfs/dbraw/zinc/72/53/50/1048725350.db2.gz KJZQOKZBVFIZPL-UHFFFAOYSA-N 1 0 314.860 4.377 20 10 DICDRO COc1ccc(N2CCC[N@@H+]([C@H]3C=CCCCCC3)CC2)cc1 ZINC001190448115 1048742245 /nfs/dbraw/zinc/74/22/45/1048742245.db2.gz XJCJRUGYBARHBE-SFHVURJKSA-N 1 0 314.473 4.096 20 10 DICDRO Cc1cc(C[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)ccc1N(C)C ZINC001191003924 1048819161 /nfs/dbraw/zinc/81/91/61/1048819161.db2.gz MEBZZALPFATAHD-FXAWDEMLSA-N 1 0 308.469 4.439 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCCCc2ccccc2)cc1 ZINC001177153640 1048839785 /nfs/dbraw/zinc/83/97/85/1048839785.db2.gz VBFBGCYHTXEXGC-XYOKQWHBSA-N 1 0 308.469 4.378 20 10 DICDRO COc1cc(C[NH2+][C@H](C)Cc2ccco2)c(O)c(C(C)(C)C)c1 ZINC001177235279 1048851369 /nfs/dbraw/zinc/85/13/69/1048851369.db2.gz BMNYNPGPFMBTIF-CYBMUJFWSA-N 1 0 317.429 4.012 20 10 DICDRO COc1cc(C[NH2+][C@@H](C)CC2CCC2)c(O)c(C(C)(C)C)c1 ZINC001203288877 1048857865 /nfs/dbraw/zinc/85/78/65/1048857865.db2.gz FQTJJQRSVOVTIJ-ZDUSSCGKSA-N 1 0 305.462 4.367 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2nccc3c2CCCC3)cc1 ZINC001177328897 1048873273 /nfs/dbraw/zinc/87/32/73/1048873273.db2.gz UVIANHWCAFSUDF-UHFFFAOYSA-N 1 0 323.484 4.096 20 10 DICDRO CCOc1cccc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)c1O ZINC000853091777 1048879284 /nfs/dbraw/zinc/87/92/84/1048879284.db2.gz RBVINOZGRCIDSN-HXUWFJFHSA-N 1 0 311.425 4.206 20 10 DICDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccc2c(c1)CCCO2 ZINC000853094751 1048882879 /nfs/dbraw/zinc/88/28/79/1048882879.db2.gz MQIBXTBUXVBSAZ-LBPRGKRZSA-N 1 0 317.816 4.221 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc2c(c1)CCCO2 ZINC000853239729 1048889234 /nfs/dbraw/zinc/88/92/34/1048889234.db2.gz CTFQSXUVSYKIII-SUMWQHHRSA-N 1 0 309.409 4.055 20 10 DICDRO COc1cccc([C@H](C)[NH2+]CC(C)(C)CC(F)(F)F)c1O ZINC000853240575 1048892148 /nfs/dbraw/zinc/89/21/48/1048892148.db2.gz KSNHJAFQACIVOV-JTQLQIEISA-N 1 0 305.340 4.030 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C2(CO)CCCCCCC2)cc1 ZINC001203421824 1048898418 /nfs/dbraw/zinc/89/84/18/1048898418.db2.gz GAJABYOTKZDHLS-UHFFFAOYSA-N 1 0 318.505 4.098 20 10 DICDRO CCc1cc(C[N@H+](C)CC2=CCCOC2)c(O)c(C(C)(C)C)c1 ZINC000853561839 1048910758 /nfs/dbraw/zinc/91/07/58/1048910758.db2.gz SJEKFUSHTGXSDC-UHFFFAOYSA-N 1 0 317.473 4.031 20 10 DICDRO Oc1cc2c(cc1C[N@@H+]1CC3(CCC3)[C@@H]1c1ccncc1)CCC2 ZINC000853629397 1048911706 /nfs/dbraw/zinc/91/17/06/1048911706.db2.gz JLXAWSYBSCPCOY-FQEVSTJZSA-N 1 0 320.436 4.003 20 10 DICDRO CCC[N@H+](Cc1ccc(N(C)CC)cc1)Cc1ccccc1O ZINC001191289554 1048916783 /nfs/dbraw/zinc/91/67/83/1048916783.db2.gz PNTPIUGTBGAOPM-UHFFFAOYSA-N 1 0 312.457 4.261 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)c(C)c1)[C@@H](C)c1cccc(O)c1 ZINC001191297982 1048918055 /nfs/dbraw/zinc/91/80/55/1048918055.db2.gz UPUGFFKUTBYDCQ-INIZCTEOSA-N 1 0 312.457 4.350 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC001177673856 1048927737 /nfs/dbraw/zinc/92/77/37/1048927737.db2.gz AEBWIRWILMFIAK-UHFFFAOYSA-N 1 0 314.448 4.268 20 10 DICDRO CCOc1cccc(C[N@H+](C)CCc2cccc(Cl)c2)c1O ZINC001203608957 1048940102 /nfs/dbraw/zinc/94/01/02/1048940102.db2.gz CJALBXZJWGYXAN-UHFFFAOYSA-N 1 0 319.832 4.119 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C2CCSCC2)cc1 ZINC001177753849 1048940988 /nfs/dbraw/zinc/94/09/88/1048940988.db2.gz SUGHQPCZSNXHQX-UHFFFAOYSA-N 1 0 306.519 4.298 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c(O)c1 ZINC001203630546 1048945356 /nfs/dbraw/zinc/94/53/56/1048945356.db2.gz UPTQYRDJXNAZQU-KRWDZBQOSA-N 1 0 317.816 4.391 20 10 DICDRO Oc1ccc(Cl)cc1C[NH+]1CCC2(CC(F)(F)C2)CC1 ZINC001203651855 1048948738 /nfs/dbraw/zinc/94/87/38/1048948738.db2.gz YHQJWKUWSPRJPU-UHFFFAOYSA-N 1 0 301.764 4.057 20 10 DICDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC001203657788 1048950160 /nfs/dbraw/zinc/95/01/60/1048950160.db2.gz NJSLCCZNYIBBGO-MRXNPFEDSA-N 1 0 317.816 4.391 20 10 DICDRO Cc1ccccc1O[C@@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203657523 1048951632 /nfs/dbraw/zinc/95/16/32/1048951632.db2.gz LVXBDWXVCWWZSQ-MRXNPFEDSA-N 1 0 317.816 4.007 20 10 DICDRO Cc1ccc(C[C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)c(C)c1 ZINC001177844761 1048953490 /nfs/dbraw/zinc/95/34/90/1048953490.db2.gz VOFWIEFFETWMLV-KRWDZBQOSA-N 1 0 309.453 4.349 20 10 DICDRO CC[N@@H+](Cc1cc(Cl)ccc1O)Cc1cccc(F)c1F ZINC001203664444 1048953486 /nfs/dbraw/zinc/95/34/86/1048953486.db2.gz FNCLMUAJAREMDH-UHFFFAOYSA-N 1 0 311.759 4.346 20 10 DICDRO COc1cccc([C@H]2CC[N@H+](Cc3cc(Cl)ccc3O)C2)c1 ZINC001203664726 1048954197 /nfs/dbraw/zinc/95/41/97/1048954197.db2.gz SHJGSXAEIGRPOC-AWEZNQCLSA-N 1 0 317.816 4.044 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1cccc(Cl)c1[O-] ZINC000854227459 1048954391 /nfs/dbraw/zinc/95/43/91/1048954391.db2.gz STBIKAFVSJVOOD-IAGOWNOFSA-N 1 0 316.832 4.356 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1cc2c(cc1O)CCCC2 ZINC000854225488 1048954447 /nfs/dbraw/zinc/95/44/47/1048954447.db2.gz GJZXIUYVMHIJBG-RNODOKPDSA-N 1 0 322.452 4.191 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1cccc(Cl)c1[O-] ZINC000854227456 1048955711 /nfs/dbraw/zinc/95/57/11/1048955711.db2.gz STBIKAFVSJVOOD-DLBZAZTESA-N 1 0 316.832 4.356 20 10 DICDRO CS[C@@H]1CCC[C@@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC001177860140 1048955936 /nfs/dbraw/zinc/95/59/36/1048955936.db2.gz RTIQJDJSFUONFX-WXFDERKXSA-N 1 0 304.503 4.030 20 10 DICDRO CC[C@@](C)([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1 ZINC001177885809 1048958312 /nfs/dbraw/zinc/95/83/12/1048958312.db2.gz SYVVPKSRXKQXPS-LJQANCHMSA-N 1 0 318.411 4.446 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]CCc1c(F)cccc1Cl ZINC001177977265 1048976986 /nfs/dbraw/zinc/97/69/86/1048976986.db2.gz WEDNSWDXXGBPLG-UHFFFAOYSA-N 1 0 314.187 4.170 20 10 DICDRO CC[C@H]([NH2+][C@H](C)COc1cccc(F)c1)c1ccccc1O ZINC000775491263 1049013355 /nfs/dbraw/zinc/01/33/55/1049013355.db2.gz HAGYLFRUYCNGRN-DYVFJYSZSA-N 1 0 303.377 4.040 20 10 DICDRO CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@@H]2CC(C)C)c1[O-] ZINC001191898635 1049016159 /nfs/dbraw/zinc/01/61/59/1049016159.db2.gz DUMQCFBSHANPOX-MRXNPFEDSA-N 1 0 307.409 4.135 20 10 DICDRO CC[C@@H]([NH2+]CCc1nc(C)cs1)c1cc(Cl)ccc1O ZINC000775492047 1049017570 /nfs/dbraw/zinc/01/75/70/1049017570.db2.gz KXRIGRKBKOIISW-CYBMUJFWSA-N 1 0 310.850 4.094 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](OC)c1ccccc1)c1cc(Cl)ccc1O ZINC000775493877 1049025217 /nfs/dbraw/zinc/02/52/17/1049025217.db2.gz VYLIAEZCUZAJLJ-AEFFLSMTSA-N 1 0 319.832 4.474 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2ncsc2c1 ZINC000776806800 1049025756 /nfs/dbraw/zinc/02/57/56/1049025756.db2.gz CMWFGKFBPMXOCE-LBPRGKRZSA-N 1 0 310.422 4.082 20 10 DICDRO COc1ccc([C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CCC2)cc1 ZINC001203906556 1049028659 /nfs/dbraw/zinc/02/86/59/1049028659.db2.gz HHRCURMDQBDFBM-NRFANRHFSA-N 1 0 323.436 4.261 20 10 DICDRO CC[C@H]([NH2+][C@H](C)CCc1ccc(OC)cc1)c1ccccc1O ZINC000775497066 1049028641 /nfs/dbraw/zinc/02/86/41/1049028641.db2.gz MEFRCBBQAKUXLW-BEFAXECRSA-N 1 0 313.441 4.463 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2ncsc2c1 ZINC000776809053 1049030177 /nfs/dbraw/zinc/03/01/77/1049030177.db2.gz XAUWFMYJHKZIOR-ZDUSSCGKSA-N 1 0 311.454 4.213 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H](c2cccs2)C2CC2)cc1F ZINC000113316736 1049031975 /nfs/dbraw/zinc/03/19/75/1049031975.db2.gz KOIJUAPQNKHBPC-QGZVFWFLSA-N 1 0 304.434 4.194 20 10 DICDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)ccc1OC ZINC001178448721 1049033456 /nfs/dbraw/zinc/03/34/56/1049033456.db2.gz ACUUITIEVSMLTA-IIDMSEBBSA-N 1 0 305.462 4.146 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(F)cc2C(F)(F)F)c1 ZINC000113321961 1049033427 /nfs/dbraw/zinc/03/34/27/1049033427.db2.gz WVDSKDFAQHMOTO-UHFFFAOYSA-N 1 0 313.294 4.148 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2csc(-c3ccccc3)n2)c1 ZINC000113329433 1049033534 /nfs/dbraw/zinc/03/35/34/1049033534.db2.gz WQALBBVWQNXXPF-UHFFFAOYSA-N 1 0 310.422 4.114 20 10 DICDRO CC[C@H]([NH2+]CCc1c[nH]c2cc(C)ccc12)c1ccccc1O ZINC000775500038 1049034274 /nfs/dbraw/zinc/03/42/74/1049034274.db2.gz MKYRNENPEFWOIP-SFHVURJKSA-N 1 0 308.425 4.465 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCc3ccsc3C2)cc1 ZINC001203939647 1049034601 /nfs/dbraw/zinc/03/46/01/1049034601.db2.gz SCMIJXXTLPFAQE-UHFFFAOYSA-N 1 0 300.471 4.153 20 10 DICDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)c1 ZINC001203937924 1049034924 /nfs/dbraw/zinc/03/49/24/1049034924.db2.gz ZTPNTVYQLOROFJ-HXUWFJFHSA-N 1 0 310.441 4.098 20 10 DICDRO COc1ccc(C2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)cc1 ZINC001203933718 1049035155 /nfs/dbraw/zinc/03/51/55/1049035155.db2.gz GVNHKAWLGALXDZ-UHFFFAOYSA-N 1 0 324.468 4.141 20 10 DICDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2Cc2ccccn2)cc1 ZINC001203939419 1049035935 /nfs/dbraw/zinc/03/59/35/1049035935.db2.gz QAHDQUXYTOVWSO-NRFANRHFSA-N 1 0 323.484 4.135 20 10 DICDRO CC[C@H]([NH2+][C@H](Cn1cccn1)c1ccccc1)c1ccccc1O ZINC000775509971 1049045833 /nfs/dbraw/zinc/04/58/33/1049045833.db2.gz STGZUPAWCPEDSR-RBUKOAKNSA-N 1 0 321.424 4.071 20 10 DICDRO CCc1cnc(CC[NH2+][C@H](CC)c2cc(Cl)ccc2O)s1 ZINC000775508056 1049046657 /nfs/dbraw/zinc/04/66/57/1049046657.db2.gz HHRUCQZQKIZUIK-CQSZACIVSA-N 1 0 324.877 4.348 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](OC)c1ccc(Cl)cc1)c1ccccc1O ZINC000775508015 1049047598 /nfs/dbraw/zinc/04/75/98/1049047598.db2.gz GTOGXABPZAPMEF-AEFFLSMTSA-N 1 0 319.832 4.474 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](O)c1ccccc1C)c1cc(Cl)ccc1O ZINC000775503913 1049047785 /nfs/dbraw/zinc/04/77/85/1049047785.db2.gz PRQNUSZLJZQDOI-AEFFLSMTSA-N 1 0 319.832 4.128 20 10 DICDRO CCOc1ccc(C[N@H+](CC)Cc2ccc(N(C)C)cc2)cc1 ZINC001203971398 1049048058 /nfs/dbraw/zinc/04/80/58/1049048058.db2.gz ZQBJWKRDMMEILO-UHFFFAOYSA-N 1 0 312.457 4.173 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]2OCC[C@@H]21)c1cc(Cl)ccc1O ZINC000775513538 1049049364 /nfs/dbraw/zinc/04/93/64/1049049364.db2.gz LACQCIHVUZCOFU-JWDQPFGJSA-N 1 0 309.837 4.044 20 10 DICDRO C[C@@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC001178523993 1049050478 /nfs/dbraw/zinc/05/04/78/1049050478.db2.gz DSKCALFYFBCVCS-ISZGNANSSA-N 1 0 316.395 4.395 20 10 DICDRO CC[C@H]([NH2+]CC1(CCOC)CCC1)c1cc(Cl)ccc1O ZINC000775513405 1049051731 /nfs/dbraw/zinc/05/17/31/1049051731.db2.gz IDYMKORNDRFBDJ-HNNXBMFYSA-N 1 0 311.853 4.293 20 10 DICDRO C[C@H](CC[NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1 ZINC001178583926 1049056695 /nfs/dbraw/zinc/05/66/95/1049056695.db2.gz BDHBAIRNHWXBTR-CQSZACIVSA-N 1 0 318.411 4.314 20 10 DICDRO CC[C@H]([NH2+]C[C@@]1(C)CCCC[C@H]1O)c1cc(Cl)ccc1O ZINC000775512453 1049057993 /nfs/dbraw/zinc/05/79/93/1049057993.db2.gz PRNFZSZMDKRQFI-USXIJHARSA-N 1 0 311.853 4.028 20 10 DICDRO Fc1ccc([C@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC001178623902 1049066554 /nfs/dbraw/zinc/06/65/54/1049066554.db2.gz BSSCWTDXTYPTKF-QFBILLFUSA-N 1 0 311.400 4.187 20 10 DICDRO Clc1cccc(CCC[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001178609651 1049067553 /nfs/dbraw/zinc/06/75/53/1049067553.db2.gz IYENRFKWELXKSB-UHFFFAOYSA-N 1 0 315.844 4.387 20 10 DICDRO C[N@H+](Cc1c[nH]c2ccccc12)Cc1ccc(N2CCCC2)cc1 ZINC001204043697 1049070290 /nfs/dbraw/zinc/07/02/90/1049070290.db2.gz XUEZQGGJZLNXJI-UHFFFAOYSA-N 1 0 319.452 4.400 20 10 DICDRO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Cl)ccc1O ZINC000775520696 1049072069 /nfs/dbraw/zinc/07/20/69/1049072069.db2.gz VTRQBSLYHNKQLC-AWEZNQCLSA-N 1 0 320.776 4.195 20 10 DICDRO CC[C@@H]([NH2+]CC(C)(C)c1ccc(OC)cc1)c1ccccc1O ZINC000775518900 1049073963 /nfs/dbraw/zinc/07/39/63/1049073963.db2.gz IHQAQUFPLSDHEV-GOSISDBHSA-N 1 0 313.441 4.419 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2cccc(C)n2)cc1 ZINC000773764601 1049076761 /nfs/dbraw/zinc/07/67/61/1049076761.db2.gz ABSLBGZOMCNMCR-FQEVSTJZSA-N 1 0 309.457 4.183 20 10 DICDRO CC[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccccc1O ZINC000775522158 1049077400 /nfs/dbraw/zinc/07/74/00/1049077400.db2.gz KQYDYOORMNAQJS-HUUCEWRRSA-N 1 0 303.789 4.220 20 10 DICDRO CCOC[C@H]1CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000113923659 1049078109 /nfs/dbraw/zinc/07/81/09/1049078109.db2.gz BQYLTPFPNMCISV-INIZCTEOSA-N 1 0 305.462 4.073 20 10 DICDRO CC[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000775521803 1049080323 /nfs/dbraw/zinc/08/03/23/1049080323.db2.gz BCGNBGSHQCYHNW-DZGCQCFKSA-N 1 0 309.837 4.188 20 10 DICDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl)C1(C)CC1 ZINC000776882913 1049090427 /nfs/dbraw/zinc/09/04/27/1049090427.db2.gz KFBBQVICDXGECA-UONOGXRCSA-N 1 0 322.880 4.016 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)cc(OC)c1)c1cc(Cl)ccc1O ZINC000775526350 1049094920 /nfs/dbraw/zinc/09/49/20/1049094920.db2.gz QYZIMNGCJBOUDB-INIZCTEOSA-N 1 0 323.795 4.434 20 10 DICDRO CC[C@H]([NH2+][C@H](CO)C1CCCCC1)c1cc(Cl)ccc1O ZINC000775527689 1049096722 /nfs/dbraw/zinc/09/67/22/1049096722.db2.gz SMVYBSWEISVLDL-JKSUJKDBSA-N 1 0 311.853 4.028 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1cncc(Cl)c1)C1CCCC1 ZINC000856725587 1049099380 /nfs/dbraw/zinc/09/93/80/1049099380.db2.gz NFRPPKSSKRMCRD-UHFFFAOYSA-N 1 0 316.832 4.385 20 10 DICDRO C[C@H]1CC[C@H](C)[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001204163206 1049100300 /nfs/dbraw/zinc/10/03/00/1049100300.db2.gz QAOCLHKTOMJGJB-STQMWFEESA-N 1 0 314.395 4.392 20 10 DICDRO COc1ccc(O)c(C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)c1 ZINC000114505762 1049100611 /nfs/dbraw/zinc/10/06/11/1049100611.db2.gz URBNLVVSSDIIFZ-UHFFFAOYSA-N 1 0 323.392 4.259 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1cc(Cl)ccc1O ZINC000775525708 1049101032 /nfs/dbraw/zinc/10/10/32/1049101032.db2.gz MJKCQMCYXOJGHV-MFKMUULPSA-N 1 0 322.840 4.089 20 10 DICDRO CCN(C)c1ccc(C[NH2+]C2(c3nccs3)CCCC2)cc1 ZINC000773779711 1049104221 /nfs/dbraw/zinc/10/42/21/1049104221.db2.gz FYNOAVZNMMTURY-UHFFFAOYSA-N 1 0 315.486 4.158 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@](C)(CC)c2nc(C)cs2)cc1 ZINC000773787366 1049115827 /nfs/dbraw/zinc/11/58/27/1049115827.db2.gz OMPBEMJWLONTMP-SFHVURJKSA-N 1 0 317.502 4.323 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@@](C)(CF)C2)c2ccccc21 ZINC001204232632 1049116493 /nfs/dbraw/zinc/11/64/93/1049116493.db2.gz GWRJEDJTDBANRG-IBGZPJMESA-N 1 0 300.421 4.087 20 10 DICDRO COc1ccc(O)c(C[N@H+](Cc2ccc(C)c(C)c2)C2CC2)c1 ZINC001204237791 1049117942 /nfs/dbraw/zinc/11/79/42/1049117942.db2.gz OARRGTHPQGDWCW-UHFFFAOYSA-N 1 0 311.425 4.182 20 10 DICDRO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204240357 1049118496 /nfs/dbraw/zinc/11/84/96/1049118496.db2.gz PXAFSVHCYNWIOR-INIZCTEOSA-N 1 0 319.452 4.284 20 10 DICDRO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204240358 1049118740 /nfs/dbraw/zinc/11/87/40/1049118740.db2.gz PXAFSVHCYNWIOR-MRXNPFEDSA-N 1 0 319.452 4.284 20 10 DICDRO CN(C)c1ccc(/C=C\C[N@H+](Cc2ccccc2)C2CC2)cc1 ZINC001204251413 1049121686 /nfs/dbraw/zinc/12/16/86/1049121686.db2.gz YPTLASUEQCAYPB-TWGQIWQCSA-N 1 0 306.453 4.430 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C2CC2)[C@H]2CCCCO2)cc1C ZINC001179044305 1049122734 /nfs/dbraw/zinc/12/27/34/1049122734.db2.gz AHXAONFMVIZKLV-WOJBJXKFSA-N 1 0 317.473 4.221 20 10 DICDRO C[C@@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(N2CCCCC2)cc1 ZINC000857081503 1049126194 /nfs/dbraw/zinc/12/61/94/1049126194.db2.gz POIRJHMYNQUKTR-GDBMZVCRSA-N 1 0 308.416 4.373 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)c(O)c1 ZINC000857082904 1049127113 /nfs/dbraw/zinc/12/71/13/1049127113.db2.gz RSLVTIJIJTXKMX-RYUDHWBXSA-N 1 0 302.245 4.244 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)c(O)c1C ZINC000857083614 1049127432 /nfs/dbraw/zinc/12/74/32/1049127432.db2.gz YGZXAQAOSJDVNY-NWDGAFQWSA-N 1 0 302.245 4.244 20 10 DICDRO Cc1[nH]c2ccccc2c1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001204293341 1049129633 /nfs/dbraw/zinc/12/96/33/1049129633.db2.gz XQRVWHJEYXVPAF-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO CC[C@H]([NH2+][C@@H](CCOC)c1ccco1)c1cc(Cl)ccc1O ZINC000775546767 1049136149 /nfs/dbraw/zinc/13/61/49/1049136149.db2.gz KZOUZXZWDBSWCI-GJZGRUSLSA-N 1 0 323.820 4.457 20 10 DICDRO CC[C@@H]([NH2+]CCc1cc(F)c(F)c(F)c1)c1ccccc1O ZINC000775548518 1049139843 /nfs/dbraw/zinc/13/98/43/1049139843.db2.gz UOMQHESKHBNFPA-OAHLLOKOSA-N 1 0 309.331 4.093 20 10 DICDRO CCC[N@H+](CCc1ccccn1)Cc1ccc(N2CCCC2)cc1 ZINC001204321756 1049142167 /nfs/dbraw/zinc/14/21/67/1049142167.db2.gz KHRMXNWFMIWWAI-UHFFFAOYSA-N 1 0 323.484 4.137 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)CCC1(F)F ZINC001204323120 1049142508 /nfs/dbraw/zinc/14/25/08/1049142508.db2.gz DRFVFPZNNKUBHO-OAHLLOKOSA-N 1 0 308.416 4.154 20 10 DICDRO Cc1cccc(CC[N@@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001204322905 1049142701 /nfs/dbraw/zinc/14/27/01/1049142701.db2.gz VVJSTDXQRBOLLM-UHFFFAOYSA-N 1 0 308.469 4.270 20 10 DICDRO CC[C@H]([NH2+]CC[C@@H]1CCO[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000775550826 1049142907 /nfs/dbraw/zinc/14/29/07/1049142907.db2.gz CGJKTJWGKSVHKH-ZENOOKHLSA-N 1 0 311.853 4.292 20 10 DICDRO c1ccc(C[N@H+](Cc2ccc(N3CCCC3)cc2)C2CC2)cc1 ZINC001204321108 1049142928 /nfs/dbraw/zinc/14/29/28/1049142928.db2.gz GMXNZGUSYPQOQQ-UHFFFAOYSA-N 1 0 306.453 4.451 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]CC[C@H]2CCCOC2)cc1 ZINC001179232486 1049145687 /nfs/dbraw/zinc/14/56/87/1049145687.db2.gz BGHUMIKPTCWAMI-LJQANCHMSA-N 1 0 318.505 4.219 20 10 DICDRO COc1cc(C[N@H+](C(C)C)[C@@H](C)c2ccccc2)cc(O)c1O ZINC001204350870 1049146546 /nfs/dbraw/zinc/14/65/46/1049146546.db2.gz LTJWOWKMPQFHFH-AWEZNQCLSA-N 1 0 315.413 4.078 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CCCS2)cc1F ZINC001179266053 1049148770 /nfs/dbraw/zinc/14/87/70/1049148770.db2.gz HUFWFOARXOYQAS-HNNXBMFYSA-N 1 0 310.482 4.047 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](C2CCC2)[C@@H]2CCOC2)cc1C ZINC001179390617 1049162576 /nfs/dbraw/zinc/16/25/76/1049162576.db2.gz KVNSFPSWKPMGRC-UYAOXDASSA-N 1 0 317.473 4.079 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CC[C@H]2CCCC2(F)F)cc1 ZINC001179443911 1049165536 /nfs/dbraw/zinc/16/55/36/1049165536.db2.gz WRGVUTCUOMNKKK-YIEVGGLXSA-N 1 0 308.416 4.181 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2c(F)cccc2OC)cc1 ZINC000773813798 1049171047 /nfs/dbraw/zinc/17/10/47/1049171047.db2.gz WEVBOFZEOIKUMK-AWEZNQCLSA-N 1 0 316.420 4.141 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2ccccc2n1 ZINC001204507859 1049178188 /nfs/dbraw/zinc/17/81/88/1049178188.db2.gz YBLNVDYBPJUTDL-UHFFFAOYSA-N 1 0 319.452 4.323 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c1 ZINC001204543697 1049188118 /nfs/dbraw/zinc/18/81/18/1049188118.db2.gz UUBABVKMYDZHCJ-AEFFLSMTSA-N 1 0 305.487 4.376 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCCCC1 ZINC000775589456 1049201241 /nfs/dbraw/zinc/20/12/41/1049201241.db2.gz QRUAHGMEYZYPLY-MRXNPFEDSA-N 1 0 305.462 4.338 20 10 DICDRO CC(C)[C@@H]1C[C@H]1[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001179838474 1049213510 /nfs/dbraw/zinc/21/35/10/1049213510.db2.gz YWQQQXCNUDHNNY-LEWJYISDSA-N 1 0 320.480 4.383 20 10 DICDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001204673698 1049218685 /nfs/dbraw/zinc/21/86/85/1049218685.db2.gz OGRDNERPXTXBKW-GUYCJALGSA-N 1 0 310.432 4.431 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccsc2C(F)(F)F)cc1C ZINC000858120807 1049220567 /nfs/dbraw/zinc/22/05/67/1049220567.db2.gz MVMJNKBZUHSBAC-UHFFFAOYSA-N 1 0 315.360 4.374 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(F)c(C(F)(F)F)c2)c1 ZINC000858237400 1049228870 /nfs/dbraw/zinc/22/88/70/1049228870.db2.gz MBZUAGBROLNDPE-UHFFFAOYSA-N 1 0 313.294 4.148 20 10 DICDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C(F)(F)F)c(C)c2)c1 ZINC000858239621 1049229427 /nfs/dbraw/zinc/22/94/27/1049229427.db2.gz QNYHUYKJFRWJDI-UHFFFAOYSA-N 1 0 309.331 4.318 20 10 DICDRO c1ccc([C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C2CCC2)nc1 ZINC000858237235 1049229484 /nfs/dbraw/zinc/22/94/84/1049229484.db2.gz HQUOFVDCIAOPGX-OAQYLSRUSA-N 1 0 321.468 4.313 20 10 DICDRO COCc1ccccc1/C=C(/C)C[NH2+]Cc1cc(C)ccc1O ZINC000858239442 1049230373 /nfs/dbraw/zinc/23/03/73/1049230373.db2.gz NRFSGDGXCYNAIS-WJDWOHSUSA-N 1 0 311.425 4.040 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1cccc(O)c1 ZINC000195454449 1049230731 /nfs/dbraw/zinc/23/07/31/1049230731.db2.gz BSDNENRUCWPRTN-INIZCTEOSA-N 1 0 310.441 4.233 20 10 DICDRO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ccc2O)C1 ZINC001179936376 1049231957 /nfs/dbraw/zinc/23/19/57/1049231957.db2.gz GMTMWZHULQLNCP-PXAZEXFGSA-N 1 0 303.352 4.254 20 10 DICDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2cccc(CC)c2O)C1(CC)CC ZINC001179953711 1049234577 /nfs/dbraw/zinc/23/45/77/1049234577.db2.gz YURSICGNNKKGEG-ROUUACIJSA-N 1 0 319.489 4.370 20 10 DICDRO Cc1cc(C[NH2+]Cc2cnn(C(C)C)c2)c(C)n1-c1ccccc1 ZINC000858292707 1049237166 /nfs/dbraw/zinc/23/71/66/1049237166.db2.gz DJCJLSZYDJDYIG-UHFFFAOYSA-N 1 0 322.456 4.161 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@H]1CCCc2ccc(Cl)cc21 ZINC000858296133 1049238090 /nfs/dbraw/zinc/23/80/90/1049238090.db2.gz PVBVYMPVXUKIGF-INIZCTEOSA-N 1 0 317.816 4.221 20 10 DICDRO COc1cccc(O)c1C[NH2+][C@@H]1CCCc2ccc(Cl)cc21 ZINC000858337941 1049242769 /nfs/dbraw/zinc/24/27/69/1049242769.db2.gz PVBVYMPVXUKIGF-MRXNPFEDSA-N 1 0 317.816 4.221 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)CC1(OC)CCCCCC1 ZINC001204762534 1049257297 /nfs/dbraw/zinc/25/72/97/1049257297.db2.gz FAZUUGKTFPYMML-UHFFFAOYSA-N 1 0 305.462 4.344 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)nc1 ZINC000858487684 1049262968 /nfs/dbraw/zinc/26/29/68/1049262968.db2.gz FVWDJOCALFLNDH-MRXNPFEDSA-N 1 0 312.457 4.341 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)nc1 ZINC000858487683 1049264709 /nfs/dbraw/zinc/26/47/09/1049264709.db2.gz FVWDJOCALFLNDH-INIZCTEOSA-N 1 0 312.457 4.341 20 10 DICDRO CCC(F)(F)C(C)(C)C[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000858514634 1049267797 /nfs/dbraw/zinc/26/77/97/1049267797.db2.gz VHRJENJHJZIVNQ-LLVKDONJSA-N 1 0 301.377 4.123 20 10 DICDRO CCC(F)(F)C(C)(C)C[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000858513587 1049268525 /nfs/dbraw/zinc/26/85/25/1049268525.db2.gz MIPMMRQGBUEMSZ-NSHDSACASA-N 1 0 301.377 4.123 20 10 DICDRO Cc1ncccc1C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000858519095 1049269544 /nfs/dbraw/zinc/26/95/44/1049269544.db2.gz RSHZHIPQRHWSDA-MRXNPFEDSA-N 1 0 309.457 4.231 20 10 DICDRO Oc1cccc2c1[C@@H]([NH2+]Cc1csc(C(F)(F)F)c1)CC2 ZINC000858564384 1049273529 /nfs/dbraw/zinc/27/35/29/1049273529.db2.gz LQVIAZHPDHTXKV-NSHDSACASA-N 1 0 313.344 4.250 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CC2(C(F)(F)F)CCCC2)c(O)c1 ZINC000858568301 1049275708 /nfs/dbraw/zinc/27/57/08/1049275708.db2.gz KOEFIFGKLGVILV-GFCCVEGCSA-N 1 0 301.352 4.474 20 10 DICDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001180141755 1049282921 /nfs/dbraw/zinc/28/29/21/1049282921.db2.gz ILBFVSRSHRAQBQ-ROUUACIJSA-N 1 0 306.519 4.167 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CCc3ccc(Cl)cc32)c1O ZINC000858583113 1049283393 /nfs/dbraw/zinc/28/33/93/1049283393.db2.gz WWRYJHLCJMUPQU-ZBEGNZNMSA-N 1 0 317.816 4.392 20 10 DICDRO CC[C@@H](C)C[N@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC001204865308 1049289636 /nfs/dbraw/zinc/28/96/36/1049289636.db2.gz ARVZGENSDDXBSC-MRXNPFEDSA-N 1 0 313.441 4.449 20 10 DICDRO COc1cc(C[N@H+]([C@H](C)C2CC2)C2CC2)c(O)c(C(C)(C)C)c1 ZINC001180178659 1049294808 /nfs/dbraw/zinc/29/48/08/1049294808.db2.gz YQKAQMPGOUMASP-CYBMUJFWSA-N 1 0 317.473 4.461 20 10 DICDRO CCN(C)c1ccc(C[NH+]2CCC(c3ccc(C)nc3)CC2)cc1 ZINC000773839743 1049297182 /nfs/dbraw/zinc/29/71/82/1049297182.db2.gz NKSVONCGKBOPBP-UHFFFAOYSA-N 1 0 323.484 4.226 20 10 DICDRO C[C@@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@H]2CCCC[C@@H]12 ZINC001204887809 1049300197 /nfs/dbraw/zinc/30/01/97/1049300197.db2.gz ASBHJTCTSFXSLQ-XUWXXGDYSA-N 1 0 322.443 4.431 20 10 DICDRO CC(C)[C@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001180166467 1049305274 /nfs/dbraw/zinc/30/52/74/1049305274.db2.gz PNDZBYWAYZABNC-LBPRGKRZSA-N 1 0 302.384 4.248 20 10 DICDRO CCC[N@H+](Cc1cc(OC)ccc1O)[C@H]1CCc2ccccc21 ZINC001180225603 1049310442 /nfs/dbraw/zinc/31/04/42/1049310442.db2.gz UAKXXYBHYHOZJI-IBGZPJMESA-N 1 0 311.425 4.300 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccccc2O)C2CCCC2)c(O)c1 ZINC001204924477 1049313161 /nfs/dbraw/zinc/31/31/61/1049313161.db2.gz VWYQEBCBCGOVFC-UHFFFAOYSA-N 1 0 311.425 4.351 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000773847998 1049326642 /nfs/dbraw/zinc/32/66/42/1049326642.db2.gz OWIFHHODQXTKFW-MRXNPFEDSA-N 1 0 311.473 4.060 20 10 DICDRO COC1(C[N@H+](Cc2ccccc2O)C2CCCC2)CCCCC1 ZINC001180291877 1049336532 /nfs/dbraw/zinc/33/65/32/1049336532.db2.gz HAPPPEQZLPVQQZ-UHFFFAOYSA-N 1 0 317.473 4.486 20 10 DICDRO C[C@H]([NH2+]CCOC1CCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000777120502 1049347494 /nfs/dbraw/zinc/34/74/94/1049347494.db2.gz JBIZOSFOUNSJJC-HNNXBMFYSA-N 1 0 320.452 4.036 20 10 DICDRO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccc2)cc1F ZINC001205039260 1049349807 /nfs/dbraw/zinc/34/98/07/1049349807.db2.gz JAPGYFMBAOYKRL-GOSISDBHSA-N 1 0 316.395 4.368 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)Cc2ccc(F)c(F)c2)c1 ZINC001205070764 1049363044 /nfs/dbraw/zinc/36/30/44/1049363044.db2.gz YMSIQVQAWYOGMK-UHFFFAOYSA-N 1 0 305.368 4.426 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccns2)ccc1N1CCCCC1 ZINC000860061750 1049365310 /nfs/dbraw/zinc/36/53/10/1049365310.db2.gz NGWQVOOPWDOIHR-OAHLLOKOSA-N 1 0 315.486 4.293 20 10 DICDRO CCc1cccc(C[NH2+]C[C@H](C)Oc2ccc(Cl)cc2)c1O ZINC001180883332 1049414797 /nfs/dbraw/zinc/41/47/97/1049414797.db2.gz HHGZRKOIMVDUQQ-ZDUSSCGKSA-N 1 0 319.832 4.165 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(Br)cc2)c(O)c1 ZINC001181267876 1049457928 /nfs/dbraw/zinc/45/79/28/1049457928.db2.gz USYKVQPBMSXZHA-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO CCOc1ccc(O)c(C[NH+]2CCC(c3ccsc3)CC2)c1 ZINC000777221760 1049463428 /nfs/dbraw/zinc/46/34/28/1049463428.db2.gz LSZFLMUGKRMDTO-UHFFFAOYSA-N 1 0 317.454 4.232 20 10 DICDRO CCOc1ccc(C[NH+]2CCC(c3ccsc3)CC2)c(O)c1 ZINC000777223020 1049463470 /nfs/dbraw/zinc/46/34/70/1049463470.db2.gz VGPMBJASGWNCIN-UHFFFAOYSA-N 1 0 317.454 4.232 20 10 DICDRO CC[NH+](CC)Cc1ccc(NCc2ccc(Cl)cc2O)cc1 ZINC001205423386 1049467539 /nfs/dbraw/zinc/46/75/39/1049467539.db2.gz OUGFHQZVJUYOSL-UHFFFAOYSA-N 1 0 318.848 4.500 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H](C(F)(F)F)[C@H]1C ZINC001205437815 1049471274 /nfs/dbraw/zinc/47/12/74/1049471274.db2.gz KTXOVZPWOQIPDT-CJNGLKHVSA-N 1 0 314.395 4.224 20 10 DICDRO COc1cccc(C[NH2+]C/C=C/c2c(C)cc(C)cc2C)c1O ZINC001181488082 1049484245 /nfs/dbraw/zinc/48/42/45/1049484245.db2.gz RVFFIIVQFUKUES-SOFGYWHQSA-N 1 0 311.425 4.129 20 10 DICDRO CCCC[N@H+](Cc1cnc(C2CC2)o1)Cc1ccccc1O ZINC000862355223 1049487999 /nfs/dbraw/zinc/48/79/99/1049487999.db2.gz HBFGJAPXCXHPPQ-UHFFFAOYSA-N 1 0 300.402 4.060 20 10 DICDRO CCCC[N@H+](Cc1ccccc1O)Cc1ccc(O)c(F)c1F ZINC001205513027 1049489111 /nfs/dbraw/zinc/48/91/11/1049489111.db2.gz ARYYJYPKYAWBOW-UHFFFAOYSA-N 1 0 321.367 4.178 20 10 DICDRO C[N@H+](Cc1cc2cccnc2o1)Cc1ccc(N2CCCC2)cc1 ZINC001181555747 1049489344 /nfs/dbraw/zinc/48/93/44/1049489344.db2.gz NRXZWSXXSGVRRH-UHFFFAOYSA-N 1 0 321.424 4.060 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H](c2ccccn2)C2CCC2)cc1Cl ZINC000862477462 1049495668 /nfs/dbraw/zinc/49/56/68/1049495668.db2.gz KPGAOKDYFKBSQJ-SFHVURJKSA-N 1 0 316.832 4.380 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2C[C@H](C(C)C)c3ccccc32)c1 ZINC000862506406 1049498329 /nfs/dbraw/zinc/49/83/29/1049498329.db2.gz WWMUFFHQRHDBHI-RTBURBONSA-N 1 0 311.425 4.375 20 10 DICDRO CC[N@H+](Cc1cc(OC)cc(C(C)(C)C)c1O)C1CCCC1 ZINC001181656324 1049501434 /nfs/dbraw/zinc/50/14/34/1049501434.db2.gz PUMZVFORZCJGDH-UHFFFAOYSA-N 1 0 305.462 4.463 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+](C)[C@@H](C)c2ccco2)c1O ZINC000775648711 1049510138 /nfs/dbraw/zinc/51/01/38/1049510138.db2.gz IMOKDJFYSSHEFN-NSHDSACASA-N 1 0 324.218 4.249 20 10 DICDRO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@@H](C3CCCC3)C2)c1O ZINC001195307270 1049514928 /nfs/dbraw/zinc/51/49/28/1049514928.db2.gz QVNJPDMEGJHYIN-CQSZACIVSA-N 1 0 321.848 4.260 20 10 DICDRO CCc1cccc(C[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c1O ZINC001181809213 1049524087 /nfs/dbraw/zinc/52/40/87/1049524087.db2.gz XPWBXVLKNLVLGI-AWEZNQCLSA-N 1 0 302.245 4.018 20 10 DICDRO CCCN(Cc1cc2ccccc2n1C)c1ccc(C[NH3+])cc1 ZINC001205659278 1049526551 /nfs/dbraw/zinc/52/65/51/1049526551.db2.gz GPSNQVSVTDLTTL-UHFFFAOYSA-N 1 0 307.441 4.054 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)C1CC(c2cccc(OC)c2)C1 ZINC001205659081 1049526676 /nfs/dbraw/zinc/52/66/76/1049526676.db2.gz BPYJCMMKUKUCEJ-UHFFFAOYSA-N 1 0 324.468 4.317 20 10 DICDRO COc1ccc(O)c(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)c1 ZINC000775659827 1049538735 /nfs/dbraw/zinc/53/87/35/1049538735.db2.gz PBIDJDDIHLBPLZ-LJQANCHMSA-N 1 0 309.409 4.053 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)c1O ZINC000775692680 1049630661 /nfs/dbraw/zinc/63/06/61/1049630661.db2.gz NBNOZODMHMPAMP-ZDUSSCGKSA-N 1 0 319.832 4.123 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@H]1CCc2ccccc21 ZINC001206048033 1049639058 /nfs/dbraw/zinc/63/90/58/1049639058.db2.gz OGOYBYIJXRBCKK-SFHVURJKSA-N 1 0 308.469 4.271 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C[C@@H]1CCc2ccccc21 ZINC001182424402 1049644207 /nfs/dbraw/zinc/64/42/07/1049644207.db2.gz SQUWSAMWNFWPHT-XLIONFOSSA-N 1 0 322.496 4.312 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@H]2CCC[C@@H]2C(C)(C)C)c1O ZINC001182444466 1049653903 /nfs/dbraw/zinc/65/39/03/1049653903.db2.gz RRVHDWVEANLLLR-HOTGVXAUSA-N 1 0 305.462 4.356 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@@H](CSc3ccccc3)C2)c1O ZINC000775722824 1049665764 /nfs/dbraw/zinc/66/57/64/1049665764.db2.gz DKUSMKZOQDMYKQ-MRXNPFEDSA-N 1 0 313.466 4.315 20 10 DICDRO COc1ccc([C@H]([NH2+]Cc2ccc(N(C)C)c(C)c2)C2CC2)cc1 ZINC000774451299 1049666194 /nfs/dbraw/zinc/66/61/94/1049666194.db2.gz XMYVHSVQPNBBDZ-OAQYLSRUSA-N 1 0 324.468 4.311 20 10 DICDRO CCO[C@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)c1ccccc1 ZINC000774498699 1049677668 /nfs/dbraw/zinc/67/76/68/1049677668.db2.gz SFQSSCVJJOORNN-QFBILLFUSA-N 1 0 313.441 4.437 20 10 DICDRO COc1cc(C[N@H+](C)C2CCC(C(C)(C)C)CC2)cc(O)c1O ZINC001204346473 1049690562 /nfs/dbraw/zinc/69/05/62/1049690562.db2.gz QXCFBXCAFCVTSM-UHFFFAOYSA-N 1 0 321.461 4.143 20 10 DICDRO CC[C@@H]([NH2+][C@H](C)c1ccc2c(c1)OCO2)c1ccc(C)cc1O ZINC000794789939 1049694306 /nfs/dbraw/zinc/69/43/06/1049694306.db2.gz BBPINIJVQXYCBO-CZUORRHYSA-N 1 0 313.397 4.231 20 10 DICDRO CC[C@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1ccc(C)cc1O ZINC000794794322 1049698290 /nfs/dbraw/zinc/69/82/90/1049698290.db2.gz LSVGKZDTTUOMLK-HOTGVXAUSA-N 1 0 318.486 4.106 20 10 DICDRO CC[C@@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1ccc(C)cc1O ZINC000794794323 1049699311 /nfs/dbraw/zinc/69/93/11/1049699311.db2.gz LSVGKZDTTUOMLK-HZPDHXFCSA-N 1 0 318.486 4.106 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2C[C@H]3CCCC[C@H]32)c(C(F)(F)F)c1 ZINC001182742675 1049710777 /nfs/dbraw/zinc/71/07/77/1049710777.db2.gz GMYGGOUANLDSPC-CZUORRHYSA-N 1 0 312.379 4.146 20 10 DICDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)c1O ZINC001206341841 1049716861 /nfs/dbraw/zinc/71/68/61/1049716861.db2.gz CYTHRUJGTOJHES-SWLSCSKDSA-N 1 0 309.837 4.113 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cc(Cl)ccc1F ZINC001206516970 1049748687 /nfs/dbraw/zinc/74/86/87/1049748687.db2.gz IYGOHMPZDSQBOR-UHFFFAOYSA-N 1 0 300.160 4.128 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cc(Cl)ccc2O)cc1Cl ZINC001206517240 1049749106 /nfs/dbraw/zinc/74/91/06/1049749106.db2.gz OVCKDXRLSYWKTL-UHFFFAOYSA-N 1 0 312.196 4.003 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@H](N(C)c3ccccc3)C2)c1 ZINC001206827703 1049808843 /nfs/dbraw/zinc/80/88/43/1049808843.db2.gz PRUNRYSRHNXRHZ-FQEVSTJZSA-N 1 0 324.468 4.226 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC001206990773 1049818018 /nfs/dbraw/zinc/81/80/18/1049818018.db2.gz IAFZNARWGNDRNL-SJDLMVEWSA-N 1 0 312.379 4.040 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccc(O)cc3)C2)c1 ZINC001206999201 1049819513 /nfs/dbraw/zinc/81/95/13/1049819513.db2.gz DYTQMFVFXUZBMS-QGZVFWFLSA-N 1 0 311.425 4.211 20 10 DICDRO C/C=C/C[C@@H]1CCC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001206999000 1049819830 /nfs/dbraw/zinc/81/98/30/1049819830.db2.gz BSMBGLGEBJAEJD-ISZGNANSSA-N 1 0 308.416 4.209 20 10 DICDRO Oc1cccc2c1C[N@H+](C[C@H]1C[C@H]1c1ccc(Cl)cc1)CC2 ZINC001207189307 1049856688 /nfs/dbraw/zinc/85/66/88/1049856688.db2.gz AIKMZMWNIIOXCD-WBVHZDCISA-N 1 0 313.828 4.207 20 10 DICDRO CCc1cccc(C[N@@H+]2CCC[C@](F)(c3ccccc3)C2)c1O ZINC001207209883 1049861779 /nfs/dbraw/zinc/86/17/79/1049861779.db2.gz SGCOCGZHGWBJPS-HXUWFJFHSA-N 1 0 313.416 4.415 20 10 DICDRO C[C@@H]([NH2+]CCc1ccccn1)c1ccc(N2CCCCCC2)cc1 ZINC000151429552 1049884965 /nfs/dbraw/zinc/88/49/65/1049884965.db2.gz NUGHLKPCVAVETL-GOSISDBHSA-N 1 0 323.484 4.355 20 10 DICDRO CSC1(C[NH2+]Cc2ccc(N(C)C)cc2C)CCCCC1 ZINC001207569492 1049909621 /nfs/dbraw/zinc/90/96/21/1049909621.db2.gz IXIDTPZTALCKNU-UHFFFAOYSA-N 1 0 306.519 4.217 20 10 DICDRO CCOCCC1(C[NH2+][C@@H](CC)c2ccccc2O)CCCC1 ZINC000156355521 1049919353 /nfs/dbraw/zinc/91/93/53/1049919353.db2.gz PZNDPLFTIVCMED-KRWDZBQOSA-N 1 0 305.462 4.420 20 10 DICDRO CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cccnc1 ZINC000164140394 1049921308 /nfs/dbraw/zinc/92/13/08/1049921308.db2.gz QHZWCJAAJAERPX-OXJNMPFZSA-N 1 0 311.473 4.238 20 10 DICDRO CCc1ccc(C[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)o1 ZINC000760677373 1049957084 /nfs/dbraw/zinc/95/70/84/1049957084.db2.gz IORIMUMIRAVXLG-UHFFFAOYSA-N 1 0 312.457 4.368 20 10 DICDRO CC/C=C\CCCCC[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001208194126 1049983366 /nfs/dbraw/zinc/98/33/66/1049983366.db2.gz KDNZFZMFKJLYEX-ARJAWSKDSA-N 1 0 303.446 4.373 20 10 DICDRO C[C@@H]([NH2+]CCc1ccc(Cl)s1)c1ccc(N(C)C)cc1 ZINC000222844851 1049993178 /nfs/dbraw/zinc/99/31/78/1049993178.db2.gz MRFUUYBMJIFNJE-GFCCVEGCSA-N 1 0 308.878 4.361 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2(Cc3ccccc3)CCC2)c1 ZINC000760718856 1050016584 /nfs/dbraw/zinc/01/65/84/1050016584.db2.gz RQWQUMVUXFCWCY-UHFFFAOYSA-N 1 0 311.425 4.046 20 10 DICDRO Oc1cccc2c1C[N@H+](CCCc1ccccc1Cl)CC2 ZINC001208874716 1050019693 /nfs/dbraw/zinc/01/96/93/1050019693.db2.gz MEJMLUDZJSGQKF-UHFFFAOYSA-N 1 0 301.817 4.037 20 10 DICDRO C[N@H+](CCc1c(Cl)cccc1Cl)Cc1ccccc1O ZINC001209108738 1050035917 /nfs/dbraw/zinc/03/59/17/1050035917.db2.gz SKZVTQXKNXSWPJ-UHFFFAOYSA-N 1 0 310.224 4.374 20 10 DICDRO CC[N@H+](CCc1ccc(F)c(F)c1)Cc1ccc(N(C)C)cc1 ZINC001209246977 1050046723 /nfs/dbraw/zinc/04/67/23/1050046723.db2.gz ZGSTUNURTUCGSN-UHFFFAOYSA-N 1 0 318.411 4.095 20 10 DICDRO CO[C@H]1CC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)[C@@H](C)C1 ZINC001209519699 1050066037 /nfs/dbraw/zinc/06/60/37/1050066037.db2.gz FRULZFSNGDXZMP-PXNSSMCTSA-N 1 0 312.457 4.093 20 10 DICDRO Cc1ccc(C)n1-c1ccc(C[NH+]2CC3(C2)CC(F)(F)C3)cc1 ZINC001209517738 1050066235 /nfs/dbraw/zinc/06/62/35/1050066235.db2.gz FUZARXLQKSAAOP-UHFFFAOYSA-N 1 0 316.395 4.325 20 10 DICDRO Cc1cnccc1C[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000823737299 1050150329 /nfs/dbraw/zinc/15/03/29/1050150329.db2.gz VGZQEIXFZDKWCV-UHFFFAOYSA-N 1 0 323.484 4.449 20 10 DICDRO Cc1cc(O)c(C[N@H+]2CCOC[C@@H]2CC(C)C)cc1C(C)C ZINC000733790146 1050155698 /nfs/dbraw/zinc/15/56/98/1050155698.db2.gz GEMVBMNUKSMVFA-KRWDZBQOSA-N 1 0 305.462 4.071 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ncc(C2CC2)o1)C1CCCC1 ZINC000760841074 1050172084 /nfs/dbraw/zinc/17/20/84/1050172084.db2.gz QJVCFYHTMGJWHN-UHFFFAOYSA-N 1 0 312.413 4.202 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCCC12CCOCC2)c1cc(Cl)ccc1O ZINC000282652431 1050172273 /nfs/dbraw/zinc/17/22/73/1050172273.db2.gz ICQLYUUNTWNFCB-WBMJQRKESA-N 1 0 309.837 4.046 20 10 DICDRO Cc1ccc(SC[C@@H](C)[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000770665462 1050182162 /nfs/dbraw/zinc/18/21/62/1050182162.db2.gz DUPGXZNXJNHBEA-CYBMUJFWSA-N 1 0 305.418 4.110 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C[C@H]1CSc2ccccc21 ZINC000824484048 1050212868 /nfs/dbraw/zinc/21/28/68/1050212868.db2.gz YVDBAOSEACJPHJ-LBPRGKRZSA-N 1 0 305.830 4.025 20 10 DICDRO CC[C@H]([NH2+]Cc1ccnc(C)c1)c1ccc(C(F)(F)F)cc1O ZINC000824596047 1050227477 /nfs/dbraw/zinc/22/74/77/1050227477.db2.gz FRAABMSTMVYIIG-HNNXBMFYSA-N 1 0 324.346 4.355 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(OC(C)(C)C)CC2)cc1Cl ZINC000824610013 1050227690 /nfs/dbraw/zinc/22/76/90/1050227690.db2.gz GLRVWVGUDJPDOY-UHFFFAOYSA-N 1 0 311.853 4.134 20 10 DICDRO Oc1ccccc1C[N@H+](C/C=C\c1ccccc1)C[C@@H]1CCCO1 ZINC000734148928 1050233313 /nfs/dbraw/zinc/23/33/13/1050233313.db2.gz QOVYRKIDVADSCU-GFWYJJLOSA-N 1 0 323.436 4.087 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(C)nc2C)cc1 ZINC000771385995 1050248625 /nfs/dbraw/zinc/24/86/25/1050248625.db2.gz VVETVYDPRLLFBI-MRXNPFEDSA-N 1 0 311.473 4.395 20 10 DICDRO Cc1ccc2c(C[N@@H+](C)Cc3ccc(N(C)C)cc3)c[nH]c2c1 ZINC001136975434 1050261604 /nfs/dbraw/zinc/26/16/04/1050261604.db2.gz GHGWMCSNUCDCPA-UHFFFAOYSA-N 1 0 307.441 4.174 20 10 DICDRO Cc1cc(O)c(CNc2cccc(C[NH+](C)C)c2)cc1Cl ZINC000824970832 1050263895 /nfs/dbraw/zinc/26/38/95/1050263895.db2.gz XRZDOALMVLLODQ-UHFFFAOYSA-N 1 0 304.821 4.028 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)cc1C ZINC000825045621 1050268534 /nfs/dbraw/zinc/26/85/34/1050268534.db2.gz IDGASGSXBOXKJC-AWEZNQCLSA-N 1 0 321.342 4.203 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000825133947 1050277852 /nfs/dbraw/zinc/27/78/52/1050277852.db2.gz RABKHGMJXZMJRG-NRFANRHFSA-N 1 0 323.436 4.062 20 10 DICDRO Oc1c(C[NH2+]C2CCC(OC(F)F)CC2)ccc2ccccc21 ZINC000825147633 1050278133 /nfs/dbraw/zinc/27/81/33/1050278133.db2.gz JFASVXCQQXEWLV-UHFFFAOYSA-N 1 0 321.367 4.185 20 10 DICDRO Cc1csc(C2([NH2+]Cc3cc(Cl)c(C)cc3O)CCC2)n1 ZINC000825197529 1050285014 /nfs/dbraw/zinc/28/50/14/1050285014.db2.gz NTNCIGKFPSXHAX-UHFFFAOYSA-N 1 0 322.861 4.288 20 10 DICDRO CCOc1ccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)cc1F ZINC000825223228 1050285076 /nfs/dbraw/zinc/28/50/76/1050285076.db2.gz ZLMQJGJVAONTMO-UHFFFAOYSA-N 1 0 323.795 4.182 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1O ZINC000825215830 1050285998 /nfs/dbraw/zinc/28/59/98/1050285998.db2.gz YHKHKRXISHTLBW-MRXNPFEDSA-N 1 0 319.351 4.016 20 10 DICDRO Cc1csc([C@@H]([NH2+]Cc2cc(Cl)c(C)cc2O)C2CC2)n1 ZINC000825320894 1050292667 /nfs/dbraw/zinc/29/26/67/1050292667.db2.gz PRYZXTMLLAAIJJ-HNNXBMFYSA-N 1 0 322.861 4.360 20 10 DICDRO COc1cccc2cc(C[N@H+](C)Cc3ccc(N(C)C)cc3)oc21 ZINC000771935121 1050301270 /nfs/dbraw/zinc/30/12/70/1050301270.db2.gz IXMNBLCCCRNKIR-UHFFFAOYSA-N 1 0 324.424 4.139 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)cc1Cl ZINC000825391568 1050302917 /nfs/dbraw/zinc/30/29/17/1050302917.db2.gz YEMGBWHQXOHOEN-XJKSGUPXSA-N 1 0 311.853 4.037 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)cc1Cl ZINC000825412455 1050305788 /nfs/dbraw/zinc/30/57/88/1050305788.db2.gz KXDVSNVEHXNPEC-GJZGRUSLSA-N 1 0 311.853 4.037 20 10 DICDRO COCC[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1ccc(C)o1 ZINC000825447289 1050306929 /nfs/dbraw/zinc/30/69/29/1050306929.db2.gz SNUWNSQRSSNHGT-OAHLLOKOSA-N 1 0 323.820 4.123 20 10 DICDRO Cc1cnc([C@@H](C)C[NH2+]Cc2cc(Cl)c(C)cc2O)s1 ZINC000825510067 1050313417 /nfs/dbraw/zinc/31/34/17/1050313417.db2.gz WBIUAHPQIFXGSR-JTQLQIEISA-N 1 0 310.850 4.012 20 10 DICDRO Cc1csc([C@H](C)C[NH2+]Cc2cc(Cl)c(C)cc2O)n1 ZINC000825510304 1050313643 /nfs/dbraw/zinc/31/36/43/1050313643.db2.gz ZXWUZSNOUOLJOM-SNVBAGLBSA-N 1 0 310.850 4.012 20 10 DICDRO CC(C)[C@H](O)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000734845108 1050324366 /nfs/dbraw/zinc/32/43/66/1050324366.db2.gz JCZRLKARCAQKTH-QGZVFWFLSA-N 1 0 321.505 4.094 20 10 DICDRO CCOc1ccc(O)c(C[NH2+][C@@]2(C)CCCc3ccccc32)c1 ZINC000734845634 1050325129 /nfs/dbraw/zinc/32/51/29/1050325129.db2.gz XCJRGOWZMJRVCD-FQEVSTJZSA-N 1 0 311.425 4.132 20 10 DICDRO CCCNc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000766213028 1050340400 /nfs/dbraw/zinc/34/04/00/1050340400.db2.gz KIVITEBOTKGRLN-UHFFFAOYSA-N 1 0 315.436 4.003 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(C)ccc1OC ZINC000772447611 1050359077 /nfs/dbraw/zinc/35/90/77/1050359077.db2.gz ZLTCKCXZDJXNBN-IBGZPJMESA-N 1 0 312.457 4.311 20 10 DICDRO Cc1csc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)c1 ZINC000379278478 1050375869 /nfs/dbraw/zinc/37/58/69/1050375869.db2.gz PQCVECAJLLTRLH-UHFFFAOYSA-N 1 0 300.471 4.337 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2cnccc2c1)c1ccc(N(C)C)cc1 ZINC000785510641 1050391026 /nfs/dbraw/zinc/39/10/26/1050391026.db2.gz AEIIAEHRROYALP-OAHLLOKOSA-N 1 0 305.425 4.152 20 10 DICDRO Cc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000766213325 1050396324 /nfs/dbraw/zinc/39/63/24/1050396324.db2.gz WYXZMWLBAZFNHD-ZBFHGGJFSA-N 1 0 300.446 4.326 20 10 DICDRO Cc1ccccc1[C@H]([C@@H](C)[NH2+][C@@H](C)c1ccccc1O)N(C)C ZINC000785572730 1050396555 /nfs/dbraw/zinc/39/65/55/1050396555.db2.gz KUZNRBRSCFPPDR-YRNRMSPPSA-N 1 0 312.457 4.043 20 10 DICDRO COc1cccc(C[NH2+]C(C2CCCC2)C2CCCC2)c1O ZINC000735509134 1050402248 /nfs/dbraw/zinc/40/22/48/1050402248.db2.gz VWYPYGKKKKQARD-UHFFFAOYSA-N 1 0 303.446 4.239 20 10 DICDRO CCOc1c(F)cc(C[N@H+](CC)Cc2ccccc2O)cc1F ZINC001144032509 1050437312 /nfs/dbraw/zinc/43/73/12/1050437312.db2.gz MRWQEWMATZEQTL-UHFFFAOYSA-N 1 0 321.367 4.091 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1 ZINC001171133415 1050452803 /nfs/dbraw/zinc/45/28/03/1050452803.db2.gz KYDLYTDBIBXFLT-IBGZPJMESA-N 1 0 316.395 4.368 20 10 DICDRO Cc1cc(C)c(/C=C/C[NH2+]Cc2ccc3c(c2)CCO3)cc1C ZINC001649010238 1050453371 /nfs/dbraw/zinc/45/33/71/1050453371.db2.gz RZFIACBNXKTTSL-SNAWJCMRSA-N 1 0 307.437 4.350 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](CC)c2ccccc2O)CCO1 ZINC000157891944 1050478576 /nfs/dbraw/zinc/47/85/76/1050478576.db2.gz NXVUERJNASUOCC-IEZWGBDMSA-N 1 0 305.462 4.417 20 10 DICDRO CC[C@@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccccc1O ZINC000786431506 1050481007 /nfs/dbraw/zinc/48/10/07/1050481007.db2.gz QZBQVCHWYUEYJW-NVXWUHKLSA-N 1 0 303.446 4.315 20 10 DICDRO CN(C)c1ccc(C[NH2+][C@@H](Cc2ccccc2)C2CC2)cc1F ZINC000736647009 1050485099 /nfs/dbraw/zinc/48/50/99/1050485099.db2.gz AEGNWGUSBWOZRA-IBGZPJMESA-N 1 0 312.432 4.003 20 10 DICDRO CC(C)[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccn1 ZINC000736648371 1050485562 /nfs/dbraw/zinc/48/55/62/1050485562.db2.gz XCXHEEWGCKXNIO-FQEVSTJZSA-N 1 0 309.457 4.169 20 10 DICDRO C[NH2+]Cc1ccc(Nc2ccccc2Cc2ccc(N)cc2)cc1 ZINC001211131389 1050489817 /nfs/dbraw/zinc/48/98/17/1050489817.db2.gz IBSNFCMLGIJUBM-UHFFFAOYSA-N 1 0 317.436 4.323 20 10 DICDRO CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000786792048 1050516775 /nfs/dbraw/zinc/51/67/75/1050516775.db2.gz HBQYKDRPJULOCT-DYESRHJHSA-N 1 0 324.468 4.153 20 10 DICDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000738243485 1050530247 /nfs/dbraw/zinc/53/02/47/1050530247.db2.gz PBIXPHRZRQYFKG-HXUWFJFHSA-N 1 0 318.420 4.450 20 10 DICDRO Cc1ncsc1CC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000738314122 1050530609 /nfs/dbraw/zinc/53/06/09/1050530609.db2.gz NEBRULFLZZCIKV-UHFFFAOYSA-N 1 0 316.470 4.144 20 10 DICDRO C[C@@H](CC1CC1)[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000766236716 1050547376 /nfs/dbraw/zinc/54/73/76/1050547376.db2.gz GMYJDLDYYTVFHQ-DZGCQCFKSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)cc1C ZINC000787417455 1050597231 /nfs/dbraw/zinc/59/72/31/1050597231.db2.gz NGULGGLRIRZFMS-AWEZNQCLSA-N 1 0 301.352 4.172 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2[nH]ccc2c1 ZINC000787439175 1050597735 /nfs/dbraw/zinc/59/77/35/1050597735.db2.gz BNZDBYKEUQHBPR-UHFFFAOYSA-N 1 0 307.441 4.256 20 10 DICDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2c(O)ccc3ccccc32)C1(C)C ZINC000740863659 1050635340 /nfs/dbraw/zinc/63/53/40/1050635340.db2.gz WCNFQKDMUTWCCJ-MOPGFXCFSA-N 1 0 313.441 4.181 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)cc2Cl)c1 ZINC000845971438 1050638516 /nfs/dbraw/zinc/63/85/16/1050638516.db2.gz KICIDKOEKMCRIY-LBPRGKRZSA-N 1 0 305.805 4.213 20 10 DICDRO C[C@@H](CO)[C@@H](C)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000740898722 1050639741 /nfs/dbraw/zinc/63/97/41/1050639741.db2.gz WYBBKBSMNHUVHB-UONOGXRCSA-N 1 0 321.505 4.094 20 10 DICDRO CCOc1ccc(O)c(C[NH2+]C2(c3ccccc3C)CCC2)c1 ZINC000845994430 1050648481 /nfs/dbraw/zinc/64/84/81/1050648481.db2.gz CTFYDNIMZMBLEC-UHFFFAOYSA-N 1 0 311.425 4.268 20 10 DICDRO CC(C)CCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001170081973 1050649747 /nfs/dbraw/zinc/64/97/47/1050649747.db2.gz IDODKDCJGXIABS-GOSISDBHSA-N 1 0 318.505 4.170 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CC[C@]2(C)C[C@]2(F)Cl)cc1 ZINC000846028587 1050650892 /nfs/dbraw/zinc/65/08/92/1050650892.db2.gz CHDXQYDDPDLGKF-ADDHZHGLSA-N 1 0 310.844 4.060 20 10 DICDRO C[C@@]1(CC[NH2+]Cc2ccc3ccccc3c2O)C[C@]1(F)Cl ZINC000846031582 1050651166 /nfs/dbraw/zinc/65/11/66/1050651166.db2.gz ASJFTTWVPNNFSG-IAGOWNOFSA-N 1 0 307.796 4.340 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CSCCS1)c1ccc2ccccc2c1O ZINC000168819665 1050654364 /nfs/dbraw/zinc/65/43/64/1050654364.db2.gz IVLXRRQSBUQJFY-JSGCOSHPSA-N 1 0 319.495 4.045 20 10 DICDRO Cc1cccc(C[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)c1O ZINC000846052466 1050659102 /nfs/dbraw/zinc/65/91/02/1050659102.db2.gz ODFBJXSYOFMJLT-INIZCTEOSA-N 1 0 315.388 4.232 20 10 DICDRO CC[C@H]([NH2+]CCc1ccccc1OC(F)F)c1ccccc1O ZINC000788257683 1050661245 /nfs/dbraw/zinc/66/12/45/1050661245.db2.gz CRFNKIALXKTBON-HNNXBMFYSA-N 1 0 321.367 4.277 20 10 DICDRO CC(C)(C)c1cc(C[NH2+]Cc2ncc[nH]2)c(O)c(C(C)(C)C)c1 ZINC000741160732 1050661826 /nfs/dbraw/zinc/66/18/26/1050661826.db2.gz SJHSPZFRCADIIP-UHFFFAOYSA-N 1 0 315.461 4.000 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)c1 ZINC000846107909 1050661756 /nfs/dbraw/zinc/66/17/56/1050661756.db2.gz UCSPPUKMHGENCS-UHFFFAOYSA-N 1 0 321.342 4.498 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000846116134 1050666701 /nfs/dbraw/zinc/66/67/01/1050666701.db2.gz FQRQIEUPHWBVJB-GOSISDBHSA-N 1 0 315.363 4.290 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C)cc2SC)c1O ZINC000846148499 1050672016 /nfs/dbraw/zinc/67/20/16/1050672016.db2.gz FJEQEONIUIAJLJ-ZDUSSCGKSA-N 1 0 317.454 4.282 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(Br)ccc1O)c1ccccc1 ZINC000227442004 1050672564 /nfs/dbraw/zinc/67/25/64/1050672564.db2.gz KYAMTBYBNRMTBK-HNNXBMFYSA-N 1 0 320.230 4.396 20 10 DICDRO CCS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cccc(OC)c2O)C1 ZINC000846149883 1050672731 /nfs/dbraw/zinc/67/27/31/1050672731.db2.gz NMPOUNZOAALWSH-MELADBBJSA-N 1 0 309.475 4.116 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H](C)Cc2ccc(C)s2)c1O ZINC000846148470 1050673030 /nfs/dbraw/zinc/67/30/30/1050673030.db2.gz ZVODTDCYQZLJPU-YPMHNXCESA-N 1 0 305.443 4.053 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2c3ccccc3CC[C@@H]2C)c1O ZINC000846155652 1050674997 /nfs/dbraw/zinc/67/49/97/1050674997.db2.gz BMMBNXIQCNXYGW-CKFHNAJUSA-N 1 0 311.425 4.375 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)c1O ZINC000846167985 1050678458 /nfs/dbraw/zinc/67/84/58/1050678458.db2.gz PSUQSIPSVSTAJQ-XNRPHZJLSA-N 1 0 315.388 4.137 20 10 DICDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc(OC)c2O)CCO1 ZINC000846163932 1050678641 /nfs/dbraw/zinc/67/86/41/1050678641.db2.gz SYRISSYLMHTFCH-XUWXXGDYSA-N 1 0 321.461 4.035 20 10 DICDRO CC[C@@H](C[NH2+][C@@H](C)c1cccc(OC)c1O)CC(F)(F)F ZINC000846170551 1050680082 /nfs/dbraw/zinc/68/00/82/1050680082.db2.gz AYGATDJKDAKVBJ-WDEREUQCSA-N 1 0 305.340 4.030 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCc3ccc(C)cc32)c1O ZINC000846169642 1050680602 /nfs/dbraw/zinc/68/06/02/1050680602.db2.gz JBNIUJCOJBQMIF-KBXCAEBGSA-N 1 0 311.425 4.437 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC[C@@H]2CCc3ccccc32)c1O ZINC000846171011 1050680691 /nfs/dbraw/zinc/68/06/91/1050680691.db2.gz QGQHQLKBBFWBIA-ZBFHGGJFSA-N 1 0 311.425 4.172 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c1O ZINC000846135709 1050681955 /nfs/dbraw/zinc/68/19/55/1050681955.db2.gz FTDJIPHJPMXKEY-VXGBXAGGSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(CSC)cc2)c1O ZINC000846173566 1050682043 /nfs/dbraw/zinc/68/20/43/1050682043.db2.gz SVHANGOOKSJNGV-CYBMUJFWSA-N 1 0 317.454 4.115 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](c2cccs2)C2CC2)c1O ZINC000846136973 1050682145 /nfs/dbraw/zinc/68/21/45/1050682145.db2.gz PBSCHSLQFXMDOQ-BZNIZROVSA-N 1 0 303.427 4.264 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccc(OC)cc1 ZINC000846138583 1050682313 /nfs/dbraw/zinc/68/23/13/1050682313.db2.gz WLGHXOIJWITGDF-GUYCJALGSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c1O ZINC000846136620 1050682334 /nfs/dbraw/zinc/68/23/34/1050682334.db2.gz IHWVJCBEUAHKIF-NWDGAFQWSA-N 1 0 305.805 4.466 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCSc3ccccc32)c1O ZINC000846139840 1050682545 /nfs/dbraw/zinc/68/25/45/1050682545.db2.gz ALIWEACHNYTVIC-DOMZBBRYSA-N 1 0 315.438 4.289 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2cc3c(s2)CCCC3)c1O ZINC000846140968 1050682623 /nfs/dbraw/zinc/68/26/23/1050682623.db2.gz BOJSDOPQDCRVPS-GFCCVEGCSA-N 1 0 317.454 4.192 20 10 DICDRO CCOc1cccc([C@H](C)[NH2+][C@@H](C)c2cccc(OC)c2O)c1 ZINC000846141970 1050683653 /nfs/dbraw/zinc/68/36/53/1050683653.db2.gz PHFQCPFBVIGKIA-KBPBESRZSA-N 1 0 315.413 4.211 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]Cc2ccccc2OC(C)C)c1O ZINC000846143467 1050684252 /nfs/dbraw/zinc/68/42/52/1050684252.db2.gz IUPFEGPBADNZSA-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CC(C)(C)c2ccccc2F)c1O ZINC000846141958 1050684393 /nfs/dbraw/zinc/68/43/93/1050684393.db2.gz OSAMFQMNKVSAKK-CYBMUJFWSA-N 1 0 317.404 4.168 20 10 DICDRO COc1cccc([C@H](C)[NH2+][C@H]2CCc3c2cccc3Cl)c1O ZINC000846141949 1050684444 /nfs/dbraw/zinc/68/44/44/1050684444.db2.gz OLRKHGVWERINIA-ZBEGNZNMSA-N 1 0 317.816 4.392 20 10 DICDRO COc1cccc([C@H](C)[NH2+]Cc2cc(F)ccc2SC)c1O ZINC000846144017 1050684556 /nfs/dbraw/zinc/68/45/56/1050684556.db2.gz FNXPGSVLHNLJNI-NSHDSACASA-N 1 0 321.417 4.113 20 10 DICDRO CC[C@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccccc1F ZINC000846191627 1050693274 /nfs/dbraw/zinc/69/32/74/1050693274.db2.gz XHTURFUCFORLTB-WBMJQRKESA-N 1 0 303.377 4.342 20 10 DICDRO C[C@H]([NH2+][C@H]1CC(C)(C)Oc2ccc(F)cc21)c1ccccc1O ZINC000846197687 1050693967 /nfs/dbraw/zinc/69/39/67/1050693967.db2.gz VODUHPJIFJDBAQ-LRDDRELGSA-N 1 0 315.388 4.484 20 10 DICDRO C[C@@H]([NH2+][C@H]1CC(C)(C)Oc2ccc(F)cc21)c1ccccc1O ZINC000846197689 1050694418 /nfs/dbraw/zinc/69/44/18/1050694418.db2.gz VODUHPJIFJDBAQ-WBMJQRKESA-N 1 0 315.388 4.484 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCC[C@H]2CC2(Cl)Cl)c(O)c1 ZINC000846216534 1050696441 /nfs/dbraw/zinc/69/64/41/1050696441.db2.gz SQJBBNLZGCZNAY-NEPJUHHUSA-N 1 0 302.245 4.325 20 10 DICDRO C[C@H]([NH2+]CCC[C@H]1CC1(Cl)Cl)c1cc(F)ccc1O ZINC000846215728 1050696770 /nfs/dbraw/zinc/69/67/70/1050696770.db2.gz OLPAUNPHYBRQLO-UWVGGRQHSA-N 1 0 306.208 4.156 20 10 DICDRO C[C@H](O)CCC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000788523653 1050698708 /nfs/dbraw/zinc/69/87/08/1050698708.db2.gz GMQVWPYWZVDNEC-AWEZNQCLSA-N 1 0 321.505 4.238 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2c(F)cccc2F)c(O)c1 ZINC000788547752 1050699932 /nfs/dbraw/zinc/69/99/32/1050699932.db2.gz PBNGQLQTRQSOJE-CYBMUJFWSA-N 1 0 305.368 4.181 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cn3ccccc3n2)cc1 ZINC000788546841 1050700354 /nfs/dbraw/zinc/70/03/54/1050700354.db2.gz MBGZRMYOWJBZAV-MRXNPFEDSA-N 1 0 322.456 4.031 20 10 DICDRO COc1cccc([C@@H](C)[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1O ZINC000846211917 1050701271 /nfs/dbraw/zinc/70/12/71/1050701271.db2.gz DCVBHUGGJVIWRO-GHMZBOCLSA-N 1 0 318.244 4.025 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCN(c3ccccc3)C2)c(O)c1 ZINC000788527592 1050703975 /nfs/dbraw/zinc/70/39/75/1050703975.db2.gz WZLHNAYBDAZMLC-ROUUACIJSA-N 1 0 324.468 4.186 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(O)c1 ZINC000788584771 1050708192 /nfs/dbraw/zinc/70/81/92/1050708192.db2.gz QHZLRUSOAAMSBJ-AWEZNQCLSA-N 1 0 316.420 4.065 20 10 DICDRO CC[C@H]([NH2+][C@H](C(C)C)[C@@H](O)c1ccccc1)c1ccccc1O ZINC000788618487 1050718740 /nfs/dbraw/zinc/71/87/40/1050718740.db2.gz ARAPRACEKLOJLT-SXLOBPIMSA-N 1 0 313.441 4.191 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](c2cccnc2)C(C)C)c(O)c1 ZINC000788629374 1050721147 /nfs/dbraw/zinc/72/11/47/1050721147.db2.gz UHFKHRGENUXOCI-FUHWJXTLSA-N 1 0 312.457 4.494 20 10 DICDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)c(O)c1 ZINC000788708977 1050732040 /nfs/dbraw/zinc/73/20/40/1050732040.db2.gz CATFWQGICZTGAJ-BBWFWOEESA-N 1 0 305.462 4.253 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C)ccc1OC)c1ccc(N(C)C)cc1 ZINC000772952246 1050745674 /nfs/dbraw/zinc/74/56/74/1050745674.db2.gz QNAXIPWPONBMQA-LJQANCHMSA-N 1 0 312.457 4.311 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000788987376 1050773864 /nfs/dbraw/zinc/77/38/64/1050773864.db2.gz LHQYZQKOEPZFLL-CQSZACIVSA-N 1 0 310.432 4.365 20 10 DICDRO COc1c2ccccc2oc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000788981499 1050777546 /nfs/dbraw/zinc/77/75/46/1050777546.db2.gz RFQVYJIQLJSVBV-CQSZACIVSA-N 1 0 324.424 4.358 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1O ZINC000761202385 1050779309 /nfs/dbraw/zinc/77/93/09/1050779309.db2.gz DOFPPIFGJRACQC-YVEFUNNKSA-N 1 0 317.816 4.247 20 10 DICDRO COc1cc(Cl)cc(C[NH2+]C(C)(C)c2cccs2)c1O ZINC000761206557 1050781109 /nfs/dbraw/zinc/78/11/09/1050781109.db2.gz KWXQADKVYFONID-UHFFFAOYSA-N 1 0 311.834 4.141 20 10 DICDRO CCSCC[C@H](C)[N@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000761207291 1050785501 /nfs/dbraw/zinc/78/55/01/1050785501.db2.gz ZRUHOVVHKNBGPP-NSHDSACASA-N 1 0 317.882 4.018 20 10 DICDRO CC1(C)CCC([NH2+]Cc2ccc(N3CCSCC3)cc2)CC1 ZINC000742367602 1050823403 /nfs/dbraw/zinc/82/34/03/1050823403.db2.gz ZOZLENOMYSOJQO-UHFFFAOYSA-N 1 0 318.530 4.298 20 10 DICDRO COc1ccc(C[NH2+]C[C@H](C)Sc2ccccc2)cc1C ZINC000742382635 1050827625 /nfs/dbraw/zinc/82/76/25/1050827625.db2.gz GZVXFCBLHAUVLF-HNNXBMFYSA-N 1 0 301.455 4.274 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H](SC)C2)cc1F ZINC000742383770 1050828180 /nfs/dbraw/zinc/82/81/80/1050828180.db2.gz TXCHLXZLLDURHL-LSDHHAIUSA-N 1 0 310.482 4.046 20 10 DICDRO C[C@@H]1CC[C@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC000742369365 1050831913 /nfs/dbraw/zinc/83/19/13/1050831913.db2.gz BKAZGNICTMTSIJ-HIFRSBDPSA-N 1 0 324.415 4.035 20 10 DICDRO C[C@H]1CC[C@@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC000742369364 1050832410 /nfs/dbraw/zinc/83/24/10/1050832410.db2.gz BKAZGNICTMTSIJ-DZGCQCFKSA-N 1 0 324.415 4.035 20 10 DICDRO Cc1cnc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)s1 ZINC000742378162 1050837614 /nfs/dbraw/zinc/83/76/14/1050837614.db2.gz CWUBVDWYDFGOGB-UHFFFAOYSA-N 1 0 310.422 4.114 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](CC2CC2)c2ccccc2)c1O ZINC000742377472 1050838226 /nfs/dbraw/zinc/83/82/26/1050838226.db2.gz DLPWLBGKAQFUOK-GOSISDBHSA-N 1 0 311.425 4.422 20 10 DICDRO COC(C)(C)C[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000742377712 1050838242 /nfs/dbraw/zinc/83/82/42/1050838242.db2.gz QEKKHUFPQOZRHO-OAHLLOKOSA-N 1 0 313.441 4.352 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000789514350 1050842800 /nfs/dbraw/zinc/84/28/00/1050842800.db2.gz PRSWTFYRMPNLRH-QZTJIDSGSA-N 1 0 317.473 4.142 20 10 DICDRO Cc1cc(O)c(C[NH+]2CCC(CC(F)(F)F)CC2)cc1C ZINC000789528773 1050845660 /nfs/dbraw/zinc/84/56/60/1050845660.db2.gz VMMYRBUEVOTPEO-UHFFFAOYSA-N 1 0 301.352 4.173 20 10 DICDRO CC[C@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000772981331 1050887158 /nfs/dbraw/zinc/88/71/58/1050887158.db2.gz ZRFBGEKEMQZNGD-SFTDATJTSA-N 1 0 324.468 4.107 20 10 DICDRO Cc1cc(C[NH2+][C@H](C)c2ccc(F)cc2F)ccc1N(C)C ZINC000772994787 1050966161 /nfs/dbraw/zinc/96/61/61/1050966161.db2.gz BKRZBDORHVQRDL-CYBMUJFWSA-N 1 0 304.384 4.190 20 10 DICDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cc1F ZINC000772996600 1050987841 /nfs/dbraw/zinc/98/78/41/1050987841.db2.gz FSJJCFOBCVVPRI-CQSZACIVSA-N 1 0 316.420 4.060 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC3(CCCCC3)O2)c(O)c1 ZINC000790716639 1050988403 /nfs/dbraw/zinc/98/84/03/1050988403.db2.gz WUJKTSXPPMRLSS-HZPDHXFCSA-N 1 0 303.446 4.233 20 10 DICDRO Cc1cccc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)c1O ZINC000790927292 1051006823 /nfs/dbraw/zinc/00/68/23/1051006823.db2.gz WRSHHNMUZXEWTA-UHFFFAOYSA-N 1 0 311.356 4.390 20 10 DICDRO Cc1cc(C[NH2+][C@@H](C)c2cc(F)ccc2F)ccc1N(C)C ZINC000772999602 1051014181 /nfs/dbraw/zinc/01/41/81/1051014181.db2.gz NFIPWEBJBCVZKW-ZDUSSCGKSA-N 1 0 304.384 4.190 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccccc1N(C)C)c1ccc(N(C)C)cc1 ZINC000773005887 1051017629 /nfs/dbraw/zinc/01/76/29/1051017629.db2.gz UYLAJHOOKYBVEP-LJQANCHMSA-N 1 0 311.473 4.060 20 10 DICDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@H]1c1cccc(F)c1 ZINC000743389376 1051019875 /nfs/dbraw/zinc/01/98/75/1051019875.db2.gz JMAIRABXKCGBRY-SFHVURJKSA-N 1 0 308.356 4.027 20 10 DICDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccncc32)[C@@H]1c1ccccc1 ZINC000743392846 1051023457 /nfs/dbraw/zinc/02/34/57/1051023457.db2.gz VLVYFOLLRAILCH-VLIAUNLRSA-N 1 0 304.393 4.133 20 10 DICDRO CC[C@@H](O)CCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000773015844 1051024541 /nfs/dbraw/zinc/02/45/41/1051024541.db2.gz OHQUIALWQGYBJY-FXAWDEMLSA-N 1 0 318.505 4.269 20 10 DICDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(-n3cccn3)cc2)cc1C ZINC000743498490 1051036778 /nfs/dbraw/zinc/03/67/78/1051036778.db2.gz PKWGPEJNQXRXST-INIZCTEOSA-N 1 0 321.424 4.040 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(OC)cc1C)c1ccc(N(C)C)cc1 ZINC000773050180 1051040066 /nfs/dbraw/zinc/04/00/66/1051040066.db2.gz FPHOPFQPQPMMLS-HXUWFJFHSA-N 1 0 312.457 4.311 20 10 DICDRO CC[C@H]([NH2+][C@@H]1COc2ccc(C)cc21)c1ccc(N(C)C)cc1 ZINC000773058678 1051042410 /nfs/dbraw/zinc/04/24/10/1051042410.db2.gz IRXJZYOOHXRCTE-RBUKOAKNSA-N 1 0 310.441 4.235 20 10 DICDRO C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccc(N(C)C)cc1 ZINC000773058443 1051043145 /nfs/dbraw/zinc/04/31/45/1051043145.db2.gz HTECGEJKMGYHIA-PXAZEXFGSA-N 1 0 316.832 4.190 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(C)cc32)cc1 ZINC000773060738 1051044908 /nfs/dbraw/zinc/04/49/08/1051044908.db2.gz RYZVWOSPKOCHER-DNVCBOLYSA-N 1 0 310.441 4.235 20 10 DICDRO Cc1cc(C[NH2+]C[C@@H]2CC2(Cl)Cl)c(C)n1-c1ccccc1 ZINC000743653617 1051052948 /nfs/dbraw/zinc/05/29/48/1051052948.db2.gz RSZQTWAMYLSDFN-HNNXBMFYSA-N 1 0 323.267 4.378 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)[C@@H]1COc2ccccc21)c1ccc(N(C)C)cc1 ZINC000773105808 1051061961 /nfs/dbraw/zinc/06/19/61/1051061961.db2.gz RHCMHXZKGPSQIB-YSSFQJQWSA-N 1 0 324.468 4.358 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)[C@@H]1CCCO1 ZINC000773102634 1051062354 /nfs/dbraw/zinc/06/23/54/1051062354.db2.gz HHIBRDSTNRHKEX-VDGAXYAQSA-N 1 0 316.489 4.285 20 10 DICDRO C[N@H+](CCCCCCCO)Cc1ccc(N2CCCCC2)cc1 ZINC000743839365 1051071902 /nfs/dbraw/zinc/07/19/02/1051071902.db2.gz RIFABZLPVYCHSW-UHFFFAOYSA-N 1 0 318.505 4.052 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)cc1 ZINC000773127765 1051073409 /nfs/dbraw/zinc/07/34/09/1051073409.db2.gz AQPKIEVBDYGGNR-IEZWGBDMSA-N 1 0 318.505 4.387 20 10 DICDRO CC[N@H+](Cc1cc(Br)ccc1O)[C@@H]1C=CCCC1 ZINC000743873244 1051085261 /nfs/dbraw/zinc/08/52/61/1051085261.db2.gz LDKZNUFZPJWOSO-CQSZACIVSA-N 1 0 310.235 4.085 20 10 DICDRO [NH3+]C1(c2ccc(NCc3cc4ccccc4cc3O)cc2)CCC1 ZINC001171404674 1051091977 /nfs/dbraw/zinc/09/19/77/1051091977.db2.gz IGWMANZDUCITFY-UHFFFAOYSA-N 1 0 318.420 4.495 20 10 DICDRO [NH3+][C@@H]1CCc2c1cccc2NCc1cc2ccccc2cc1O ZINC001171407822 1051096267 /nfs/dbraw/zinc/09/62/67/1051096267.db2.gz XKAVIYBPCBLPGZ-GOSISDBHSA-N 1 0 304.393 4.104 20 10 DICDRO CC[C@@H]1C[C@@H]([NH2+][C@@H]2c3c(c(C)cc(C)c3O)CC2(C)C)CCO1 ZINC001170201537 1051156141 /nfs/dbraw/zinc/15/61/41/1051156141.db2.gz DBGMPKGLJLVSCX-QMTMVMCOSA-N 1 0 317.473 4.180 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c2C1)c1ccccc1O ZINC001171511978 1051158068 /nfs/dbraw/zinc/15/80/68/1051158068.db2.gz LVOPJQASVGTXES-ZYHUDNBSSA-N 1 0 321.342 4.018 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(Br)cc1O)c1ccccc1 ZINC000691415494 1051163216 /nfs/dbraw/zinc/16/32/16/1051163216.db2.gz QEKSVEVKFRUIGR-HNNXBMFYSA-N 1 0 320.230 4.396 20 10 DICDRO CC[N@H+](Cc1ccccc1O)[C@H](C)Cc1ccccc1Cl ZINC001170288469 1051180933 /nfs/dbraw/zinc/18/09/33/1051180933.db2.gz OSAIWGYONNNOOC-CQSZACIVSA-N 1 0 303.833 4.499 20 10 DICDRO CNc1ccccc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001170336976 1051188450 /nfs/dbraw/zinc/18/84/50/1051188450.db2.gz INMIZVAPCXEWJR-LDLYASANSA-N 1 0 321.468 4.336 20 10 DICDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000792977770 1051232874 /nfs/dbraw/zinc/23/28/74/1051232874.db2.gz NRPQTDYXEVIKML-UHFFFAOYSA-N 1 0 304.384 4.288 20 10 DICDRO CCc1cccc(F)c1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000792976704 1051233815 /nfs/dbraw/zinc/23/38/15/1051233815.db2.gz GEERBPCMXFEDOU-UHFFFAOYSA-N 1 0 300.421 4.052 20 10 DICDRO CO[C@@]1(C)CCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000793218349 1051262110 /nfs/dbraw/zinc/26/21/10/1051262110.db2.gz RYJQWHANFYDGSD-FQEVSTJZSA-N 1 0 311.425 4.060 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000793230024 1051264204 /nfs/dbraw/zinc/26/42/04/1051264204.db2.gz CLBWGRVCCGQXQX-SKDRFNHKSA-N 1 0 307.743 4.127 20 10 DICDRO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000793231276 1051264950 /nfs/dbraw/zinc/26/49/50/1051264950.db2.gz LYZJECGHGIAIOL-ABAIWWIYSA-N 1 0 309.331 4.318 20 10 DICDRO COCCCC[C@H]([NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC000793232439 1051265897 /nfs/dbraw/zinc/26/58/97/1051265897.db2.gz LKHCASIKWXDZSN-SFHVURJKSA-N 1 0 317.404 4.179 20 10 DICDRO COCCCC[C@@H]([NH2+]Cc1cc(C)ccc1O)c1ccccc1 ZINC000793238784 1051267763 /nfs/dbraw/zinc/26/77/63/1051267763.db2.gz GFADRKXVSAIBQK-LJQANCHMSA-N 1 0 313.441 4.348 20 10 DICDRO CCOc1ccc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)c(O)c1 ZINC000793303979 1051278876 /nfs/dbraw/zinc/27/88/76/1051278876.db2.gz IGFVTEXGGRRIGK-GOSISDBHSA-N 1 0 315.388 4.097 20 10 DICDRO CN(c1ccc(N)cc1)c1cccc(C[NH+]2CCCCC2)c1F ZINC001215678921 1051296176 /nfs/dbraw/zinc/29/61/76/1051296176.db2.gz WMKGFHPVGCISLD-UHFFFAOYSA-N 1 0 313.420 4.162 20 10 DICDRO CCCC[N@H+](Cc1cc2c(cc1O)OCO2)C1CCCCC1 ZINC000746043759 1051308286 /nfs/dbraw/zinc/30/82/86/1051308286.db2.gz BXDQQXZYUAMOCY-UHFFFAOYSA-N 1 0 305.418 4.056 20 10 DICDRO Cc1cccc(C[N@@H+](C)Cc2c(O)ccc3ccncc32)c1C ZINC000793541335 1051313226 /nfs/dbraw/zinc/31/32/26/1051313226.db2.gz BATQYHPVCLUCLA-UHFFFAOYSA-N 1 0 306.409 4.189 20 10 DICDRO CCOC1(C)CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000793547864 1051318200 /nfs/dbraw/zinc/31/82/00/1051318200.db2.gz YGOAPGFJPNYRNV-UHFFFAOYSA-N 1 0 305.462 4.215 20 10 DICDRO C[C@@H]([NH2+]CCC1(O)CCC1)c1ccc(N2CCCCCC2)cc1 ZINC000793566184 1051321817 /nfs/dbraw/zinc/32/18/17/1051321817.db2.gz RKPSWFWTZZZHHS-QGZVFWFLSA-N 1 0 316.489 4.023 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000793607664 1051325203 /nfs/dbraw/zinc/32/52/03/1051325203.db2.gz BOEDXYIASGGSKY-CTNGQTDRSA-N 1 0 323.436 4.203 20 10 DICDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000752267279 1051382999 /nfs/dbraw/zinc/38/29/99/1051382999.db2.gz WZKNIJYISIBIFZ-JSGCOSHPSA-N 1 0 301.352 4.159 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(CC)CCOCC2)cc1 ZINC000766380977 1051409793 /nfs/dbraw/zinc/40/97/93/1051409793.db2.gz DFVQAFWMGYHLQU-INIZCTEOSA-N 1 0 304.478 4.000 20 10 DICDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C(C)(C)C ZINC000766370411 1051410789 /nfs/dbraw/zinc/41/07/89/1051410789.db2.gz TYOMNJGUUJDWOX-QFBILLFUSA-N 1 0 318.505 4.389 20 10 DICDRO C[C@H](Cc1ccncc1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000766490349 1051432167 /nfs/dbraw/zinc/43/21/67/1051432167.db2.gz UEGAPYZHRBUHTG-MSOLQXFVSA-N 1 0 323.484 4.354 20 10 DICDRO C[C@H]([NH2+]CCC(F)(F)F)c1ccc(N2CCCCC2)c(F)c1 ZINC000766529264 1051467866 /nfs/dbraw/zinc/46/78/66/1051467866.db2.gz OGOIXEPPILIVLK-LBPRGKRZSA-N 1 0 318.358 4.419 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2cc(C)ccc2C)c1O ZINC001168924554 1051468023 /nfs/dbraw/zinc/46/80/23/1051468023.db2.gz DWUXZQIMKYVYCG-CYBMUJFWSA-N 1 0 315.388 4.202 20 10 DICDRO CC1(C)CC([NH2+]Cc2cc3ccccc3cc2O)CC(C)(C)O1 ZINC001172651810 1051470229 /nfs/dbraw/zinc/47/02/29/1051470229.db2.gz JDNXGIWXSYREFX-UHFFFAOYSA-N 1 0 313.441 4.371 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@]2(C)Cc2ccccc2)cc1 ZINC001168968248 1051481380 /nfs/dbraw/zinc/48/13/80/1051481380.db2.gz FDBLCNSXRNXKBC-OAQYLSRUSA-N 1 0 308.469 4.350 20 10 DICDRO Oc1cc2c(cc1O)C[N@@H+](C1CCC3(CCCC3)CC1)CCC2 ZINC001172730616 1051490545 /nfs/dbraw/zinc/49/05/45/1051490545.db2.gz LEHKDHXOPKSOLP-UHFFFAOYSA-N 1 0 315.457 4.349 20 10 DICDRO C[C@@H]([NH2+]C[C@@H]1CCCS1)c1ccc(N2CCCCC2)c(F)c1 ZINC000766566818 1051496059 /nfs/dbraw/zinc/49/60/59/1051496059.db2.gz GUCOOQRZMPCDFG-ZBFHGGJFSA-N 1 0 322.493 4.362 20 10 DICDRO COC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000766583074 1051514975 /nfs/dbraw/zinc/51/49/75/1051514975.db2.gz BDTNTPGWYPRCHB-INIZCTEOSA-N 1 0 304.478 4.143 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(CCOC)CCCC2)cc1 ZINC000766583236 1051515630 /nfs/dbraw/zinc/51/56/30/1051515630.db2.gz CEVVWLACBZNDGU-QGZVFWFLSA-N 1 0 318.505 4.390 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCc3c2cccc3OC)cc1 ZINC000766583755 1051517289 /nfs/dbraw/zinc/51/72/89/1051517289.db2.gz KHDIVFXKOXLWIQ-YWZLYKJASA-N 1 0 324.468 4.489 20 10 DICDRO Cc1cccc(C[NH2+][C@H](C)Cc2c(F)cccc2Cl)c1O ZINC001172851372 1051537453 /nfs/dbraw/zinc/53/74/53/1051537453.db2.gz IJIIOLKCNJALQE-GFCCVEGCSA-N 1 0 307.796 4.214 20 10 DICDRO Cc1cccc(C[NH2+][C@@H](C)Cc2ccc(F)cc2Cl)c1O ZINC001172859906 1051546962 /nfs/dbraw/zinc/54/69/62/1051546962.db2.gz KLWAJYDEIRUHTR-LBPRGKRZSA-N 1 0 307.796 4.214 20 10 DICDRO Cc1cccc(C[NH2+][C@H](C)Cc2ccc(F)cc2Cl)c1O ZINC001172859905 1051547794 /nfs/dbraw/zinc/54/77/94/1051547794.db2.gz KLWAJYDEIRUHTR-GFCCVEGCSA-N 1 0 307.796 4.214 20 10 DICDRO C[C@H](Cc1ccc(F)cc1Cl)[N@H+](C)Cc1ccccc1O ZINC001172870620 1051556587 /nfs/dbraw/zinc/55/65/87/1051556587.db2.gz BAXOBPLPYICWJP-GFCCVEGCSA-N 1 0 307.796 4.248 20 10 DICDRO Oc1ccc(CC[NH2+][C@H]2CCCC3(CCCCC3)C2)cc1O ZINC001173348467 1051704513 /nfs/dbraw/zinc/70/45/13/1051704513.db2.gz KUFCVXJDMQCWAI-INIZCTEOSA-N 1 0 303.446 4.123 20 10 DICDRO Oc1ccc(CC[NH2+][C@@H]2CCCC3(CCCCC3)C2)cc1O ZINC001173348470 1051707335 /nfs/dbraw/zinc/70/73/35/1051707335.db2.gz KUFCVXJDMQCWAI-MRXNPFEDSA-N 1 0 303.446 4.123 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+][C@H](CCO)c2ccc(Cl)cc2)c(O)c1 ZINC000806176568 1051749225 /nfs/dbraw/zinc/74/92/25/1051749225.db2.gz MROQQWMLHORROF-CXAGYDPISA-N 1 0 319.832 4.128 20 10 DICDRO CC[C@H]([NH2+]CCC1CC[NH+](CC)CC1)c1cccc(Cl)c1[O-] ZINC000806142026 1051750159 /nfs/dbraw/zinc/75/01/59/1051750159.db2.gz NEVKGQXGNADHAJ-KRWDZBQOSA-N 1 0 324.896 4.208 20 10 DICDRO CC[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1cccc(Cl)c1[O-] ZINC000806157499 1051761896 /nfs/dbraw/zinc/76/18/96/1051761896.db2.gz GDUMEDGADRQVCE-WMLDXEAASA-N 1 0 324.896 4.351 20 10 DICDRO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+]Cc1ccccc1O ZINC000767739441 1051846004 /nfs/dbraw/zinc/84/60/04/1051846004.db2.gz QESMVDDZIKIISP-OAHLLOKOSA-N 1 0 309.331 4.484 20 10 DICDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2c(c1)CCCO2 ZINC000768088808 1051878747 /nfs/dbraw/zinc/87/87/47/1051878747.db2.gz BDORQUQGKRMPGI-FQEVSTJZSA-N 1 0 324.468 4.319 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)cc1F ZINC000768195071 1051901013 /nfs/dbraw/zinc/90/10/13/1051901013.db2.gz KOHRWZSLJRZLOF-INIZCTEOSA-N 1 0 304.434 4.290 20 10 DICDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)c1 ZINC000768231073 1051905968 /nfs/dbraw/zinc/90/59/68/1051905968.db2.gz UKENJDCDDCBTLT-LBPRGKRZSA-N 1 0 321.367 4.262 20 10 DICDRO CCOc1cccc(C[NH+]2CCC(c3ccccc3)CC2)c1O ZINC000768232910 1051907656 /nfs/dbraw/zinc/90/76/56/1051907656.db2.gz HLEJGNYKQVBDQY-UHFFFAOYSA-N 1 0 311.425 4.171 20 10 DICDRO CCOc1cccc(C[N@H+](Cc2cccs2)C(C)C)c1O ZINC000768334182 1051918309 /nfs/dbraw/zinc/91/83/09/1051918309.db2.gz MORQCUYPAZXYNQ-UHFFFAOYSA-N 1 0 305.443 4.263 20 10 DICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(O)cccc1Cl ZINC000768334938 1051919969 /nfs/dbraw/zinc/91/99/69/1051919969.db2.gz RXHXFRWHYPZMET-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)Cc1cc(C)ccc1O ZINC000768338796 1051920809 /nfs/dbraw/zinc/92/08/09/1051920809.db2.gz PMUUMJDJNVGXIK-IBGZPJMESA-N 1 0 311.425 4.219 20 10 DICDRO CC[N@H+](Cc1ccccc1Cl)Cc1c(O)cccc1OC ZINC000768342930 1051921514 /nfs/dbraw/zinc/92/15/14/1051921514.db2.gz UFJITKFPJRFHHN-UHFFFAOYSA-N 1 0 305.805 4.076 20 10 DICDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)c(O)cc1C ZINC000768446426 1051931538 /nfs/dbraw/zinc/93/15/38/1051931538.db2.gz XENNHRZIIVLNBJ-MRXNPFEDSA-N 1 0 311.425 4.007 20 10 DICDRO CCC[N@H+](Cc1cccc(OC)c1O)[C@@H]1CCc2ccccc21 ZINC000768483265 1051933706 /nfs/dbraw/zinc/93/37/06/1051933706.db2.gz FVQRGNWWVMJWHO-GOSISDBHSA-N 1 0 311.425 4.300 20 10 DICDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc3c(cc2O)CCCC3)n1 ZINC000768463417 1051934367 /nfs/dbraw/zinc/93/43/67/1051934367.db2.gz SPXDIOQPVUOPCJ-HXUWFJFHSA-N 1 0 322.452 4.312 20 10 DICDRO COc1cc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c(O)cc1C ZINC000768467132 1051934438 /nfs/dbraw/zinc/93/44/38/1051934438.db2.gz ZTLPCMYROYLIGS-INIZCTEOSA-N 1 0 317.816 4.310 20 10 DICDRO COc1cc(C[N@H+](C)Cc2ccc(Cl)c(F)c2)c(O)cc1C ZINC000768465919 1051934698 /nfs/dbraw/zinc/93/46/98/1051934698.db2.gz SOAMAIMCMWJPNX-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO Cc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)c1 ZINC000743473730 1051940232 /nfs/dbraw/zinc/94/02/32/1051940232.db2.gz QIVHTDJNVBYRBZ-MSOLQXFVSA-N 1 0 324.468 4.243 20 10 DICDRO COc1cccc(C[N@@H+](Cc2ccccc2F)CC(C)C)c1O ZINC000768670986 1051951737 /nfs/dbraw/zinc/95/17/37/1051951737.db2.gz VWDRZIWDXQFGIO-UHFFFAOYSA-N 1 0 317.404 4.198 20 10 DICDRO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1cc(C)ccc1O)CC3 ZINC000768769189 1051958648 /nfs/dbraw/zinc/95/86/48/1051958648.db2.gz QVDZNHVMUJCJOJ-UHFFFAOYSA-N 1 0 306.409 4.049 20 10 DICDRO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(C(C)C)c(C)cc2O)no1 ZINC000747448597 1051970637 /nfs/dbraw/zinc/97/06/37/1051970637.db2.gz IGPOGZWNROVHMZ-SFHVURJKSA-N 1 0 314.429 4.458 20 10 DICDRO Cc1ccc(C[N@H+](C)Cc2ccccc2O)c(Br)c1 ZINC000768873478 1051974587 /nfs/dbraw/zinc/97/45/87/1051974587.db2.gz OFTSBFZTQGCAJR-UHFFFAOYSA-N 1 0 320.230 4.095 20 10 DICDRO C[C@H]1C[NH+](Cc2ccc(N3CCCCC3)cc2)C[C@H](C)S1 ZINC000769142742 1052000524 /nfs/dbraw/zinc/00/05/24/1052000524.db2.gz ZEEHXKRRIRTASI-HOTGVXAUSA-N 1 0 304.503 4.003 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1ccnc2ccccc12 ZINC000769201598 1052009332 /nfs/dbraw/zinc/00/93/32/1052009332.db2.gz XLQHORLEYUISGU-UHFFFAOYSA-N 1 0 306.409 4.353 20 10 DICDRO COc1cccc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)c1O ZINC000769233977 1052011078 /nfs/dbraw/zinc/01/10/78/1052011078.db2.gz SOZWSXTWULODIS-UHFFFAOYSA-N 1 0 317.404 4.341 20 10 DICDRO COc1ccc([C@@H]2CC[N@H+](Cc3cc(Cl)ccc3O)C2)cc1 ZINC000769246230 1052012585 /nfs/dbraw/zinc/01/25/85/1052012585.db2.gz XYMSIPVUOYNGBL-CQSZACIVSA-N 1 0 317.816 4.044 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2c3ccccc3O[C@H]2C)cc1 ZINC000808443764 1052022685 /nfs/dbraw/zinc/02/26/85/1052022685.db2.gz GNMLRYKJIGRNPZ-YWZLYKJASA-N 1 0 310.441 4.145 20 10 DICDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000769319700 1052023129 /nfs/dbraw/zinc/02/31/29/1052023129.db2.gz XKQLBQHGMAEDJT-IBGZPJMESA-N 1 0 310.441 4.098 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C[C@H]1CC[C@H](c2ccccc2)O1 ZINC000808451686 1052025990 /nfs/dbraw/zinc/02/59/90/1052025990.db2.gz WDKQTFDKBYDBEL-SJLPKXTDSA-N 1 0 317.816 4.056 20 10 DICDRO CN(C)c1ccc(C[NH2+]CCC2(F)CCC2)c(C(F)(F)F)c1 ZINC000808428646 1052030648 /nfs/dbraw/zinc/03/06/48/1052030648.db2.gz KBBICZPTCBYGGJ-UHFFFAOYSA-N 1 0 318.358 4.143 20 10 DICDRO CCOc1ccc(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)c(O)c1 ZINC000769381455 1052037916 /nfs/dbraw/zinc/03/79/16/1052037916.db2.gz OLLVCNYYNPWSBN-LBPRGKRZSA-N 1 0 320.458 4.057 20 10 DICDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c1O ZINC000769427088 1052045133 /nfs/dbraw/zinc/04/51/33/1052045133.db2.gz GFJBSOOHZAGNCZ-INIZCTEOSA-N 1 0 319.351 4.016 20 10 DICDRO COc1cccc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)c1O ZINC000769456094 1052058259 /nfs/dbraw/zinc/05/82/59/1052058259.db2.gz HHDCAVPMTCOCOK-DYVFJYSZSA-N 1 0 315.388 4.123 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c1O ZINC000808681202 1052059182 /nfs/dbraw/zinc/05/91/82/1052059182.db2.gz WTYWSBIORZFCOO-CHWSQXEVSA-N 1 0 319.832 4.258 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c1O ZINC000808681205 1052060967 /nfs/dbraw/zinc/06/09/67/1052060967.db2.gz WTYWSBIORZFCOO-STQMWFEESA-N 1 0 319.832 4.258 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c1O ZINC000808685785 1052061519 /nfs/dbraw/zinc/06/15/19/1052061519.db2.gz CUCHAVZLXXNJMO-GFCCVEGCSA-N 1 0 317.816 4.140 20 10 DICDRO Cc1cccc([C@@H](O)C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c1 ZINC000808706203 1052068366 /nfs/dbraw/zinc/06/83/66/1052068366.db2.gz FDWQZQXLCXMFGV-GUYCJALGSA-N 1 0 319.832 4.047 20 10 DICDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000769504798 1052069045 /nfs/dbraw/zinc/06/90/45/1052069045.db2.gz ZQCZVGMQZFNOOO-KRWDZBQOSA-N 1 0 316.832 4.122 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1O ZINC000808704897 1052069266 /nfs/dbraw/zinc/06/92/66/1052069266.db2.gz MRKFAEIITLLJEQ-LLVKDONJSA-N 1 0 320.776 4.113 20 10 DICDRO CCC1(O)CCC([NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000808703868 1052069315 /nfs/dbraw/zinc/06/93/15/1052069315.db2.gz YRIWMICYZVSGFA-MKQDKFQKSA-N 1 0 311.853 4.088 20 10 DICDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000769499978 1052069365 /nfs/dbraw/zinc/06/93/65/1052069365.db2.gz UEEVPGUGNHTKJD-QGZVFWFLSA-N 1 0 317.816 4.391 20 10 DICDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000769502898 1052069920 /nfs/dbraw/zinc/06/99/20/1052069920.db2.gz DXOTYBYAHJGRHS-HNNXBMFYSA-N 1 0 316.832 4.122 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCCc2nccs2)c1O ZINC000808706895 1052070206 /nfs/dbraw/zinc/07/02/06/1052070206.db2.gz AORSTHKHVCAVON-NSHDSACASA-N 1 0 310.850 4.094 20 10 DICDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808708246 1052070870 /nfs/dbraw/zinc/07/08/70/1052070870.db2.gz KCACUMDURNOTNA-GHMZBOCLSA-N 1 0 322.836 4.413 20 10 DICDRO COc1cccc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)c1O ZINC000769512653 1052071085 /nfs/dbraw/zinc/07/10/85/1052071085.db2.gz MQKYEBCQVMMNIW-QGZVFWFLSA-N 1 0 315.388 4.267 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCC[C@H]2CCCCO2)c1O ZINC000808713541 1052072505 /nfs/dbraw/zinc/07/25/05/1052072505.db2.gz ITWOSLXLVCZPBV-DZGCQCFKSA-N 1 0 311.853 4.354 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c1O ZINC000808712427 1052072767 /nfs/dbraw/zinc/07/27/67/1052072767.db2.gz GNRLQPMVLTXVOG-MELADBBJSA-N 1 0 311.853 4.210 20 10 DICDRO COCC[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)c1ccco1 ZINC000808713453 1052072841 /nfs/dbraw/zinc/07/28/41/1052072841.db2.gz NCXOEFAFDNRAIT-SWLSCSKDSA-N 1 0 323.820 4.375 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC[C@@H]2CCCCO2)c1O ZINC000808713542 1052074429 /nfs/dbraw/zinc/07/44/29/1052074429.db2.gz ITWOSLXLVCZPBV-HIFRSBDPSA-N 1 0 311.853 4.354 20 10 DICDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@H]2CCO[C@@H](C)C2)c1O ZINC000808712426 1052074533 /nfs/dbraw/zinc/07/45/33/1052074533.db2.gz GNRLQPMVLTXVOG-IHRRRGAJSA-N 1 0 311.853 4.210 20 10 DICDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2(C(F)(F)F)CC2)c1O ZINC000808717534 1052075996 /nfs/dbraw/zinc/07/59/96/1052075996.db2.gz GEDDIRYAAWWUCI-SECBINFHSA-N 1 0 307.743 4.347 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1cc(F)ccc1O ZINC000808728399 1052084212 /nfs/dbraw/zinc/08/42/12/1052084212.db2.gz QZYFMDCWIHSGJV-URKNILKWSA-N 1 0 315.388 4.102 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1CCCC[NH2+]C1 ZINC001217970391 1052178506 /nfs/dbraw/zinc/17/85/06/1052178506.db2.gz MNGSPSYEKWTEHR-PXKHIBQASA-N 1 0 311.385 4.329 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CCCC[NH2+]C2)=C1 ZINC001217973935 1052179578 /nfs/dbraw/zinc/17/95/78/1052179578.db2.gz LASLNOGNGCALBT-FVGNFYTDSA-N 1 0 311.385 4.329 20 10 DICDRO C[C@H]1C[C@H](Oc2ccccc2NN=C2C=CC=CC2=O)CC[NH2+]1 ZINC001218056835 1052191427 /nfs/dbraw/zinc/19/14/27/1052191427.db2.gz POUMOZZZJMVQGI-KYATVUERSA-N 1 0 311.385 4.327 20 10 DICDRO O=C1C=CC(=NNc2ccc(OC3CC4(C3)CC[NH2+]C4)cc2)C=C1 ZINC001218063776 1052192266 /nfs/dbraw/zinc/19/22/66/1052192266.db2.gz NKVXQZSGIOMZMM-UHFFFAOYSA-N 1 0 323.396 4.329 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@@H]3CCOC4(C[NH2+]C4)C3)cc2)cc1 ZINC001218087306 1052195121 /nfs/dbraw/zinc/19/51/21/1052195121.db2.gz AVOVJMOUDIAJFH-KHOFPDMRSA-N 1 0 323.396 4.002 20 10 DICDRO O=C1C=CC(=NNc2ccc(O[C@H]3CC[C@@]34CC[NH2+]C4)cc2)C=C1 ZINC001218113984 1052199053 /nfs/dbraw/zinc/19/90/53/1052199053.db2.gz APZXDSNIWDFQKW-OALUTQOASA-N 1 0 323.396 4.329 20 10 DICDRO c1ccc(/N=N/c2ccc(O[C@H]3CCO[C@@]34CC[NH2+]C4)cc2)cc1 ZINC001218139554 1052201409 /nfs/dbraw/zinc/20/14/09/1052201409.db2.gz WFOGVDFTQWTBQZ-QZDOXPCSSA-N 1 0 323.396 4.002 20 10 DICDRO c1csc(/N=N/c2c(O[C@H]3CC[NH2+]C3)ccc3ccccc32)n1 ZINC001218180941 1052203297 /nfs/dbraw/zinc/20/32/97/1052203297.db2.gz FWLMXINSBKERIH-LBVBEYCISA-N 1 0 324.409 4.452 20 10 DICDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001218185129 1052203754 /nfs/dbraw/zinc/20/37/54/1052203754.db2.gz VHPKIIVKSMJJLA-AIGGXMEWSA-N 1 0 323.396 4.469 20 10 DICDRO C[C@@H](Oc1ccc(/N=N/c2ccc(N(C)C)cc2)cc1)C1C[NH2+]C1 ZINC001218198200 1052207321 /nfs/dbraw/zinc/20/73/21/1052207321.db2.gz DUXRPTQPHMCRMT-CTBAPTLKSA-N 1 0 324.428 4.155 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2CCC3(C[NH2+]C3)C2)=C1 ZINC001218238469 1052209580 /nfs/dbraw/zinc/20/95/80/1052209580.db2.gz POXKEJLLTXSAHH-YWBAYFEHSA-N 1 0 323.396 4.329 20 10 DICDRO CCCc1cc(N=Nc2ccncc2)ccc1O[C@H]1C[NH2+][C@@H]1C ZINC001218392221 1052232963 /nfs/dbraw/zinc/23/29/63/1052232963.db2.gz OXMXPGWWVFWDHO-ACJLOTCBSA-N 1 0 310.401 4.189 20 10 DICDRO C[C@H]1C[NH2+]CC[C@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001218425702 1052237038 /nfs/dbraw/zinc/23/70/38/1052237038.db2.gz ULHRAOMIIYQETB-SCLBCKFNSA-N 1 0 311.385 4.184 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CC[C@@H]3C[NH2+]C[C@@H]23)=C1 ZINC001218460600 1052242502 /nfs/dbraw/zinc/24/25/02/1052242502.db2.gz NFUXWNLHWRYUKT-KSDVFSPFSA-N 1 0 323.396 4.184 20 10 DICDRO CCC1(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)CCOCC1 ZINC000324360983 1052284924 /nfs/dbraw/zinc/28/49/24/1052284924.db2.gz VVNPNDJXHVCWHX-HNNXBMFYSA-N 1 0 313.441 4.403 20 10 DICDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2ccsc2)c1O ZINC000153544569 1052381748 /nfs/dbraw/zinc/38/17/48/1052381748.db2.gz QZLIUZGUKKEQRS-HNNXBMFYSA-N 1 0 303.427 4.190 20 10 DICDRO Cc1cc(O)c(C[NH2+]CCC2CC(OC(C)(C)C)C2)cc1C ZINC000762459633 1052386500 /nfs/dbraw/zinc/38/65/00/1052386500.db2.gz DGZWNCXXBAXDJI-UHFFFAOYSA-N 1 0 305.462 4.082 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)Cc2ccc(Cl)c(F)c2)c1O ZINC000762501492 1052392306 /nfs/dbraw/zinc/39/23/06/1052392306.db2.gz JPFWGWDYHFYHMF-UHFFFAOYSA-N 1 0 323.795 4.134 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]C1(c2ccc(F)cc2F)CCC1 ZINC000762628328 1052408005 /nfs/dbraw/zinc/40/80/05/1052408005.db2.gz MPYROCIUJQDIEU-UHFFFAOYSA-N 1 0 323.770 4.493 20 10 DICDRO Cc1ccc([C@@H](C)[NH2+]CCC2CC(OC(C)(C)C)C2)c(O)c1 ZINC000762621501 1052408782 /nfs/dbraw/zinc/40/87/82/1052408782.db2.gz KHNYSERULCWPTN-QQFBHYJXSA-N 1 0 305.462 4.335 20 10 DICDRO C[C@@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1ccc(N(C)C)cc1 ZINC000762643721 1052410858 /nfs/dbraw/zinc/41/08/58/1052410858.db2.gz QXNCDCJMVVSYPI-MDCZIUGASA-N 1 0 318.505 4.387 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2ccc(OC(C)C)cc2)c1O ZINC000237235317 1052437069 /nfs/dbraw/zinc/43/70/69/1052437069.db2.gz GQQURLOYIQVMMI-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@H](C)c2cccc(OC(C)C)c2)c1 ZINC000237206302 1052437327 /nfs/dbraw/zinc/43/73/27/1052437327.db2.gz FDJUSILFCGQHMY-CQSZACIVSA-N 1 0 315.413 4.039 20 10 DICDRO COc1cccc(C[NH2+][C@@H]2CC(C)(C)Cc3oc(C)cc32)c1O ZINC000237414099 1052440698 /nfs/dbraw/zinc/44/06/98/1052440698.db2.gz DAWGLJBTIPICSM-OAHLLOKOSA-N 1 0 315.413 4.106 20 10 DICDRO COc1cccc(C[N@H+](C)Cc2cc(C(C)C)c(C)cc2O)c1 ZINC000915805739 1052481458 /nfs/dbraw/zinc/48/14/58/1052481458.db2.gz XYDAFGJFPCPMTM-UHFFFAOYSA-N 1 0 313.441 4.465 20 10 DICDRO Cc1ccccc1C[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000915809247 1052481537 /nfs/dbraw/zinc/48/15/37/1052481537.db2.gz QFGIFSYEOVHWCI-UHFFFAOYSA-N 1 0 313.441 4.336 20 10 DICDRO CC(F)(F)CCC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000929972777 1052720156 /nfs/dbraw/zinc/72/01/56/1052720156.db2.gz VGWYMWLSUQVXQL-UHFFFAOYSA-N 1 0 309.356 4.423 20 10 DICDRO CC[C@@H]([NH2+]CCCn1c(C)nc2ccccc21)c1ccccc1O ZINC000154893938 1052850802 /nfs/dbraw/zinc/85/08/02/1052850802.db2.gz WERWKXYMLUJYJL-QGZVFWFLSA-N 1 0 323.440 4.181 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccccc2OC)cc1 ZINC000322269186 1052865996 /nfs/dbraw/zinc/86/59/96/1052865996.db2.gz VGVWVJHCRXKWKH-INIZCTEOSA-N 1 0 312.457 4.392 20 10 DICDRO CCc1cc(C[N@@H+]2CCCSCC2)c(O)c(C(C)(C)C)c1 ZINC000919939498 1052905350 /nfs/dbraw/zinc/90/53/50/1052905350.db2.gz XICXIQPSBQCHMK-UHFFFAOYSA-N 1 0 307.503 4.191 20 10 DICDRO CCOC1CC[NH+](Cc2cc(CC)cc(C(C)(C)C)c2O)CC1 ZINC000919944208 1052905388 /nfs/dbraw/zinc/90/53/88/1052905388.db2.gz XJMLAFOIRJANQC-UHFFFAOYSA-N 1 0 319.489 4.253 20 10 DICDRO Cc1cc(C[NH2+]Cc2c(C)noc2C)c(C)n1-c1cccc(C)c1 ZINC000920411229 1052938220 /nfs/dbraw/zinc/93/82/20/1052938220.db2.gz RZJQDXJIZTWSSG-UHFFFAOYSA-N 1 0 323.440 4.297 20 10 DICDRO C[C@@H](CCO)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000237572540 1053013435 /nfs/dbraw/zinc/01/34/35/1053013435.db2.gz DOWDEDSDKXNIIR-AWEZNQCLSA-N 1 0 321.505 4.095 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2c[nH]c3ccccc32)CC1 ZINC000179555160 1053016361 /nfs/dbraw/zinc/01/63/61/1053016361.db2.gz CWJKBIXYVVMZLA-UHFFFAOYSA-N 1 0 306.409 4.253 20 10 DICDRO COc1ccc(O)c(C[N@H+](Cc2ccco2)Cc2ccccc2)c1 ZINC000179582651 1053017035 /nfs/dbraw/zinc/01/70/35/1053017035.db2.gz PDPBFPVGVCQWDX-UHFFFAOYSA-N 1 0 323.392 4.196 20 10 DICDRO C[C@@H](c1ccccc1)N(Cc1ccon1)Cc1ccccc1O ZINC000179647185 1053020133 /nfs/dbraw/zinc/02/01/33/1053020133.db2.gz ZQABWUKEWLFKQM-HNNXBMFYSA-N 1 0 308.381 4.144 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Oc1ccc(N(C)C)cc1 ZINC001227939258 1053030496 /nfs/dbraw/zinc/03/04/96/1053030496.db2.gz QBJONMJUMNGKGR-UWJYYQICSA-N 1 0 324.468 4.042 20 10 DICDRO C[C@H]([NH2+]Cc1ccc(F)cc1Br)c1ccccc1O ZINC000179889591 1053034777 /nfs/dbraw/zinc/03/47/77/1053034777.db2.gz JCWLDRIYIFJGHI-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCCc2cccnc21 ZINC001350987193 1053125689 /nfs/dbraw/zinc/12/56/89/1053125689.db2.gz JWSMHBLCYRXXJE-BMFZPTHFSA-N 1 0 308.425 4.311 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CCCc2cccnc21 ZINC001350987194 1053125831 /nfs/dbraw/zinc/12/58/31/1053125831.db2.gz JWSMHBLCYRXXJE-FVQBIDKESA-N 1 0 308.425 4.311 20 10 DICDRO Cc1ccc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)c(C)c1 ZINC001318368554 1053165991 /nfs/dbraw/zinc/16/59/91/1053165991.db2.gz WUEZVKNYJPJNKO-UHFFFAOYSA-N 1 0 308.469 4.236 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CN(C)Cc2ccccc21 ZINC001320132222 1053309472 /nfs/dbraw/zinc/30/94/72/1053309472.db2.gz IUOHLIXNPARITI-OLMNPRSZSA-N 1 0 322.452 4.025 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCO[C@@H](CC(C)C)C1 ZINC001320133873 1053309853 /nfs/dbraw/zinc/30/98/53/1053309853.db2.gz RQRPEXJSJRKGFH-NCOADZHNSA-N 1 0 317.473 4.432 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CN(C)Cc2ccccc21 ZINC001320132219 1053310074 /nfs/dbraw/zinc/31/00/74/1053310074.db2.gz IUOHLIXNPARITI-JLSDUUJJSA-N 1 0 322.452 4.025 20 10 DICDRO CCOCCC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC001320253758 1053319649 /nfs/dbraw/zinc/31/96/49/1053319649.db2.gz ZUAFNXKFAWOIMP-JKSUJKDBSA-N 1 0 317.473 4.435 20 10 DICDRO CCO[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)C12CCC2 ZINC001320410470 1053331357 /nfs/dbraw/zinc/33/13/57/1053331357.db2.gz BSJWTMMZHSXVKV-NXNVCVFFSA-N 1 0 315.457 4.186 20 10 DICDRO CCc1nc(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)cs1 ZINC001320411281 1053333064 /nfs/dbraw/zinc/33/30/64/1053333064.db2.gz LIYZKSFRVGOGJF-GXTWGEPZSA-N 1 0 316.470 4.100 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCSCC(F)(F)F ZINC001320423824 1053333296 /nfs/dbraw/zinc/33/32/96/1053333296.db2.gz CGFIMCNXMDQOIS-GHMZBOCLSA-N 1 0 319.392 4.134 20 10 DICDRO C[C@H]([NH2+]CCCCCCO)c1ccc(N2CCCCC2)c(F)c1 ZINC000182146424 1053359697 /nfs/dbraw/zinc/35/96/97/1053359697.db2.gz SVJZPKPCOYBUMO-INIZCTEOSA-N 1 0 322.468 4.019 20 10 DICDRO Fc1cc(Cl)ccc1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001320765711 1053359812 /nfs/dbraw/zinc/35/98/12/1053359812.db2.gz ZPFSMFOIXQIGOW-UHFFFAOYSA-N 1 0 318.823 4.369 20 10 DICDRO COc1ccc(F)cc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001320763257 1053359883 /nfs/dbraw/zinc/35/98/83/1053359883.db2.gz GVFJAFOUSZSHLU-DOMZBBRYSA-N 1 0 315.388 4.186 20 10 DICDRO CC[C@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)c1ccc(F)cc1 ZINC001320906176 1053374544 /nfs/dbraw/zinc/37/45/44/1053374544.db2.gz ZGUPCJRCTPHYOE-KRWDZBQOSA-N 1 0 319.351 4.114 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1cccc(N(C)C)c1 ZINC001321023692 1053383479 /nfs/dbraw/zinc/38/34/79/1053383479.db2.gz OIPJRIOGRQBWPY-WMLDXEAASA-N 1 0 310.441 4.105 20 10 DICDRO CCCC[N@H+](Cc1ncoc1C(C)C)Cc1ccccc1O ZINC001321242838 1053403716 /nfs/dbraw/zinc/40/37/16/1053403716.db2.gz FZWBQXRVPRZTEO-UHFFFAOYSA-N 1 0 302.418 4.306 20 10 DICDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2C[NH+]3CCC2CC3)=C1 ZINC001229813801 1053408448 /nfs/dbraw/zinc/40/84/48/1053408448.db2.gz BCOAEGRQHBPQAU-UOFXHNCJSA-N 1 0 323.396 4.281 20 10 DICDRO C[C@H](C[N+](C)(C)C)OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001229817014 1053410480 /nfs/dbraw/zinc/41/04/80/1053410480.db2.gz YJKQBLTWCUVEJM-CQSZACIVSA-O 1 0 314.409 4.281 20 10 DICDRO CC[C@H]([NH2+][C@@H]1CCCc2cn(C(C)C)nc21)c1ccccc1O ZINC001321387761 1053411229 /nfs/dbraw/zinc/41/12/29/1053411229.db2.gz WIFIMQUJVKACJJ-DLBZAZTESA-N 1 0 313.445 4.288 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccc(F)cc1 ZINC000182323345 1053413172 /nfs/dbraw/zinc/41/31/72/1053413172.db2.gz HWMNUJMBNSHNLR-YVEFUNNKSA-N 1 0 303.377 4.342 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC001321457410 1053414793 /nfs/dbraw/zinc/41/47/93/1053414793.db2.gz OQLVEEUUBPWTSO-UUAJXVIYSA-N 1 0 317.473 4.432 20 10 DICDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CCC(F)(F)C1 ZINC000763524216 1053414925 /nfs/dbraw/zinc/41/49/25/1053414925.db2.gz YUJBOAGCIZURDB-INIZCTEOSA-N 1 0 303.352 4.337 20 10 DICDRO CCc1ccc2c(c1)C[N@@H+](Cc1cc(Cl)c(C)cc1O)CC2 ZINC001474760631 1053427954 /nfs/dbraw/zinc/42/79/54/1053427954.db2.gz UIQMSZRSQJSOCR-UHFFFAOYSA-N 1 0 315.844 4.475 20 10 DICDRO Oc1cccc(Cl)c1C[NH+]1CCC(Nc2ccccc2)CC1 ZINC001323304116 1053572288 /nfs/dbraw/zinc/57/22/88/1053572288.db2.gz UXLSFMKONPKVPS-UHFFFAOYSA-N 1 0 316.832 4.122 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]Cc2csc(C)c2)cc1F ZINC001200354869 1053589908 /nfs/dbraw/zinc/58/99/08/1053589908.db2.gz DTSCMZGDOHQKJG-UHFFFAOYSA-N 1 0 306.450 4.332 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)CCc1ccc(O)cc1 ZINC000326835241 1053618738 /nfs/dbraw/zinc/61/87/38/1053618738.db2.gz NCSUBFDOJZVJPK-HNNXBMFYSA-N 1 0 322.452 4.303 20 10 DICDRO CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001200391112 1053625548 /nfs/dbraw/zinc/62/55/48/1053625548.db2.gz WFVJJRRJDIKYQM-SFHVURJKSA-N 1 0 315.844 4.386 20 10 DICDRO CC1(C)C[N@H+](Cc2ccc(N3CCCC3)cc2)[C@H]1c1ccncc1 ZINC001324276596 1053639710 /nfs/dbraw/zinc/63/97/10/1053639710.db2.gz REAWFQNCJYNQLJ-FQEVSTJZSA-N 1 0 321.468 4.265 20 10 DICDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1nc(C(C)(C)C)cs1 ZINC001324543383 1053660936 /nfs/dbraw/zinc/66/09/36/1053660936.db2.gz SVGIMROBCSKFHV-AAEUAGOBSA-N 1 0 316.470 4.484 20 10 DICDRO Oc1c(C[NH2+]CCCCOc2ccccc2)ccc2ccccc21 ZINC001324554330 1053661276 /nfs/dbraw/zinc/66/12/76/1053661276.db2.gz JTHHIUWGVCPZOO-UHFFFAOYSA-N 1 0 321.420 4.494 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC001324602313 1053664648 /nfs/dbraw/zinc/66/46/48/1053664648.db2.gz UKEWPONWAPURBP-OWCLPIDISA-N 1 0 315.457 4.188 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1F ZINC000183505210 1053665522 /nfs/dbraw/zinc/66/55/22/1053665522.db2.gz PLHZUUNCGZSJPW-CQSZACIVSA-N 1 0 316.420 4.228 20 10 DICDRO C[C@@H]([NH2+]C[C@H](O)c1ccc(C(C)(C)C)cc1)c1ccccc1O ZINC000183516906 1053670500 /nfs/dbraw/zinc/67/05/00/1053670500.db2.gz RICRNRKSLIBEGX-KUHUBIRLSA-N 1 0 313.441 4.074 20 10 DICDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc(C(C)(C)C)cc1)c1ccccc1O ZINC000183516945 1053670529 /nfs/dbraw/zinc/67/05/29/1053670529.db2.gz RICRNRKSLIBEGX-AUUYWEPGSA-N 1 0 313.441 4.074 20 10 DICDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)c(OCC2CC2)c1 ZINC000183550466 1053676961 /nfs/dbraw/zinc/67/69/61/1053676961.db2.gz CBBFUSSFBSKXIJ-HNNXBMFYSA-N 1 0 311.425 4.340 20 10 DICDRO CC[C@H](C[NH2+][C@H](C)c1ccccc1O)Oc1ccccc1F ZINC000183544525 1053677495 /nfs/dbraw/zinc/67/74/95/1053677495.db2.gz TXHPCOQGTLPQBW-ZIAGYGMSSA-N 1 0 303.377 4.040 20 10 DICDRO CS[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001324749109 1053678084 /nfs/dbraw/zinc/67/80/84/1053678084.db2.gz DJYLSJPXVQJKIJ-MSOLQXFVSA-N 1 0 304.503 4.003 20 10 DICDRO Cc1c2ccccc2oc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001200486964 1053696562 /nfs/dbraw/zinc/69/65/62/1053696562.db2.gz QLKLYTSUTOCNFE-UHFFFAOYSA-N 1 0 307.393 4.356 20 10 DICDRO COCC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)c1ccco1 ZINC001325357932 1053716893 /nfs/dbraw/zinc/71/68/93/1053716893.db2.gz YAERJLYCBKEKER-QLFBSQMISA-N 1 0 315.413 4.209 20 10 DICDRO Cc1cc(NCc2ccc(N3CCCC3)cc2)ccc1C[NH+](C)C ZINC001325382967 1053717190 /nfs/dbraw/zinc/71/71/90/1053717190.db2.gz JSNUKNGLIMLPKY-UHFFFAOYSA-N 1 0 323.484 4.269 20 10 DICDRO C[N@@H+]1CCC[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001231320929 1053727113 /nfs/dbraw/zinc/72/71/13/1053727113.db2.gz ZREPSHYAAILUKB-GOSISDBHSA-N 1 0 311.385 4.281 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H](C)Oc1ccccc1 ZINC001200553101 1053753769 /nfs/dbraw/zinc/75/37/69/1053753769.db2.gz ZUFSNORHAWNZDC-OAHLLOKOSA-N 1 0 308.425 4.044 20 10 DICDRO Oc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCCC12CC2 ZINC001231465934 1053757916 /nfs/dbraw/zinc/75/79/16/1053757916.db2.gz IFXJSPFZWMSMGI-UHFFFAOYSA-N 1 0 309.409 4.100 20 10 DICDRO C[C@@H]1CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001231466762 1053759225 /nfs/dbraw/zinc/75/92/25/1053759225.db2.gz VHBCVTZTIUTTRZ-MRXNPFEDSA-N 1 0 311.425 4.203 20 10 DICDRO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C(C)C ZINC001200582418 1053787768 /nfs/dbraw/zinc/78/77/68/1053787768.db2.gz ZILJJEXNYTUNAZ-FQEVSTJZSA-N 1 0 323.484 4.477 20 10 DICDRO Cc1cccc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1O ZINC001231592227 1053793880 /nfs/dbraw/zinc/79/38/80/1053793880.db2.gz GJKGGDIRETVTRB-OAHLLOKOSA-N 1 0 301.817 4.344 20 10 DICDRO COc1cc(C[NH+](CCC(C)C)CCC(C)C)c(O)cc1O ZINC001231639473 1053814302 /nfs/dbraw/zinc/81/43/02/1053814302.db2.gz QNLZADLZHVTRET-UHFFFAOYSA-N 1 0 309.450 4.001 20 10 DICDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000273379444 1053848526 /nfs/dbraw/zinc/84/85/26/1053848526.db2.gz HZAVFPWAQHGTHF-STQMWFEESA-N 1 0 303.377 4.260 20 10 DICDRO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc3ccccc3c2O)s1 ZINC000274281539 1053861482 /nfs/dbraw/zinc/86/14/82/1053861482.db2.gz YMJOOWBKLHDVPX-MNOVXSKESA-N 1 0 313.426 4.117 20 10 DICDRO Cc1ncc(C[N@H+](Cc2ccccc2O)[C@@H](C)c2ccccc2)o1 ZINC001354468992 1053876469 /nfs/dbraw/zinc/87/64/69/1053876469.db2.gz KPLJHKYQLKLOFG-HNNXBMFYSA-N 1 0 322.408 4.452 20 10 DICDRO COCC1(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC001327835698 1053883488 /nfs/dbraw/zinc/88/34/88/1053883488.db2.gz XUAOASPONHXWSG-LSDHHAIUSA-N 1 0 303.446 4.045 20 10 DICDRO Cc1cc(O)c(C[NH2+]C2CCC(C(F)F)CC2)cc1Cl ZINC001327881848 1053889172 /nfs/dbraw/zinc/88/91/72/1053889172.db2.gz UKFXMZQIOJKNKN-UHFFFAOYSA-N 1 0 303.780 4.268 20 10 DICDRO Cc1cc(C)c(C[N@@H+]2CCSC[C@H]2c2ccccc2)c(O)c1 ZINC001231846826 1053890641 /nfs/dbraw/zinc/89/06/41/1053890641.db2.gz QIQIJBLAZSVXAU-SFHVURJKSA-N 1 0 313.466 4.299 20 10 DICDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(N(C)C)cc1OC ZINC001231854999 1053891720 /nfs/dbraw/zinc/89/17/20/1053891720.db2.gz NTPBJPYFJIWTNN-IBGZPJMESA-N 1 0 312.457 4.344 20 10 DICDRO COc1cc(N(C)C)ccc1C[N@H+](Cc1ccccc1)C1CCC1 ZINC001231857406 1053895022 /nfs/dbraw/zinc/89/50/22/1053895022.db2.gz JASHTAZREMOUOX-UHFFFAOYSA-N 1 0 324.468 4.316 20 10 DICDRO Cc1cc(C[NH2+]CCCSc2nccs2)ccc1Cl ZINC001200692002 1053898592 /nfs/dbraw/zinc/89/85/92/1053898592.db2.gz LBKROFRKVVHIQB-UHFFFAOYSA-N 1 0 312.891 4.377 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCCC3(CC(F)C3)CC2)cc1Cl ZINC001231870250 1053900453 /nfs/dbraw/zinc/90/04/53/1053900453.db2.gz PQXPOHSRKSTYGO-UHFFFAOYSA-N 1 0 311.828 4.458 20 10 DICDRO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc2ccccc2c1O ZINC001231879604 1053901369 /nfs/dbraw/zinc/90/13/69/1053901369.db2.gz KEGDXCUIMXCFNJ-UHFFFAOYSA-N 1 0 318.829 4.287 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)ccc2ccccc21 ZINC001231878740 1053901861 /nfs/dbraw/zinc/90/18/61/1053901861.db2.gz RMVBBIGMDPFEBP-OAHLLOKOSA-N 1 0 309.331 4.115 20 10 DICDRO Cc1ccc2c(c1)C[N@@H+](Cc1ccc3ccccc3c1O)CC2 ZINC001231879609 1053902903 /nfs/dbraw/zinc/90/29/03/1053902903.db2.gz KJAJIUOAFFNQLY-UHFFFAOYSA-N 1 0 303.405 4.412 20 10 DICDRO COc1ccc2c(c1)C[N@@H+](Cc1ccc3ccccc3c1O)C2 ZINC001231880712 1053906603 /nfs/dbraw/zinc/90/66/03/1053906603.db2.gz FBDJDZXCYJUPEZ-UHFFFAOYSA-N 1 0 305.377 4.070 20 10 DICDRO C[C@H]([NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F)c1cc(Cl)ccc1O ZINC001328098298 1053907806 /nfs/dbraw/zinc/90/78/06/1053907806.db2.gz PXQMQIWAWCNCTQ-YPWHJJHSSA-N 1 0 301.764 4.130 20 10 DICDRO Cc1ccccc1O[C@H](C)C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001200772623 1053961530 /nfs/dbraw/zinc/96/15/30/1053961530.db2.gz CYZQNCYWIATACH-PDFOZTTASA-N 1 0 324.468 4.131 20 10 DICDRO COc1ccc(C[NH2+]Cc2ccccc2OC(C)(C)C)cc1C ZINC001200783133 1053970279 /nfs/dbraw/zinc/97/02/79/1053970279.db2.gz DISPCYWABSDARP-UHFFFAOYSA-N 1 0 313.441 4.471 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CCC12CCOCC2 ZINC001329374675 1053986857 /nfs/dbraw/zinc/98/68/57/1053986857.db2.gz DIUWLSBBFPIGCX-OAGGEKHMSA-N 1 0 315.457 4.045 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC001329589906 1053999290 /nfs/dbraw/zinc/99/92/90/1053999290.db2.gz WICLFYJAQLZFPK-CSMYWGQOSA-N 1 0 309.409 4.232 20 10 DICDRO CC1(C)C[N@H+](Cc2cc(Cl)c(O)cc2O)Cc2ccccc21 ZINC001232262909 1054005500 /nfs/dbraw/zinc/00/55/00/1054005500.db2.gz VQSXYDBNXILWLD-UHFFFAOYSA-N 1 0 317.816 4.045 20 10 DICDRO COc1cc(O)c(C[N@H+](C)Cc2ccc(C)c(C)c2)cc1Cl ZINC001232268565 1054008545 /nfs/dbraw/zinc/00/85/45/1054008545.db2.gz PLALVHHOZZXBIV-UHFFFAOYSA-N 1 0 319.832 4.303 20 10 DICDRO c1ccc2c(c1)SC[C@H]2C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001330563374 1054040656 /nfs/dbraw/zinc/04/06/56/1054040656.db2.gz HRZZZLVYNVXZDV-QGZVFWFLSA-N 1 0 324.493 4.266 20 10 DICDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1OC(F)F ZINC000296024408 1054085452 /nfs/dbraw/zinc/08/54/52/1054085452.db2.gz PRQJCYJBGHOIDV-RISCZKNCSA-N 1 0 319.351 4.332 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1cc3ccc(Cl)cc3[nH]1)CC2 ZINC001232734838 1054110872 /nfs/dbraw/zinc/11/08/72/1054110872.db2.gz KCLOXQDHIQYBPS-UHFFFAOYSA-N 1 0 312.800 4.085 20 10 DICDRO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(N(C)C)cc1O ZINC001232840533 1054127464 /nfs/dbraw/zinc/12/74/64/1054127464.db2.gz ZDLYSOURNAZSRQ-ZDUSSCGKSA-N 1 0 318.848 4.305 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCCc2cccnc21 ZINC001332912659 1054131865 /nfs/dbraw/zinc/13/18/65/1054131865.db2.gz JWSMHBLCYRXXJE-KBMXLJTQSA-N 1 0 308.425 4.311 20 10 DICDRO Cc1cnc(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c(C)c1 ZINC001332947605 1054133855 /nfs/dbraw/zinc/13/38/55/1054133855.db2.gz ZRDPIZMIRKFVPW-DOTOQJQBSA-N 1 0 310.441 4.093 20 10 DICDRO C[C@H]([NH2+][C@H](C1CC1)[C@@H]1CCCCO1)c1ccc(Cl)cc1O ZINC000848557802 1054149078 /nfs/dbraw/zinc/14/90/78/1054149078.db2.gz HOERGIOUSRIVDX-MZPVMMEZSA-N 1 0 309.837 4.044 20 10 DICDRO CC[C@H]([NH2+][C@@H](C1CC1)[C@@H]1CCCCO1)c1ccc(C)cc1O ZINC000848557541 1054149226 /nfs/dbraw/zinc/14/92/26/1054149226.db2.gz FOGIAGDJKWMOOI-WDSOQIARSA-N 1 0 303.446 4.089 20 10 DICDRO COc1c(C)cccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000848560292 1054149503 /nfs/dbraw/zinc/14/95/03/1054149503.db2.gz KONGBWVZNDUGHQ-WFASDCNBSA-N 1 0 315.388 4.186 20 10 DICDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccccn1)c1cc(Cl)ccc1O ZINC000848564048 1054151195 /nfs/dbraw/zinc/15/11/95/1054151195.db2.gz AMLAVLMWJZPGAB-BLLLJJGKSA-N 1 0 304.821 4.113 20 10 DICDRO COc1cccc([C@@H](C)[NH2+][C@H](C)C2CCC(F)(F)CC2)c1O ZINC000848567630 1054154325 /nfs/dbraw/zinc/15/43/25/1054154325.db2.gz KEFBNCISHMPVGX-VXGBXAGGSA-N 1 0 313.388 4.265 20 10 DICDRO C[C@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)c1cc(F)ccc1O ZINC000848567715 1054155185 /nfs/dbraw/zinc/15/51/85/1054155185.db2.gz LVJBROIMZAAOBN-QWRGUYRKSA-N 1 0 301.352 4.396 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2noc3ccccc23)cc1 ZINC000848573607 1054156562 /nfs/dbraw/zinc/15/65/62/1054156562.db2.gz WLSZMOUZIQDXKW-AWEZNQCLSA-N 1 0 309.413 4.135 20 10 DICDRO Cc1ccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)c(Cl)n1 ZINC001334385821 1054188040 /nfs/dbraw/zinc/18/80/40/1054188040.db2.gz WECDXPKOJWQPIB-UHFFFAOYSA-N 1 0 311.212 4.001 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H]2c2nccs2)c1 ZINC001233286248 1054222744 /nfs/dbraw/zinc/22/27/44/1054222744.db2.gz MAJQQQPFGNDVNV-HNNXBMFYSA-N 1 0 316.470 4.483 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCOc3ccccc3C2)c1 ZINC001233286169 1054223158 /nfs/dbraw/zinc/22/31/58/1054223158.db2.gz IOQFMKOUOBRURM-UHFFFAOYSA-N 1 0 311.425 4.084 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)c1 ZINC001233283923 1054223200 /nfs/dbraw/zinc/22/32/00/1054223200.db2.gz AYEZOLMEXQSVMI-IRXDYDNUSA-N 1 0 315.457 4.023 20 10 DICDRO COc1cc(Cl)cc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1O ZINC001233287208 1054224576 /nfs/dbraw/zinc/22/45/76/1054224576.db2.gz BPFZHEXRIJKPGJ-LBPRGKRZSA-N 1 0 317.816 4.174 20 10 DICDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccn3)C2)c1 ZINC001233286381 1054224709 /nfs/dbraw/zinc/22/47/09/1054224709.db2.gz RGCBIUCANVUDJF-HNNXBMFYSA-N 1 0 310.441 4.074 20 10 DICDRO COc1cc(Cl)cc(C[N@H+](C)C/C=C/c2ccccc2)c1O ZINC001233290114 1054226065 /nfs/dbraw/zinc/22/60/65/1054226065.db2.gz KAWNSCGJHXELCZ-RMKNXTFCSA-N 1 0 317.816 4.199 20 10 DICDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c([O-])ccc(F)c2F)cc1 ZINC001233334296 1054235331 /nfs/dbraw/zinc/23/53/31/1054235331.db2.gz AWWBBTTZADIJDF-INIZCTEOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c([O-])ccc(F)c1F ZINC001233332208 1054235492 /nfs/dbraw/zinc/23/54/92/1054235492.db2.gz CGSVGTSCTFFJDL-INIZCTEOSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](CN2CCCC2)c2ccccc2)c(O)c1 ZINC000184919752 1054267243 /nfs/dbraw/zinc/26/72/43/1054267243.db2.gz ICUXCPGAMMFKMM-PXNSSMCTSA-N 1 0 324.468 4.188 20 10 DICDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001233454790 1054276428 /nfs/dbraw/zinc/27/64/28/1054276428.db2.gz KGQSQIGEILSWOL-HNNXBMFYSA-N 1 0 307.315 4.358 20 10 DICDRO Oc1cccc2c1C[N@H+](Cc1ccc3nc(Cl)ccc3c1)CC2 ZINC001233445812 1054277239 /nfs/dbraw/zinc/27/72/39/1054277239.db2.gz VPELQKVWASXOOD-UHFFFAOYSA-N 1 0 324.811 4.152 20 10 DICDRO CCc1cccc(C[NH+]2CCC(C(=O)c3ccccc3)CC2)c1O ZINC000848881408 1054281493 /nfs/dbraw/zinc/28/14/93/1054281493.db2.gz ORMTWXIIVLCCLJ-UHFFFAOYSA-N 1 0 323.436 4.050 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1OCCc2ccccc21 ZINC001337797762 1054285725 /nfs/dbraw/zinc/28/57/25/1054285725.db2.gz CWINSXLSRRWXJG-LSBZLQRGSA-N 1 0 323.436 4.153 20 10 DICDRO COc1cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)ccc1C ZINC001337786057 1054286376 /nfs/dbraw/zinc/28/63/76/1054286376.db2.gz UVAAHAARNJYYBN-GOEBONIOSA-N 1 0 311.425 4.356 20 10 DICDRO CCc1cccc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)c1O ZINC000848894977 1054287887 /nfs/dbraw/zinc/28/78/87/1054287887.db2.gz JBLCLQHVJMYTAP-UHFFFAOYSA-N 1 0 301.817 4.387 20 10 DICDRO CCc1cccc(C[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)c1O ZINC000848895980 1054288533 /nfs/dbraw/zinc/28/85/33/1054288533.db2.gz XBILUBZKVZUEQQ-UHFFFAOYSA-N 1 0 308.425 4.343 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCCOc3cc(F)ccc32)c1O ZINC000848900571 1054289063 /nfs/dbraw/zinc/28/90/63/1054289063.db2.gz NZLMEIUQXCKDOY-KRWDZBQOSA-N 1 0 315.388 4.097 20 10 DICDRO CCc1cccc(C[NH2+][C@@H]2CCCOc3c(F)cccc32)c1O ZINC000848901230 1054291256 /nfs/dbraw/zinc/29/12/56/1054291256.db2.gz PXLWQGJARCBLJJ-QGZVFWFLSA-N 1 0 315.388 4.097 20 10 DICDRO COc1cc(C)cc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1O ZINC001338234935 1054299731 /nfs/dbraw/zinc/29/97/31/1054299731.db2.gz PTULJVRSVKRSGS-ZDUSSCGKSA-N 1 0 301.386 4.028 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000185068120 1054343814 /nfs/dbraw/zinc/34/38/14/1054343814.db2.gz ZDNBQUARAGOIOF-MRXNPFEDSA-N 1 0 312.457 4.398 20 10 DICDRO Oc1c(C[N@@H+]2CCC3(CCCC3)C2)cccc1OC(F)(F)F ZINC001233760851 1054353684 /nfs/dbraw/zinc/35/36/84/1054353684.db2.gz LTKMSFZKDAOYSE-UHFFFAOYSA-N 1 0 315.335 4.057 20 10 DICDRO Cc1cnc(C(C)(C)[NH2+]Cc2ccc(N3CCCC3)cc2)s1 ZINC001340022495 1054354412 /nfs/dbraw/zinc/35/44/12/1054354412.db2.gz WCYCPHQKGCHVHK-UHFFFAOYSA-N 1 0 315.486 4.077 20 10 DICDRO Oc1c(C[NH+]2CCCCCCC2)cccc1OC(F)(F)F ZINC001233761340 1054354475 /nfs/dbraw/zinc/35/44/75/1054354475.db2.gz RTZGFLKLYJSVCN-UHFFFAOYSA-N 1 0 303.324 4.057 20 10 DICDRO COC1CCC(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001342420473 1054420861 /nfs/dbraw/zinc/42/08/61/1054420861.db2.gz IKQNZGPLJLSKBH-OTBWCIGPSA-N 1 0 317.473 4.434 20 10 DICDRO COC1CCC(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001342420476 1054421491 /nfs/dbraw/zinc/42/14/91/1054421491.db2.gz IKQNZGPLJLSKBH-ZGRYLRDCSA-N 1 0 317.473 4.434 20 10 DICDRO C[C@@H]1c2ccsc2CC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001343333110 1054442837 /nfs/dbraw/zinc/44/28/37/1054442837.db2.gz BPAQQQANOIFMQC-OAHLLOKOSA-N 1 0 312.482 4.468 20 10 DICDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCOCc2ccccc2)c(O)c1 ZINC001343917383 1054456461 /nfs/dbraw/zinc/45/64/61/1054456461.db2.gz UPTACVLRYQIFGT-QGZVFWFLSA-N 1 0 313.441 4.267 20 10 DICDRO Nc1ccc(C[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)cc1 ZINC001345159771 1054490174 /nfs/dbraw/zinc/49/01/74/1054490174.db2.gz KWKXTGHCCXUYKB-OAHLLOKOSA-N 1 0 312.310 4.191 20 10 DICDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](O)c2ccc3ccccc3c2)c1 ZINC000185406566 1054540175 /nfs/dbraw/zinc/54/01/75/1054540175.db2.gz FZWWIUGDONNKGE-BTYIYWSLSA-N 1 0 321.420 4.238 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CC[C@@H]4CCC[C@H]4C3)c2c1 ZINC001234525452 1054542748 /nfs/dbraw/zinc/54/27/48/1054542748.db2.gz HZMIQYWCENPMIB-HOCLYGCPSA-N 1 0 311.425 4.176 20 10 DICDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC34CCCCC4)c2c1 ZINC001234525816 1054542913 /nfs/dbraw/zinc/54/29/13/1054542913.db2.gz KLDWQJZVMVTJJS-UHFFFAOYSA-N 1 0 311.425 4.463 20 10 DICDRO C[C@H]([NH2+]C[C@](C)(O)c1ccccc1)c1ccc2ccccc2c1O ZINC000185454102 1054548417 /nfs/dbraw/zinc/54/84/17/1054548417.db2.gz OFVWZVBMHARBBF-BTYIYWSLSA-N 1 0 321.420 4.104 20 10 DICDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185564531 1054583091 /nfs/dbraw/zinc/58/30/91/1054583091.db2.gz SYJLOWRNFFTIKR-KBPBESRZSA-N 1 0 301.430 4.400 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)Sc2ccccc2)c1 ZINC000185580546 1054586411 /nfs/dbraw/zinc/58/64/11/1054586411.db2.gz CTBPCYLYGXTKPW-KBPBESRZSA-N 1 0 317.454 4.232 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)c2ccc(F)cc2F)c1 ZINC000185601443 1054596123 /nfs/dbraw/zinc/59/61/23/1054596123.db2.gz VOJVCNLSKWMYBV-NEPJUHHUSA-N 1 0 321.367 4.133 20 10 DICDRO C[C@H]1c2cccn2CC[N@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996303 1054638436 /nfs/dbraw/zinc/63/84/36/1054638436.db2.gz FINOTMSTOGAMIH-INIZCTEOSA-N 1 0 318.420 4.438 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)cccc1-c1ccccc1 ZINC001235000479 1054640464 /nfs/dbraw/zinc/64/04/64/1054640464.db2.gz IPSFNJHJEKJXGB-PXNSSMCTSA-N 1 0 323.436 4.060 20 10 DICDRO Oc1c(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)cccc1-c1ccccc1 ZINC001235000482 1054640841 /nfs/dbraw/zinc/64/08/41/1054640841.db2.gz IPSFNJHJEKJXGB-YLJYHZDGSA-N 1 0 323.436 4.060 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc2c(c1)CCCN2 ZINC001348855576 1054688640 /nfs/dbraw/zinc/68/86/40/1054688640.db2.gz GVCXZCTVFNMJDC-KDOFPFPSSA-N 1 0 322.452 4.397 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@@H](F)C1)c1cc(Br)ccc1O ZINC001349314796 1054736023 /nfs/dbraw/zinc/73/60/23/1054736023.db2.gz ZQRUDIDJSSPAAV-WCQGTBRESA-N 1 0 316.214 4.086 20 10 DICDRO C[C@H]([NH2+][C@H]1CCC[C@H](F)C1)c1cc(Br)ccc1O ZINC001349314794 1054737480 /nfs/dbraw/zinc/73/74/80/1054737480.db2.gz ZQRUDIDJSSPAAV-DLOVCJGASA-N 1 0 316.214 4.086 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c(O)c1 ZINC001235676072 1054772129 /nfs/dbraw/zinc/77/21/29/1054772129.db2.gz PNVFYXBSLLZJEV-GOSISDBHSA-N 1 0 310.441 4.422 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c(O)c1 ZINC001235675991 1054772440 /nfs/dbraw/zinc/77/24/40/1054772440.db2.gz NMEVVDGQTMJMDJ-HNNXBMFYSA-N 1 0 315.379 4.259 20 10 DICDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccccn3)C2)c(O)c1 ZINC001235686205 1054778337 /nfs/dbraw/zinc/77/83/37/1054778337.db2.gz YLMDSPWIEDNHHG-OAHLLOKOSA-N 1 0 310.441 4.074 20 10 DICDRO CCCOc1ccc(C[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)cc1C ZINC001474121501 1054785172 /nfs/dbraw/zinc/78/51/72/1054785172.db2.gz XAGKHJCPXGXIMT-UYAOXDASSA-N 1 0 319.489 4.467 20 10 DICDRO C[C@H]([NH2+]Cc1ccccc1OC1CCC1)c1cc(F)ccc1O ZINC000186055668 1054871359 /nfs/dbraw/zinc/87/13/59/1054871359.db2.gz UTEBZSPDJZGKHR-ZDUSSCGKSA-N 1 0 315.388 4.313 20 10 DICDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2c[nH]c3ccccc32)c(O)c1 ZINC001236192053 1054991884 /nfs/dbraw/zinc/99/18/84/1054991884.db2.gz NLLQGDMPOPPVBN-LJQANCHMSA-N 1 0 322.408 4.219 20 10 DICDRO CC(C)CC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000764502547 1055198291 /nfs/dbraw/zinc/19/82/91/1055198291.db2.gz GQUGLASWPFIEPU-HOTGVXAUSA-N 1 0 322.468 4.138 20 10 DICDRO CCCCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000764526450 1055205165 /nfs/dbraw/zinc/20/51/65/1055205165.db2.gz ZDSVDUFUXXIMTF-AWEZNQCLSA-N 1 0 310.869 4.017 20 10 DICDRO CC(C)OCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000764574434 1055212284 /nfs/dbraw/zinc/21/22/84/1055212284.db2.gz RVFHQJVTQCFBIM-INIZCTEOSA-N 1 0 322.468 4.282 20 10 DICDRO C[C@@H]([NH2+]CCCC1CCCC1)c1ccc(N2CCOCC2)cc1 ZINC000764743724 1055242132 /nfs/dbraw/zinc/24/21/32/1055242132.db2.gz GFWVJQMANCMAEJ-QGZVFWFLSA-N 1 0 316.489 4.144 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C)c2)cc1 ZINC000764743678 1055243633 /nfs/dbraw/zinc/24/36/33/1055243633.db2.gz RNBNUVIKCWQZRZ-OAHLLOKOSA-N 1 0 300.421 4.441 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(C)c(F)c1)c1ccc(N(C)C)cc1 ZINC000764739390 1055244137 /nfs/dbraw/zinc/24/41/37/1055244137.db2.gz UJZZSWVOOVGXBT-LJQANCHMSA-N 1 0 300.421 4.441 20 10 DICDRO CC(C)(C)C[N@H+](Cc1ccc(Cl)cc1[O-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767259 1055253081 /nfs/dbraw/zinc/25/30/81/1055253081.db2.gz LOXAHFHHAQGDAS-WKILWMFISA-N 1 0 324.896 4.164 20 10 DICDRO CC1CC([N@H+](C)Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001236779115 1055255152 /nfs/dbraw/zinc/25/51/52/1055255152.db2.gz QBPTZEMPLNYGEA-UHFFFAOYSA-N 1 0 311.425 4.202 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2ncccc2C(F)(F)F)c(O)c1 ZINC001236782580 1055257189 /nfs/dbraw/zinc/25/71/89/1055257189.db2.gz CRUFOLFDFVBFLQ-UHFFFAOYSA-N 1 0 324.346 4.000 20 10 DICDRO CCC(CC)[N@H+](Cc1cccc(Cl)c1[O-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790020 1055258214 /nfs/dbraw/zinc/25/82/14/1055258214.db2.gz FVBRQSTZINCHBN-KOMQPUFPSA-N 1 0 324.896 4.306 20 10 DICDRO CCc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2OC)c(O)c1 ZINC001236795770 1055260198 /nfs/dbraw/zinc/26/01/98/1055260198.db2.gz ZUODCGJAPHWDDS-SFHVURJKSA-N 1 0 311.425 4.300 20 10 DICDRO CCc1ccc(C[N@H+](C)Cc2ccc(OC)c(Cl)c2[O-])cc1 ZINC001236806902 1055268859 /nfs/dbraw/zinc/26/88/59/1055268859.db2.gz KIKLRAQAOCQEIJ-UHFFFAOYSA-N 1 0 319.832 4.249 20 10 DICDRO COc1cc(O)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c(Cl)c1 ZINC001236804492 1055269407 /nfs/dbraw/zinc/26/94/07/1055269407.db2.gz USSVRFGUEKXFJF-MRXNPFEDSA-N 1 0 303.789 4.001 20 10 DICDRO COc1ccccc1CC[N@H+](C)Cc1cc2ccccc2cc1O ZINC001236831183 1055283726 /nfs/dbraw/zinc/28/37/26/1055283726.db2.gz FXEBBVFKVQNWET-UHFFFAOYSA-N 1 0 321.420 4.229 20 10 DICDRO C[N@H+](CCc1cccc(F)c1)Cc1cc2ccccc2cc1O ZINC001236836581 1055284817 /nfs/dbraw/zinc/28/48/17/1055284817.db2.gz KSKPGDOFZDSXQI-UHFFFAOYSA-N 1 0 309.384 4.359 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC001236842827 1055286741 /nfs/dbraw/zinc/28/67/41/1055286741.db2.gz YUBXRORCEOMVAB-HNNXBMFYSA-N 1 0 309.331 4.320 20 10 DICDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC001236842482 1055287209 /nfs/dbraw/zinc/28/72/09/1055287209.db2.gz VTDBOXDYVOJIGL-LJQANCHMSA-N 1 0 304.393 4.278 20 10 DICDRO COc1ccccc1C[N@H+](C)Cc1cc2ccccc2cc1O ZINC001236842475 1055288020 /nfs/dbraw/zinc/28/80/20/1055288020.db2.gz VMNNHLSXVHQXMZ-UHFFFAOYSA-N 1 0 307.393 4.186 20 10 DICDRO C[N@@H+](Cc1cc2ccccc2cc1O)Cc1ccc(F)cc1F ZINC001236838123 1055288342 /nfs/dbraw/zinc/28/83/42/1055288342.db2.gz VFOKMJIPYFREPN-UHFFFAOYSA-N 1 0 313.347 4.456 20 10 DICDRO C[N@H+](CCc1ccccc1F)Cc1cc2ccccc2cc1O ZINC001236837618 1055290034 /nfs/dbraw/zinc/29/00/34/1055290034.db2.gz RKAJSTHGNYYIMI-UHFFFAOYSA-N 1 0 309.384 4.359 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCSC1)c1ccc2ccccc2c1O ZINC000384179973 1055322791 /nfs/dbraw/zinc/32/27/91/1055322791.db2.gz WMCCOKGKBLOIIC-UONOGXRCSA-N 1 0 301.455 4.339 20 10 DICDRO CC(C)Oc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000765095822 1055327864 /nfs/dbraw/zinc/32/78/64/1055327864.db2.gz PLTVXCYQXPCRFW-MRXNPFEDSA-N 1 0 312.457 4.391 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccnc(Cl)c2)cc1 ZINC000765103653 1055329934 /nfs/dbraw/zinc/32/99/34/1055329934.db2.gz GRUAZAGWLOCMBA-AWEZNQCLSA-N 1 0 317.864 4.432 20 10 DICDRO Cc1ccc(-c2cncc(C[N@@H+](C)Cc3ccccc3O)c2)cc1 ZINC001237001339 1055334106 /nfs/dbraw/zinc/33/41/06/1055334106.db2.gz BPEFTAJLIPJBAF-UHFFFAOYSA-N 1 0 318.420 4.395 20 10 DICDRO CCOc1ccc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c(O)c1 ZINC001237047492 1055348565 /nfs/dbraw/zinc/34/85/65/1055348565.db2.gz ZBHQAFPZPXGOED-UHFFFAOYSA-N 1 0 311.425 4.084 20 10 DICDRO CCOc1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2CC)c(O)c1 ZINC001237047187 1055350969 /nfs/dbraw/zinc/35/09/69/1055350969.db2.gz UKHWZXWIDUEXCP-IBGZPJMESA-N 1 0 311.425 4.300 20 10 DICDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(N(C)CC)cc2)cc1 ZINC000765330988 1055362162 /nfs/dbraw/zinc/36/21/62/1055362162.db2.gz LWKMQRQKWSWGIY-MRXNPFEDSA-N 1 0 312.457 4.392 20 10 DICDRO COC[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765328331 1055363024 /nfs/dbraw/zinc/36/30/24/1055363024.db2.gz DXVFPRQFDOSLAE-IRXDYDNUSA-N 1 0 304.478 4.000 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(F)c(F)c2)cc1 ZINC000765321881 1055363576 /nfs/dbraw/zinc/36/35/76/1055363576.db2.gz AIZUCHLDHSEAJN-ZDUSSCGKSA-N 1 0 304.384 4.272 20 10 DICDRO COCC[C@@H]1CCCC[N@@H+]1Cc1c([O-])ccc(Cl)c1Cl ZINC001237080503 1055364009 /nfs/dbraw/zinc/36/40/09/1055364009.db2.gz DLOMTVJGTOOVET-NSHDSACASA-N 1 0 318.244 4.090 20 10 DICDRO C[C@H]([NH2+]C[C@H]1CCCCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765343820 1055366031 /nfs/dbraw/zinc/36/60/31/1055366031.db2.gz NGOAYYBXIYZJQW-DOTOQJQBSA-N 1 0 320.452 4.036 20 10 DICDRO Cc1ccc(C[N@@H+](C)Cc2cc(C(F)(F)F)ccc2O)cc1 ZINC001237138763 1055378721 /nfs/dbraw/zinc/37/87/21/1055378721.db2.gz FVFRBJOSBZLZMI-UHFFFAOYSA-N 1 0 309.331 4.351 20 10 DICDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(O)ccc(F)c1Cl ZINC001237129513 1055379285 /nfs/dbraw/zinc/37/92/85/1055379285.db2.gz HXROHHKKMSBSIH-UHFFFAOYSA-N 1 0 323.795 4.215 20 10 DICDRO C[N@H+](Cc1ccc(F)cc1)Cc1cc(C(F)(F)F)ccc1O ZINC001237137253 1055379755 /nfs/dbraw/zinc/37/97/55/1055379755.db2.gz NUTWSBXVOPUZLF-UHFFFAOYSA-N 1 0 313.294 4.182 20 10 DICDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001237140687 1055383395 /nfs/dbraw/zinc/38/33/95/1055383395.db2.gz NMPHCUMAYXYACI-OAHLLOKOSA-N 1 0 307.315 4.358 20 10 DICDRO COCCC[C@H](C)[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000765443512 1055391998 /nfs/dbraw/zinc/39/19/98/1055391998.db2.gz GDOMPKFBGJZCFG-KRWDZBQOSA-N 1 0 318.505 4.360 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)CCCN3C)CC2 ZINC000765481709 1055402877 /nfs/dbraw/zinc/40/28/77/1055402877.db2.gz QCHUJEFVBPXBRA-FQEVSTJZSA-N 1 0 306.453 4.155 20 10 DICDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cc(F)cc(F)c1 ZINC000765481948 1055403853 /nfs/dbraw/zinc/40/38/53/1055403853.db2.gz RYIIDVWUCONMJH-ZDUSSCGKSA-N 1 0 316.395 4.198 20 10 DICDRO CCCCN(CCCC)c1ccc(C[NH+]2CC=CC2)c(O)c1 ZINC001237216897 1055405100 /nfs/dbraw/zinc/40/51/00/1055405100.db2.gz WGHHTTPUMYQCLJ-UHFFFAOYSA-N 1 0 302.462 4.171 20 10 DICDRO CC[C@@H]([NH2+]CCCOC1CCCC1)c1ccc(N(C)C)cc1 ZINC000765502505 1055410841 /nfs/dbraw/zinc/41/08/41/1055410841.db2.gz TWMMOYIYJBXNIG-LJQANCHMSA-N 1 0 304.478 4.143 20 10 DICDRO CC[N@H+](Cc1cnc(-c2ccccc2)o1)Cc1ccccc1O ZINC001237371796 1055441044 /nfs/dbraw/zinc/44/10/44/1055441044.db2.gz UQHOIOYHVLWXGS-UHFFFAOYSA-N 1 0 308.381 4.069 20 10 DICDRO C[C@H]([NH2+]CC1(O)CCCCC1)c1ccc(N2CCCCC2)cc1 ZINC000765549684 1055451454 /nfs/dbraw/zinc/45/14/54/1055451454.db2.gz WISLHNLGOWHCKN-KRWDZBQOSA-N 1 0 316.489 4.023 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC(Cc2ccc(F)cc2)CC1 ZINC001237488429 1055459769 /nfs/dbraw/zinc/45/97/69/1055459769.db2.gz XJCGLTLKUJSWOX-UHFFFAOYSA-N 1 0 313.416 4.294 20 10 DICDRO Cc1cccc(O)c1C[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC001237491262 1055461233 /nfs/dbraw/zinc/46/12/33/1055461233.db2.gz JEZGVYJTYADHBI-UHFFFAOYSA-N 1 0 321.342 4.278 20 10 DICDRO Cc1cccc(O)c1C[NH+]1CCC2(CC1)O[C@@H](C)c1ccccc12 ZINC001237495719 1055462006 /nfs/dbraw/zinc/46/20/06/1055462006.db2.gz UTKWOKNSJPUCMO-INIZCTEOSA-N 1 0 323.436 4.283 20 10 DICDRO COCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765574898 1055479673 /nfs/dbraw/zinc/47/96/73/1055479673.db2.gz NIUHCVMTDIBULM-SJORKVTESA-N 1 0 304.478 4.143 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[NH+]1CCC(F)CC1 ZINC001237640697 1055491481 /nfs/dbraw/zinc/49/14/81/1055491481.db2.gz FDFPGPQUNDSXPN-UHFFFAOYSA-N 1 0 303.352 4.132 20 10 DICDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCc2occc2C1 ZINC001237651023 1055493755 /nfs/dbraw/zinc/49/37/55/1055493755.db2.gz YFFXIIBGZOWFAT-UHFFFAOYSA-N 1 0 323.367 4.350 20 10 DICDRO CCC[N@@H+](Cc1cc(Br)c(C)cc1O)CC1CC1 ZINC001237676477 1055504507 /nfs/dbraw/zinc/50/45/07/1055504507.db2.gz ISUAAHGQYQWTOX-UHFFFAOYSA-N 1 0 312.251 4.085 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC3(CCCC3)C2)cc1Br ZINC001237679240 1055502873 /nfs/dbraw/zinc/50/28/73/1055502873.db2.gz OCUIIWXQDGWBSP-UHFFFAOYSA-N 1 0 324.262 4.229 20 10 DICDRO Cc1cc(Cl)cc(C[N@H+]2CCC(=O)[C@@H](C)C23CCCC3)c1O ZINC001237688176 1055502589 /nfs/dbraw/zinc/50/25/89/1055502589.db2.gz GAXRMOKJBFYXGX-CYBMUJFWSA-N 1 0 321.848 4.078 20 10 DICDRO Cc1cc(Cl)cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1O ZINC001237688274 1055502785 /nfs/dbraw/zinc/50/27/85/1055502785.db2.gz HGMKKNZOBFLEBP-UHFFFAOYSA-N 1 0 318.848 4.052 20 10 DICDRO COc1ccc(CC[N@H+](C)Cc2cc(Cl)cc(C)c2O)cc1 ZINC001237686857 1055504751 /nfs/dbraw/zinc/50/47/51/1055504751.db2.gz QKVVHXOONZEDTF-UHFFFAOYSA-N 1 0 319.832 4.037 20 10 DICDRO CCC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(OC)cc1 ZINC000765607968 1055512775 /nfs/dbraw/zinc/51/27/75/1055512775.db2.gz GCGIDSJJDVVVHY-IBGZPJMESA-N 1 0 311.425 4.261 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@@H](OC(C)C)C2(C)C)c(Cl)c1 ZINC001620893086 1055518231 /nfs/dbraw/zinc/51/82/31/1055518231.db2.gz BKUDWVCAXDXUCC-HZPDHXFCSA-N 1 0 311.853 4.036 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@H](OC(C)C)C2(C)C)c(Cl)c1 ZINC001620893085 1055518293 /nfs/dbraw/zinc/51/82/93/1055518293.db2.gz BKUDWVCAXDXUCC-HOTGVXAUSA-N 1 0 311.853 4.036 20 10 DICDRO Cc1c(Cl)cccc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001237734138 1055520207 /nfs/dbraw/zinc/52/02/07/1055520207.db2.gz FLBXDKPEXWIFBL-UHFFFAOYSA-N 1 0 317.816 4.008 20 10 DICDRO C[C@H]([NH2+]CCc1ccccc1O)c1ccc(N2CCCCC2)cc1 ZINC000765621441 1055525185 /nfs/dbraw/zinc/52/51/85/1055525185.db2.gz TZPMCDGMYNKPCI-KRWDZBQOSA-N 1 0 324.468 4.276 20 10 DICDRO CO[C@H](C)CC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000765632215 1055528734 /nfs/dbraw/zinc/52/87/34/1055528734.db2.gz YCEHEETYGPGJCR-SJORKVTESA-N 1 0 304.478 4.143 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)CCC=C(C)C)CC2)cc1 ZINC000765638329 1055531478 /nfs/dbraw/zinc/53/14/78/1055531478.db2.gz KMPLNWDYGHPEKY-KRWDZBQOSA-N 1 0 316.489 4.389 20 10 DICDRO CC(C)(O)CC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001620908763 1055532702 /nfs/dbraw/zinc/53/27/02/1055532702.db2.gz NYTZRXLNXJWCIN-UHFFFAOYSA-N 1 0 321.505 4.238 20 10 DICDRO COc1ccc(O)c(C[NH2+][C@@H]2c3ccccc3CCC[C@@H]2C)c1 ZINC000765662966 1055537668 /nfs/dbraw/zinc/53/76/68/1055537668.db2.gz PNQCDXZOEJTAIN-XOBRGWDASA-N 1 0 311.425 4.204 20 10 DICDRO C[C@]1(CC[NH2+]Cc2c(O)cccc2Cl)CC1(Cl)Cl ZINC001620938043 1055551110 /nfs/dbraw/zinc/55/11/10/1055551110.db2.gz KFYUSAMAHAAENL-LBPRGKRZSA-N 1 0 308.636 4.109 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H](c1ccccc1)C1CC1 ZINC001620951177 1055567481 /nfs/dbraw/zinc/56/74/81/1055567481.db2.gz BHMBIUQSDOLSBR-HNNXBMFYSA-N 1 0 301.817 4.329 20 10 DICDRO CC[C@@H]1CCCC[C@H]1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001620953433 1055572547 /nfs/dbraw/zinc/57/25/47/1055572547.db2.gz LQARUYUGJXXNDN-KGLIPLIRSA-N 1 0 310.432 4.337 20 10 DICDRO CN(C)c1ccc(C[NH2+]CC[C@H]2CCc3ccccc32)cc1F ZINC001620954444 1055574664 /nfs/dbraw/zinc/57/46/64/1055574664.db2.gz ULDIIYVAVRPHNA-QGZVFWFLSA-N 1 0 312.432 4.101 20 10 DICDRO CCN(Cc1ccccc1O)Cc1cncc(Cl)c1Cl ZINC001238015877 1055583580 /nfs/dbraw/zinc/58/35/80/1055583580.db2.gz RKZDYDNMVIUMII-UHFFFAOYSA-N 1 0 311.212 4.116 20 10 DICDRO Cc1cc(F)cc(C[NH+]2CCC(c3ccccc3F)CC2)c1O ZINC001238060520 1055596435 /nfs/dbraw/zinc/59/64/35/1055596435.db2.gz BRMHYPLGSWQCNO-UHFFFAOYSA-N 1 0 317.379 4.358 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1O ZINC001238061940 1055597083 /nfs/dbraw/zinc/59/70/83/1055597083.db2.gz MBOIBZGQLYFNCO-QGZVFWFLSA-N 1 0 303.352 4.316 20 10 DICDRO Cc1cc(F)cc(C[N@H+](C)CCc2cccc(Cl)c2)c1O ZINC001238061197 1055597133 /nfs/dbraw/zinc/59/71/33/1055597133.db2.gz FFRZUQGQIDWPOF-UHFFFAOYSA-N 1 0 307.796 4.168 20 10 DICDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1O ZINC001238065770 1055598750 /nfs/dbraw/zinc/59/87/50/1055598750.db2.gz FEHVNXMPJMHXHN-KRWDZBQOSA-N 1 0 321.342 4.455 20 10 DICDRO CSc1cc(C)cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001238683293 1055721229 /nfs/dbraw/zinc/72/12/29/1055721229.db2.gz SGMMFSGQHOOHFI-UHFFFAOYSA-N 1 0 314.498 4.415 20 10 DICDRO Oc1ccccc1C[NH+]1CCC(c2ccc(Cl)cc2)CC1 ZINC001203549864 1055793696 /nfs/dbraw/zinc/79/36/96/1055793696.db2.gz ABRFDLJCBVYIBO-UHFFFAOYSA-N 1 0 301.817 4.425 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)cc1 ZINC000765770103 1055914350 /nfs/dbraw/zinc/91/43/50/1055914350.db2.gz WJKCWCBNRDPZCJ-HZPDHXFCSA-N 1 0 312.457 4.130 20 10 DICDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)c1ccc(N(C)C)cc1 ZINC000765770046 1055914368 /nfs/dbraw/zinc/91/43/68/1055914368.db2.gz VMMDBUJKNZTSTF-YWZLYKJASA-N 1 0 312.457 4.130 20 10 DICDRO CN(C)c1ccc(C[NH2+]C2(c3cccc(F)c3)CCC2)cc1F ZINC001620981576 1055919768 /nfs/dbraw/zinc/91/97/68/1055919768.db2.gz VGMLREWDNMRAAE-UHFFFAOYSA-N 1 0 316.395 4.200 20 10 DICDRO CCOc1ccc(N(CCC2(OC)CCC2)CC2CC2)cc1 ZINC001620499627 1055958097 /nfs/dbraw/zinc/95/80/97/1055958097.db2.gz YDZCLZYJCFIXBM-UHFFFAOYSA-N 1 0 303.446 4.261 20 10 DICDRO CC(C)[N@H+](Cc1cc(Br)cc(F)c1[O-])C1CCC1 ZINC001621121687 1055966294 /nfs/dbraw/zinc/96/62/94/1055966294.db2.gz KOFGVUYGMGIPRZ-UHFFFAOYSA-N 1 0 316.214 4.057 20 10 DICDRO C[C@H]1CC(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C[C@@H](C)C1 ZINC001620999415 1055967511 /nfs/dbraw/zinc/96/75/11/1055967511.db2.gz QAOZRDRQMUVVCX-CFMLYZNSSA-N 1 0 300.490 4.428 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C2(COC)CCCC2)cc1 ZINC001621003626 1055971311 /nfs/dbraw/zinc/97/13/11/1055971311.db2.gz QEQDSBZYRYTRDI-UHFFFAOYSA-N 1 0 318.505 4.362 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@H]2CCC[C@H](C)O2)cc1 ZINC001621008816 1055976514 /nfs/dbraw/zinc/97/65/14/1055976514.db2.gz IVVXRDKMWGLTBW-FXAWDEMLSA-N 1 0 318.505 4.360 20 10 DICDRO CN(C)c1cc(F)c(C[NH2+]CCCCc2ccccc2)cc1F ZINC001620704622 1055983573 /nfs/dbraw/zinc/98/35/73/1055983573.db2.gz VSCAGQORDDUCLI-UHFFFAOYSA-N 1 0 318.411 4.143 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2cc3ccccc3o2)c(Cl)c1 ZINC001620724156 1055986967 /nfs/dbraw/zinc/98/69/67/1055986967.db2.gz LBPGBNKWSURGAO-UHFFFAOYSA-N 1 0 301.773 4.390 20 10 DICDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001621023688 1055989321 /nfs/dbraw/zinc/98/93/21/1055989321.db2.gz VJPGLTIWRPYLCR-OAHLLOKOSA-N 1 0 308.208 4.476 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)COc1cccc(C)c1 ZINC001620739420 1055990448 /nfs/dbraw/zinc/99/04/48/1055990448.db2.gz RBIRJRCRPCQTOD-MRXNPFEDSA-N 1 0 322.452 4.352 20 10 DICDRO CC[C@](C)([NH2+]Cc1c(C)c2ccccc2n1C)c1nccs1 ZINC001620806284 1056001066 /nfs/dbraw/zinc/00/10/66/1056001066.db2.gz CJTIFZSJNNFHMY-SFHVURJKSA-N 1 0 313.470 4.358 20 10 DICDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](c2ccccc2)N(C)C)c(O)c1 ZINC000186320554 1056103577 /nfs/dbraw/zinc/10/35/77/1056103577.db2.gz NOTBVMYCEZVCFG-FTRWYGJKSA-N 1 0 312.457 4.043 20 10 DICDRO C[C@@H](CCc1ccsc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000765806688 1056136336 /nfs/dbraw/zinc/13/63/36/1056136336.db2.gz DAXUQFJNNNTNBL-INIZCTEOSA-N 1 0 314.498 4.459 20 10 DICDRO C[C@H]([NH2+]CCOCC1CCC1)c1ccc(N2CCCCC2)cc1 ZINC000765810120 1056147733 /nfs/dbraw/zinc/14/77/33/1056147733.db2.gz QFTKJOUCRFZBDO-KRWDZBQOSA-N 1 0 316.489 4.144 20 10 DICDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1nc2ccccc2s1 ZINC000921742112 1056439599 /nfs/dbraw/zinc/43/95/99/1056439599.db2.gz CIWQTWRZGTYEMT-CYBMUJFWSA-N 1 0 324.449 4.472 20 10 DICDRO CC(C)[N@H+](CCCC1CCOCC1)Cc1ccc(N(C)C)cc1 ZINC000765920874 1056483309 /nfs/dbraw/zinc/48/33/09/1056483309.db2.gz CHEPHLDXWZZAKL-UHFFFAOYSA-N 1 0 318.505 4.170 20 10 DICDRO CC[C@](C)([NH2+]Cc1ccc2c(c1)CCCO2)c1nc(C)cs1 ZINC000921782307 1056488162 /nfs/dbraw/zinc/48/81/62/1056488162.db2.gz QHWDIZMAQQWCTE-SFHVURJKSA-N 1 0 316.470 4.192 20 10 DICDRO CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765943230 1056538188 /nfs/dbraw/zinc/53/81/88/1056538188.db2.gz AEUNFCRJLMOSNL-ZWOKBUDYSA-N 1 0 318.505 4.125 20 10 DICDRO COc1cccc2[nH]cc(CC[NH2+][C@H](C)c3ccc(C)cc3O)c21 ZINC000186507222 1056761024 /nfs/dbraw/zinc/76/10/24/1056761024.db2.gz QDGQTPGKBYOHCV-CQSZACIVSA-N 1 0 324.424 4.084 20 10 DICDRO c1ccc([C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CCC2)nc1 ZINC000922286571 1056998414 /nfs/dbraw/zinc/99/84/14/1056998414.db2.gz ZAUUEUSLDAWSMY-HXUWFJFHSA-N 1 0 308.425 4.038 20 10 DICDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2C)c1O ZINC000922664432 1057046976 /nfs/dbraw/zinc/04/69/76/1057046976.db2.gz BPSYVXUCUCTXJV-CYBMUJFWSA-N 1 0 303.377 4.089 20 10 DICDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2c(C)noc2C)cc1 ZINC000765999290 1057055314 /nfs/dbraw/zinc/05/53/14/1057055314.db2.gz ARFVXRCBXHHLPS-CHWSQXEVSA-N 1 0 301.434 4.159 20 10 DICDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)c2c(C)noc2C)cc1 ZINC000765999291 1057055945 /nfs/dbraw/zinc/05/59/45/1057055945.db2.gz ARFVXRCBXHHLPS-QWHCGFSZSA-N 1 0 301.434 4.159 20 10 DICDRO C[C@@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1ccc2ccccc2c1O ZINC000282382704 1057064200 /nfs/dbraw/zinc/06/42/00/1057064200.db2.gz JEQCDLSKHDDQSN-FZKQIMNGSA-N 1 0 321.424 4.007 20 10 DICDRO CC[C@@H]([NH2+]Cc1cc(C)cc(Cl)n1)c1ccc(C)cc1O ZINC000282410736 1057084840 /nfs/dbraw/zinc/08/48/40/1057084840.db2.gz CFXLHBPEGNEDBE-OAHLLOKOSA-N 1 0 304.821 4.298 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H](c2cnn(C)c2)C(C)C)cc1C ZINC000922891134 1057099015 /nfs/dbraw/zinc/09/90/15/1057099015.db2.gz RQOPDUUBXOONCA-IBGZPJMESA-N 1 0 315.461 4.004 20 10 DICDRO CCC[N@H+](CCc1cccs1)Cc1cc(C)cc(OC)c1O ZINC000766028756 1057125727 /nfs/dbraw/zinc/12/57/27/1057125727.db2.gz ZTOHRLSCXWOSBJ-UHFFFAOYSA-N 1 0 319.470 4.225 20 10 DICDRO C[C@H]([NH2+]C[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1O ZINC000186852484 1057136055 /nfs/dbraw/zinc/13/60/55/1057136055.db2.gz OFGFSSSWLXLUEC-WFASDCNBSA-N 1 0 309.331 4.389 20 10 DICDRO COCCC1(C[NH2+][C@H](C)c2cc(OC)ccc2O)CCCCC1 ZINC000186886601 1057143939 /nfs/dbraw/zinc/14/39/39/1057143939.db2.gz IEJRCFPYXKYMQN-OAHLLOKOSA-N 1 0 321.461 4.038 20 10 DICDRO CCOc1ccccc1[C@H](C)[NH2+]CCCSc1nccs1 ZINC000766071082 1057285311 /nfs/dbraw/zinc/28/53/11/1057285311.db2.gz IVRSXVJJGWHGCU-ZDUSSCGKSA-N 1 0 322.499 4.375 20 10 DICDRO CSC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000766073506 1057285891 /nfs/dbraw/zinc/28/58/91/1057285891.db2.gz AMOILEOHVQSXKC-KGLIPLIRSA-N 1 0 310.482 4.218 20 10 DICDRO C[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766073628 1057286236 /nfs/dbraw/zinc/28/62/36/1057286236.db2.gz RSADJHJFIIMMFH-VDZJLULYSA-N 1 0 318.505 4.245 20 10 DICDRO C[C@@H](CCC(C)(C)C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000766075312 1057287600 /nfs/dbraw/zinc/28/76/00/1057287600.db2.gz LTLVVJYJJCKEPZ-IRXDYDNUSA-N 1 0 318.505 4.389 20 10 DICDRO Cc1cc(C)cc(C[N@@H+](C)Cc2c(O)ccc3ccncc32)c1 ZINC000766094596 1057321559 /nfs/dbraw/zinc/32/15/59/1057321559.db2.gz YULPDFXXHGRIFN-UHFFFAOYSA-N 1 0 306.409 4.189 20 10 DICDRO Cc1ccc([C@H](C)[NH2+]Cc2c(O)cccc2Br)cc1 ZINC000706809760 1057481304 /nfs/dbraw/zinc/48/13/04/1057481304.db2.gz MGWQAKBIQWPBGX-LBPRGKRZSA-N 1 0 320.230 4.314 20 10 DICDRO CCC[N@H+](Cc1cccc(OC(F)F)c1)Cc1ccccc1O ZINC000727830963 1057677085 /nfs/dbraw/zinc/67/70/85/1057677085.db2.gz YHQLLDIZRQCPCH-UHFFFAOYSA-N 1 0 321.367 4.406 20 10 DICDRO Oc1ccccc1C[NH2+][C@@H](COc1ccccc1)c1ccccc1 ZINC000730818194 1057726436 /nfs/dbraw/zinc/72/64/36/1057726436.db2.gz LCLGADSHHJHWTH-FQEVSTJZSA-N 1 0 319.404 4.302 20 10 DICDRO COc1cccc(C[NH2+][C@H](C)c2csc3ccccc32)c1O ZINC000731452412 1057744432 /nfs/dbraw/zinc/74/44/32/1057744432.db2.gz YATVCTQCWAHREZ-GFCCVEGCSA-N 1 0 313.422 4.466 20 10 DICDRO CCOCc1cc(C[NH2+]C2(c3ccccc3)CC2)ccc1OC ZINC000731678080 1057751820 /nfs/dbraw/zinc/75/18/20/1057751820.db2.gz GSWUFDZMSZIUPM-UHFFFAOYSA-N 1 0 311.425 4.011 20 10 DICDRO Oc1ccccc1C[N@H+](Cc1ccnc(Cl)c1)C1CCCC1 ZINC000731846431 1057756104 /nfs/dbraw/zinc/75/61/04/1057756104.db2.gz YVIRCVKFGXYOEX-UHFFFAOYSA-N 1 0 316.832 4.385 20 10 DICDRO C[C@H](c1ccccc1Br)[N@H+](C)Cc1ccccc1O ZINC000732203114 1057770539 /nfs/dbraw/zinc/77/05/39/1057770539.db2.gz PPLYALAKPMFPAI-GFCCVEGCSA-N 1 0 320.230 4.348 20 10 DICDRO Cc1ccc(CC[NH2+]Cc2cc(-c3ccccc3)ccc2O)cn1 ZINC000732230426 1057771315 /nfs/dbraw/zinc/77/13/15/1057771315.db2.gz PLFGDSOQTHOUMF-UHFFFAOYSA-N 1 0 318.420 4.095 20 10 DICDRO CC[C@](C)(O)C[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000732229220 1057771803 /nfs/dbraw/zinc/77/18/03/1057771803.db2.gz JIBHEIDMHBZMLN-FQEVSTJZSA-N 1 0 321.505 4.238 20 10 DICDRO CCOc1ccc(C[NH2+]C2CC(C)(c3ccccc3)C2)c(O)c1 ZINC000733326667 1057813590 /nfs/dbraw/zinc/81/35/90/1057813590.db2.gz SGJHPBCIXDPQCH-UHFFFAOYSA-N 1 0 311.425 4.001 20 10 DICDRO COc1ccc(N2CCC[N@H+](CC3CCCCCC3)CC2)cc1 ZINC001559492635 1059270144 /nfs/dbraw/zinc/27/01/44/1059270144.db2.gz XPMCTLUYWWIIAX-UHFFFAOYSA-N 1 0 316.489 4.178 20 10 DICDRO C=C/C=C/CC[N@@H+](CC)Cc1cc(Br)ccc1O ZINC001559568988 1059400031 /nfs/dbraw/zinc/40/00/31/1059400031.db2.gz LPBRHXHCMYWRDZ-AATRIKPKSA-N 1 0 310.235 4.109 20 10 DICDRO CCC[N@H+](Cc1ccccc1O)Cc1cc(OC)ccc1Cl ZINC001559571449 1059401266 /nfs/dbraw/zinc/40/12/66/1059401266.db2.gz ULRZQSQQZKCZJF-UHFFFAOYSA-N 1 0 319.832 4.466 20 10 DICDRO CCN(C)c1ccc(C[N@@H+]2CCO[C@H](c3ccccc3C)C2)cc1 ZINC001559575841 1059409696 /nfs/dbraw/zinc/40/96/96/1059409696.db2.gz MOIQAYWNLKHKPP-NRFANRHFSA-N 1 0 324.468 4.025 20 10 DICDRO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cccn2C)ccc1N(C)C ZINC001559589605 1059422586 /nfs/dbraw/zinc/42/25/86/1059422586.db2.gz ATUHFWOPHGNNMF-FQEVSTJZSA-N 1 0 311.473 4.127 20 10 DICDRO CCC1(CC)[C@H](OC)C[C@H]1[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC001559612369 1059442854 /nfs/dbraw/zinc/44/28/54/1059442854.db2.gz ULUTVUORQBHSMD-RTBURBONSA-N 1 0 318.505 4.087 20 10 DICDRO C[C@@H]1CCC[C@H](C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)C1 ZINC001559635148 1059463790 /nfs/dbraw/zinc/46/37/90/1059463790.db2.gz LYWDYRFCVQSETL-ZIFCJYIRSA-N 1 0 317.473 4.200 20 10 DICDRO CCOc1ccc(N2CC[NH+](C[C@@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC001559667085 1059496432 /nfs/dbraw/zinc/49/64/32/1059496432.db2.gz KKRZBPFCLPMMQX-QZTJIDSGSA-N 1 0 316.489 4.034 20 10 DICDRO Cc1cc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)ccc1N(C)C ZINC001559748976 1059581844 /nfs/dbraw/zinc/58/18/44/1059581844.db2.gz BMIGBABFFCTDST-UHFFFAOYSA-N 1 0 320.839 4.486 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H]2CCC(C)(C)C[C@H]2C)c1O ZINC001559775337 1059612956 /nfs/dbraw/zinc/61/29/56/1059612956.db2.gz JSLKWZXBGQPQQI-BDJLRTHQSA-N 1 0 307.409 4.038 20 10 DICDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCC(C)(C)CO1 ZINC001559790161 1059625211 /nfs/dbraw/zinc/62/52/11/1059625211.db2.gz KTQMCQYRGSULQO-KRWDZBQOSA-N 1 0 305.462 4.200 20 10 DICDRO COc1ccc(N(CCC[NH+]2CCCCC2)CCC(C)C)cc1 ZINC001559809524 1059643244 /nfs/dbraw/zinc/64/32/44/1059643244.db2.gz BWKRTZVZBDUREP-UHFFFAOYSA-N 1 0 318.505 4.424 20 10 DICDRO Cc1cccc2c1CC(C)(C)[N@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001559856906 1059680632 /nfs/dbraw/zinc/68/06/32/1059680632.db2.gz PAOLPPYBHWYDFC-UHFFFAOYSA-N 1 0 308.469 4.398 20 10 DICDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)CCc2ccc(F)cc21 ZINC001559959289 1059770126 /nfs/dbraw/zinc/77/01/26/1059770126.db2.gz YABRJNNWPIDEMI-HNNXBMFYSA-N 1 0 312.432 4.054 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)CC2CCC3(CC3)CC2)cc1 ZINC001559966729 1059771545 /nfs/dbraw/zinc/77/15/45/1059771545.db2.gz JMKKITZXLSSYIS-UHFFFAOYSA-N 1 0 316.489 4.034 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]CCc2c[nH]c3ccccc23)cc1 ZINC001560249536 1060017288 /nfs/dbraw/zinc/01/72/88/1060017288.db2.gz PEKLJQJFCXMHTJ-AATRIKPKSA-N 1 0 319.452 4.079 20 10 DICDRO C[C@H](OCCC[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC001560253541 1060022520 /nfs/dbraw/zinc/02/25/20/1060022520.db2.gz UQEMQZUCCUQHTR-AWEZNQCLSA-N 1 0 319.832 4.303 20 10 DICDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1c(O)cccc1Br ZINC001560322588 1060110437 /nfs/dbraw/zinc/11/04/37/1060110437.db2.gz LJYZYGAAXZOFOR-HBYGRHMLSA-N 1 0 312.251 4.069 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cc(F)ccc2F)cc1C ZINC001560324831 1060112735 /nfs/dbraw/zinc/11/27/35/1060112735.db2.gz HEBGRYRIVNCBTN-UHFFFAOYSA-N 1 0 305.368 4.352 20 10 DICDRO CCCC[NH2+]Cc1nc(-c2ccc(-n3c(C)ccc3C)cc2)no1 ZINC001249025500 1060115122 /nfs/dbraw/zinc/11/51/22/1060115122.db2.gz HJNORVDDFNNETE-UHFFFAOYSA-N 1 0 324.428 4.034 20 10 DICDRO COc1ccc(C[NH2+]C[C@H](C)Oc2cccc(Cl)c2)cc1C ZINC001560350663 1060135536 /nfs/dbraw/zinc/13/55/36/1060135536.db2.gz BQCZCBKDJFZQOO-AWEZNQCLSA-N 1 0 319.832 4.214 20 10 DICDRO CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001560370131 1060157442 /nfs/dbraw/zinc/15/74/42/1060157442.db2.gz WZEFTZJAHTVDRN-RBUKOAKNSA-N 1 0 318.530 4.441 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@]2(C)CCCS2)cc1F ZINC001560394570 1060181769 /nfs/dbraw/zinc/18/17/69/1060181769.db2.gz DRNXJCGJMJWKPX-KRWDZBQOSA-N 1 0 310.482 4.047 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCO[C@@H](C(C)C)C2)cc1C ZINC001560415962 1060199480 /nfs/dbraw/zinc/19/94/80/1060199480.db2.gz GZGZNMGWALPTSF-PKOBYXMFSA-N 1 0 305.462 4.077 20 10 DICDRO C[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001560415973 1060199601 /nfs/dbraw/zinc/19/96/01/1060199601.db2.gz HQYJHDNMKPYLPF-BTYIYWSLSA-N 1 0 307.437 4.425 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[NH+]3CCC(C(F)F)CC3)ccc2O1 ZINC001249252875 1060203308 /nfs/dbraw/zinc/20/33/08/1060203308.db2.gz YTARNMYFYREYQL-UHFFFAOYSA-N 1 0 323.383 4.054 20 10 DICDRO CC1(C)C=Cc2c(O)c(C[NH+]3C4CCCC3CCC4)ccc2O1 ZINC001249259448 1060204646 /nfs/dbraw/zinc/20/46/46/1060204646.db2.gz ZKHBPPWOGRPLOW-UHFFFAOYSA-N 1 0 313.441 4.483 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H](C)c2ccccc2)ccc1OC ZINC001560434519 1060222544 /nfs/dbraw/zinc/22/25/44/1060222544.db2.gz YRRXTMZRPXVAGE-MRXNPFEDSA-N 1 0 313.441 4.125 20 10 DICDRO CC(C)(CF)[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560445175 1060233148 /nfs/dbraw/zinc/23/31/48/1060233148.db2.gz NSAUIRGHGLAMQB-UHFFFAOYSA-N 1 0 312.432 4.087 20 10 DICDRO CC(C)Cc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cn1 ZINC001560445308 1060237782 /nfs/dbraw/zinc/23/77/82/1060237782.db2.gz RADOFMHZQNQWQF-INIZCTEOSA-N 1 0 311.473 4.197 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CC2CCC(F)(F)CC2)cc1 ZINC001560451433 1060243251 /nfs/dbraw/zinc/24/32/51/1060243251.db2.gz MSLROFGLWCBHMQ-UHFFFAOYSA-N 1 0 310.432 4.448 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H]2CCO[C@H](C(C)C)C2)cc1C ZINC001560479188 1060269185 /nfs/dbraw/zinc/26/91/85/1060269185.db2.gz ZQUFSWHXVKDBSL-QUCCMNQESA-N 1 0 319.489 4.325 20 10 DICDRO COc1cc(C[NH2+][C@H]2CC3CCC2CC3)c(O)c(C(C)(C)C)c1 ZINC001560482745 1060271255 /nfs/dbraw/zinc/27/12/55/1060271255.db2.gz ZXVGXJKMJOUDAH-JRSKDTKFSA-N 1 0 317.473 4.367 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCCC2(F)F)c(Cl)c1 ZINC001560483973 1060274786 /nfs/dbraw/zinc/27/47/86/1060274786.db2.gz RKGUENHKKJJRJB-NSHDSACASA-N 1 0 303.780 4.269 20 10 DICDRO CC/C=C\C[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560485813 1060277779 /nfs/dbraw/zinc/27/77/79/1060277779.db2.gz HPLPRESPMIVXOU-CLTKARDFSA-N 1 0 306.453 4.305 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1ccc2[nH]ccc2c1 ZINC001560508575 1060306234 /nfs/dbraw/zinc/30/62/34/1060306234.db2.gz BBEDFFRBROZULG-MRXNPFEDSA-N 1 0 321.468 4.263 20 10 DICDRO CC[C@@H]1CCC[C@H](C[NH2+][C@H]2CCN(c3ccc(OC)cc3)C2)C1 ZINC001560529137 1060329881 /nfs/dbraw/zinc/32/98/81/1060329881.db2.gz SSJDGGAPLUNVCS-SQNIBIBYSA-N 1 0 316.489 4.080 20 10 DICDRO CC[C@H](CCc1ccccc1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001560533149 1060334463 /nfs/dbraw/zinc/33/44/63/1060334463.db2.gz IHDOGESAQTZFEV-GOSISDBHSA-N 1 0 314.448 4.393 20 10 DICDRO CC(C)(C)OC1CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC001560553191 1060362856 /nfs/dbraw/zinc/36/28/56/1060362856.db2.gz XZJWXOCZWQHDRI-UHFFFAOYSA-N 1 0 317.473 4.228 20 10 DICDRO CCC[C@@H](C)CC[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC001560573256 1060386991 /nfs/dbraw/zinc/38/69/91/1060386991.db2.gz PESYWAYCBCAZQC-MRXNPFEDSA-N 1 0 304.478 4.080 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H]2CCCC(C)(C)O2)cc1C ZINC001560610183 1060424409 /nfs/dbraw/zinc/42/44/09/1060424409.db2.gz MFARVWSCYMGVKQ-QGZVFWFLSA-N 1 0 305.462 4.221 20 10 DICDRO Cc1ccc(Cl)cc1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001560609589 1060424421 /nfs/dbraw/zinc/42/44/21/1060424421.db2.gz QGNQWYYXMVUZIZ-UHFFFAOYSA-N 1 0 324.802 4.282 20 10 DICDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)c(C)cc2O)n1 ZINC001560644809 1060468322 /nfs/dbraw/zinc/46/83/22/1060468322.db2.gz HGODNTCTWIAGAC-KRWDZBQOSA-N 1 0 316.832 4.395 20 10 DICDRO CC(C)[C@H]1CC[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001560647620 1060471251 /nfs/dbraw/zinc/47/12/51/1060471251.db2.gz BCVQQPXSVSKLFZ-ZDUSSCGKSA-N 1 0 314.395 4.249 20 10 DICDRO CCCC[N@H+](Cc1cc(Br)cc(C)c1O)C1CC1 ZINC001560658222 1060479767 /nfs/dbraw/zinc/47/97/67/1060479767.db2.gz QLZHNFNBLQQKLT-UHFFFAOYSA-N 1 0 312.251 4.228 20 10 DICDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC001560661377 1060487875 /nfs/dbraw/zinc/48/78/75/1060487875.db2.gz BVTFACABXDTDJR-KRWDZBQOSA-N 1 0 316.832 4.122 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC001560665093 1060493363 /nfs/dbraw/zinc/49/33/63/1060493363.db2.gz MACGAEQYQDDNOU-YJJPMGAVSA-N 1 0 306.453 4.255 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCOC3(C2)CCCCCC3)c(Cl)c1 ZINC001560664566 1060493406 /nfs/dbraw/zinc/49/34/06/1060493406.db2.gz BKLPZTLKUKMOSJ-UHFFFAOYSA-N 1 0 323.864 4.279 20 10 DICDRO C[C@H]1c2ccccc2OCC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001560680503 1060520716 /nfs/dbraw/zinc/52/07/16/1060520716.db2.gz CIXDUNBNMNEVBI-LXXRFIIISA-N 1 0 322.452 4.221 20 10 DICDRO CCN(CC)c1ccc(C[N@H+](C)CC2CCSCC2)cc1 ZINC001560715162 1060574324 /nfs/dbraw/zinc/57/43/24/1060574324.db2.gz RTBSQFYFFWOXKL-UHFFFAOYSA-N 1 0 306.519 4.108 20 10 DICDRO COc1cc(C)cc(C[N@H+](C)[C@@H](C)c2ccccc2F)c1O ZINC001560717851 1060578773 /nfs/dbraw/zinc/57/87/73/1060578773.db2.gz ANVQHYJVPSDJLP-ZDUSSCGKSA-N 1 0 303.377 4.041 20 10 DICDRO CCC[N@H+](Cc1ccc(C)cc1)Cc1cc(C)cc(OC)c1O ZINC001560722191 1060584885 /nfs/dbraw/zinc/58/48/85/1060584885.db2.gz SQNFTJZAKVPWER-UHFFFAOYSA-N 1 0 313.441 4.430 20 10 DICDRO Oc1cc(Cl)ccc1C[N@H+](Cc1ccccc1F)C1CC1 ZINC001560731451 1060597928 /nfs/dbraw/zinc/59/79/28/1060597928.db2.gz XLOCXSSZGKABPQ-UHFFFAOYSA-N 1 0 305.780 4.349 20 10 DICDRO CC1=CCC[C@@H](C)[C@@H]1CN(C)c1ccc(OCC[NH+](C)C)cc1 ZINC001560738782 1060607690 /nfs/dbraw/zinc/60/76/90/1060607690.db2.gz WOEVBJHJNLLUBI-YLJYHZDGSA-N 1 0 316.489 4.056 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCc2ccc(F)cc2)c1 ZINC001560814609 1060673923 /nfs/dbraw/zinc/67/39/23/1060673923.db2.gz COTMQODYJFTAAB-KBPBESRZSA-N 1 0 317.404 4.212 20 10 DICDRO COc1cc(C)cc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2)c1O ZINC001560820402 1060679227 /nfs/dbraw/zinc/67/92/27/1060679227.db2.gz AUWFJMFSLFFVLZ-MAUKXSAKSA-N 1 0 311.425 4.292 20 10 DICDRO C[C@H](C1CC1)[N@H+](C)Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001560836593 1060693288 /nfs/dbraw/zinc/69/32/88/1060693288.db2.gz CKRHGIANEGZHHV-QGZVFWFLSA-N 1 0 320.480 4.480 20 10 DICDRO COc1cc(C)c(C[NH2+][C@@H]2CCCc3ccc(C)cc32)c(O)c1 ZINC001560846688 1060702374 /nfs/dbraw/zinc/70/23/74/1060702374.db2.gz CXRGOFHFDSXSQR-LJQANCHMSA-N 1 0 311.425 4.185 20 10 DICDRO CC[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1C)CC(F)(F)F ZINC001560889133 1060750843 /nfs/dbraw/zinc/75/08/43/1060750843.db2.gz NKNMUKQQIHQCEE-CYBMUJFWSA-N 1 0 302.384 4.129 20 10 DICDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[C@@H]2CCC[C@H]12 ZINC001560890781 1060753239 /nfs/dbraw/zinc/75/32/39/1060753239.db2.gz QMKRFBRCCRQCQG-CPLUKWAASA-N 1 0 300.490 4.160 20 10 DICDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@]2(F)c2ccccc2)cc1Cl ZINC001560897941 1060760147 /nfs/dbraw/zinc/76/01/47/1060760147.db2.gz RSLONDWBHLFPSA-SJORKVTESA-N 1 0 305.780 4.081 20 10 DICDRO CC[C@]1(C)CCC[C@H]1[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC001560899127 1060762140 /nfs/dbraw/zinc/76/21/40/1060762140.db2.gz YIGBJBXXQWUFPO-PWIZWCRZSA-N 1 0 316.489 4.080 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1 ZINC001560904194 1060768406 /nfs/dbraw/zinc/76/84/06/1060768406.db2.gz QAPUDCWKFYSBIW-IBGZPJMESA-N 1 0 311.425 4.169 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC001560913472 1060774327 /nfs/dbraw/zinc/77/43/27/1060774327.db2.gz MXIQDLAJZJHXKS-UHFFFAOYSA-N 1 0 305.805 4.164 20 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MAWCXMJMZHBABV-UHFFFAOYSA-N 1 0 306.450 4.176 20 10 DICDRO CC[N@H+](Cc1cc(Br)ccc1O)CC1(C)CCC1 ZINC001473193012 1060946672 /nfs/dbraw/zinc/94/66/72/1060946672.db2.gz ZYQVGASRRWMGKI-UHFFFAOYSA-N 1 0 312.251 4.167 20 10 DICDRO CCC[N@H+](CCCOCc1ccccc1)Cc1ccccc1O ZINC001473195983 1060952161 /nfs/dbraw/zinc/95/21/61/1060952161.db2.gz NIJHLRQMHZMNQB-UHFFFAOYSA-N 1 0 313.441 4.211 20 10 DICDRO CCN(C[C@@H](C)COCc1ccccc1)c1ccc(OC)cc1 ZINC001473246322 1061020828 /nfs/dbraw/zinc/02/08/28/1061020828.db2.gz AUBSWTVYKXJSFY-QGZVFWFLSA-N 1 0 313.441 4.374 20 10 DICDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001462204280 1061024033 /nfs/dbraw/zinc/02/40/33/1061024033.db2.gz UIRGINSDXOTXFH-ZFWWWQNUSA-N 1 0 305.462 4.461 20 10 DICDRO CCc1ccc([C@@H]2CCC[N@H+](Cc3cc(F)ccc3O)C2)cc1 ZINC001462211245 1061030329 /nfs/dbraw/zinc/03/03/29/1061030329.db2.gz NOXMJWQMLYKPAK-QGZVFWFLSA-N 1 0 313.416 4.473 20 10 DICDRO CC[C@H](CCc1ccccc1)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC001462211083 1061030636 /nfs/dbraw/zinc/03/06/36/1061030636.db2.gz UFURFUJTUQEHMO-NVXWUHKLSA-N 1 0 313.441 4.463 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@H](c3ccccc3F)C2)cc1 ZINC001462272310 1061067052 /nfs/dbraw/zinc/06/70/52/1061067052.db2.gz OJEBCDHWAQICEX-DUMMIQTOSA-N 1 0 324.443 4.394 20 10 DICDRO CCC(CC)[N@H+](CC)Cc1ccc(Br)cc1[O-] ZINC001462297407 1061086398 /nfs/dbraw/zinc/08/63/98/1061086398.db2.gz OLXPSKUODLQLNW-UHFFFAOYSA-N 1 0 300.240 4.165 20 10 DICDRO Cc1cc(Br)cc(C[NH2+][C@H](C)CC(C)(C)C)c1O ZINC001462314714 1061100898 /nfs/dbraw/zinc/10/08/98/1061100898.db2.gz KRRRJMHKUDDNOM-LLVKDONJSA-N 1 0 314.267 4.377 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2C)CC2CC2)cn1 ZINC001462366911 1061132274 /nfs/dbraw/zinc/13/22/74/1061132274.db2.gz APMMNMFQLHOTES-UHFFFAOYSA-N 1 0 323.484 4.177 20 10 DICDRO COc1c(C)cccc1C[NH2+]Cc1ccc2ccccc2c1O ZINC001462382974 1061140259 /nfs/dbraw/zinc/14/02/59/1061140259.db2.gz KKKMXVGZBPUYPR-UHFFFAOYSA-N 1 0 307.393 4.152 20 10 DICDRO COc1cc(C)cc(C[NH2+]C2(c3ccc(C)cc3)CCC2)c1O ZINC001462405784 1061154126 /nfs/dbraw/zinc/15/41/26/1061154126.db2.gz SJKXKKKUOCBPQH-UHFFFAOYSA-N 1 0 311.425 4.187 20 10 DICDRO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001473448378 1061165846 /nfs/dbraw/zinc/16/58/46/1061165846.db2.gz IVBRLGMVIHNNMX-HXUWFJFHSA-N 1 0 312.457 4.344 20 10 DICDRO Oc1c(C[NH2+]C[C@@H]2CCN2C2CCCCC2)ccc2ccccc21 ZINC001462433904 1061172118 /nfs/dbraw/zinc/17/21/18/1061172118.db2.gz ARGAHAOYUGVYTD-IBGZPJMESA-N 1 0 324.468 4.042 20 10 DICDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC001462466585 1061191709 /nfs/dbraw/zinc/19/17/09/1061191709.db2.gz AJSXWMFLEMMKQJ-SNVBAGLBSA-N 1 0 307.743 4.128 20 10 DICDRO Cc1cc(C[NH2+][C@@H]2COC(C)(C)C2)c(C)n1-c1cccc(C)c1 ZINC001462502104 1061214458 /nfs/dbraw/zinc/21/44/58/1061214458.db2.gz BVVRPXOMSWKJLD-SFHVURJKSA-N 1 0 312.457 4.060 20 10 DICDRO Oc1cc(Cl)ccc1C[NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F ZINC001462522951 1061232390 /nfs/dbraw/zinc/23/23/90/1061232390.db2.gz KWGFTKOZVJKVCL-VXGBXAGGSA-N 1 0 305.727 4.032 20 10 DICDRO COC1([C@@H](C)[NH2+]Cc2ccc(N3CCCCC3)c(C)c2)CCC1 ZINC001473554433 1061242195 /nfs/dbraw/zinc/24/21/95/1061242195.db2.gz FIEHGONHRVGJPI-QGZVFWFLSA-N 1 0 316.489 4.033 20 10 DICDRO CC1(C)CC[C@H](CC[NH2+]Cc2ccc3ccccc3c2O)OC1 ZINC001462616959 1061300334 /nfs/dbraw/zinc/30/03/34/1061300334.db2.gz IKLMVJDZQCGPGM-QGZVFWFLSA-N 1 0 313.441 4.230 20 10 DICDRO C[C@@H]([NH2+]CCCSCc1ccccc1)c1ccccc1O ZINC001473722940 1061371650 /nfs/dbraw/zinc/37/16/50/1061371650.db2.gz SWSXHDPZVQGQMZ-OAHLLOKOSA-N 1 0 301.455 4.366 20 10 DICDRO COc1ccc(N2CCC([NH2+][C@@H](C)CCCC(C)C)CC2)cc1 ZINC001473913147 1061460303 /nfs/dbraw/zinc/46/03/03/1061460303.db2.gz JXRJNDIEFKZKNF-KRWDZBQOSA-N 1 0 318.505 4.468 20 10 DICDRO CN(C)c1ccc(/C=C\C[NH2+]CCc2cccc(Cl)c2)cc1 ZINC001473913777 1061461668 /nfs/dbraw/zinc/46/16/68/1061461668.db2.gz BUCUOTFYSQGKOK-XQRVVYSFSA-N 1 0 314.860 4.252 20 10 DICDRO C(=C\c1ccccc1)\C[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC001473939054 1061485258 /nfs/dbraw/zinc/48/52/58/1061485258.db2.gz SDODUGGPJBJOCI-DAXSKMNVSA-N 1 0 324.493 4.043 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1)C1CC1 ZINC001473958188 1061499235 /nfs/dbraw/zinc/49/92/35/1061499235.db2.gz WYCCDMVDTGPFQM-QGZVFWFLSA-N 1 0 320.480 4.385 20 10 DICDRO CN(C)c1ccc(/C=C/C[NH2+]C2(c3ccccc3)CCC2)cc1 ZINC001473966287 1061509166 /nfs/dbraw/zinc/50/91/66/1061509166.db2.gz SQOLBONSEROBOL-SOFGYWHQSA-N 1 0 306.453 4.435 20 10 DICDRO Cc1cc(C)c(/C=C\C[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC001473970366 1061514424 /nfs/dbraw/zinc/51/44/24/1061514424.db2.gz QBNAGZOAOQYPSG-PLNGDYQASA-N 1 0 307.437 4.350 20 10 DICDRO Clc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c2ncccc12 ZINC001473970208 1061515376 /nfs/dbraw/zinc/51/53/76/1061515376.db2.gz KPABEPZVTRKZLN-UHFFFAOYSA-N 1 0 324.811 4.113 20 10 DICDRO Cc1ccccc1C1(C[NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC001473972379 1061516694 /nfs/dbraw/zinc/51/66/94/1061516694.db2.gz NXAYQPGGIRCPPX-UHFFFAOYSA-N 1 0 307.437 4.141 20 10 DICDRO CC(C)[C@H]1CCC[C@H]([NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001473986823 1061528358 /nfs/dbraw/zinc/52/83/58/1061528358.db2.gz QVVIFCUBBRAYNP-ZFWWWQNUSA-N 1 0 310.432 4.335 20 10 DICDRO COc1ccc(C[NH2+]CCCc2ccc(Cl)cc2)cc1C ZINC001473990260 1061535596 /nfs/dbraw/zinc/53/55/96/1061535596.db2.gz MONHBEABYUFGSS-UHFFFAOYSA-N 1 0 303.833 4.379 20 10 DICDRO CCS[C@@H]1CCC[C@@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC001474038400 1061582610 /nfs/dbraw/zinc/58/26/10/1061582610.db2.gz PVTQFZHTZUHCFR-WAQVGJNASA-N 1 0 318.530 4.420 20 10 DICDRO CCCOc1ccc(C[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)cc1C ZINC001474099245 1061645236 /nfs/dbraw/zinc/64/52/36/1061645236.db2.gz IJXVBGUBTVYTMO-PKOBYXMFSA-N 1 0 319.489 4.467 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@@H](C)c2nccs2)cc1C ZINC001474106419 1061656782 /nfs/dbraw/zinc/65/67/82/1061656782.db2.gz TYQNAJLOYMPMIA-CQSZACIVSA-N 1 0 304.459 4.134 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](C)c2ncc(C)s2)cc1 ZINC001474106421 1061657253 /nfs/dbraw/zinc/65/72/53/1061657253.db2.gz UCUUWMZFRNFSBL-CQSZACIVSA-N 1 0 317.502 4.191 20 10 DICDRO Cc1cc(O)c(C[NH2+]Cc2ccc(Cl)cc2F)c(Cl)c1 ZINC001474120229 1061669503 /nfs/dbraw/zinc/66/95/03/1061669503.db2.gz JKRWYJZFQOOWPQ-UHFFFAOYSA-N 1 0 314.187 4.436 20 10 DICDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3ccc4c(c3)CCCO4)C2)c1 ZINC001474146959 1061693242 /nfs/dbraw/zinc/69/32/42/1061693242.db2.gz MUSBAJYLAPECRZ-WGSAOQKQSA-N 1 0 323.436 4.056 20 10 DICDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CSc3ccccc32)c(Cl)c1 ZINC001474157856 1061698550 /nfs/dbraw/zinc/69/85/50/1061698550.db2.gz QIOVIVKPZUNJBL-GFCCVEGCSA-N 1 0 319.857 4.333 20 10 DICDRO CCOCc1cc(C[NH2+]CC(C)(C)C(C)(C)C)ccc1OC ZINC001474159192 1061700527 /nfs/dbraw/zinc/70/05/27/1061700527.db2.gz HXEMAFZQLOCLQM-UHFFFAOYSA-N 1 0 307.478 4.394 20 10 DICDRO COc1ccccc1C1([NH2+]Cc2c(C)c3ccccc3n2C)CC1 ZINC001474187201 1061736525 /nfs/dbraw/zinc/73/65/25/1061736525.db2.gz AJIXVGHHYAMQKD-UHFFFAOYSA-N 1 0 320.436 4.274 20 10 DICDRO Cc1ccc2c(c1)[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)CC2 ZINC001474198033 1061748522 /nfs/dbraw/zinc/74/85/22/1061748522.db2.gz VBMLGLPJPQZIHN-NYPGBQQYSA-N 1 0 306.453 4.351 20 10 DICDRO CC[C@H](OCC[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC001474201527 1061755133 /nfs/dbraw/zinc/75/51/33/1061755133.db2.gz YMRADNZWUTVJHA-SFHVURJKSA-N 1 0 319.832 4.303 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+]Cc3cccc(C(C)C)c3)C2)cc1 ZINC001474205244 1061760990 /nfs/dbraw/zinc/76/09/90/1061760990.db2.gz CQIHRGBWMAOZOA-IBGZPJMESA-N 1 0 324.468 4.187 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](OC)C2CCCCC2)cc1C ZINC001474222915 1061783955 /nfs/dbraw/zinc/78/39/55/1061783955.db2.gz MXVWEXHTZQRJBZ-FQEVSTJZSA-N 1 0 319.489 4.469 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)[C@H]2CCCCO2)cc1F ZINC001474240996 1061804390 /nfs/dbraw/zinc/80/43/90/1061804390.db2.gz FWGWYSYKAWKZAM-GOSISDBHSA-N 1 0 322.468 4.109 20 10 DICDRO C[C@H]([NH2+]Cc1cccc(F)c1Br)c1ccccc1O ZINC001474253282 1061818624 /nfs/dbraw/zinc/81/86/24/1061818624.db2.gz NLPZHOLSLOSYNX-JTQLQIEISA-N 1 0 324.193 4.145 20 10 DICDRO COc1ccc(N2CCC([NH2+]CCC[C@@H]3C=CCC3)CC2)cc1 ZINC001474254711 1061821883 /nfs/dbraw/zinc/82/18/83/1061821883.db2.gz HIUYPDHHENFCAU-QGZVFWFLSA-N 1 0 314.473 4.000 20 10 DICDRO COc1cc(C[NH2+]C[C@@H](C)C(C)(C)C)c(O)c(C(C)(C)C)c1 ZINC001474269044 1061835764 /nfs/dbraw/zinc/83/57/64/1061835764.db2.gz ARFWHLKHOGUVHY-CYBMUJFWSA-N 1 0 307.478 4.470 20 10 DICDRO CSC1(C[NH2+]Cc2ccc3c(c2)CCCO3)CCCCC1 ZINC001474270447 1061838747 /nfs/dbraw/zinc/83/87/47/1061838747.db2.gz ZRHZYNAFZXCRAE-UHFFFAOYSA-N 1 0 305.487 4.167 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC001474276649 1061843625 /nfs/dbraw/zinc/84/36/25/1061843625.db2.gz FORVWANAWOIMNS-FQEVSTJZSA-N 1 0 305.425 4.123 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+]C[C@]2(C)CCCCO2)cc1 ZINC001474284906 1061854869 /nfs/dbraw/zinc/85/48/69/1061854869.db2.gz KXYZNAOCMSGJOL-FQEVSTJZSA-N 1 0 318.505 4.362 20 10 DICDRO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c(O)c1 ZINC001474308751 1061876417 /nfs/dbraw/zinc/87/64/17/1061876417.db2.gz ZBJXWAJZVQNCLM-UHFFFAOYSA-N 1 0 323.392 4.202 20 10 DICDRO C[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)[C@H]1C ZINC001474309489 1061876795 /nfs/dbraw/zinc/87/67/95/1061876795.db2.gz HPKWKHMTWUTTAD-OLZOCXBDSA-N 1 0 314.395 4.392 20 10 DICDRO CCC1(CC)[C@@H](OC)C[C@@H]1[N@H+](C)Cc1ccc(Cl)cc1O ZINC001474320959 1061895429 /nfs/dbraw/zinc/89/54/29/1061895429.db2.gz VJMIOMBRRYHKHE-HOTGVXAUSA-N 1 0 311.853 4.071 20 10 DICDRO CC[N@H+](Cc1ccccc1C)Cc1cc(Cl)cc(OC)c1O ZINC001474319794 1061898497 /nfs/dbraw/zinc/89/84/97/1061898497.db2.gz SNOLVMUWJKATEV-UHFFFAOYSA-N 1 0 319.832 4.385 20 10 DICDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC001474345171 1061944445 /nfs/dbraw/zinc/94/44/45/1061944445.db2.gz FIEQZUWNJSYPNE-GUWAZMKPSA-N 1 0 322.452 4.309 20 10 DICDRO Cc1cc(O)c(C[N@H+]2Cc3ccccc3C[C@H]2C)cc1Cl ZINC001474352075 1061961054 /nfs/dbraw/zinc/96/10/54/1061961054.db2.gz SFVLWWFXUBOMPB-CYBMUJFWSA-N 1 0 301.817 4.301 20 10 DICDRO CCC[N@H+](Cc1cc(O)cc(Cl)c1)Cc1ccccc1O ZINC001474368011 1062003791 /nfs/dbraw/zinc/00/37/91/1062003791.db2.gz FNFGYBMGMFZSKU-UHFFFAOYSA-N 1 0 305.805 4.163 20 10 DICDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)C1CCC(F)(F)CC1 ZINC001254223673 1062056406 /nfs/dbraw/zinc/05/64/06/1062056406.db2.gz NRPZRBQJKIRNND-UHFFFAOYSA-N 1 0 308.416 4.297 20 10 DICDRO CCc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)CCO2 ZINC001474424049 1062099906 /nfs/dbraw/zinc/09/99/06/1062099906.db2.gz QTXBBQCLDFXXNE-FQEVSTJZSA-N 1 0 324.468 4.237 20 10 DICDRO Cc1ccc([C@@H]2CC[N@@H+](Cc3ccc(N(C)C)cc3C)C2)cc1 ZINC001474438147 1062114701 /nfs/dbraw/zinc/11/47/01/1062114701.db2.gz DAJFEEFIUPJKDS-HXUWFJFHSA-N 1 0 308.469 4.359 20 10 DICDRO COc1ccc(C[NH2+][C@H]2CCC[C@@H](C(C)C)CC2)c(O)c1OC ZINC001474461843 1062140031 /nfs/dbraw/zinc/14/00/31/1062140031.db2.gz WJHFUINJROZKCZ-ZBFHGGJFSA-N 1 0 321.461 4.104 20 10 DICDRO Cc1ccc(C[NH2+]CCCCCc2ccc(F)cc2)c(O)c1 ZINC001474461672 1062140441 /nfs/dbraw/zinc/14/04/41/1062140441.db2.gz UHNYMHWFBSTIIJ-UHFFFAOYSA-N 1 0 301.405 4.342 20 10 DICDRO CCC[C@@]1(COC)CCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001474476803 1062155217 /nfs/dbraw/zinc/15/52/17/1062155217.db2.gz IKPSPAICTOBPCS-LZVBJTEYSA-N 1 0 316.489 4.047 20 10 DICDRO Cc1ccccc1C[C@@H]1CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001459513941 1062174630 /nfs/dbraw/zinc/17/46/30/1062174630.db2.gz IWPHXCYTVOEFFL-NRFANRHFSA-N 1 0 308.469 4.268 20 10 DICDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1C[C@H](OC(C)(C)C)C1(C)C ZINC001474494969 1062176103 /nfs/dbraw/zinc/17/61/03/1062176103.db2.gz HEEUNYMRLKFMDJ-MSOLQXFVSA-N 1 0 318.505 4.344 20 10 DICDRO CCC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1C[C@@H](OCC)C1(C)C ZINC001459528414 1062185544 /nfs/dbraw/zinc/18/55/44/1062185544.db2.gz IROJBJQLAQUWNP-RBUKOAKNSA-N 1 0 318.505 4.168 20 10 DICDRO C[N@H+](Cc1cc2cnccc2o1)Cc1ccc(N2CCCC2)cc1 ZINC001474505672 1062188307 /nfs/dbraw/zinc/18/83/07/1062188307.db2.gz FDLCKUNTAORFBL-UHFFFAOYSA-N 1 0 321.424 4.060 20 10 DICDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(C(C)C)cc2)c1 ZINC001474505072 1062188879 /nfs/dbraw/zinc/18/88/79/1062188879.db2.gz NGCVUHDUARYWMS-HNNXBMFYSA-N 1 0 313.441 4.418 20 10 DICDRO Cc1cc(C[N@@H+]2CCc3c(Cl)cccc3C2)ccc1N(C)C ZINC001459536880 1062193094 /nfs/dbraw/zinc/19/30/94/1062193094.db2.gz DTEOMFYFHUHGQW-UHFFFAOYSA-N 1 0 314.860 4.273 20 10 DICDRO CC(C)c1ccc(O)c(C[NH2+]C[C@]2(C)CC2(Cl)Cl)c1 ZINC001474531320 1062216214 /nfs/dbraw/zinc/21/62/14/1062216214.db2.gz BCIHBCBGOQPZPE-AWEZNQCLSA-N 1 0 302.245 4.189 20 10 DICDRO COc1ccc(O)c(C[NH2+]C2(C(C)(C)c3ccccc3)CC2)c1 ZINC001474521082 1062206748 /nfs/dbraw/zinc/20/67/48/1062206748.db2.gz OVNPNXUEBJWJCD-UHFFFAOYSA-N 1 0 311.425 4.001 20 10 DICDRO CC(=O)c1cc(F)cc(C[NH+]2CCC(C3CCCC3)CC2)c1O ZINC001459596530 1062233567 /nfs/dbraw/zinc/23/35/67/1062233567.db2.gz MROOISKLLKULHR-UHFFFAOYSA-N 1 0 319.420 4.136 20 10 DICDRO COc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@H](c3ccccc3)[C@@H]2C)c1 ZINC001474544437 1062238771 /nfs/dbraw/zinc/23/87/71/1062238771.db2.gz HFUMBQDQKNTDDG-VCBZYWHSSA-N 1 0 311.425 4.167 20 10 DICDRO C[C@H]([NH2+]CCc1ccc(N(C)C)cc1)c1cc(Cl)ccc1O ZINC001254720924 1062238779 /nfs/dbraw/zinc/23/87/79/1062238779.db2.gz CMUDMXDPUIFLLC-ZDUSSCGKSA-N 1 0 318.848 4.005 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2sccc2[C@H]1C ZINC001474560649 1062266233 /nfs/dbraw/zinc/26/62/33/1062266233.db2.gz LBKCDOXKPGGYOH-CQSZACIVSA-N 1 0 300.471 4.242 20 10 DICDRO Cc1cc(O)c(CNc2ccc(C[NH+](C)C)c(C)c2)cc1Cl ZINC001474573699 1062282161 /nfs/dbraw/zinc/28/21/61/1062282161.db2.gz CDQJIZBXVNYALU-UHFFFAOYSA-N 1 0 318.848 4.336 20 10 DICDRO CC[C@@H]([NH2+]Cc1ccc(Br)cc1O)[C@@H]1CC1(C)C ZINC001474587267 1062296903 /nfs/dbraw/zinc/29/69/03/1062296903.db2.gz PSJRGQQQKZDJHZ-QWHCGFSZSA-N 1 0 312.251 4.069 20 10 DICDRO COc1cc(C[N@@H+]2C[C@H](C)[C@@H](C)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC001474588825 1062302300 /nfs/dbraw/zinc/30/23/00/1062302300.db2.gz MWRJRNUFYSARHB-MJBXVCDLSA-N 1 0 305.462 4.175 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)ccc1N(C)C ZINC001459691692 1062310773 /nfs/dbraw/zinc/31/07/73/1062310773.db2.gz FZTUTHDWWWKDOX-HXUWFJFHSA-N 1 0 323.484 4.138 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H](C)[C@@H]3CCCC[C@@H]3C)C2)cc1 ZINC001474624291 1062345173 /nfs/dbraw/zinc/34/51/73/1062345173.db2.gz PLPILGROAAIHDW-PFRQMTDMSA-N 1 0 316.489 4.078 20 10 DICDRO COc1ccc(N2CC[C@H]([NH2+][C@H](C)[C@@H]3CCCC[C@H]3C)C2)cc1 ZINC001474624290 1062345368 /nfs/dbraw/zinc/34/53/68/1062345368.db2.gz PLPILGROAAIHDW-PDOICOKGSA-N 1 0 316.489 4.078 20 10 DICDRO C[C@H]([NH2+]C1CC(c2ccc(F)cc2F)C1)c1ccccc1O ZINC001474669454 1062399308 /nfs/dbraw/zinc/39/93/08/1062399308.db2.gz DRLJNPZASXCDNO-DCBWTQNWSA-N 1 0 303.352 4.267 20 10 DICDRO CCCC[C@@H](C)[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001255328866 1062405632 /nfs/dbraw/zinc/40/56/32/1062405632.db2.gz FIZNLCAQUPZVOW-CQSZACIVSA-N 1 0 300.446 4.124 20 10 DICDRO CCCC[C@H](C)[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001255328865 1062405689 /nfs/dbraw/zinc/40/56/89/1062405689.db2.gz FIZNLCAQUPZVOW-AWEZNQCLSA-N 1 0 300.446 4.124 20 10 DICDRO CCOc1ccc(N2CC[NH+]([C@H](CC)c3ccccc3)CC2)cc1 ZINC001459798312 1062407600 /nfs/dbraw/zinc/40/76/00/1062407600.db2.gz QXZZXMRKBMREOB-OAQYLSRUSA-N 1 0 324.468 4.359 20 10 DICDRO CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC001459865697 1062457421 /nfs/dbraw/zinc/45/74/21/1062457421.db2.gz BVPZCHGBMJWOCN-FQEVSTJZSA-N 1 0 314.448 4.249 20 10 DICDRO Oc1c(C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)ccc2ccccc21 ZINC001474745716 1062459731 /nfs/dbraw/zinc/45/97/31/1062459731.db2.gz ZMAAXIYNRRADAG-SFHVURJKSA-N 1 0 323.823 4.456 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1CCOC(C)(C)C1 ZINC001255534664 1062475791 /nfs/dbraw/zinc/47/57/91/1062475791.db2.gz GYUIVBUCZNUKHW-KDOFPFPSSA-N 1 0 317.473 4.180 20 10 DICDRO C[C@@H](CSc1ccc(F)cc1)[N@@H+]1CCc2cccc(O)c2C1 ZINC001255750030 1062572217 /nfs/dbraw/zinc/57/22/17/1062572217.db2.gz YPCUGMLHHGTWQW-ZDUSSCGKSA-N 1 0 317.429 4.070 20 10 DICDRO COc1cccc(C[C@H](C)[NH2+]Cc2cc3ccccc3cc2O)c1 ZINC001256153627 1062732454 /nfs/dbraw/zinc/73/24/54/1062732454.db2.gz JRPHCZJQSKCFTM-HNNXBMFYSA-N 1 0 321.420 4.275 20 10 DICDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H](C)Cc1ccncc1 ZINC001256732264 1062956879 /nfs/dbraw/zinc/95/68/79/1062956879.db2.gz CXISUKYXBHLBCJ-QRWLVFNGSA-N 1 0 324.468 4.248 20 10 DICDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2C)cc1 ZINC001460746636 1063035246 /nfs/dbraw/zinc/03/52/46/1063035246.db2.gz MBXCMXWHCQEVIC-HNNXBMFYSA-N 1 0 300.421 4.441 20 10 DICDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)cc1 ZINC001460750899 1063039524 /nfs/dbraw/zinc/03/95/24/1063039524.db2.gz RZEKPESMYRYXCL-HNNXBMFYSA-N 1 0 316.395 4.020 20 10 DICDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]C[C@@H]2C[C@H]2C)cc1 ZINC001461051243 1063218171 /nfs/dbraw/zinc/21/81/71/1063218171.db2.gz ITACXFQJBPQERA-XLIONFOSSA-N 1 0 308.469 4.459 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@H](SC)C2)cc1F ZINC001461184498 1063317303 /nfs/dbraw/zinc/31/73/03/1063317303.db2.gz ZRCBSIDQNKWYHG-CVEARBPZSA-N 1 0 324.509 4.436 20 10 DICDRO CCCOc1ccc(C[NH2+]Cc2cn3c(cccc3C)n2)cc1C ZINC001461190181 1063321091 /nfs/dbraw/zinc/32/10/91/1063321091.db2.gz PEXRMUKQGJWALT-UHFFFAOYSA-N 1 0 323.440 4.030 20 10 DICDRO C[C@H](C[NH2+]Cc1ccc2c(c1)CCCO2)Sc1ccccc1 ZINC001461260734 1063373856 /nfs/dbraw/zinc/37/38/56/1063373856.db2.gz VQXCQRYVLSVIPC-OAHLLOKOSA-N 1 0 313.466 4.282 20 10 DICDRO C[C@@H](C[NH2+]Cc1ccc2c(c1)CCCO2)Cc1cccs1 ZINC001461264760 1063378954 /nfs/dbraw/zinc/37/89/54/1063378954.db2.gz MHAUNJAYIBAESI-CQSZACIVSA-N 1 0 301.455 4.042 20 10 DICDRO CC[C@@H](C[NH2+]Cc1c(O)cccc1Cl)Oc1ccccc1F ZINC001461270850 1063379925 /nfs/dbraw/zinc/37/99/25/1063379925.db2.gz ZHYZEWWRBSNTFM-LBPRGKRZSA-N 1 0 323.795 4.132 20 10 DICDRO CC[C@H](CC(F)F)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001473114364 1063416981 /nfs/dbraw/zinc/41/69/81/1063416981.db2.gz CLOPRDZMTFEBFV-CQSZACIVSA-N 1 0 310.432 4.398 20 10 DICDRO CC(C)CSCCC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001461354189 1063437767 /nfs/dbraw/zinc/43/77/67/1063437767.db2.gz LNHPJCXGIMXLHC-FNORWQNLSA-N 1 0 306.519 4.135 20 10 DICDRO CO[C@@H](C[N@H+](Cc1ccccc1O)C1CCCC1)C1CCCC1 ZINC001473154175 1063457960 /nfs/dbraw/zinc/45/79/60/1063457960.db2.gz MXIWLEYKLYTUMI-FQEVSTJZSA-N 1 0 317.473 4.342 20 10 DICDRO CO[C@H](C[N@H+](Cc1ccccc1O)C1CCCC1)C1CCCC1 ZINC001473154176 1063458547 /nfs/dbraw/zinc/45/85/47/1063458547.db2.gz MXIWLEYKLYTUMI-HXUWFJFHSA-N 1 0 317.473 4.342 20 10 DICDRO Cc1cc(C[NH+](C)C)cc(NC/C=C\c2ccc(N(C)C)cc2)c1 ZINC001461404766 1063476736 /nfs/dbraw/zinc/47/67/36/1063476736.db2.gz MNRFDIHFWRVWHI-SREVYHEPSA-N 1 0 323.484 4.248 20 10 DICDRO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001258076217 1063501442 /nfs/dbraw/zinc/50/14/42/1063501442.db2.gz YAUPKRDOWWKAQZ-GJZGRUSLSA-N 1 0 305.462 4.307 20 10 DICDRO CC(C)=CCC[C@H](C)[NH2+]Cc1cc(Br)ccc1O ZINC001258083480 1063505906 /nfs/dbraw/zinc/50/59/06/1063505906.db2.gz KNHFLWXSDZRHAK-LBPRGKRZSA-N 1 0 312.251 4.379 20 10 DICDRO CCN(CC)c1ccc(C[NH2+]CCc2ccc(F)c(F)c2)cc1 ZINC001461440271 1063507344 /nfs/dbraw/zinc/50/73/44/1063507344.db2.gz CIGFLQKXDIAWSY-UHFFFAOYSA-N 1 0 318.411 4.143 20 10 DICDRO CCCOc1ccc(C[NH2+]C[C@H](CO)CC2CCCC2)cc1C ZINC001461462228 1063522804 /nfs/dbraw/zinc/52/28/04/1063522804.db2.gz KXMGGNBFPOCBTQ-LJQANCHMSA-N 1 0 319.489 4.062 20 10 DICDRO COCC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CCCCC1 ZINC001461547420 1063572616 /nfs/dbraw/zinc/57/26/16/1063572616.db2.gz GMDVRFPIGOJPNL-UHFFFAOYSA-N 1 0 311.853 4.041 20 10 DICDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@H]2C2CC2)ccc1OC ZINC001461577957 1063589246 /nfs/dbraw/zinc/58/92/46/1063589246.db2.gz FHJVJOGOLAYZFH-HKUYNNGSSA-N 1 0 317.473 4.148 20 10 DICDRO C[C@H]1C[C@@H]([NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CO1 ZINC001461618359 1063616876 /nfs/dbraw/zinc/61/68/76/1063616876.db2.gz UGFANODBAWFVIR-XJKSGUPXSA-N 1 0 319.489 4.254 20 10 DICDRO CC[C@H](OCC[NH2+]Cc1ccc(OC)c(C)c1)c1ccccc1 ZINC001461624209 1063621590 /nfs/dbraw/zinc/62/15/90/1063621590.db2.gz STQIKZONJUBHPY-IBGZPJMESA-N 1 0 313.441 4.261 20 10 DICDRO CCCC1CCC([NH2+][C@H]2CCN(c3ccc(OC)cc3)C2)CC1 ZINC001461629351 1063624952 /nfs/dbraw/zinc/62/49/52/1063624952.db2.gz HCZXAKZILLFKGY-ABHNRTSZSA-N 1 0 316.489 4.222 20 10 DICDRO COc1ccc(CC[C@H](C)[NH2+]Cc2c(C)cc(C)cc2O)cc1 ZINC001258395218 1063635597 /nfs/dbraw/zinc/63/55/97/1063635597.db2.gz SFQLTBBJZUYTOR-INIZCTEOSA-N 1 0 313.441 4.129 20 10 DICDRO C1=CCC(C[NH2+]Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC001461649422 1063636087 /nfs/dbraw/zinc/63/60/87/1063636087.db2.gz ZBYRDNBGILTFFG-UHFFFAOYSA-N 1 0 318.464 4.305 20 10 DICDRO CCSC1(C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC001461652774 1063639377 /nfs/dbraw/zinc/63/93/77/1063639377.db2.gz LSFKGZXBMDXCLL-UHFFFAOYSA-N 1 0 323.502 4.074 20 10 DICDRO Clc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)CCCO3)CC2 ZINC001461669926 1063649760 /nfs/dbraw/zinc/64/97/60/1063649760.db2.gz IINQWUNPOIBETD-SFHVURJKSA-N 1 0 313.828 4.442 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+]CC[C@H]1CCCC1(F)F ZINC001461709144 1063671959 /nfs/dbraw/zinc/67/19/59/1063671959.db2.gz KEPRLGWXGAISBN-CQSZACIVSA-N 1 0 306.400 4.402 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCc3c2cccc3F)cc1 ZINC001461761012 1063702022 /nfs/dbraw/zinc/70/20/22/1063702022.db2.gz UHBNBVWAEDAEPY-FQEVSTJZSA-N 1 0 312.432 4.449 20 10 DICDRO c1ccc2c(c1)CCC[C@H]([NH2+]Cc1ccc3c(c1)CCCO3)C2 ZINC001461788402 1063719035 /nfs/dbraw/zinc/71/90/35/1063719035.db2.gz BNCLRGMXPPPCTF-FQEVSTJZSA-N 1 0 307.437 4.049 20 10 DICDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCSC(C)(C)C2)cc1 ZINC001461790627 1063720492 /nfs/dbraw/zinc/72/04/92/1063720492.db2.gz YWDBLDSUXBSQMY-INIZCTEOSA-N 1 0 306.519 4.297 20 10 DICDRO CC(C)c1ccc(O)c(C[N@@H+]2CCCN(c3ccccc3)CC2)c1 ZINC001461884945 1063776554 /nfs/dbraw/zinc/77/65/54/1063776554.db2.gz MFJQLLOXEWAEKB-UHFFFAOYSA-N 1 0 324.468 4.228 20 10 DICDRO C[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)[C@@H]1c1ccccc1 ZINC001461933851 1063820450 /nfs/dbraw/zinc/82/04/50/1063820450.db2.gz GDBOOGOXMRYOEG-FLNVOPPSSA-N 1 0 306.453 4.459 20 10 DICDRO C[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)[C@H]1c1ccccc1 ZINC001461933865 1063821679 /nfs/dbraw/zinc/82/16/79/1063821679.db2.gz GDBOOGOXMRYOEG-ILLWNSAZSA-N 1 0 306.453 4.459 20 10 DICDRO CCc1cccc(C[N@H+](C)[C@@H](C)Cc2ccccc2OC)c1O ZINC001461949443 1063831999 /nfs/dbraw/zinc/83/19/99/1063831999.db2.gz MCJCKWOWWTYARV-HNNXBMFYSA-N 1 0 313.441 4.026 20 10 DICDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCc2ccccc2C1 ZINC001461959667 1063841462 /nfs/dbraw/zinc/84/14/62/1063841462.db2.gz PGCJWBTYDOEXFE-KRWDZBQOSA-N 1 0 309.453 4.409 20 10 DICDRO COc1cc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001461965040 1063844389 /nfs/dbraw/zinc/84/43/89/1063844389.db2.gz YWPIVSMJSYQZLR-OLZOCXBDSA-N 1 0 323.502 4.024 20 10 DICDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)cc1Cl ZINC001461984136 1063860347 /nfs/dbraw/zinc/86/03/47/1063860347.db2.gz SHNNYZZGDSODGI-ZDUSSCGKSA-N 1 0 319.832 4.123 20 10 DICDRO CC(C)c1ccc(O)c(C[N@H+](C)CCOc2ccc(F)cc2)c1 ZINC001462027485 1063889065 /nfs/dbraw/zinc/88/90/65/1063889065.db2.gz RGWRSTCICHHKRK-UHFFFAOYSA-N 1 0 317.404 4.166 20 10 DICDRO C[C@@H](c1ccccc1)[N@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC001462032488 1063891330 /nfs/dbraw/zinc/89/13/30/1063891330.db2.gz RVQOHUWMEXYHBA-ZDUSSCGKSA-N 1 0 304.384 4.224 20 10 DICDRO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N(C)C)cc1C ZINC001462051105 1063901836 /nfs/dbraw/zinc/90/18/36/1063901836.db2.gz NBHCFVFVMVTJLB-HXUWFJFHSA-N 1 0 308.469 4.398 20 10 DICDRO COc1cccc([C@H]2C[C@H](C)C[N@@H+]2Cc2ccc(C)cc2O)c1 ZINC001462086905 1063922195 /nfs/dbraw/zinc/92/21/95/1063922195.db2.gz KYXTZWFWTQBABC-HNAYVOBHSA-N 1 0 311.425 4.292 20 10 DICDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](C1CC1)C1CCOCC1 ZINC001261515263 1063931314 /nfs/dbraw/zinc/93/13/14/1063931314.db2.gz BCJRZEWCDVSKEF-JOTOCRJQSA-N 1 0 315.457 4.044 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1noc2ccccc12 ZINC001262033859 1063954420 /nfs/dbraw/zinc/95/44/20/1063954420.db2.gz KYXGZNHAUZIKOD-GXTWGEPZSA-N 1 0 308.381 4.180 20 10 DICDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1noc2ccccc12 ZINC001262033860 1063954978 /nfs/dbraw/zinc/95/49/78/1063954978.db2.gz KYXGZNHAUZIKOD-JSGCOSHPSA-N 1 0 308.381 4.180 20 10 DICDRO C[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)c1ccc(Br)cc1O ZINC001332341560 1064113594 /nfs/dbraw/zinc/11/35/94/1064113594.db2.gz WVQQFBJCRHHDRH-ZMLRMANQSA-N 1 0 316.214 4.086 20 10 DICDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1c(O)cccc1Cl ZINC000388781322 1064115946 /nfs/dbraw/zinc/11/59/46/1064115946.db2.gz NAFGJAMANPKTSY-ZDUSSCGKSA-N 1 0 319.832 4.117 20 10 DICDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1c(O)cccc1Cl ZINC000388781313 1064116033 /nfs/dbraw/zinc/11/60/33/1064116033.db2.gz NAFGJAMANPKTSY-CYBMUJFWSA-N 1 0 319.832 4.117 20 10 DICDRO C[C@@H](Cc1ccsc1)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000393392526 1064277008 /nfs/dbraw/zinc/27/70/08/1064277008.db2.gz JJPCKYXXBFOOPA-INIZCTEOSA-N 1 0 314.498 4.459 20 10 DICDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000749295180 1065139335 /nfs/dbraw/zinc/13/93/35/1065139335.db2.gz LAXXXMPMSJCVDU-CQSZACIVSA-N 1 0 314.385 4.071 20 10 DICDRO COc1ccc(N(C)CC[N@H+](C)CCCC2CCCCC2)cc1 ZINC001307901311 1065672902 /nfs/dbraw/zinc/67/29/02/1065672902.db2.gz KKCIWOHTAQDAFG-UHFFFAOYSA-N 1 0 318.505 4.424 20 10 DICDRO CCC(CC)CCC[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001307969200 1065704793 /nfs/dbraw/zinc/70/47/93/1065704793.db2.gz PHWJZFMFFJWAKQ-UHFFFAOYSA-N 1 0 318.505 4.171 20 10 DICDRO Cc1cc(C[N@@H+]2CCC[C@@H](C3CCCC3)C2)ccc1N(C)C ZINC001308157900 1065785116 /nfs/dbraw/zinc/78/51/16/1065785116.db2.gz QKQCMLXKWPKGKQ-LJQANCHMSA-N 1 0 300.490 4.463 20 10 DICDRO CCN(CCC[NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1 ZINC001308187171 1065796902 /nfs/dbraw/zinc/79/69/02/1065796902.db2.gz VTGWOKGPLOEEFG-UHFFFAOYSA-N 1 0 324.468 4.018 20 10 DICDRO Cc1ccc([C@H](C)C[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC001308275858 1065874597 /nfs/dbraw/zinc/87/45/97/1065874597.db2.gz HIPVQZQHJLOCCG-DUMMIQTOSA-N 1 0 308.469 4.468 20 10 DICDRO CCCOc1cc(C)ccc1C[NH2+]Cc1c(O)cccc1Cl ZINC001308304252 1065898438 /nfs/dbraw/zinc/89/84/38/1065898438.db2.gz BOYCULZJZFPPDS-UHFFFAOYSA-N 1 0 319.832 4.433 20 10 DICDRO Cc1ccc(NCc2cc(Cl)cc(F)c2O)c(C[NH+](C)C)c1 ZINC001308322374 1065913081 /nfs/dbraw/zinc/91/30/81/1065913081.db2.gz ZQVQSICLLDYXDE-UHFFFAOYSA-N 1 0 322.811 4.167 20 10 DICDRO C[C@H](C[C@H](C)O)[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC001308345869 1065929270 /nfs/dbraw/zinc/92/92/70/1065929270.db2.gz XSAHQYYYBUTPPR-KGLIPLIRSA-N 1 0 321.505 4.236 20 10 DICDRO CCCOc1ccc(C[NH2+]CC2([C@@H](C)CCO)CCC2)cc1C ZINC001308348321 1065931516 /nfs/dbraw/zinc/93/15/16/1065931516.db2.gz BGZNQXNEBRNPAJ-KRWDZBQOSA-N 1 0 319.489 4.062 20 10 DICDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC001308353460 1065934136 /nfs/dbraw/zinc/93/41/36/1065934136.db2.gz CFXWIXAJJRTHAU-FQEVSTJZSA-N 1 0 305.425 4.123 20 10 DICDRO Cc1ccc(C(C)(C)C[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC001308418969 1065977306 /nfs/dbraw/zinc/97/73/06/1065977306.db2.gz YYBSWSNPFCHZIK-UHFFFAOYSA-N 1 0 309.453 4.306 20 10 DICDRO CCCN(CCC)c1ccc(C[NH2+][C@H](C)C2(OC)CCC2)cc1 ZINC001308439368 1065989688 /nfs/dbraw/zinc/98/96/88/1065989688.db2.gz MNVYNKAGTWCCCH-QGZVFWFLSA-N 1 0 318.505 4.360 20 10 DICDRO CCC(O)(CC)C(C)(C)C[NH2+]Cc1c(C)c2ccccc2n1C ZINC001308460468 1066002797 /nfs/dbraw/zinc/00/27/97/1066002797.db2.gz AEVWTENSPLMKNP-UHFFFAOYSA-N 1 0 316.489 4.154 20 10 DICDRO CC[C@@H](C[NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)c1ccccc1 ZINC001308461543 1066003742 /nfs/dbraw/zinc/00/37/42/1066003742.db2.gz RKDOOAHHGGCFKN-HKUYNNGSSA-N 1 0 324.468 4.057 20 10 DICDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CC2(Cl)Cl)c(Cl)c1 ZINC001308472462 1066012910 /nfs/dbraw/zinc/01/29/10/1066012910.db2.gz UTMNUKYGWAFRTE-VIFPVBQESA-N 1 0 308.636 4.028 20 10 DICDRO CCCOc1ccc(C[NH2+]C2(COC)CCCCC2)cc1C ZINC001308476062 1066015373 /nfs/dbraw/zinc/01/53/73/1066015373.db2.gz RPCSFHKUQHITGZ-UHFFFAOYSA-N 1 0 305.462 4.223 20 10 DICDRO Cc1coc(C[NH2+]CCc2cc(C)n(-c3ccccc3)c2C)c1 ZINC001308482507 1066020168 /nfs/dbraw/zinc/02/01/68/1066020168.db2.gz QXHBUTFIYJGXRB-UHFFFAOYSA-N 1 0 308.425 4.328 20 10 DICDRO COc1ccc([C@H](C)[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1C ZINC001308515113 1066040903 /nfs/dbraw/zinc/04/09/03/1066040903.db2.gz XSANLIVRVVVQHX-TUYSUELWSA-N 1 0 324.468 4.434 20 10 DICDRO Cc1cc(Br)cc(C[N@@H+]2CCC[C@@H]2C2CCC2)c1O ZINC001308599149 1066110710 /nfs/dbraw/zinc/11/07/10/1066110710.db2.gz KZDBAGAWYFCMBG-OAHLLOKOSA-N 1 0 324.262 4.228 20 10 DICDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2cc(Cl)c(C)cc2O)C12CCC2 ZINC001308607506 1066114267 /nfs/dbraw/zinc/11/42/67/1066114267.db2.gz MXLKAADYTBMTDW-IRXDYDNUSA-N 1 0 323.864 4.134 20 10 DICDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC001308607514 1066115161 /nfs/dbraw/zinc/11/51/61/1066115161.db2.gz NBDFOQYRDNNWRU-SFHVURJKSA-N 1 0 300.471 4.460 20 10 DICDRO CC[N@H+](Cc1ccc(N(C)C)cc1C)[C@H](C)c1cccc(O)c1 ZINC001308625876 1066124310 /nfs/dbraw/zinc/12/43/10/1066124310.db2.gz YIARPCCXBMPNGB-MRXNPFEDSA-N 1 0 312.457 4.350 20 10 DICDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001308634565 1066130178 /nfs/dbraw/zinc/13/01/78/1066130178.db2.gz MTHPRPBKRKMLMY-IGCXYCKISA-N 1 0 308.416 4.184 20 10 DICDRO C[C@@H]1C[N@H+](Cc2c(O)cccc2Br)[C@@H]2CCCC[C@H]21 ZINC001308637666 1066131604 /nfs/dbraw/zinc/13/16/04/1066131604.db2.gz PLYFWTLMQUYJJC-TYNCELHUSA-N 1 0 324.262 4.165 20 10 DICDRO Cc1cc(O)c(C[N@H+](C)CCOc2ccccc2C)c(Cl)c1 ZINC001308654157 1066139142 /nfs/dbraw/zinc/13/91/42/1066139142.db2.gz XPCAQNPSEVAXHW-UHFFFAOYSA-N 1 0 319.832 4.173 20 10 DICDRO COCC[N@H+](Cc1ccccc1)Cc1cc(Cl)c(C)cc1O ZINC001308657472 1066141175 /nfs/dbraw/zinc/14/11/75/1066141175.db2.gz ZJPUXURUKDRDHC-UHFFFAOYSA-N 1 0 319.832 4.003 20 10 DICDRO CC[N@@H+](Cc1cc(Br)cc(C)c1O)CC1CCC1 ZINC001308713699 1066193661 /nfs/dbraw/zinc/19/36/61/1066193661.db2.gz CRYSDLVDFWQWQQ-UHFFFAOYSA-N 1 0 312.251 4.085 20 10 DICDRO COc1ccc(C[NH2+]CC2CCC(C(C)(C)C)CC2)c(O)c1 ZINC001308715754 1066195324 /nfs/dbraw/zinc/19/53/24/1066195324.db2.gz JNVSEJQFDIQQLY-UHFFFAOYSA-N 1 0 305.462 4.343 20 10 DICDRO CCc1cccc(C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)c1O ZINC001308791117 1066266938 /nfs/dbraw/zinc/26/69/38/1066266938.db2.gz WIQYACQQTUKRBG-SFHVURJKSA-N 1 0 317.379 4.400 20 10 DICDRO Oc1ccc(Cl)cc1C[NH2+]Cc1ccsc1C(F)(F)F ZINC001308846545 1066322799 /nfs/dbraw/zinc/32/27/99/1066322799.db2.gz SQFLSYSZVYPBHB-UHFFFAOYSA-N 1 0 321.751 4.416 20 10 DICDRO CCC[C@H]([NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)C1CCCC1 ZINC001308860208 1066341113 /nfs/dbraw/zinc/34/11/13/1066341113.db2.gz QDJCCJYLPHRZQH-XLIONFOSSA-N 1 0 316.489 4.222 20 10 DICDRO COc1cc(C[N@@H+]2CCCC3(CC3)CC2)c(O)c(C(C)(C)C)c1 ZINC001308888442 1066370635 /nfs/dbraw/zinc/37/06/35/1066370635.db2.gz PTMUXFSRDTVSID-UHFFFAOYSA-N 1 0 317.473 4.464 20 10 DICDRO Oc1ccc(Cl)c(C[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC001308917709 1066396777 /nfs/dbraw/zinc/39/67/77/1066396777.db2.gz GEMCGXKUFFTGCX-UHFFFAOYSA-N 1 0 313.784 4.194 20 10 DICDRO CCC[C@H](C)CC[NH2+]Cc1cc(Br)cc(C)c1O ZINC001308921112 1066398293 /nfs/dbraw/zinc/39/82/93/1066398293.db2.gz HFRCCPJGEQBBOM-NSHDSACASA-N 1 0 314.267 4.379 20 10 DICDRO