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ZINC000790416683 629210195 /nfs/dbraw/zinc/21/01/95/629210195.db2.gz BELDXWDMJWSFSL-UHFFFAOYSA-N 0 2 297.401 3.125 20 10 CGCDLN C[NH+](Cc1ccc2ccccc2c1O)C[C@H]1CCC[N@@H+](C)C1 ZINC000816489927 631992356 /nfs/dbraw/zinc/99/23/56/631992356.db2.gz HLZRTKVXTLNZMP-HNNXBMFYSA-N 0 2 298.430 3.319 20 10 CGCDLN CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1)c1ccccc1O ZINC000528003646 330300421 /nfs/dbraw/zinc/30/04/21/330300421.db2.gz UDBCHVKSGKJLKW-DOTOQJQBSA-N 0 2 288.435 3.450 20 10 CGCDLN CCCN(Cc1ccccc1O)C(=O)[C@H](F)C(F)(F)F ZINC000278417390 521689081 /nfs/dbraw/zinc/68/90/81/521689081.db2.gz QIKGNXJEOKLTLK-NSHDSACASA-N 0 2 293.260 3.031 20 10 CGCDLN CCCN(Cc1ccccc1O)C(=O)C(F)C(F)(F)F ZINC000278417390 521689086 /nfs/dbraw/zinc/68/90/86/521689086.db2.gz QIKGNXJEOKLTLK-NSHDSACASA-N 0 2 293.260 3.031 20 10 CGCDLN CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(F)cc2O)CC1 ZINC000062747581 623266561 /nfs/dbraw/zinc/26/65/61/623266561.db2.gz YFANEWLWJDZJAW-CYBMUJFWSA-N 0 2 294.414 3.446 20 10 CGCDLN Cc1ccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2O)cn1 ZINC000756852088 626737792 /nfs/dbraw/zinc/73/77/92/626737792.db2.gz ZVYSSTHDYHFFPB-JTQLQIEISA-N 0 2 273.292 3.177 20 10 CGCDLN CN(Cc1ccccc1O)C(=O)c1cccc(Cl)c1O ZINC000775773995 628135609 /nfs/dbraw/zinc/13/56/09/628135609.db2.gz NCHVRRSHKLVPGI-UHFFFAOYSA-N 0 2 291.734 3.023 20 10 CGCDLN CC(C)([NH2+]Cc1cc(Cl)cc([N+](=O)[O-])c1[O-])C(F)F ZINC000793253322 629436046 /nfs/dbraw/zinc/43/60/46/629436046.db2.gz DXZIODNKPYHLAT-UHFFFAOYSA-N 0 2 294.685 3.087 20 10 CGCDLN C[C@H]([NH2+]Cc1cccc(F)c1[O-])c1c(F)cncc1F ZINC000809716482 630790176 /nfs/dbraw/zinc/79/01/76/630790176.db2.gz PBODJRUJJQEZBX-QMMMGPOBSA-N 0 2 282.265 3.055 20 10 CGCDLN C[C@H](NCc1cccc(F)c1O)c1c(F)cncc1F ZINC000809716482 630790178 /nfs/dbraw/zinc/79/01/78/630790178.db2.gz PBODJRUJJQEZBX-QMMMGPOBSA-N 0 2 282.265 3.055 20 10 CGCDLN CC[C@H]1COCCN1Cc1cc(Cl)cc(Cl)c1O ZINC000132330737 636801742 /nfs/dbraw/zinc/80/17/42/636801742.db2.gz IZVFVXQYUADTIV-NSHDSACASA-N 0 2 290.190 3.310 20 10 CGCDLN C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1[O-])c1cscn1 ZINC000697819376 799850498 /nfs/dbraw/zinc/85/04/98/799850498.db2.gz HWGHINZCABKWEU-IUCAKERBSA-N 0 2 266.341 3.400 20 10 CGCDLN Oc1cc(Cl)c(Cl)cc1CN1CC[C@H]2OCC[C@H]21 ZINC001236790571 819595641 /nfs/dbraw/zinc/59/56/41/819595641.db2.gz QGPRDLPODLIABK-DGCLKSJQSA-N 0 2 288.174 3.062 20 10 CGCDLN CC[C@H]([NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1)c1ccccc1O ZINC000528003650 330300323 /nfs/dbraw/zinc/30/03/23/330300323.db2.gz UDBCHVKSGKJLKW-RDJZCZTQSA-N 0 2 288.435 3.450 20 10 CGCDLN COc1ccc2c(c1)CCC[N@H+]2CCCCCC(=O)[O-] ZINC000738110684 572364243 /nfs/dbraw/zinc/36/42/43/572364243.db2.gz OHSGDFCLKXDEKC-UHFFFAOYSA-N 0 2 277.364 3.093 20 10 CGCDLN COc1ccc2c(c1)CCC[N@@H+]2CCCCCC(=O)[O-] ZINC000738110684 572364247 /nfs/dbraw/zinc/36/42/47/572364247.db2.gz OHSGDFCLKXDEKC-UHFFFAOYSA-N 0 2 277.364 3.093 20 10 CGCDLN Oc1c(CN2CCCC[C@H]2c2ncc[nH]2)ccc(F)c1F ZINC000876656455 634876900 /nfs/dbraw/zinc/87/69/00/634876900.db2.gz PIRBXVZRTWYNSX-LBPRGKRZSA-N 0 2 293.317 3.121 20 10 CGCDLN Oc1cc(F)cc(F)c1CN1CCC[C@H]1c1nccs1 ZINC001140583469 804465852 /nfs/dbraw/zinc/46/58/52/804465852.db2.gz IBNRGRHWKUSANP-LBPRGKRZSA-N 0 2 296.342 3.464 20 10 CGCDLN CN(Cc1ccccc1O)Cc1ccc(F)c(O)c1F ZINC001232937704 818476579 /nfs/dbraw/zinc/47/65/79/818476579.db2.gz RQGZVBOMUMYBSZ-UHFFFAOYSA-N 0 2 279.286 3.008 20 10 CGCDLN C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc3ccccc3c2O)CC[NH+]1C ZINC000816514795 631999740 /nfs/dbraw/zinc/99/97/40/631999740.db2.gz HSENTTWRGDGLOQ-PBHICJAKSA-N 0 2 298.430 3.460 20 10 CGCDLN CC[C@@H]1COCCN1Cc1cc(Cl)cc(Cl)c1O ZINC000132330530 636801914 /nfs/dbraw/zinc/80/19/14/636801914.db2.gz IZVFVXQYUADTIV-LLVKDONJSA-N 0 2 290.190 3.310 20 10 CGCDLN C[C@@H]1[C@H](CC(=O)[O-])CC[C@@H]1[NH2+]Cc1cccc(Cl)c1O ZINC001594183872 998711763 /nfs/dbraw/zinc/71/17/63/998711763.db2.gz BIZKYLCCGKXHTD-NRUUGDAUSA-N 0 2 297.782 3.025 20 10 CGCDLN Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c(O)c1 ZINC000284293533 380138789 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ZINC001593365794 995044858 /nfs/dbraw/zinc/04/48/58/995044858.db2.gz KAEQYNYAXDZHOF-JTQLQIEISA-N 0 2 298.342 3.232 20 10 CGCDLN C[N@@H+](Cc1ccsc1)Cc1c(O)cccc1F ZINC001137838697 803781626 /nfs/dbraw/zinc/78/16/26/803781626.db2.gz HXJJUKSTRFMFKI-UHFFFAOYSA-N 0 2 251.326 3.225 20 10 CGCDLN Oc1cc(F)cc(F)c1CN1Cc2ccc(F)cc2C1 ZINC001140583310 804467204 /nfs/dbraw/zinc/46/72/04/804467204.db2.gz DRQAOCYREJYJPP-UHFFFAOYSA-N 0 2 279.261 3.325 20 10 CGCDLN C[C@@H]1CC[C@H](C[NH3+])[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC001205845316 813105301 /nfs/dbraw/zinc/10/53/01/813105301.db2.gz ZOVNNQDZTJTCTL-CZUORRHYSA-N 0 2 284.403 3.105 20 10 CGCDLN Oc1ccc(F)c(F)c1CN1CCC[C@@H]1c1cccnc1 ZINC001233331532 818581526 /nfs/dbraw/zinc/58/15/26/818581526.db2.gz AANNAHBDIAEBSW-CQSZACIVSA-N 0 2 290.313 3.403 20 10 CGCDLN O=C([O-])CC[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC001595018690 951302768 /nfs/dbraw/zinc/30/27/68/951302768.db2.gz ASXMXETXKXUCMD-NSHDSACASA-N 0 2 297.782 3.122 20 10 CGCDLN O=C([O-])CC[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC001595018690 951302772 /nfs/dbraw/zinc/30/27/72/951302772.db2.gz ASXMXETXKXUCMD-NSHDSACASA-N 0 2 297.782 3.122 20 10 CGCDLN COCc1ccc(NCc2cc([N+](=O)[O-])ccc2O)cc1 ZINC000195462902 619149910 /nfs/dbraw/zinc/14/99/10/619149910.db2.gz UHNMFZWWQKTQLM-UHFFFAOYSA-N 0 2 288.303 3.059 20 10 CGCDLN Oc1ccc(Cl)c(F)c1CNCc1ncccc1F ZINC000790983709 629246541 /nfs/dbraw/zinc/24/65/41/629246541.db2.gz VTMIGHNXUVJUHI-UHFFFAOYSA-N 0 2 284.693 3.009 20 10 CGCDLN Oc1c(CN2CCC[C@@H]2CF)cccc1C(F)(F)F ZINC001233420065 818614399 /nfs/dbraw/zinc/61/43/99/818614399.db2.gz YFEUPKLDSOEDTB-SNVBAGLBSA-N 0 2 277.261 3.345 20 10 CGCDLN [O-]c1c(C[N@@H+]2CCC[C@@H]2CF)cccc1C(F)(F)F ZINC001233420065 818614404 /nfs/dbraw/zinc/61/44/04/818614404.db2.gz YFEUPKLDSOEDTB-SNVBAGLBSA-N 0 2 277.261 3.345 20 10 CGCDLN [O-]c1c(C[N@H+]2CCC[C@@H]2CF)cccc1C(F)(F)F ZINC001233420065 818614409 /nfs/dbraw/zinc/61/44/09/818614409.db2.gz YFEUPKLDSOEDTB-SNVBAGLBSA-N 0 2 277.261 3.345 20 10 CGCDLN C[NH+]1CC[C@H]2CC[N@H+](Cc3c(O)ccc4ccccc43)[C@@H]2C1 ZINC000272226323 378589219 /nfs/dbraw/zinc/58/92/19/378589219.db2.gz JFVRGMRDMYNWEH-MAUKXSAKSA-N 0 2 296.414 3.071 20 10 CGCDLN C[NH+]1CC[C@H]2CC[N@@H+](Cc3c(O)ccc4ccccc43)[C@@H]2C1 ZINC000272226323 378589223 /nfs/dbraw/zinc/58/92/23/378589223.db2.gz JFVRGMRDMYNWEH-MAUKXSAKSA-N 0 2 296.414 3.071 20 10 CGCDLN Cc1cc(O)c(C[N@H+](C)[C@@H]2CCN(C)C[C@@H]2C)cc1Cl ZINC000825935437 633389957 /nfs/dbraw/zinc/38/99/57/633389957.db2.gz UDLMWQNPPKRTDT-SWLSCSKDSA-N 0 2 296.842 3.126 20 10 CGCDLN C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2O)C[C@@H](C)O1 ZINC000126958101 635395243 /nfs/dbraw/zinc/39/52/43/635395243.db2.gz ZMSATGIEIRNENZ-RKDXNWHRSA-N 0 2 290.190 3.308 20 10 CGCDLN C[C@@H]1C[NH+](Cc2cc(Cl)cc(Cl)c2[O-])C[C@@H](C)O1 ZINC000126958101 635395249 /nfs/dbraw/zinc/39/52/49/635395249.db2.gz ZMSATGIEIRNENZ-RKDXNWHRSA-N 0 2 290.190 3.308 20 10 CGCDLN CC[C@H]1C[N@H+](Cc2cc(F)cc(F)c2O)[C@@H](CC)CO1 ZINC000708422325 799989140 /nfs/dbraw/zinc/98/91/40/799989140.db2.gz MJYCEPUHURNHCO-STQMWFEESA-N 0 2 285.334 3.060 20 10 CGCDLN CC[C@H]1CN(Cc2cc(F)cc(F)c2O)[C@@H](CC)CO1 ZINC000708422325 799989149 /nfs/dbraw/zinc/98/91/49/799989149.db2.gz MJYCEPUHURNHCO-STQMWFEESA-N 0 2 285.334 3.060 20 10 CGCDLN O=C1CCN(Cc2c(O)cc(F)cc2F)[C@@H]2CCCC[C@@H]12 ZINC001140582572 804466640 /nfs/dbraw/zinc/46/66/40/804466640.db2.gz KAYQRZPHRKPQBX-BXUZGUMPSA-N 0 2 295.329 3.004 20 10 CGCDLN O=C1CCN(Cc2c(O)cc(F)cc2F)[C@H]2CCCC[C@H]12 ZINC001140582573 804466782 /nfs/dbraw/zinc/46/67/82/804466782.db2.gz KAYQRZPHRKPQBX-FZMZJTMJSA-N 0 2 295.329 3.004 20 10 CGCDLN O=C1CCN(Cc2c(O)cc(F)cc2F)[C@@H]2CCCC[C@H]12 ZINC001140582577 804466967 /nfs/dbraw/zinc/46/69/67/804466967.db2.gz KAYQRZPHRKPQBX-SMDDNHRTSA-N 0 2 295.329 3.004 20 10 CGCDLN COc1ccc2c(c1)CN(Cc1c(O)cc(F)cc1F)C2 ZINC001140583820 804468528 /nfs/dbraw/zinc/46/85/28/804468528.db2.gz UQNUBTUMTOCABH-UHFFFAOYSA-N 0 2 291.297 3.195 20 10 CGCDLN C[N@@H+](Cc1cccc(-n2cc[nH+]c2)c1)Cc1ccccc1O 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/nfs/dbraw/zinc/92/98/77/636929877.db2.gz PRDQFVOQRRBCHD-UHFFFAOYSA-N 0 2 290.190 3.310 20 10 CGCDLN C[C@@H]1[C@H](C)OCCN1Cc1cc(Cl)cc(Cl)c1O ZINC000093418231 640770641 /nfs/dbraw/zinc/77/06/41/640770641.db2.gz BOGUQLMSBOZLPJ-BDAKNGLRSA-N 0 2 290.190 3.308 20 10 CGCDLN Oc1c(F)ccc(F)c1CN1CCC[C@@H]1c1nccs1 ZINC001139685276 804251933 /nfs/dbraw/zinc/25/19/33/804251933.db2.gz DEDDIXJZTHZNPU-GFCCVEGCSA-N 0 2 296.342 3.464 20 10 CGCDLN [O-]c1c(F)ccc(F)c1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001139685276 804251935 /nfs/dbraw/zinc/25/19/35/804251935.db2.gz DEDDIXJZTHZNPU-GFCCVEGCSA-N 0 2 296.342 3.464 20 10 CGCDLN [O-]c1c(F)ccc(F)c1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001139685276 804251943 /nfs/dbraw/zinc/25/19/43/804251943.db2.gz DEDDIXJZTHZNPU-GFCCVEGCSA-N 0 2 296.342 3.464 20 10 CGCDLN Cc1cc(S(=O)(=O)Nc2ccc(O)c(C)c2)sc1C ZINC000776747315 628230129 /nfs/dbraw/zinc/23/01/29/628230129.db2.gz AKFIZSJTDNICIS-UHFFFAOYSA-N 0 2 297.401 3.180 20 10 CGCDLN COc1cc(NCc2cc([N+](=O)[O-])ccc2O)ccc1F ZINC000189570002 640199569 /nfs/dbraw/zinc/19/95/69/640199569.db2.gz HIFWTOYAPGIQIO-UHFFFAOYSA-N 0 2 292.266 3.060 20 10 CGCDLN C[N@H+](Cc1cccc(F)c1)Cc1c(O)ccc(F)c1F ZINC001233332151 818585678 /nfs/dbraw/zinc/58/56/78/818585678.db2.gz AIIZWCFQFFEVDL-UHFFFAOYSA-N 0 2 281.277 3.442 20 10 CGCDLN CN(Cc1cccc(F)c1)Cc1c(O)ccc(F)c1F ZINC001233332151 818585691 /nfs/dbraw/zinc/58/56/91/818585691.db2.gz AIIZWCFQFFEVDL-UHFFFAOYSA-N 0 2 281.277 3.442 20 10 CGCDLN C[N@H+](Cc1cccc(F)c1)Cc1c([O-])ccc(F)c1F ZINC001233332151 818585697 /nfs/dbraw/zinc/58/56/97/818585697.db2.gz AIIZWCFQFFEVDL-UHFFFAOYSA-N 0 2 281.277 3.442 20 10 CGCDLN C[N@@H+](Cc1cccc(F)c1)Cc1c([O-])ccc(F)c1F ZINC001233332151 818585703 /nfs/dbraw/zinc/58/57/03/818585703.db2.gz AIIZWCFQFFEVDL-UHFFFAOYSA-N 0 2 281.277 3.442 20 10 CGCDLN C[C@@H]1[C@H]([NH2+]Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000288514955 371739513 /nfs/dbraw/zinc/73/95/13/371739513.db2.gz UBIODKVIQXJHTA-CRAIPNDOSA-N 0 2 296.414 3.145 20 10 CGCDLN CC(C)c1nnc(CN[C@@H](C)c2ccc(Cl)cc2O)[nH]1 ZINC000841753067 620388435 /nfs/dbraw/zinc/38/84/35/620388435.db2.gz DUZPNLOONDKYOG-VIFPVBQESA-N 0 2 294.786 3.138 20 10 CGCDLN O=[N+]([O-])c1ccc(O)c(CNc2ccc(F)cc2F)c1 ZINC000782532787 628653000 /nfs/dbraw/zinc/65/30/00/628653000.db2.gz OXVZCYSNAFLXPK-UHFFFAOYSA-N 0 2 280.230 3.191 20 10 CGCDLN C[N@H+](Cc1cccc(F)c1[O-])Cc1cccc(F)c1F ZINC001138129730 803864173 /nfs/dbraw/zinc/86/41/73/803864173.db2.gz TYZVCPNXEBUJAZ-UHFFFAOYSA-N 0 2 281.277 3.442 20 10 CGCDLN C[N@@H+](Cc1cccc(F)c1[O-])Cc1cccc(F)c1F ZINC001138129730 803864182 /nfs/dbraw/zinc/86/41/82/803864182.db2.gz TYZVCPNXEBUJAZ-UHFFFAOYSA-N 0 2 281.277 3.442 20 10 CGCDLN Cc1ccsc1S(=O)(=O)Nc1c(C)cc(O)cc1C ZINC001260069191 807696158 /nfs/dbraw/zinc/69/61/58/807696158.db2.gz NXCGMKCZQVKROJ-UHFFFAOYSA-N 0 2 297.401 3.180 20 10 CGCDLN Oc1c(Cl)cc(Cl)cc1CN1CCCC12COC2 ZINC001203580485 812398477 /nfs/dbraw/zinc/39/84/77/812398477.db2.gz OGAGUXRDGWQGDJ-UHFFFAOYSA-N 0 2 288.174 3.064 20 10 CGCDLN [O-]c1c(Cl)cc(Cl)cc1C[N@@H+]1CCCC12COC2 ZINC001203580485 812398483 /nfs/dbraw/zinc/39/84/83/812398483.db2.gz OGAGUXRDGWQGDJ-UHFFFAOYSA-N 0 2 288.174 3.064 20 10 CGCDLN [O-]c1c(Cl)cc(Cl)cc1C[N@H+]1CCCC12COC2 ZINC001203580485 812398492 /nfs/dbraw/zinc/39/84/92/812398492.db2.gz OGAGUXRDGWQGDJ-UHFFFAOYSA-N 0 2 288.174 3.064 20 10 CGCDLN CN(Cc1cccc(-c2ccccc2)c1O)[C@@H]1CC[N@@H+](C)C1 ZINC001234996921 818972674 /nfs/dbraw/zinc/97/26/74/818972674.db2.gz PVJFHWXOMXEBJP-QGZVFWFLSA-N 0 2 296.414 3.195 20 10 CGCDLN C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2O)[C@@H](C)CO1 ZINC000217776303 928159269 /nfs/dbraw/zinc/15/92/69/928159269.db2.gz MOZNJNVQJVBCLU-DTWKUNHWSA-N 0 2 290.190 3.308 20 10 CGCDLN Cc1cc(NS(=O)(=O)c2cccs2)c(C)c(C)c1O ZINC000187061475 619074775 /nfs/dbraw/zinc/07/47/75/619074775.db2.gz DEZWLUHOVUNXNN-UHFFFAOYSA-N 0 2 297.401 3.180 20 10 CGCDLN C[C@@H](N[C@H](c1ncccn1)C1CC1)c1ccc(F)cc1O ZINC000903325936 621699756 /nfs/dbraw/zinc/69/97/56/621699756.db2.gz JIBDLIXCVOAVPN-BMIGLBTASA-N 0 2 287.338 3.123 20 10 CGCDLN C[C@@H]([NH2+][C@H](c1ncccn1)C1CC1)c1ccc(F)cc1[O-] ZINC000903325936 621699763 /nfs/dbraw/zinc/69/97/63/621699763.db2.gz JIBDLIXCVOAVPN-BMIGLBTASA-N 0 2 287.338 3.123 20 10 CGCDLN C[C@]1(CF)CC(F)(F)CN1Cc1c(F)ccc(F)c1O ZINC001139684587 804251299 /nfs/dbraw/zinc/25/12/99/804251299.db2.gz JTRNEOGVHNGPSX-GFCCVEGCSA-N 0 2 295.251 3.240 20 10 CGCDLN Oc1c(F)ccc(F)c1CN1CCCC(F)(F)[C@@H](F)C1 ZINC001139685848 804251956 /nfs/dbraw/zinc/25/19/56/804251956.db2.gz YTGGVGBFHUAIHH-NSHDSACASA-N 0 2 295.251 3.240 20 10 CGCDLN [O-]c1c(F)ccc(F)c1C[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001139685848 804251965 /nfs/dbraw/zinc/25/19/65/804251965.db2.gz YTGGVGBFHUAIHH-NSHDSACASA-N 0 2 295.251 3.240 20 10 CGCDLN [O-]c1c(F)ccc(F)c1C[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001139685848 804251968 /nfs/dbraw/zinc/25/19/68/804251968.db2.gz YTGGVGBFHUAIHH-NSHDSACASA-N 0 2 295.251 3.240 20 10 CGCDLN [O-]c1c(F)ccc(F)c1C[NH+]1Cc2ccccc2C1 ZINC001139685795 804252240 /nfs/dbraw/zinc/25/22/40/804252240.db2.gz XQESSESPCUYWJZ-UHFFFAOYSA-N 0 2 261.271 3.186 20 10 CGCDLN Oc1cc(F)c(F)cc1C[N@@H+]1CCc2ccsc2C1 ZINC001142524726 804731878 /nfs/dbraw/zinc/73/18/78/804731878.db2.gz IIBJRLPPUHOCDI-UHFFFAOYSA-N 0 2 281.327 3.290 20 10 CGCDLN Oc1cc(F)c(F)cc1CN1CCc2ccsc2C1 ZINC001142524726 804731883 /nfs/dbraw/zinc/73/18/83/804731883.db2.gz IIBJRLPPUHOCDI-UHFFFAOYSA-N 0 2 281.327 3.290 20 10 CGCDLN CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756450225 626707252 /nfs/dbraw/zinc/70/72/52/626707252.db2.gz RPZZDNPWTLOKDZ-RYUDHWBXSA-N 0 2 298.377 3.053 20 10 CGCDLN COc1cccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2O)c1 ZINC000756795528 626732888 /nfs/dbraw/zinc/73/28/88/626732888.db2.gz KTDNJARHEFNFRJ-JTQLQIEISA-N 0 2 288.303 3.482 20 10 CGCDLN Cc1cc(O)c(C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1Cl ZINC000824862511 633301955 /nfs/dbraw/zinc/30/19/55/633301955.db2.gz KCYCSEFOXBQRNC-JSGCOSHPSA-N 0 2 296.842 3.269 20 10 CGCDLN Cc1cc(O)c(C[N@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1Cl ZINC000824862511 633301960 /nfs/dbraw/zinc/30/19/60/633301960.db2.gz KCYCSEFOXBQRNC-JSGCOSHPSA-N 0 2 296.842 3.269 20 10 CGCDLN CCc1nc(C[NH2+][C@H](CC)c2ccc(F)cc2[O-])co1 ZINC000834900135 634276559 /nfs/dbraw/zinc/27/65/59/634276559.db2.gz SYTGPIOWYGXMSV-CYBMUJFWSA-N 0 2 278.327 3.323 20 10 CGCDLN C[C@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC001205845313 813105646 /nfs/dbraw/zinc/10/56/46/813105646.db2.gz ZOVNNQDZTJTCTL-BBRMVZONSA-N 0 2 284.403 3.105 20 10 CGCDLN C[C@@H]1[C@@H](CC(=O)[O-])CC[C@@H]1[NH2+]Cc1cccc(Cl)c1O ZINC001594183869 998711594 /nfs/dbraw/zinc/71/15/94/998711594.db2.gz BIZKYLCCGKXHTD-BREBYQMCSA-N 0 2 297.782 3.025 20 10 CGCDLN CC[NH+]1CCC([N@H+](C)Cc2ccc3ccccc3c2O)CC1 ZINC000816484168 631989653 /nfs/dbraw/zinc/98/96/53/631989653.db2.gz RINDBEFLRZNXPJ-UHFFFAOYSA-N 0 2 298.430 3.462 20 10 CGCDLN C[C@H]1[C@@H]([NH2+]Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000288514966 371740280 /nfs/dbraw/zinc/74/02/80/371740280.db2.gz UBIODKVIQXJHTA-YJBOKZPZSA-N 0 2 296.414 3.145 20 10 CGCDLN C[C@]1([NH2+]Cc2cccc(Cl)c2O)CCCC[C@@H]1C(=O)[O-] ZINC000833573435 605520394 /nfs/dbraw/zinc/52/03/94/605520394.db2.gz XINKZNWJALUPSB-ABAIWWIYSA-N 0 2 297.782 3.169 20 10 CGCDLN CCc1ccc(S(=O)(=O)Nc2ccc(O)c(C)c2)s1 ZINC000148630976 620403487 /nfs/dbraw/zinc/40/34/87/620403487.db2.gz ZWEUNAJLVSTEFO-UHFFFAOYSA-N 0 2 297.401 3.125 20 10 CGCDLN Oc1c(Cl)cc(Cl)cc1CN1CC(OC(F)F)C1 ZINC000839142555 626322943 /nfs/dbraw/zinc/32/29/43/626322943.db2.gz BBTWXRKPVVLTQB-UHFFFAOYSA-N 0 2 298.116 3.122 20 10 CGCDLN C[C@H]1C[C@H]([N@@H+](C)Cc2ccc3ccccc3c2O)CC[NH+]1C ZINC000816514797 632000807 /nfs/dbraw/zinc/00/08/07/632000807.db2.gz HSENTTWRGDGLOQ-WMLDXEAASA-N 0 2 298.430 3.460 20 10 CGCDLN C[C@@H]1CC(=O)CCN1Cc1cc(Cl)cc(Cl)c1O ZINC001203573428 812396076 /nfs/dbraw/zinc/39/60/76/812396076.db2.gz ALGAXKXEVOHOOS-MRVPVSSYSA-N 0 2 288.174 3.252 20 10 CGCDLN