smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)[N@H+](Cc1cccc(F)c1O)C1CC1 ZINC000272223572 187335445 /nfs/dbraw/zinc/33/54/45/187335445.db2.gz CJTVAKTXNZCUGQ-UHFFFAOYSA-N 1 2 223.291 2.904 20 10 BFCDLO CC(C)[N@@H+](Cc1cccc(F)c1O)C1CC1 ZINC000272223572 187335447 /nfs/dbraw/zinc/33/54/47/187335447.db2.gz CJTVAKTXNZCUGQ-UHFFFAOYSA-N 1 2 223.291 2.904 20 10 BFCDLO Oc1ccc(F)cc1C[N@@H+]1CCC=C(F)C1 ZINC000274470597 183274955 /nfs/dbraw/zinc/27/49/55/183274955.db2.gz JYMLDCUPJFJRBB-UHFFFAOYSA-N 1 2 225.238 2.590 20 10 BFCDLO Oc1ccc(F)cc1C[N@H+]1CCC=C(F)C1 ZINC000274470597 183274958 /nfs/dbraw/zinc/27/49/58/183274958.db2.gz JYMLDCUPJFJRBB-UHFFFAOYSA-N 1 2 225.238 2.590 20 10 BFCDLO C[C@@H]([NH2+]C1CCC1)c1ccc(F)c(F)c1O ZINC000276976284 384628731 /nfs/dbraw/zinc/62/87/31/384628731.db2.gz VAIDOAGJWKEEIF-SSDOTTSWSA-N 1 2 227.254 2.874 20 10 BFCDLO Oc1c(Cl)cccc1C[NH+]1CCCC1 ZINC000157752841 385268502 /nfs/dbraw/zinc/26/85/02/385268502.db2.gz SVENTLDASRSZQT-UHFFFAOYSA-N 1 2 211.692 2.641 20 10 BFCDLO C[N@H+](Cc1cccc(Cl)c1O)C1CC1 ZINC000179690880 385483270 /nfs/dbraw/zinc/48/32/70/385483270.db2.gz FMRZLLMGZHLJHX-UHFFFAOYSA-N 1 2 211.692 2.640 20 10 BFCDLO C[N@@H+](Cc1cccc(Cl)c1O)C1CC1 ZINC000179690880 385483275 /nfs/dbraw/zinc/48/32/75/385483275.db2.gz FMRZLLMGZHLJHX-UHFFFAOYSA-N 1 2 211.692 2.640 20 10 BFCDLO CCCC[N@H+](C)Cc1cccc(F)c1O ZINC000165408847 388252294 /nfs/dbraw/zinc/25/22/94/388252294.db2.gz NPFCEBHMYHGPFL-UHFFFAOYSA-N 1 2 211.280 2.763 20 10 BFCDLO CCCC[N@@H+](C)Cc1cccc(F)c1O ZINC000165408847 388252295 /nfs/dbraw/zinc/25/22/95/388252295.db2.gz NPFCEBHMYHGPFL-UHFFFAOYSA-N 1 2 211.280 2.763 20 10 BFCDLO C[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1ccc(F)c(F)c1O ZINC000276928935 176863020 /nfs/dbraw/zinc/86/30/20/176863020.db2.gz NYDGXKMSCKXDRL-CIUDSAMLSA-N 1 2 241.281 2.977 20 10 BFCDLO C[C@H](C1CC1)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000893946131 583257463 /nfs/dbraw/zinc/25/74/63/583257463.db2.gz LIIVZXLHYMZWNS-MRVPVSSYSA-N 1 2 241.281 2.901 20 10 BFCDLO C[C@H](C1CC1)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000893946131 583257466 /nfs/dbraw/zinc/25/74/66/583257466.db2.gz LIIVZXLHYMZWNS-MRVPVSSYSA-N 1 2 241.281 2.901 20 10 BFCDLO COc1cccc([C@@H](C)[NH2+][C@H](C)C(F)F)c1O ZINC000883400972 583795272 /nfs/dbraw/zinc/79/52/72/583795272.db2.gz ZAVGGBPNPDQFLX-HTQZYQBOSA-N 1 2 245.269 2.705 20 10 BFCDLO CCOc1ccc(O)c(C[NH2+][C@@H](C)C(F)F)c1 ZINC000883407594 583800007 /nfs/dbraw/zinc/80/00/07/583800007.db2.gz ZNTAIJKUDZFQPX-QMMMGPOBSA-N 1 2 245.269 2.534 20 10 BFCDLO CCOc1ccc([N@H+](C)C[C@@H]2CCOC2)cc1 ZINC000739923945 585086343 /nfs/dbraw/zinc/08/63/43/585086343.db2.gz OAUPXVMUFGIGSM-LBPRGKRZSA-N 1 2 235.327 2.558 20 10 BFCDLO CCOc1ccc([N@@H+](C)C[C@@H]2CCOC2)cc1 ZINC000739923945 585086344 /nfs/dbraw/zinc/08/63/44/585086344.db2.gz OAUPXVMUFGIGSM-LBPRGKRZSA-N 1 2 235.327 2.558 20 10 BFCDLO CC[N@H+](CC1(C)COC1)c1ccc(OC)cc1 ZINC000744391898 585149795 /nfs/dbraw/zinc/14/97/95/585149795.db2.gz OFXSHFPZIJIUHT-UHFFFAOYSA-N 1 2 235.327 2.558 20 10 BFCDLO CC[N@@H+](CC1(C)COC1)c1ccc(OC)cc1 ZINC000744391898 585149796 /nfs/dbraw/zinc/14/97/96/585149796.db2.gz OFXSHFPZIJIUHT-UHFFFAOYSA-N 1 2 235.327 2.558 20 10 BFCDLO CCOc1ccc([N@H+](CC)CCCOC)cc1 ZINC000746159115 585163985 /nfs/dbraw/zinc/16/39/85/585163985.db2.gz OQWLZYABUQPUKK-UHFFFAOYSA-N 1 2 237.343 2.948 20 10 BFCDLO CCOc1ccc([N@@H+](CC)CCCOC)cc1 ZINC000746159115 585163986 /nfs/dbraw/zinc/16/39/86/585163986.db2.gz OQWLZYABUQPUKK-UHFFFAOYSA-N 1 2 237.343 2.948 20 10 BFCDLO CCOc1ccc([N@H+](CC)C[C@@H](C)CO)cc1 ZINC000766914336 585511537 /nfs/dbraw/zinc/51/15/37/585511537.db2.gz JAHGDMWWZMJOLN-GFCCVEGCSA-N 1 2 237.343 2.540 20 10 BFCDLO CCOc1ccc([N@@H+](CC)C[C@@H](C)CO)cc1 ZINC000766914336 585511538 /nfs/dbraw/zinc/51/15/38/585511538.db2.gz JAHGDMWWZMJOLN-GFCCVEGCSA-N 1 2 237.343 2.540 20 10 BFCDLO CC[N@H+](C[C@H]1CCCOC1)c1ccc(OC)cc1 ZINC000768542147 585539892 /nfs/dbraw/zinc/53/98/92/585539892.db2.gz NMIMXVCXJLAYIQ-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO CC[N@@H+](C[C@H]1CCCOC1)c1ccc(OC)cc1 ZINC000768542147 585539893 /nfs/dbraw/zinc/53/98/93/585539893.db2.gz NMIMXVCXJLAYIQ-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO CC[N@H+](CCC[C@H](C)O)c1ccc(OC)cc1 ZINC000789342310 585940467 /nfs/dbraw/zinc/94/04/67/585940467.db2.gz NDXZEFSUFNSIQY-LBPRGKRZSA-N 1 2 237.343 2.683 20 10 BFCDLO CC[N@@H+](CCC[C@H](C)O)c1ccc(OC)cc1 ZINC000789342310 585940468 /nfs/dbraw/zinc/94/04/68/585940468.db2.gz NDXZEFSUFNSIQY-LBPRGKRZSA-N 1 2 237.343 2.683 20 10 BFCDLO CC(C)([NH2+]Cc1ccc2c(c1)CCO2)C(F)F ZINC000793256130 586015443 /nfs/dbraw/zinc/01/54/43/586015443.db2.gz SJKDHPMXSUGLSI-UHFFFAOYSA-N 1 2 241.281 2.755 20 10 BFCDLO Cc1cc(O)c(C[NH2+]C2(C(F)F)CC2)cc1C ZINC000800310712 586211229 /nfs/dbraw/zinc/21/12/29/586211229.db2.gz IAGXEFXBFZICLS-UHFFFAOYSA-N 1 2 241.281 2.896 20 10 BFCDLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2O)[C@H]1C ZINC000816648222 586750972 /nfs/dbraw/zinc/75/09/72/586750972.db2.gz GYGXBQWSSWFIKW-IUCAKERBSA-N 1 2 225.719 2.886 20 10 BFCDLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2O)[C@H]1C ZINC000816648222 586750975 /nfs/dbraw/zinc/75/09/75/586750975.db2.gz GYGXBQWSSWFIKW-IUCAKERBSA-N 1 2 225.719 2.886 20 10 BFCDLO CC(C)Nc1ccccc1NCc1c[nH+]cn1C ZINC000871846160 589824118 /nfs/dbraw/zinc/82/41/18/589824118.db2.gz TZRUENBIWBDFGY-UHFFFAOYSA-N 1 2 244.342 2.853 20 10 BFCDLO CC1=CC[N@H+](Cc2ccc(F)c(F)c2O)CC1 ZINC000876749014 590237229 /nfs/dbraw/zinc/23/72/29/590237229.db2.gz HBUIMBGWYOJKQG-UHFFFAOYSA-N 1 2 239.265 2.822 20 10 BFCDLO CC1=CC[N@@H+](Cc2ccc(F)c(F)c2O)CC1 ZINC000876749014 590237230 /nfs/dbraw/zinc/23/72/30/590237230.db2.gz HBUIMBGWYOJKQG-UHFFFAOYSA-N 1 2 239.265 2.822 20 10 BFCDLO C[N@H+](CCC1CC1)Cc1ccc(F)c(F)c1O ZINC000876810953 590245249 /nfs/dbraw/zinc/24/52/49/590245249.db2.gz FIHAUMLGSMCKBN-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO C[N@@H+](CCC1CC1)Cc1ccc(F)c(F)c1O ZINC000876810953 590245250 /nfs/dbraw/zinc/24/52/50/590245250.db2.gz FIHAUMLGSMCKBN-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO CC(C)[C@H]1CC[N@@H+]1Cc1ccc(F)c(F)c1O ZINC000876879316 590252830 /nfs/dbraw/zinc/25/28/30/590252830.db2.gz PRRWMSGOBNQALD-LLVKDONJSA-N 1 2 241.281 2.901 20 10 BFCDLO CC(C)[C@H]1CC[N@H+]1Cc1ccc(F)c(F)c1O ZINC000876879316 590252831 /nfs/dbraw/zinc/25/28/31/590252831.db2.gz PRRWMSGOBNQALD-LLVKDONJSA-N 1 2 241.281 2.901 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2C[C@@H](OC)C2)cc1 ZINC000878801830 590624870 /nfs/dbraw/zinc/62/48/70/590624870.db2.gz PUBNIWSHYPXLGC-VDISTLRHSA-N 1 2 235.327 2.556 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2C[C@@H](OC)C2)cc1 ZINC000878801830 590624871 /nfs/dbraw/zinc/62/48/71/590624871.db2.gz PUBNIWSHYPXLGC-VDISTLRHSA-N 1 2 235.327 2.556 20 10 BFCDLO CCC1(C)C[NH+](Cc2cc(F)cc(F)c2O)C1 ZINC000894980084 636011998 /nfs/dbraw/zinc/01/19/98/636011998.db2.gz IUZZHUCWAKJZLY-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO C[C@H]([NH2+]C[C@H]1C[C@@H]1C)c1cc(F)cc(F)c1O ZINC000756458568 644627990 /nfs/dbraw/zinc/62/79/90/644627990.db2.gz XMHVTCLHJRNETR-XHNCKOQMSA-N 1 2 241.281 2.977 20 10 BFCDLO CC(C)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000708397965 712192754 /nfs/dbraw/zinc/19/27/54/712192754.db2.gz DQHSHFFZYXZUFX-UHFFFAOYSA-N 1 2 215.243 2.511 20 10 BFCDLO CC(C)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000708397965 712192756 /nfs/dbraw/zinc/19/27/56/712192756.db2.gz DQHSHFFZYXZUFX-UHFFFAOYSA-N 1 2 215.243 2.511 20 10 BFCDLO CC[N@H+](Cc1cc(F)cc(F)c1O)C(C)C ZINC000708402961 712192946 /nfs/dbraw/zinc/19/29/46/712192946.db2.gz YENVZOMEDSIBDF-UHFFFAOYSA-N 1 2 229.270 2.901 20 10 BFCDLO CC[N@@H+](Cc1cc(F)cc(F)c1O)C(C)C ZINC000708402961 712192949 /nfs/dbraw/zinc/19/29/49/712192949.db2.gz YENVZOMEDSIBDF-UHFFFAOYSA-N 1 2 229.270 2.901 20 10 BFCDLO C/C=C/C[NH2+]Cc1cccc(Cl)c1O ZINC000394977909 711200110 /nfs/dbraw/zinc/20/01/10/711200110.db2.gz CMBQTDYKWIEASI-NSCUHMNNSA-N 1 2 211.692 2.711 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]Cc1cccnc1 ZINC000161121336 711810610 /nfs/dbraw/zinc/81/06/10/711810610.db2.gz AADHDHMZLQAMSV-UHFFFAOYSA-N 1 2 248.713 2.730 20 10 BFCDLO CC1(C)C[C@@]1(C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708389947 712191776 /nfs/dbraw/zinc/19/17/76/712191776.db2.gz NLLQJGOPJQNAIZ-CYBMUJFWSA-N 1 2 241.281 2.949 20 10 BFCDLO CCC[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708394438 712192783 /nfs/dbraw/zinc/19/27/83/712192783.db2.gz ZYWVFCPLWIICKE-QMMMGPOBSA-N 1 2 229.270 2.949 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]CCCCF ZINC000380114406 712687432 /nfs/dbraw/zinc/68/74/32/712687432.db2.gz PBVVMLBUQDCRCP-UHFFFAOYSA-N 1 2 231.698 2.885 20 10 BFCDLO CCC[N@H+](CC)Cc1c(O)cc(F)cc1F ZINC001140579824 960441214 /nfs/dbraw/zinc/44/12/14/960441214.db2.gz IKSPZMVJGDPEDU-UHFFFAOYSA-N 1 2 229.270 2.902 20 10 BFCDLO CCC[N@@H+](CC)Cc1c(O)cc(F)cc1F ZINC001140579824 960441225 /nfs/dbraw/zinc/44/12/25/960441225.db2.gz IKSPZMVJGDPEDU-UHFFFAOYSA-N 1 2 229.270 2.902 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH+]1CC=CC1 ZINC001237619434 979951654 /nfs/dbraw/zinc/95/16/54/979951654.db2.gz OBUGFXOWRXYGST-UHFFFAOYSA-N 1 2 227.666 2.557 20 10 BFCDLO C[C@H]1CC[N@@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237933384 980113507 /nfs/dbraw/zinc/11/35/07/980113507.db2.gz ASCLHFSYNFYISE-ZETCQYMHSA-N 1 2 229.682 2.779 20 10 BFCDLO C[C@H]1CC[N@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237933384 980113510 /nfs/dbraw/zinc/11/35/10/980113510.db2.gz ASCLHFSYNFYISE-ZETCQYMHSA-N 1 2 229.682 2.779 20 10 BFCDLO Oc1cc(F)cc(F)c1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001140585363 960445433 /nfs/dbraw/zinc/44/54/33/960445433.db2.gz GXQHLDSENDJRPI-PELKAZGASA-N 1 2 239.265 2.655 20 10 BFCDLO Oc1cc(F)cc(F)c1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001140585363 960445439 /nfs/dbraw/zinc/44/54/39/960445439.db2.gz GXQHLDSENDJRPI-PELKAZGASA-N 1 2 239.265 2.655 20 10 BFCDLO Cc1ccc(C[N@@H+]2C[C@@H](F)C[C@H]2CF)c(O)c1 ZINC001140947815 960740265 /nfs/dbraw/zinc/74/02/65/960740265.db2.gz GTQBSLJNROPJKW-RYUDHWBXSA-N 1 2 241.281 2.583 20 10 BFCDLO Cc1ccc(C[N@H+]2C[C@@H](F)C[C@H]2CF)c(O)c1 ZINC001140947815 960740274 /nfs/dbraw/zinc/74/02/74/960740274.db2.gz GTQBSLJNROPJKW-RYUDHWBXSA-N 1 2 241.281 2.583 20 10 BFCDLO Nc1ccc(Nc2cccc3[nH+]c[nH]c32)cc1 ZINC001213032385 964589989 /nfs/dbraw/zinc/58/99/89/964589989.db2.gz COLHQIXNPNGKNB-UHFFFAOYSA-N 1 2 224.267 2.889 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+][C@H]1C=CCC1 ZINC000698210858 965105233 /nfs/dbraw/zinc/10/52/33/965105233.db2.gz BFERCHLUNKUDJA-JTQLQIEISA-N 1 2 223.703 2.854 20 10 BFCDLO Cc1c[nH+]c(C)c(Nc2cccc(O)c2O)c1 ZINC001203663335 966730492 /nfs/dbraw/zinc/73/04/92/966730492.db2.gz NQKLZSBLKKDQLZ-UHFFFAOYSA-N 1 2 230.267 2.853 20 10 BFCDLO Oc1c(Cl)cccc1C[NH+]1CC2CC(C2)C1 ZINC001231915055 977797077 /nfs/dbraw/zinc/79/70/77/977797077.db2.gz VYAHZIQGJNFMKC-UHFFFAOYSA-N 1 2 237.730 2.887 20 10 BFCDLO C[C@@H]1CC[N@@H+]1Cc1cc(F)cc(Cl)c1O ZINC001237808515 980057285 /nfs/dbraw/zinc/05/72/85/980057285.db2.gz TVMCNRGKYYYICB-SSDOTTSWSA-N 1 2 229.682 2.779 20 10 BFCDLO C[C@@H]1CC[N@H+]1Cc1cc(F)cc(Cl)c1O ZINC001237808515 980057290 /nfs/dbraw/zinc/05/72/90/980057290.db2.gz TVMCNRGKYYYICB-SSDOTTSWSA-N 1 2 229.682 2.779 20 10 BFCDLO COc1ncccc1-c1[nH+]ccc2c1ccn2C ZINC001239854896 980995280 /nfs/dbraw/zinc/99/52/80/980995280.db2.gz XNUJXMRZHYDAGS-UHFFFAOYSA-N 1 2 239.278 2.644 20 10 BFCDLO c1c[nH+]c(-c2ccc(N3CCSCC3)cc2)[nH]1 ZINC001242019660 983226224 /nfs/dbraw/zinc/22/62/24/983226224.db2.gz IZLFJDHZBKXQPB-UHFFFAOYSA-N 1 2 245.351 2.630 20 10 BFCDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000827506707 986897640 /nfs/dbraw/zinc/89/76/40/986897640.db2.gz KSUKFACHUJWLBD-MWLCHTKSSA-N 1 2 237.730 2.887 20 10 BFCDLO Oc1c(Cl)cccc1C[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000827506707 986897649 /nfs/dbraw/zinc/89/76/49/986897649.db2.gz KSUKFACHUJWLBD-MWLCHTKSSA-N 1 2 237.730 2.887 20 10 BFCDLO Cc1ccc(C)c(C[N@H+]2C[C@@H](F)[C@@H](F)C2)c1O ZINC001140178303 991553371 /nfs/dbraw/zinc/55/33/71/991553371.db2.gz HLXFSTFBJGQRKE-TXEJJXNPSA-N 1 2 241.281 2.501 20 10 BFCDLO Cc1ccc(C)c(C[N@@H+]2C[C@@H](F)[C@@H](F)C2)c1O ZINC001140178303 991553380 /nfs/dbraw/zinc/55/33/80/991553380.db2.gz HLXFSTFBJGQRKE-TXEJJXNPSA-N 1 2 241.281 2.501 20 10 BFCDLO CC[N@@H+](Cc1cccc(F)c1O)CC(F)F ZINC000273510681 389041123 /nfs/dbraw/zinc/04/11/23/389041123.db2.gz QWDDGDRGSIKTNE-UHFFFAOYSA-N 1 2 233.233 2.618 20 10 BFCDLO CC[N@H+](Cc1cccc(F)c1O)CC(F)F ZINC000273510681 389041126 /nfs/dbraw/zinc/04/11/26/389041126.db2.gz QWDDGDRGSIKTNE-UHFFFAOYSA-N 1 2 233.233 2.618 20 10 BFCDLO CC(C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293825238 167116583 /nfs/dbraw/zinc/11/65/83/167116583.db2.gz DPISCEUCZOHQBL-UHFFFAOYSA-N 1 2 217.671 2.683 20 10 BFCDLO C[C@H]1C[N@H+](Cc2ccc(F)c(F)c2O)[C@H]1C ZINC000894861667 583535039 /nfs/dbraw/zinc/53/50/39/583535039.db2.gz LPLPJDNQLLDPQG-YUMQZZPRSA-N 1 2 227.254 2.511 20 10 BFCDLO C[C@H]1C[N@@H+](Cc2ccc(F)c(F)c2O)[C@H]1C ZINC000894861667 583535041 /nfs/dbraw/zinc/53/50/41/583535041.db2.gz LPLPJDNQLLDPQG-YUMQZZPRSA-N 1 2 227.254 2.511 20 10 BFCDLO COCCCC[N@@H+]1CCCc2cc(OC)ccc21 ZINC000735492317 584977911 /nfs/dbraw/zinc/97/79/11/584977911.db2.gz NFJNEJANVCCIKM-UHFFFAOYSA-N 1 2 249.354 2.874 20 10 BFCDLO COCCCC[N@H+]1CCCc2cc(OC)ccc21 ZINC000735492317 584977912 /nfs/dbraw/zinc/97/79/12/584977912.db2.gz NFJNEJANVCCIKM-UHFFFAOYSA-N 1 2 249.354 2.874 20 10 BFCDLO COCCC[N@@H+]1CCCCc2cc(OC)ccc21 ZINC000766268808 585499846 /nfs/dbraw/zinc/49/98/46/585499846.db2.gz GRGWTQRCOAOMQB-UHFFFAOYSA-N 1 2 249.354 2.874 20 10 BFCDLO COCCC[N@H+]1CCCCc2cc(OC)ccc21 ZINC000766268808 585499847 /nfs/dbraw/zinc/49/98/47/585499847.db2.gz GRGWTQRCOAOMQB-UHFFFAOYSA-N 1 2 249.354 2.874 20 10 BFCDLO CN(C)c1ccc(C[N@@H+]2CCC(F)(F)C2)cc1 ZINC000776693403 585703089 /nfs/dbraw/zinc/70/30/89/585703089.db2.gz JGDPVEHFTJATJX-UHFFFAOYSA-N 1 2 240.297 2.594 20 10 BFCDLO CN(C)c1ccc(C[N@H+]2CCC(F)(F)C2)cc1 ZINC000776693403 585703090 /nfs/dbraw/zinc/70/30/90/585703090.db2.gz JGDPVEHFTJATJX-UHFFFAOYSA-N 1 2 240.297 2.594 20 10 BFCDLO Oc1c(Cl)cccc1C[NH+]1CC(C2CC2)C1 ZINC000812776318 586583506 /nfs/dbraw/zinc/58/35/06/586583506.db2.gz UAFRMGZFUIDHND-UHFFFAOYSA-N 1 2 237.730 2.887 20 10 BFCDLO CC1C[NH+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816595310 586743472 /nfs/dbraw/zinc/74/34/72/586743472.db2.gz ITQKDRQSMXZJOM-UHFFFAOYSA-N 1 2 229.682 2.636 20 10 BFCDLO CC[C@@H]([NH2+]Cc1cc(F)ccc1O)C(F)F ZINC000824510629 587272808 /nfs/dbraw/zinc/27/28/08/587272808.db2.gz YKVGSKTUNTUEHI-SECBINFHSA-N 1 2 233.233 2.665 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@H](F)C1 ZINC000824571155 587277024 /nfs/dbraw/zinc/27/70/24/587277024.db2.gz KSOQINVLZXWHFQ-VIFPVBQESA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@H](F)C1 ZINC000824571155 587277025 /nfs/dbraw/zinc/27/70/25/587277025.db2.gz KSOQINVLZXWHFQ-VIFPVBQESA-N 1 2 247.672 2.729 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2CCO[C@H](C)C2)cc1 ZINC000844355144 588187586 /nfs/dbraw/zinc/18/75/86/588187586.db2.gz LOHYTQUYQGXXOL-CHWSQXEVSA-N 1 2 249.354 2.947 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2CCO[C@H](C)C2)cc1 ZINC000844355144 588187588 /nfs/dbraw/zinc/18/75/88/588187588.db2.gz LOHYTQUYQGXXOL-CHWSQXEVSA-N 1 2 249.354 2.947 20 10 BFCDLO CO[C@H](CN(C)c1ccc([NH3+])cc1)C1CCCC1 ZINC000863558465 589298944 /nfs/dbraw/zinc/29/89/44/589298944.db2.gz JQMCPXKDDFOEGU-OAHLLOKOSA-N 1 2 248.370 2.910 20 10 BFCDLO COc1ccc([N@H+](C)CCC[C@H]2CCO2)cc1 ZINC000877610409 590372648 /nfs/dbraw/zinc/37/26/48/590372648.db2.gz UYSVJMQWGJGOIF-AWEZNQCLSA-N 1 2 235.327 2.701 20 10 BFCDLO COc1ccc([N@@H+](C)CCC[C@H]2CCO2)cc1 ZINC000877610409 590372650 /nfs/dbraw/zinc/37/26/50/590372650.db2.gz UYSVJMQWGJGOIF-AWEZNQCLSA-N 1 2 235.327 2.701 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2CCO[C@@H]2C)cc1 ZINC000878801341 590624699 /nfs/dbraw/zinc/62/46/99/590624699.db2.gz JVRKSERFYAOWHH-NEPJUHHUSA-N 1 2 235.327 2.556 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2CCO[C@@H]2C)cc1 ZINC000878801341 590624700 /nfs/dbraw/zinc/62/47/00/590624700.db2.gz JVRKSERFYAOWHH-NEPJUHHUSA-N 1 2 235.327 2.556 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2C[C@]23CCOC3)cc1 ZINC000886267777 592191042 /nfs/dbraw/zinc/19/10/42/592191042.db2.gz UXPUQOMRHKYZSV-WFASDCNBSA-N 1 2 247.338 2.558 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2C[C@]23CCOC3)cc1 ZINC000886267777 592191044 /nfs/dbraw/zinc/19/10/44/592191044.db2.gz UXPUQOMRHKYZSV-WFASDCNBSA-N 1 2 247.338 2.558 20 10 BFCDLO C[C@H]([NH2+]CC(C)(F)F)c1c(O)cccc1F ZINC000886615548 592276359 /nfs/dbraw/zinc/27/63/59/592276359.db2.gz IUWNGTCFNGKPGN-ZETCQYMHSA-N 1 2 233.233 2.837 20 10 BFCDLO C[C@@H]1CC[C@@H]1[NH2+]Cc1cccc(Cl)c1O ZINC000309063275 631829925 /nfs/dbraw/zinc/82/99/25/631829925.db2.gz XMTQRSYWHOSUMP-KCJUWKMLSA-N 1 2 225.719 2.934 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]CCC1CC1 ZINC000162869175 635143185 /nfs/dbraw/zinc/14/31/85/635143185.db2.gz ALKPBWNRLAHQJK-UHFFFAOYSA-N 1 2 225.719 2.935 20 10 BFCDLO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)C(F)F ZINC000895726017 636175055 /nfs/dbraw/zinc/17/50/55/636175055.db2.gz XAVYVGAZWSOYHV-SNVBAGLBSA-N 1 2 242.313 2.804 20 10 BFCDLO CN(C)c1ccc(CNc2cc[nH+]cc2F)cc1 ZINC000180189317 642777042 /nfs/dbraw/zinc/77/70/42/642777042.db2.gz KWDYEVJXJBDCJZ-UHFFFAOYSA-N 1 2 245.301 2.899 20 10 BFCDLO Cc1ccc(O)c(C[NH2+]C2(C(F)F)CC2)c1 ZINC000390521101 711122327 /nfs/dbraw/zinc/12/23/27/711122327.db2.gz FLLOSHJGHICKIB-UHFFFAOYSA-N 1 2 227.254 2.588 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000397726345 711389991 /nfs/dbraw/zinc/38/99/91/711389991.db2.gz ZMAAWQZSJKTMRR-JGPRNRPPSA-N 1 2 237.730 2.934 20 10 BFCDLO C[C@@H](CF)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000379953822 712636152 /nfs/dbraw/zinc/63/61/52/712636152.db2.gz FTTIDDLTYNPMDS-LURJTMIESA-N 1 2 235.661 2.632 20 10 BFCDLO Cc1ccc(O)c(C[N@@H+]2CCCC(F)(F)C2)c1 ZINC000404887676 971184023 /nfs/dbraw/zinc/18/40/23/971184023.db2.gz GKMSUUOPQJKTSI-UHFFFAOYSA-N 1 2 241.281 2.932 20 10 BFCDLO Cc1ccc(O)c(C[N@H+]2CCCC(F)(F)C2)c1 ZINC000404887676 971184031 /nfs/dbraw/zinc/18/40/31/971184031.db2.gz GKMSUUOPQJKTSI-UHFFFAOYSA-N 1 2 241.281 2.932 20 10 BFCDLO Cc1cc(-c2cnc3ccn(C)c3c2)c[nH+]c1N ZINC001245539720 971853407 /nfs/dbraw/zinc/85/34/07/971853407.db2.gz OXURGIUMHWRYJF-UHFFFAOYSA-N 1 2 238.294 2.526 20 10 BFCDLO C[C@H]1CCC[N@@H+]1Cc1c(O)cc(F)cc1F ZINC001140580369 958989623 /nfs/dbraw/zinc/98/96/23/958989623.db2.gz ZPQZTULOUCCGPY-QMMMGPOBSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@H]1CCC[N@H+]1Cc1c(O)cc(F)cc1F ZINC001140580369 958989635 /nfs/dbraw/zinc/98/96/35/958989635.db2.gz ZPQZTULOUCCGPY-QMMMGPOBSA-N 1 2 227.254 2.655 20 10 BFCDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@@H](F)C1 ZINC000689864957 960296757 /nfs/dbraw/zinc/29/67/57/960296757.db2.gz WNOWACAJNJUSDD-SECBINFHSA-N 1 2 229.682 2.589 20 10 BFCDLO Oc1c(Cl)cccc1C[N@H+]1CC[C@@H](F)C1 ZINC000689864957 960296765 /nfs/dbraw/zinc/29/67/65/960296765.db2.gz WNOWACAJNJUSDD-SECBINFHSA-N 1 2 229.682 2.589 20 10 BFCDLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001142508511 961464689 /nfs/dbraw/zinc/46/46/89/961464689.db2.gz BINDNKCIOGEOEE-APPZFPTMSA-N 1 2 245.244 2.603 20 10 BFCDLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cc(F)c(F)cc1O ZINC001142508511 961464700 /nfs/dbraw/zinc/46/47/00/961464700.db2.gz BINDNKCIOGEOEE-APPZFPTMSA-N 1 2 245.244 2.603 20 10 BFCDLO CCC(F)(F)C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000697654074 964417348 /nfs/dbraw/zinc/41/73/48/964417348.db2.gz FGDAVDIGWKKAED-UHFFFAOYSA-N 1 2 241.281 2.756 20 10 BFCDLO COc1c[nH+]c(NCc2ccc(N)cc2)c(C)c1 ZINC001162785603 965172077 /nfs/dbraw/zinc/17/20/77/965172077.db2.gz JRXNXWLAKBOOQW-UHFFFAOYSA-N 1 2 243.310 2.593 20 10 BFCDLO Cc1cccc(C[NH+]2CC(F)(C3CC3)C2)c1O ZINC001231591042 977644624 /nfs/dbraw/zinc/64/46/24/977644624.db2.gz RCFOQMQQNWYMFH-UHFFFAOYSA-N 1 2 235.302 2.635 20 10 BFCDLO C[C@@]1(F)CCC[N@H+](Cc2c(O)cccc2F)C1 ZINC001137833109 990857143 /nfs/dbraw/zinc/85/71/43/990857143.db2.gz SZJSUMZGEPCNAB-CYBMUJFWSA-N 1 2 241.281 2.855 20 10 BFCDLO C[C@@]1(F)CCC[N@@H+](Cc2c(O)cccc2F)C1 ZINC001137833109 990857149 /nfs/dbraw/zinc/85/71/49/990857149.db2.gz SZJSUMZGEPCNAB-CYBMUJFWSA-N 1 2 241.281 2.855 20 10 BFCDLO CC[N@@H+](Cc1cc(C)ccc1O)CC(F)F ZINC000184090993 347917858 /nfs/dbraw/zinc/91/78/58/347917858.db2.gz ZPEDHHDWPTVBLO-UHFFFAOYSA-N 1 2 229.270 2.788 20 10 BFCDLO CC[N@H+](Cc1cc(C)ccc1O)CC(F)F ZINC000184090993 347917861 /nfs/dbraw/zinc/91/78/61/347917861.db2.gz ZPEDHHDWPTVBLO-UHFFFAOYSA-N 1 2 229.270 2.788 20 10 BFCDLO CCC[N@@H+](Cc1ccccc1O)CC(F)F ZINC000112979393 169179457 /nfs/dbraw/zinc/17/94/57/169179457.db2.gz QTYOAGCNHYBBGP-UHFFFAOYSA-N 1 2 229.270 2.869 20 10 BFCDLO CCC[N@H+](Cc1ccccc1O)CC(F)F ZINC000112979393 169179459 /nfs/dbraw/zinc/17/94/59/169179459.db2.gz QTYOAGCNHYBBGP-UHFFFAOYSA-N 1 2 229.270 2.869 20 10 BFCDLO COCC[C@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000162834681 384696097 /nfs/dbraw/zinc/69/60/97/384696097.db2.gz ONRAIBFUNFJZFV-VIFPVBQESA-N 1 2 243.734 2.560 20 10 BFCDLO CO[C@@H](C)[C@@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000290908676 384947575 /nfs/dbraw/zinc/94/75/75/384947575.db2.gz MYFWYORCCHRGSL-BDAKNGLRSA-N 1 2 243.734 2.559 20 10 BFCDLO Oc1c(Cl)cccc1C[N@@H+]1CCC[C@@H]1CF ZINC000294077004 385799181 /nfs/dbraw/zinc/79/91/81/385799181.db2.gz QVRJBOXGLVXOLN-SNVBAGLBSA-N 1 2 243.709 2.980 20 10 BFCDLO Oc1c(Cl)cccc1C[N@H+]1CCC[C@@H]1CF ZINC000294077004 385799185 /nfs/dbraw/zinc/79/91/85/385799185.db2.gz QVRJBOXGLVXOLN-SNVBAGLBSA-N 1 2 243.709 2.980 20 10 BFCDLO CCCC[NH2+]Cc1cccc(Cl)c1O ZINC000157756475 387870231 /nfs/dbraw/zinc/87/02/31/387870231.db2.gz AWZGJFUEKKVQJK-UHFFFAOYSA-N 1 2 213.708 2.935 20 10 BFCDLO CC[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000019488456 170125838 /nfs/dbraw/zinc/12/58/38/170125838.db2.gz LHELQOSBERNQDH-UHFFFAOYSA-N 1 2 220.099 2.809 20 10 BFCDLO COc1ccc([N@H+](CCCO)[C@H](C)C2CC2)cc1 ZINC000264598698 175137490 /nfs/dbraw/zinc/13/74/90/175137490.db2.gz JGWVKXNGEPUUHW-GFCCVEGCSA-N 1 2 249.354 2.683 20 10 BFCDLO COc1ccc([N@@H+](CCCO)[C@H](C)C2CC2)cc1 ZINC000264598698 175137492 /nfs/dbraw/zinc/13/74/92/175137492.db2.gz JGWVKXNGEPUUHW-GFCCVEGCSA-N 1 2 249.354 2.683 20 10 BFCDLO COc1cccc([C@H](C)[NH2+][C@@H](C)C(F)F)c1O ZINC000883400975 583795043 /nfs/dbraw/zinc/79/50/43/583795043.db2.gz ZAVGGBPNPDQFLX-YUMQZZPRSA-N 1 2 245.269 2.705 20 10 BFCDLO CCOCCC[N@@H+]1CCCc2cc(OC)ccc21 ZINC000741774814 585117963 /nfs/dbraw/zinc/11/79/63/585117963.db2.gz HOAVGYQFBJBPAI-UHFFFAOYSA-N 1 2 249.354 2.874 20 10 BFCDLO CCOCCC[N@H+]1CCCc2cc(OC)ccc21 ZINC000741774814 585117964 /nfs/dbraw/zinc/11/79/64/585117964.db2.gz HOAVGYQFBJBPAI-UHFFFAOYSA-N 1 2 249.354 2.874 20 10 BFCDLO CC(C)Oc1ccc([N@H+](C)C[C@H]2CCOC2)cc1 ZINC000759933839 585382928 /nfs/dbraw/zinc/38/29/28/585382928.db2.gz RHMZTSJPDFZOQC-CYBMUJFWSA-N 1 2 249.354 2.947 20 10 BFCDLO CC(C)Oc1ccc([N@@H+](C)C[C@H]2CCOC2)cc1 ZINC000759933839 585382929 /nfs/dbraw/zinc/38/29/29/585382929.db2.gz RHMZTSJPDFZOQC-CYBMUJFWSA-N 1 2 249.354 2.947 20 10 BFCDLO Cc1cc(C)c(O)c(C[N@@H+]2CCC(F)(F)C2)c1 ZINC000776293889 585694975 /nfs/dbraw/zinc/69/49/75/585694975.db2.gz QNVNOXKZSLTKEH-UHFFFAOYSA-N 1 2 241.281 2.850 20 10 BFCDLO Cc1cc(C)c(O)c(C[N@H+]2CCC(F)(F)C2)c1 ZINC000776293889 585694976 /nfs/dbraw/zinc/69/49/76/585694976.db2.gz QNVNOXKZSLTKEH-UHFFFAOYSA-N 1 2 241.281 2.850 20 10 BFCDLO COc1ccc2c(c1)CCC[N@H+]2CCC[C@H](C)O ZINC000789304771 585939178 /nfs/dbraw/zinc/93/91/78/585939178.db2.gz DODCZQJDHIFTIM-LBPRGKRZSA-N 1 2 249.354 2.609 20 10 BFCDLO COc1ccc2c(c1)CCC[N@@H+]2CCC[C@H](C)O ZINC000789304771 585939179 /nfs/dbraw/zinc/93/91/79/585939179.db2.gz DODCZQJDHIFTIM-LBPRGKRZSA-N 1 2 249.354 2.609 20 10 BFCDLO CC[N@H+](CCC[C@@H](C)O)c1ccc(OC)cc1 ZINC000789342306 585940670 /nfs/dbraw/zinc/94/06/70/585940670.db2.gz NDXZEFSUFNSIQY-GFCCVEGCSA-N 1 2 237.343 2.683 20 10 BFCDLO CC[N@@H+](CCC[C@@H](C)O)c1ccc(OC)cc1 ZINC000789342306 585940671 /nfs/dbraw/zinc/94/06/71/585940671.db2.gz NDXZEFSUFNSIQY-GFCCVEGCSA-N 1 2 237.343 2.683 20 10 BFCDLO CN(C)c1ccc(C[NH2+]C(C)(C)C(F)F)cc1 ZINC000793255912 586015424 /nfs/dbraw/zinc/01/54/24/586015424.db2.gz UYEDTEOOZQXJJE-UHFFFAOYSA-N 1 2 242.313 2.886 20 10 BFCDLO CC[C@@H]([NH2+]Cc1ccn[nH]1)c1ccc(C)cc1O ZINC000794808492 586049453 /nfs/dbraw/zinc/04/94/53/586049453.db2.gz ODSKGYVXRGGYGV-CYBMUJFWSA-N 1 2 245.326 2.665 20 10 BFCDLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1cc(F)ccc1O ZINC000800503224 586223409 /nfs/dbraw/zinc/22/34/09/586223409.db2.gz PXDJIDKIHKLSHH-SSDOTTSWSA-N 1 2 245.244 2.980 20 10 BFCDLO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccn[nH]2)c(O)c1 ZINC000815577050 586688036 /nfs/dbraw/zinc/68/80/36/586688036.db2.gz FOKKSZDRKZICBN-NSHDSACASA-N 1 2 245.326 2.583 20 10 BFCDLO C[C@@H]1C[C@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816535699 586739211 /nfs/dbraw/zinc/73/92/11/586739211.db2.gz XDCPYCVWFNJABL-SFYZADRCSA-N 1 2 243.709 2.930 20 10 BFCDLO Oc1c(Cl)cccc1C[NH+]1CC2(CC2)C1 ZINC000824534048 587274274 /nfs/dbraw/zinc/27/42/74/587274274.db2.gz YNXCFIHMYKJRBU-UHFFFAOYSA-N 1 2 223.703 2.641 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH2+][C@@H]1C=CCC1 ZINC000826941866 587366381 /nfs/dbraw/zinc/36/63/81/587366381.db2.gz LMUGSYMCLWQPAF-SNVBAGLBSA-N 1 2 241.693 2.993 20 10 BFCDLO COc1ccc([N@H+](C[C@H](C)CO)CC2CC2)cc1 ZINC000831587999 587621493 /nfs/dbraw/zinc/62/14/93/587621493.db2.gz QIEIJGZJNWDPQO-LBPRGKRZSA-N 1 2 249.354 2.540 20 10 BFCDLO COc1ccc([N@@H+](C[C@H](C)CO)CC2CC2)cc1 ZINC000831587999 587621494 /nfs/dbraw/zinc/62/14/94/587621494.db2.gz QIEIJGZJNWDPQO-LBPRGKRZSA-N 1 2 249.354 2.540 20 10 BFCDLO COc1ccc([N@H+](C)CCC2CCOCC2)cc1 ZINC000844354869 588186897 /nfs/dbraw/zinc/18/68/97/588186897.db2.gz JCUJTNABVYDFMV-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1ccc([N@@H+](C)CCC2CCOCC2)cc1 ZINC000844354869 588186899 /nfs/dbraw/zinc/18/68/99/588186899.db2.gz JCUJTNABVYDFMV-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1ccc([N@H+](C)CCC2CC2)cc1 ZINC000844352743 588187041 /nfs/dbraw/zinc/18/70/41/588187041.db2.gz FZWFUHRXFLEPJH-UHFFFAOYSA-N 1 2 205.301 2.932 20 10 BFCDLO COc1ccc([N@@H+](C)CCC2CC2)cc1 ZINC000844352743 588187043 /nfs/dbraw/zinc/18/70/43/588187043.db2.gz FZWFUHRXFLEPJH-UHFFFAOYSA-N 1 2 205.301 2.932 20 10 BFCDLO COc1ccc([N@H+](C)CCCCF)cc1 ZINC000844355149 588187538 /nfs/dbraw/zinc/18/75/38/588187538.db2.gz LPAYXEGHZLRUDP-UHFFFAOYSA-N 1 2 211.280 2.881 20 10 BFCDLO COc1ccc([N@@H+](C)CCCCF)cc1 ZINC000844355149 588187539 /nfs/dbraw/zinc/18/75/39/588187539.db2.gz LPAYXEGHZLRUDP-UHFFFAOYSA-N 1 2 211.280 2.881 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2C[C@H]2C)cc1 ZINC000845997657 588253080 /nfs/dbraw/zinc/25/30/80/588253080.db2.gz BDUKHMMMYBLART-GHMZBOCLSA-N 1 2 205.301 2.787 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2C[C@H]2C)cc1 ZINC000845997657 588253081 /nfs/dbraw/zinc/25/30/81/588253081.db2.gz BDUKHMMMYBLART-GHMZBOCLSA-N 1 2 205.301 2.787 20 10 BFCDLO Clc1cnc(SCCn2cc[nH+]c2)s1 ZINC000850000024 588513687 /nfs/dbraw/zinc/51/36/87/588513687.db2.gz GZJBAXABLQVPLM-UHFFFAOYSA-N 1 2 245.760 2.785 20 10 BFCDLO CCC1(C)C[NH+](Cc2ccc(F)c(F)c2O)C1 ZINC000877581933 590365465 /nfs/dbraw/zinc/36/54/65/590365465.db2.gz ABXMSBDDLWXYJH-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO Cc1nc(C[N@@H+]2Cc3cccc(O)c3C2)cs1 ZINC000877703579 590397506 /nfs/dbraw/zinc/39/75/06/590397506.db2.gz PKGHTRPKLOMZPI-UHFFFAOYSA-N 1 2 246.335 2.673 20 10 BFCDLO Cc1nc(C[N@H+]2Cc3cccc(O)c3C2)cs1 ZINC000877703579 590397510 /nfs/dbraw/zinc/39/75/10/590397510.db2.gz PKGHTRPKLOMZPI-UHFFFAOYSA-N 1 2 246.335 2.673 20 10 BFCDLO CCOc1ccc([N@H+](C)C[C@H]2CCO[C@@H]2C)cc1 ZINC000878124152 590499855 /nfs/dbraw/zinc/49/98/55/590499855.db2.gz HJMCVOMDHBNBFL-CHWSQXEVSA-N 1 2 249.354 2.947 20 10 BFCDLO CCOc1ccc([N@@H+](C)C[C@H]2CCO[C@@H]2C)cc1 ZINC000878124152 590499858 /nfs/dbraw/zinc/49/98/58/590499858.db2.gz HJMCVOMDHBNBFL-CHWSQXEVSA-N 1 2 249.354 2.947 20 10 BFCDLO CCOc1ccc([N@H+](C)C[C@@H]2CCO[C@H]2C)cc1 ZINC000878124162 590499938 /nfs/dbraw/zinc/49/99/38/590499938.db2.gz HJMCVOMDHBNBFL-STQMWFEESA-N 1 2 249.354 2.947 20 10 BFCDLO CCOc1ccc([N@@H+](C)C[C@@H]2CCO[C@H]2C)cc1 ZINC000878124162 590499940 /nfs/dbraw/zinc/49/99/40/590499940.db2.gz HJMCVOMDHBNBFL-STQMWFEESA-N 1 2 249.354 2.947 20 10 BFCDLO CC[N@H+](C[C@H]1C[C@@H](OC)C1)c1ccc(OC)cc1 ZINC000878219501 590526147 /nfs/dbraw/zinc/52/61/47/590526147.db2.gz MHRFJPNBKFFGLK-JNSHFYNHSA-N 1 2 249.354 2.947 20 10 BFCDLO CC[N@@H+](C[C@H]1C[C@@H](OC)C1)c1ccc(OC)cc1 ZINC000878219501 590526149 /nfs/dbraw/zinc/52/61/49/590526149.db2.gz MHRFJPNBKFFGLK-JNSHFYNHSA-N 1 2 249.354 2.947 20 10 BFCDLO CCOc1ccc(C[NH2+][C@H](C)C(F)F)c(O)c1 ZINC000883406995 591650110 /nfs/dbraw/zinc/65/01/10/591650110.db2.gz HYQTZDPLWMHXEN-MRVPVSSYSA-N 1 2 245.269 2.534 20 10 BFCDLO CCc1nc(NCc2cc(C)ccc2O)cc[nH+]1 ZINC000884564693 591982471 /nfs/dbraw/zinc/98/24/71/591982471.db2.gz OHWDNYVTCKNCML-UHFFFAOYSA-N 1 2 243.310 2.665 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]Cc1ccco1 ZINC000162822996 633040093 /nfs/dbraw/zinc/04/00/93/633040093.db2.gz KMOSIQQLHCTYQO-UHFFFAOYSA-N 1 2 237.686 2.928 20 10 BFCDLO CCCC[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000708402994 712192957 /nfs/dbraw/zinc/19/29/57/712192957.db2.gz YJVSNVWLCICHIS-UHFFFAOYSA-N 1 2 229.270 2.902 20 10 BFCDLO CCCC[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000708402994 712192958 /nfs/dbraw/zinc/19/29/58/712192958.db2.gz YJVSNVWLCICHIS-UHFFFAOYSA-N 1 2 229.270 2.902 20 10 BFCDLO CC(F)(F)C[NH2+]Cc1c(O)cccc1Cl ZINC000378757286 712361132 /nfs/dbraw/zinc/36/11/32/712361132.db2.gz TVCGOSKJHCENNT-UHFFFAOYSA-N 1 2 235.661 2.790 20 10 BFCDLO C[C@@H]([NH2+]CC(C)(F)F)c1ccc(F)cc1O ZINC000378859716 712363731 /nfs/dbraw/zinc/36/37/31/712363731.db2.gz NSZKQPKBTDLCFN-SSDOTTSWSA-N 1 2 233.233 2.837 20 10 BFCDLO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C(F)F)c1 ZINC000389916362 711097110 /nfs/dbraw/zinc/09/71/10/711097110.db2.gz NDUKYIULPLVVJQ-SFYZADRCSA-N 1 2 245.269 2.705 20 10 BFCDLO Cc1cc(NCc2ccc(O)c(O)c2)c[nH+]c1C ZINC001169995171 969977139 /nfs/dbraw/zinc/97/71/39/969977139.db2.gz RLKBQVVNNFBUNW-UHFFFAOYSA-N 1 2 244.294 2.722 20 10 BFCDLO CCc1ccc(O)c([NH+]=c2cc[nH]cc2OC)c1 ZINC001211263486 970213019 /nfs/dbraw/zinc/21/30/19/970213019.db2.gz UHBAALFNWFMJFB-UHFFFAOYSA-N 1 2 244.294 2.524 20 10 BFCDLO Cc1cc(C)c(Nc2cccc(O)c2O)c[nH+]1 ZINC001213516020 970338057 /nfs/dbraw/zinc/33/80/57/970338057.db2.gz YWPNPOVQUYAKIH-UHFFFAOYSA-N 1 2 230.267 2.853 20 10 BFCDLO Oc1ccc2ccccc2c1C[NH+]1CC(F)C1 ZINC001231588351 977634806 /nfs/dbraw/zinc/63/48/06/977634806.db2.gz PVBPOPOCTJKSAJ-UHFFFAOYSA-N 1 2 231.270 2.699 20 10 BFCDLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1c(O)ccc(F)c1F ZINC001233332170 978566397 /nfs/dbraw/zinc/56/63/97/978566397.db2.gz BESULUWRBXQRIR-SFYZADRCSA-N 1 2 245.244 2.603 20 10 BFCDLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1c(O)ccc(F)c1F ZINC001233332170 978566401 /nfs/dbraw/zinc/56/64/01/978566401.db2.gz BESULUWRBXQRIR-SFYZADRCSA-N 1 2 245.244 2.603 20 10 BFCDLO COc1ccc(C[N@H+](C)C(C)C)c(O)c1Cl ZINC001236806276 979739224 /nfs/dbraw/zinc/73/92/24/979739224.db2.gz STCDDLOOASQUAN-UHFFFAOYSA-N 1 2 243.734 2.894 20 10 BFCDLO COc1ccc(C[N@@H+](C)C(C)C)c(O)c1Cl ZINC001236806276 979739229 /nfs/dbraw/zinc/73/92/29/979739229.db2.gz STCDDLOOASQUAN-UHFFFAOYSA-N 1 2 243.734 2.894 20 10 BFCDLO CC[NH+](CC)Cc1ccc(OC)c(Cl)c1O ZINC001236806680 979742181 /nfs/dbraw/zinc/74/21/81/979742181.db2.gz ZEOYRCRZHKYQCS-UHFFFAOYSA-N 1 2 243.734 2.896 20 10 BFCDLO Cc1cc(CN(C)c2ccc(N)cc2)cc(C)[nH+]1 ZINC001579592967 986104801 /nfs/dbraw/zinc/10/48/01/986104801.db2.gz OVONGPCXWKPIAB-UHFFFAOYSA-N 1 2 241.338 2.917 20 10 BFCDLO C[C@@H]1CC[N@H+](Cc2c(O)cccc2F)C[C@H]1F ZINC001137831993 990857339 /nfs/dbraw/zinc/85/73/39/990857339.db2.gz VYEZNLLWYQOUMV-BXKDBHETSA-N 1 2 241.281 2.711 20 10 BFCDLO C[C@@H]1CC[N@@H+](Cc2c(O)cccc2F)C[C@H]1F ZINC001137831993 990857341 /nfs/dbraw/zinc/85/73/41/990857341.db2.gz VYEZNLLWYQOUMV-BXKDBHETSA-N 1 2 241.281 2.711 20 10 BFCDLO Oc1c(Cl)cc(Cl)cc1C[NH2+]C1CC1 ZINC000021956459 343030312 /nfs/dbraw/zinc/03/03/12/343030312.db2.gz YJUBRHOJAOIEFS-UHFFFAOYSA-N 1 2 232.110 2.951 20 10 BFCDLO Cc1cccc(C[N@H+](C)Cc2cscn2)c1O ZINC000179865383 179070390 /nfs/dbraw/zinc/07/03/90/179070390.db2.gz NXDXGBJTAKOXDX-UHFFFAOYSA-N 1 2 248.351 2.789 20 10 BFCDLO Cc1cccc(C[N@@H+](C)Cc2cscn2)c1O ZINC000179865383 179070392 /nfs/dbraw/zinc/07/03/92/179070392.db2.gz NXDXGBJTAKOXDX-UHFFFAOYSA-N 1 2 248.351 2.789 20 10 BFCDLO CCC[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000191179497 169287349 /nfs/dbraw/zinc/28/73/49/169287349.db2.gz UBVNXBBAGIGFGS-SSDOTTSWSA-N 1 2 215.243 2.731 20 10 BFCDLO Oc1c(Cl)cccc1C[NH+]1CCSCC1 ZINC000179666116 385482294 /nfs/dbraw/zinc/48/22/94/385482294.db2.gz PGVLQFOGBUMMOF-UHFFFAOYSA-N 1 2 243.759 2.594 20 10 BFCDLO C[N@@H+](Cc1cccc(Cl)c1O)CC1CC1 ZINC000179793256 385492409 /nfs/dbraw/zinc/49/24/09/385492409.db2.gz JQBIERWWBZOSCW-UHFFFAOYSA-N 1 2 225.719 2.887 20 10 BFCDLO C[N@H+](Cc1cccc(Cl)c1O)CC1CC1 ZINC000179793256 385492413 /nfs/dbraw/zinc/49/24/13/385492413.db2.gz JQBIERWWBZOSCW-UHFFFAOYSA-N 1 2 225.719 2.887 20 10 BFCDLO C[N@H+](Cc1cccc(F)c1O)C1CCC1 ZINC000272325828 385893715 /nfs/dbraw/zinc/89/37/15/385893715.db2.gz VHZFTZDVNBAOJA-UHFFFAOYSA-N 1 2 209.264 2.516 20 10 BFCDLO C[N@@H+](Cc1cccc(F)c1O)C1CCC1 ZINC000272325828 385893718 /nfs/dbraw/zinc/89/37/18/385893718.db2.gz VHZFTZDVNBAOJA-UHFFFAOYSA-N 1 2 209.264 2.516 20 10 BFCDLO COc1ccc(O)c(CNc2ccc(C)[nH+]c2)c1 ZINC000083372618 175159555 /nfs/dbraw/zinc/15/95/55/175159555.db2.gz PKFWIBKVEPTSHU-UHFFFAOYSA-N 1 2 244.294 2.716 20 10 BFCDLO C[N@@H+](Cc1cc(F)cc(F)c1O)CC1CC1 ZINC000893966196 583264095 /nfs/dbraw/zinc/26/40/95/583264095.db2.gz JICOZONNYBPHGI-UHFFFAOYSA-N 1 2 227.254 2.512 20 10 BFCDLO C[N@H+](Cc1cc(F)cc(F)c1O)CC1CC1 ZINC000893966196 583264096 /nfs/dbraw/zinc/26/40/96/583264096.db2.gz JICOZONNYBPHGI-UHFFFAOYSA-N 1 2 227.254 2.512 20 10 BFCDLO C[N@H+](Cc1cc(F)cc(F)c1O)C1CCC1 ZINC000894032537 583277627 /nfs/dbraw/zinc/27/76/27/583277627.db2.gz LQTVNFJULQZUDD-UHFFFAOYSA-N 1 2 227.254 2.655 20 10 BFCDLO C[N@@H+](Cc1cc(F)cc(F)c1O)C1CCC1 ZINC000894032537 583277628 /nfs/dbraw/zinc/27/76/28/583277628.db2.gz LQTVNFJULQZUDD-UHFFFAOYSA-N 1 2 227.254 2.655 20 10 BFCDLO Oc1c(C[NH+]2CC(C3CC3)C2)ccc(F)c1F ZINC000877542513 583325627 /nfs/dbraw/zinc/32/56/27/583325627.db2.gz SHBJTBGRIKGDBG-UHFFFAOYSA-N 1 2 239.265 2.512 20 10 BFCDLO Cc1ccc(O)c(C[N@@H+]2CC[C@@H]2C(F)F)c1 ZINC000895430732 583670361 /nfs/dbraw/zinc/67/03/61/583670361.db2.gz HGKAONJYCBYZPY-SNVBAGLBSA-N 1 2 227.254 2.540 20 10 BFCDLO Cc1ccc(O)c(C[N@H+]2CC[C@@H]2C(F)F)c1 ZINC000895430732 583670362 /nfs/dbraw/zinc/67/03/62/583670362.db2.gz HGKAONJYCBYZPY-SNVBAGLBSA-N 1 2 227.254 2.540 20 10 BFCDLO CC[N@H+](C[C@@H]1CCOC1)c1ccc(OC)cc1 ZINC000746108803 585163206 /nfs/dbraw/zinc/16/32/06/585163206.db2.gz CZBQXLRCQIDAJC-LBPRGKRZSA-N 1 2 235.327 2.558 20 10 BFCDLO CC[N@@H+](C[C@@H]1CCOC1)c1ccc(OC)cc1 ZINC000746108803 585163207 /nfs/dbraw/zinc/16/32/07/585163207.db2.gz CZBQXLRCQIDAJC-LBPRGKRZSA-N 1 2 235.327 2.558 20 10 BFCDLO CC(C)Oc1ccc([N@H+](C)CC2(C)COC2)cc1 ZINC000759913447 585382644 /nfs/dbraw/zinc/38/26/44/585382644.db2.gz BRDYBGZMYHHZKT-UHFFFAOYSA-N 1 2 249.354 2.947 20 10 BFCDLO CC(C)Oc1ccc([N@@H+](C)CC2(C)COC2)cc1 ZINC000759913447 585382645 /nfs/dbraw/zinc/38/26/45/585382645.db2.gz BRDYBGZMYHHZKT-UHFFFAOYSA-N 1 2 249.354 2.947 20 10 BFCDLO CCOc1ccc([N@H+](C)C[C@@H]2CCCOC2)cc1 ZINC000768531289 585539976 /nfs/dbraw/zinc/53/99/76/585539976.db2.gz ZWSYVKHLUOYCNN-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO CCOc1ccc([N@@H+](C)C[C@@H]2CCCOC2)cc1 ZINC000768531289 585539977 /nfs/dbraw/zinc/53/99/77/585539977.db2.gz ZWSYVKHLUOYCNN-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO CCOc1ccc([N@H+](C)CCC[C@H](C)O)cc1 ZINC000789325340 585939688 /nfs/dbraw/zinc/93/96/88/585939688.db2.gz HITJHHFNELNFKX-LBPRGKRZSA-N 1 2 237.343 2.683 20 10 BFCDLO CCOc1ccc([N@@H+](C)CCC[C@H](C)O)cc1 ZINC000789325340 585939689 /nfs/dbraw/zinc/93/96/89/585939689.db2.gz HITJHHFNELNFKX-LBPRGKRZSA-N 1 2 237.343 2.683 20 10 BFCDLO CCOc1ccc([N@H+](C)CCC[C@@H](C)O)cc1 ZINC000789325334 585939874 /nfs/dbraw/zinc/93/98/74/585939874.db2.gz HITJHHFNELNFKX-GFCCVEGCSA-N 1 2 237.343 2.683 20 10 BFCDLO CCOc1ccc([N@@H+](C)CCC[C@@H](C)O)cc1 ZINC000789325334 585939875 /nfs/dbraw/zinc/93/98/75/585939875.db2.gz HITJHHFNELNFKX-GFCCVEGCSA-N 1 2 237.343 2.683 20 10 BFCDLO C[C@H]([NH2+][C@@H]1CC12CC2)c1cc(F)cc(F)c1O ZINC000818356730 586888822 /nfs/dbraw/zinc/88/88/22/586888822.db2.gz QLCOFHAZTBNNJB-WRWORJQWSA-N 1 2 239.265 2.874 20 10 BFCDLO Cc1cc(O)c(C[NH2+]C(CF)CF)c(Cl)c1 ZINC000840949903 587931545 /nfs/dbraw/zinc/93/15/45/587931545.db2.gz CDYKBWYMMXUEGR-UHFFFAOYSA-N 1 2 249.688 2.751 20 10 BFCDLO COCCCCC[N@H+](C)c1ccc(OC)cc1 ZINC000844353279 588186779 /nfs/dbraw/zinc/18/67/79/588186779.db2.gz KGIYHBFQCOUZBA-UHFFFAOYSA-N 1 2 237.343 2.948 20 10 BFCDLO COCCCCC[N@@H+](C)c1ccc(OC)cc1 ZINC000844353279 588186780 /nfs/dbraw/zinc/18/67/80/588186780.db2.gz KGIYHBFQCOUZBA-UHFFFAOYSA-N 1 2 237.343 2.948 20 10 BFCDLO COc1ccc([N@H+](C)CC2CCOCC2)cc1 ZINC000844352706 588187025 /nfs/dbraw/zinc/18/70/25/588187025.db2.gz DFUPEQROBDDDFJ-UHFFFAOYSA-N 1 2 235.327 2.558 20 10 BFCDLO COc1ccc([N@@H+](C)CC2CCOCC2)cc1 ZINC000844352706 588187027 /nfs/dbraw/zinc/18/70/27/588187027.db2.gz DFUPEQROBDDDFJ-UHFFFAOYSA-N 1 2 235.327 2.558 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2CCO[C@H](C)C2)cc1 ZINC000844355146 588187382 /nfs/dbraw/zinc/18/73/82/588187382.db2.gz LOHYTQUYQGXXOL-OLZOCXBDSA-N 1 2 249.354 2.947 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2CCO[C@H](C)C2)cc1 ZINC000844355146 588187384 /nfs/dbraw/zinc/18/73/84/588187384.db2.gz LOHYTQUYQGXXOL-OLZOCXBDSA-N 1 2 249.354 2.947 20 10 BFCDLO CCO[C@H](CN(C)c1ccc([NH3+])cc1)C1CC1 ZINC000863558709 589298754 /nfs/dbraw/zinc/29/87/54/589298754.db2.gz ULHUTJZTKQKTRF-CQSZACIVSA-N 1 2 234.343 2.520 20 10 BFCDLO CC1(C)CC[N@@H+]1Cc1ccc(F)c(F)c1O ZINC000876743235 590235869 /nfs/dbraw/zinc/23/58/69/590235869.db2.gz CRRHZWRALBUYSX-UHFFFAOYSA-N 1 2 227.254 2.655 20 10 BFCDLO CC1(C)CC[N@H+]1Cc1ccc(F)c(F)c1O ZINC000876743235 590235870 /nfs/dbraw/zinc/23/58/70/590235870.db2.gz CRRHZWRALBUYSX-UHFFFAOYSA-N 1 2 227.254 2.655 20 10 BFCDLO CC(C)(F)C[NH2+]Cc1ccc(F)c(F)c1O ZINC000877663553 590388191 /nfs/dbraw/zinc/38/81/91/590388191.db2.gz UIWYFPDVRFFBOB-UHFFFAOYSA-N 1 2 233.233 2.508 20 10 BFCDLO C[C@@H]([NH2+]CCCF)c1cc(F)cc(F)c1O ZINC000134936261 591961639 /nfs/dbraw/zinc/96/16/39/591961639.db2.gz DMWVRIUQJMPJMT-SSDOTTSWSA-N 1 2 233.233 2.681 20 10 BFCDLO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ncco1 ZINC000886276130 592195735 /nfs/dbraw/zinc/19/57/35/592195735.db2.gz XSXXDGKDEMZOBN-NSHDSACASA-N 1 2 245.326 2.591 20 10 BFCDLO CC(C)([NH2+]Cc1cccc(F)c1O)C(F)F ZINC000309712266 632655822 /nfs/dbraw/zinc/65/58/22/632655822.db2.gz XMQZGYIDRPADGL-UHFFFAOYSA-N 1 2 233.233 2.665 20 10 BFCDLO COc1ccc(C[NH2+]Cc2cc(C)on2)cc1C ZINC000044412173 641601596 /nfs/dbraw/zinc/60/15/96/641601596.db2.gz DOSRBYQDHDPMSC-UHFFFAOYSA-N 1 2 246.310 2.590 20 10 BFCDLO CC(F)(F)C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922149603 643873389 /nfs/dbraw/zinc/87/33/89/643873389.db2.gz OTZJOOGBCMBXEN-UHFFFAOYSA-N 1 2 241.281 2.756 20 10 BFCDLO C[C@@H]([NH2+][C@H](C)C(F)F)c1ccc(F)cc1O ZINC000389967370 711100856 /nfs/dbraw/zinc/10/08/56/711100856.db2.gz OKQHSHVDPZIHKM-RNFRBKRXSA-N 1 2 233.233 2.836 20 10 BFCDLO Oc1c(F)cc(F)cc1C[NH2+]C1CCCC1 ZINC000708389437 712191805 /nfs/dbraw/zinc/19/18/05/712191805.db2.gz KULIGZWTVZKGLE-UHFFFAOYSA-N 1 2 227.254 2.703 20 10 BFCDLO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)C1(C)CC1 ZINC000708392250 712192078 /nfs/dbraw/zinc/19/20/78/712192078.db2.gz ZOURMVOJFWMELF-QMMMGPOBSA-N 1 2 241.281 2.949 20 10 BFCDLO CC1(C)CC[C@@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC000708440644 712194982 /nfs/dbraw/zinc/19/49/82/712194982.db2.gz DFHRUWDOXHFBEH-NSHDSACASA-N 1 2 241.281 2.949 20 10 BFCDLO C[C@H]1CCC[C@@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC000708442667 712194987 /nfs/dbraw/zinc/19/49/87/712194987.db2.gz NZCPOPJWYHOAGF-UFBFGSQYSA-N 1 2 241.281 2.949 20 10 BFCDLO COc1ccccc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000708952118 712204445 /nfs/dbraw/zinc/20/44/45/712204445.db2.gz OJCZIEISJOPUBU-UHFFFAOYSA-N 1 2 231.299 2.647 20 10 BFCDLO C[N@H+](Cc1c(O)cc(F)cc1F)CC1CCC1 ZINC001140583453 959009103 /nfs/dbraw/zinc/00/91/03/959009103.db2.gz HNDDGKFHANWHKH-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO CC[C@@H]1CC[N@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585762 960444776 /nfs/dbraw/zinc/44/47/76/960444776.db2.gz TZTVTLMISAXTMA-SECBINFHSA-N 1 2 241.281 2.902 20 10 BFCDLO CC[C@@H]1CC[N@@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585762 960444777 /nfs/dbraw/zinc/44/47/77/960444777.db2.gz TZTVTLMISAXTMA-SECBINFHSA-N 1 2 241.281 2.902 20 10 BFCDLO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@@H](F)C1 ZINC001237121828 979820911 /nfs/dbraw/zinc/82/09/11/979820911.db2.gz PSFSRFRKUBRRFV-SSDOTTSWSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1ccc(F)c(Cl)c1C[N@H+]1CC[C@@H](F)C1 ZINC001237121828 979820912 /nfs/dbraw/zinc/82/09/12/979820912.db2.gz PSFSRFRKUBRRFV-SSDOTTSWSA-N 1 2 247.672 2.729 20 10 BFCDLO C[N@@H+](Cc1c(O)cc(F)cc1F)CC1CCC1 ZINC001140583453 959009090 /nfs/dbraw/zinc/00/90/90/959009090.db2.gz HNDDGKFHANWHKH-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO Cc1ccc(Nc2cccc(O)c2O)c(C)[nH+]1 ZINC001203375388 962369327 /nfs/dbraw/zinc/36/93/27/962369327.db2.gz XJBRJIDVSLGNQA-UHFFFAOYSA-N 1 2 230.267 2.853 20 10 BFCDLO CCC(F)(F)C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000697659542 964425987 /nfs/dbraw/zinc/42/59/87/964425987.db2.gz GVXADDSPVHWOJW-UHFFFAOYSA-N 1 2 242.313 2.888 20 10 BFCDLO Oc1c(C[NH2+]CC(F)F)ccc2ccccc21 ZINC001205715787 967801220 /nfs/dbraw/zinc/80/12/20/967801220.db2.gz ANTKWXJADSCBIR-UHFFFAOYSA-N 1 2 237.249 2.900 20 10 BFCDLO CC[N@H+](CC[C@@H]1CCOC1)c1ccc(OC)cc1 ZINC001327984990 972844864 /nfs/dbraw/zinc/84/48/64/972844864.db2.gz MKZNQFRZXFXNFH-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO CC[N@@H+](CC[C@@H]1CCOC1)c1ccc(OC)cc1 ZINC001327984990 972844870 /nfs/dbraw/zinc/84/48/70/972844870.db2.gz MKZNQFRZXFXNFH-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO Cc1cc(C)c(C[N@H+]2C[C@@H](F)[C@@H](F)C2)c(O)c1 ZINC001231841916 977761182 /nfs/dbraw/zinc/76/11/82/977761182.db2.gz GYEHKQICDMSDCY-TXEJJXNPSA-N 1 2 241.281 2.501 20 10 BFCDLO Cc1cc(C)c(C[N@@H+]2C[C@@H](F)[C@@H](F)C2)c(O)c1 ZINC001231841916 977761196 /nfs/dbraw/zinc/76/11/96/977761196.db2.gz GYEHKQICDMSDCY-TXEJJXNPSA-N 1 2 241.281 2.501 20 10 BFCDLO CC[N@H+](C)Cc1ccc(OC)c(Cl)c1O ZINC001236806019 979737858 /nfs/dbraw/zinc/73/78/58/979737858.db2.gz LCTNWJLUFQAKJN-UHFFFAOYSA-N 1 2 229.707 2.506 20 10 BFCDLO CC[N@@H+](C)Cc1ccc(OC)c(Cl)c1O ZINC001236806019 979737869 /nfs/dbraw/zinc/73/78/69/979737869.db2.gz LCTNWJLUFQAKJN-UHFFFAOYSA-N 1 2 229.707 2.506 20 10 BFCDLO C/C(=C\C=C\[NH3+])c1ccc(N(C)C)c(C)c1 ZINC001242241366 983452725 /nfs/dbraw/zinc/45/27/25/983452725.db2.gz GMQGDSODGYAMHH-MPEOSAONSA-N 1 2 216.328 2.937 20 10 BFCDLO CC(C)(CF)[NH2+]Cc1cccc(Cl)c1O ZINC000389882974 993766192 /nfs/dbraw/zinc/76/61/92/993766192.db2.gz PKMIXDXAUOFQJZ-UHFFFAOYSA-N 1 2 231.698 2.883 20 10 BFCDLO Cc1cc(Cl)cc(C[NH2+]CC(F)F)c1O ZINC000298136782 178064325 /nfs/dbraw/zinc/06/43/25/178064325.db2.gz QLVPGXVBTGRRMN-UHFFFAOYSA-N 1 2 235.661 2.709 20 10 BFCDLO CC1(C)C[C@H]1[NH2+]Cc1cccc(Cl)c1O ZINC000162829631 188048729 /nfs/dbraw/zinc/04/87/29/188048729.db2.gz VNAZXKBKIFJWAL-SNVBAGLBSA-N 1 2 225.719 2.934 20 10 BFCDLO CCC[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000191179482 169276415 /nfs/dbraw/zinc/27/64/15/169276415.db2.gz UBVNXBBAGIGFGS-ZETCQYMHSA-N 1 2 215.243 2.731 20 10 BFCDLO COC[C@H](C)[N@H+](C)Cc1cccc(Cl)c1O ZINC000162814646 384693780 /nfs/dbraw/zinc/69/37/80/384693780.db2.gz PVCYZYUSASWJJT-VIFPVBQESA-N 1 2 243.734 2.512 20 10 BFCDLO COC[C@H](C)[N@@H+](C)Cc1cccc(Cl)c1O ZINC000162814646 384693788 /nfs/dbraw/zinc/69/37/88/384693788.db2.gz PVCYZYUSASWJJT-VIFPVBQESA-N 1 2 243.734 2.512 20 10 BFCDLO CC[N@H+](CCCCOC)c1ccc(OC)cc1 ZINC000265381196 386334138 /nfs/dbraw/zinc/33/41/38/386334138.db2.gz CORKCDODVRVQKK-UHFFFAOYSA-N 1 2 237.343 2.948 20 10 BFCDLO CC[N@@H+](CCCCOC)c1ccc(OC)cc1 ZINC000265381196 386334140 /nfs/dbraw/zinc/33/41/40/386334140.db2.gz CORKCDODVRVQKK-UHFFFAOYSA-N 1 2 237.343 2.948 20 10 BFCDLO CC[C@@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000157755144 387870902 /nfs/dbraw/zinc/87/09/02/387870902.db2.gz UHVWRJLZPPXRMK-MRVPVSSYSA-N 1 2 213.708 2.934 20 10 BFCDLO Cc1cc(O)c(C[N@@H+]2CC[C@H]2C(F)F)cc1C ZINC000895430716 583669777 /nfs/dbraw/zinc/66/97/77/583669777.db2.gz GYUGFGZNLXBIAG-NSHDSACASA-N 1 2 241.281 2.848 20 10 BFCDLO Cc1cc(O)c(C[N@H+]2CC[C@H]2C(F)F)cc1C ZINC000895430716 583669778 /nfs/dbraw/zinc/66/97/78/583669778.db2.gz GYUGFGZNLXBIAG-NSHDSACASA-N 1 2 241.281 2.848 20 10 BFCDLO Cc1cccc(O)c1C[N@@H+]1CC[C@@H]1C(F)F ZINC000895432115 583670811 /nfs/dbraw/zinc/67/08/11/583670811.db2.gz UXMAAIJATDHHID-SNVBAGLBSA-N 1 2 227.254 2.540 20 10 BFCDLO Cc1cccc(O)c1C[N@H+]1CC[C@@H]1C(F)F ZINC000895432115 583670813 /nfs/dbraw/zinc/67/08/13/583670813.db2.gz UXMAAIJATDHHID-SNVBAGLBSA-N 1 2 227.254 2.540 20 10 BFCDLO CCc1cccc(C[N@@H+]2CC[C@@H]2C(F)F)c1O ZINC000895432410 583671488 /nfs/dbraw/zinc/67/14/88/583671488.db2.gz ZITTXCWKFJWBHC-LLVKDONJSA-N 1 2 241.281 2.794 20 10 BFCDLO CCc1cccc(C[N@H+]2CC[C@@H]2C(F)F)c1O ZINC000895432410 583671490 /nfs/dbraw/zinc/67/14/90/583671490.db2.gz ZITTXCWKFJWBHC-LLVKDONJSA-N 1 2 241.281 2.794 20 10 BFCDLO COc1cccc([C@H](C)[NH2+][C@H](C)C(F)F)c1O ZINC000883400973 583795146 /nfs/dbraw/zinc/79/51/46/583795146.db2.gz ZAVGGBPNPDQFLX-JGVFFNPUSA-N 1 2 245.269 2.705 20 10 BFCDLO C/C=C/C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000858536365 588962158 /nfs/dbraw/zinc/96/21/58/588962158.db2.gz HBCCJQNECQXNNB-MPJRPATESA-N 1 2 227.254 2.897 20 10 BFCDLO CN(C)c1ccc(/C=C\C[NH2+]CC(F)F)cc1 ZINC000839093598 585090503 /nfs/dbraw/zinc/09/05/03/585090503.db2.gz UQGSEJQLOSTOLZ-ARJAWSKDSA-N 1 2 240.297 2.621 20 10 BFCDLO Oc1c(Cl)cccc1C[NH+]1CC(C(F)F)C1 ZINC000839141244 585094374 /nfs/dbraw/zinc/09/43/74/585094374.db2.gz NEJJVMWPEXOMPT-UHFFFAOYSA-N 1 2 247.672 2.743 20 10 BFCDLO COc1ccc2c(c1)CCC[N@H+]2CCCCCO ZINC000744384795 585149667 /nfs/dbraw/zinc/14/96/67/585149667.db2.gz PJXINEBOVBYSQE-UHFFFAOYSA-N 1 2 249.354 2.610 20 10 BFCDLO COc1ccc2c(c1)CCC[N@@H+]2CCCCCO ZINC000744384795 585149668 /nfs/dbraw/zinc/14/96/68/585149668.db2.gz PJXINEBOVBYSQE-UHFFFAOYSA-N 1 2 249.354 2.610 20 10 BFCDLO C[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1cc(F)cc(F)c1O ZINC000756458559 585319945 /nfs/dbraw/zinc/31/99/45/585319945.db2.gz XMHVTCLHJRNETR-CIUDSAMLSA-N 1 2 241.281 2.977 20 10 BFCDLO COc1ccc2c(c1)CCC[N@H+]2CCC[C@@H](C)O ZINC000789304767 585939249 /nfs/dbraw/zinc/93/92/49/585939249.db2.gz DODCZQJDHIFTIM-GFCCVEGCSA-N 1 2 249.354 2.609 20 10 BFCDLO COc1ccc2c(c1)CCC[N@@H+]2CCC[C@@H](C)O ZINC000789304767 585939250 /nfs/dbraw/zinc/93/92/50/585939250.db2.gz DODCZQJDHIFTIM-GFCCVEGCSA-N 1 2 249.354 2.609 20 10 BFCDLO Cc1cc(C[N@H+](C)CC(F)F)ccc1N(C)C ZINC000815037441 586664342 /nfs/dbraw/zinc/66/43/42/586664342.db2.gz KPQGOJFZRWKZPV-UHFFFAOYSA-N 1 2 242.313 2.758 20 10 BFCDLO Cc1cc(C[N@@H+](C)CC(F)F)ccc1N(C)C ZINC000815037441 586664344 /nfs/dbraw/zinc/66/43/44/586664344.db2.gz KPQGOJFZRWKZPV-UHFFFAOYSA-N 1 2 242.313 2.758 20 10 BFCDLO C[C@H]([NH2+][C@H]1CC12CC2)c1cc(F)cc(F)c1O ZINC000818356727 586888772 /nfs/dbraw/zinc/88/87/72/586888772.db2.gz QLCOFHAZTBNNJB-CPCISQLKSA-N 1 2 239.265 2.874 20 10 BFCDLO CCOc1ccc([N@H+](CC)CC[C@@H](C)O)cc1 ZINC000828194290 587423818 /nfs/dbraw/zinc/42/38/18/587423818.db2.gz IIZGXXHSPBWAHR-GFCCVEGCSA-N 1 2 237.343 2.683 20 10 BFCDLO CCOc1ccc([N@@H+](CC)CC[C@@H](C)O)cc1 ZINC000828194290 587423819 /nfs/dbraw/zinc/42/38/19/587423819.db2.gz IIZGXXHSPBWAHR-GFCCVEGCSA-N 1 2 237.343 2.683 20 10 BFCDLO CCC1C[NH+](Cc2cccc(Cl)c2O)C1 ZINC000835075712 587780374 /nfs/dbraw/zinc/78/03/74/587780374.db2.gz YTRTZOPLIGEMSI-UHFFFAOYSA-N 1 2 225.719 2.887 20 10 BFCDLO COCCCC[N@H+](C)c1ccc(OC)cc1 ZINC000844355309 588187605 /nfs/dbraw/zinc/18/76/05/588187605.db2.gz MYMOVUUPLMDCGW-UHFFFAOYSA-N 1 2 223.316 2.558 20 10 BFCDLO COCCCC[N@@H+](C)c1ccc(OC)cc1 ZINC000844355309 588187607 /nfs/dbraw/zinc/18/76/07/588187607.db2.gz MYMOVUUPLMDCGW-UHFFFAOYSA-N 1 2 223.316 2.558 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2CCSC2)cc1 ZINC000845999263 588253127 /nfs/dbraw/zinc/25/31/27/588253127.db2.gz VISYYNMOGAJJMJ-LLVKDONJSA-N 1 2 237.368 2.885 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2CCSC2)cc1 ZINC000845999263 588253128 /nfs/dbraw/zinc/25/31/28/588253128.db2.gz VISYYNMOGAJJMJ-LLVKDONJSA-N 1 2 237.368 2.885 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2C[C@@H]2C)cc1 ZINC000845997659 588253233 /nfs/dbraw/zinc/25/32/33/588253233.db2.gz BDUKHMMMYBLART-QWRGUYRKSA-N 1 2 205.301 2.787 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2C[C@@H]2C)cc1 ZINC000845997659 588253234 /nfs/dbraw/zinc/25/32/34/588253234.db2.gz BDUKHMMMYBLART-QWRGUYRKSA-N 1 2 205.301 2.787 20 10 BFCDLO Cc1c[nH+]cc(NCc2ccccc2O)c1 ZINC000117871737 589136588 /nfs/dbraw/zinc/13/65/88/589136588.db2.gz YTZTWSPEPQMIJV-UHFFFAOYSA-N 1 2 214.268 2.708 20 10 BFCDLO C[N@@H+](Cc1ccc(F)c(F)c1O)CC1CC1 ZINC000876622875 590222871 /nfs/dbraw/zinc/22/28/71/590222871.db2.gz PDPMVWKNGNAIDB-UHFFFAOYSA-N 1 2 227.254 2.512 20 10 BFCDLO C[N@H+](Cc1ccc(F)c(F)c1O)CC1CC1 ZINC000876622875 590222872 /nfs/dbraw/zinc/22/28/72/590222872.db2.gz PDPMVWKNGNAIDB-UHFFFAOYSA-N 1 2 227.254 2.512 20 10 BFCDLO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(F)c(F)c1O ZINC000877486368 590339334 /nfs/dbraw/zinc/33/93/34/590339334.db2.gz IMWNIRKESUWPCY-HTQZYQBOSA-N 1 2 227.254 2.653 20 10 BFCDLO CCC1C[NH+](Cc2ccc(F)c(F)c2O)C1 ZINC000877579575 590364429 /nfs/dbraw/zinc/36/44/29/590364429.db2.gz WAQWBXZREFUHIE-UHFFFAOYSA-N 1 2 227.254 2.512 20 10 BFCDLO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C(F)F ZINC000883407329 591651520 /nfs/dbraw/zinc/65/15/20/591651520.db2.gz RTZSIROTQJWSGY-QMMMGPOBSA-N 1 2 246.276 2.635 20 10 BFCDLO Cc1cccc(C[NH2+]C2(C(F)F)CC2)c1O ZINC000309726747 632661661 /nfs/dbraw/zinc/66/16/61/632661661.db2.gz YHBOUJSYODONIP-UHFFFAOYSA-N 1 2 227.254 2.588 20 10 BFCDLO Oc1ccc(F)cc1CNc1cccc[nH+]1 ZINC000083349258 643437726 /nfs/dbraw/zinc/43/77/26/643437726.db2.gz HFQITWQKOBMMIW-UHFFFAOYSA-N 1 2 218.231 2.538 20 10 BFCDLO CC[NH+](CC)Cc1cc(F)cc(F)c1O ZINC000708399958 712192326 /nfs/dbraw/zinc/19/23/26/712192326.db2.gz MMHYMFHCIPPYHZ-UHFFFAOYSA-N 1 2 215.243 2.512 20 10 BFCDLO C[C@H]([NH2+]CC(C)(F)F)c1ccc(F)cc1O ZINC000378859717 712363204 /nfs/dbraw/zinc/36/32/04/712363204.db2.gz NSZKQPKBTDLCFN-ZETCQYMHSA-N 1 2 233.233 2.837 20 10 BFCDLO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)C(F)F ZINC000389942058 711099733 /nfs/dbraw/zinc/09/97/33/711099733.db2.gz NNEFIJLZXBBFIK-LURJTMIESA-N 1 2 235.661 2.789 20 10 BFCDLO C[C@@H]1CCC[N@@H+]1Cc1ccc(F)c(F)c1O ZINC000703447871 712076083 /nfs/dbraw/zinc/07/60/83/712076083.db2.gz MOBWFWVUUGTRCG-MRVPVSSYSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@@H]1CCC[N@H+]1Cc1ccc(F)c(F)c1O ZINC000703447871 712076086 /nfs/dbraw/zinc/07/60/86/712076086.db2.gz MOBWFWVUUGTRCG-MRVPVSSYSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@@H](F)CC[NH2+]Cc1cccc(Cl)c1O ZINC000705670757 712135328 /nfs/dbraw/zinc/13/53/28/712135328.db2.gz WIJZAZHIQGQOGQ-MRVPVSSYSA-N 1 2 231.698 2.883 20 10 BFCDLO CCC(CC)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708394381 712192780 /nfs/dbraw/zinc/19/27/80/712192780.db2.gz YBNUFPPUIWLGMC-UHFFFAOYSA-N 1 2 229.270 2.949 20 10 BFCDLO Oc1c(F)cc(F)cc1C[NH2+]C1(C2CC2)CC1 ZINC000708518008 712211940 /nfs/dbraw/zinc/21/19/40/712211940.db2.gz XTMZOMNOOLETCI-UHFFFAOYSA-N 1 2 239.265 2.703 20 10 BFCDLO CC(C)C1([NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000708556777 712212699 /nfs/dbraw/zinc/21/26/99/712212699.db2.gz XXQAEMVJMTYJGG-UHFFFAOYSA-N 1 2 241.281 2.949 20 10 BFCDLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cccc(Cl)c1O ZINC001231909316 977791169 /nfs/dbraw/zinc/79/11/69/977791169.db2.gz IRVMICQNQAIGAL-PSASIEDQSA-N 1 2 243.709 2.978 20 10 BFCDLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cccc(Cl)c1O ZINC001231909316 977791182 /nfs/dbraw/zinc/79/11/82/977791182.db2.gz IRVMICQNQAIGAL-PSASIEDQSA-N 1 2 243.709 2.978 20 10 BFCDLO C[C@@H]1CC[N@@H+]1Cc1c(O)ccc(F)c1Cl ZINC001237122734 979821128 /nfs/dbraw/zinc/82/11/28/979821128.db2.gz XSSMFLUSJPNENH-SSDOTTSWSA-N 1 2 229.682 2.779 20 10 BFCDLO C[C@@H]1CC[N@H+]1Cc1c(O)ccc(F)c1Cl ZINC001237122734 979821138 /nfs/dbraw/zinc/82/11/38/979821138.db2.gz XSSMFLUSJPNENH-SSDOTTSWSA-N 1 2 229.682 2.779 20 10 BFCDLO CC1([NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC000309121893 959623188 /nfs/dbraw/zinc/62/31/88/959623188.db2.gz OEYLMZYGBJZTPC-UHFFFAOYSA-N 1 2 229.682 2.827 20 10 BFCDLO Oc1cccc(Nc2cccc3[nH+]c[nH]c32)c1O ZINC001213032214 964584224 /nfs/dbraw/zinc/58/42/24/964584224.db2.gz YDNULKYAUCAECR-UHFFFAOYSA-N 1 2 241.250 2.718 20 10 BFCDLO CC1(C[NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000224898553 965199782 /nfs/dbraw/zinc/19/97/82/965199782.db2.gz XQEYDBQNJJCOSQ-UHFFFAOYSA-N 1 2 225.719 2.935 20 10 BFCDLO Nc1ccc(Nc2ccn3cc[nH+]c3c2)cc1 ZINC001204982804 967273987 /nfs/dbraw/zinc/27/39/87/967273987.db2.gz JETQSVPALSJPEO-UHFFFAOYSA-N 1 2 224.267 2.660 20 10 BFCDLO Cc1c[nH+]cc(NCc2ccc(O)c(O)c2)c1C ZINC001169995336 969978417 /nfs/dbraw/zinc/97/84/17/969978417.db2.gz ZRQKSAPUXOQGOB-UHFFFAOYSA-N 1 2 244.294 2.722 20 10 BFCDLO Cc1ccc(N(C)c2ccc(N)cc2)[nH+]c1 ZINC001211012561 970116704 /nfs/dbraw/zinc/11/67/04/970116704.db2.gz JDFJFFXJDPOBSH-UHFFFAOYSA-N 1 2 213.284 2.740 20 10 BFCDLO C[C@H]1CC[N@@H+]1Cc1cccc(Cl)c1O ZINC001231910204 977790681 /nfs/dbraw/zinc/79/06/81/977790681.db2.gz JTLJSRJJBDDQHK-QMMMGPOBSA-N 1 2 211.692 2.640 20 10 BFCDLO C[C@H]1CC[N@H+]1Cc1cccc(Cl)c1O ZINC001231910204 977790689 /nfs/dbraw/zinc/79/06/89/977790689.db2.gz JTLJSRJJBDDQHK-QMMMGPOBSA-N 1 2 211.692 2.640 20 10 BFCDLO Cn1ccc2ccc(-c3ccc[nH+]c3N)cc21 ZINC001240573407 981485754 /nfs/dbraw/zinc/48/57/54/981485754.db2.gz AEYRRKTXVAYQGR-UHFFFAOYSA-N 1 2 223.279 2.823 20 10 BFCDLO Cn1c[nH+]cc1C1=CCN(c2ccccc2)CC1 ZINC001241345572 982502922 /nfs/dbraw/zinc/50/29/22/982502922.db2.gz JXODUNYTMYZYKC-UHFFFAOYSA-N 1 2 239.322 2.714 20 10 BFCDLO Cn1ccc2c1cccc2-c1c[nH+]cn1C ZINC001241821936 983075485 /nfs/dbraw/zinc/07/54/85/983075485.db2.gz LLMHOOWZYNSQQU-UHFFFAOYSA-N 1 2 211.268 2.579 20 10 BFCDLO Cc1cc(NCc2ccc(N)cc2)c[nH+]c1C ZINC001579635842 986154892 /nfs/dbraw/zinc/15/48/92/986154892.db2.gz LMYCCQXCRIDGPT-UHFFFAOYSA-N 1 2 227.311 2.893 20 10 BFCDLO Oc1c(F)cccc1C[N@H+](CC1CC1)C1CC1 ZINC001138129421 990887128 /nfs/dbraw/zinc/88/71/28/990887128.db2.gz BYUYITXIQDJCNB-UHFFFAOYSA-N 1 2 235.302 2.906 20 10 BFCDLO Oc1c(F)cccc1C[N@@H+](CC1CC1)C1CC1 ZINC001138129421 990887133 /nfs/dbraw/zinc/88/71/33/990887133.db2.gz BYUYITXIQDJCNB-UHFFFAOYSA-N 1 2 235.302 2.906 20 10 BFCDLO Cc1ccc(C)c(C[NH+]2C[C@@H](F)[C@H](F)C2)c1O ZINC001140178304 991553207 /nfs/dbraw/zinc/55/32/07/991553207.db2.gz HLXFSTFBJGQRKE-VXGBXAGGSA-N 1 2 241.281 2.501 20 10 BFCDLO CCN(CC)c1ccc(C[NH2+]CC(F)F)cc1 ZINC000136574748 398342763 /nfs/dbraw/zinc/34/27/63/398342763.db2.gz SUYPKVDLHCVXSA-UHFFFAOYSA-N 1 2 242.313 2.888 20 10 BFCDLO CC[N@H+](CCCCCO)c1ccc(OC)cc1 ZINC000146956857 345993051 /nfs/dbraw/zinc/99/30/51/345993051.db2.gz DZFASAHFZFTUJL-UHFFFAOYSA-N 1 2 237.343 2.684 20 10 BFCDLO CC[N@@H+](CCCCCO)c1ccc(OC)cc1 ZINC000146956857 345993054 /nfs/dbraw/zinc/99/30/54/345993054.db2.gz DZFASAHFZFTUJL-UHFFFAOYSA-N 1 2 237.343 2.684 20 10 BFCDLO CCC[N@H+](CC)Cc1cccc(F)c1O ZINC000165411652 169129836 /nfs/dbraw/zinc/12/98/36/169129836.db2.gz WOVIDNFASMDNEG-UHFFFAOYSA-N 1 2 211.280 2.763 20 10 BFCDLO CCC[N@@H+](CC)Cc1cccc(F)c1O ZINC000165411652 169129837 /nfs/dbraw/zinc/12/98/37/169129837.db2.gz WOVIDNFASMDNEG-UHFFFAOYSA-N 1 2 211.280 2.763 20 10 BFCDLO Oc1ccccc1C[N@H+](CC(F)F)C1CC1 ZINC000179572874 183302272 /nfs/dbraw/zinc/30/22/72/183302272.db2.gz WQHDTNUEVRGLJJ-UHFFFAOYSA-N 1 2 227.254 2.622 20 10 BFCDLO Oc1ccccc1C[N@@H+](CC(F)F)C1CC1 ZINC000179572874 183302274 /nfs/dbraw/zinc/30/22/74/183302274.db2.gz WQHDTNUEVRGLJJ-UHFFFAOYSA-N 1 2 227.254 2.622 20 10 BFCDLO C[C@@H]([NH2+]Cc1cccc(Cl)c1O)C1CC1 ZINC000162825568 387842750 /nfs/dbraw/zinc/84/27/50/387842750.db2.gz AHUOEJBWRLGITQ-MRVPVSSYSA-N 1 2 225.719 2.934 20 10 BFCDLO C[C@H]([NH2+]Cc1cccc(Cl)c1O)C1CC1 ZINC000162825456 397958924 /nfs/dbraw/zinc/95/89/24/397958924.db2.gz AHUOEJBWRLGITQ-QMMMGPOBSA-N 1 2 225.719 2.934 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+][C@@H]1CCSC1 ZINC000224889695 398103473 /nfs/dbraw/zinc/10/34/73/398103473.db2.gz KGEYVHPSDNUJGW-SECBINFHSA-N 1 2 243.759 2.641 20 10 BFCDLO CC(C)C[NH2+]Cc1cccc(Cl)c1O ZINC000157754611 167010081 /nfs/dbraw/zinc/01/00/81/167010081.db2.gz ZTLJVVLMKODGIY-UHFFFAOYSA-N 1 2 213.708 2.791 20 10 BFCDLO CC(C)[NH2+]Cc1cccc(Br)c1O ZINC000042411502 167118227 /nfs/dbraw/zinc/11/82/27/167118227.db2.gz MHLALCUURNGDFQ-UHFFFAOYSA-N 1 2 244.132 2.653 20 10 BFCDLO COc1ccc(C[N@@H+]2Cc3cccc(O)c3C2)o1 ZINC000895784627 583727178 /nfs/dbraw/zinc/72/71/78/583727178.db2.gz JVVUUAMELWSADE-UHFFFAOYSA-N 1 2 245.278 2.510 20 10 BFCDLO COc1ccc(C[N@H+]2Cc3cccc(O)c3C2)o1 ZINC000895784627 583727181 /nfs/dbraw/zinc/72/71/81/583727181.db2.gz JVVUUAMELWSADE-UHFFFAOYSA-N 1 2 245.278 2.510 20 10 BFCDLO COc1ccc(N(C)Cc2[nH]cc(C)[nH+]2)cc1F ZINC000862306831 583960181 /nfs/dbraw/zinc/96/01/81/583960181.db2.gz PLDRAONMWUXSQR-UHFFFAOYSA-N 1 2 249.289 2.502 20 10 BFCDLO C/C=C\C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000858536368 588962458 /nfs/dbraw/zinc/96/24/58/588962458.db2.gz HBCCJQNECQXNNB-TUUFMJSCSA-N 1 2 227.254 2.897 20 10 BFCDLO CC(C)c1nc(NCc2ccccc2O)cc[nH+]1 ZINC000732008495 584932821 /nfs/dbraw/zinc/93/28/21/584932821.db2.gz ANKCRXRQDAMJQZ-UHFFFAOYSA-N 1 2 243.310 2.918 20 10 BFCDLO CC[N@H+](C[C@H]1CCOC1)c1ccc(OC)cc1 ZINC000746108802 585163097 /nfs/dbraw/zinc/16/30/97/585163097.db2.gz CZBQXLRCQIDAJC-GFCCVEGCSA-N 1 2 235.327 2.558 20 10 BFCDLO CC[N@@H+](C[C@H]1CCOC1)c1ccc(OC)cc1 ZINC000746108802 585163098 /nfs/dbraw/zinc/16/30/98/585163098.db2.gz CZBQXLRCQIDAJC-GFCCVEGCSA-N 1 2 235.327 2.558 20 10 BFCDLO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](F)C1 ZINC000824571950 587277110 /nfs/dbraw/zinc/27/71/10/587277110.db2.gz SNQCVDHWXDPWSS-ZETCQYMHSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](F)C1 ZINC000824571950 587277112 /nfs/dbraw/zinc/27/71/12/587277112.db2.gz SNQCVDHWXDPWSS-ZETCQYMHSA-N 1 2 247.672 2.729 20 10 BFCDLO COc1cccc(CNc2c[nH+]cc(C)c2)c1O ZINC000119634826 589315464 /nfs/dbraw/zinc/31/54/64/589315464.db2.gz KPEQASLHILCMMI-UHFFFAOYSA-N 1 2 244.294 2.716 20 10 BFCDLO Cc1ccc(C[N@@H+]2CCC(F)(F)C2)c(O)c1 ZINC000877140798 590291561 /nfs/dbraw/zinc/29/15/61/590291561.db2.gz LMJBRGDSHBTCGE-UHFFFAOYSA-N 1 2 227.254 2.542 20 10 BFCDLO Cc1ccc(C[N@H+]2CCC(F)(F)C2)c(O)c1 ZINC000877140798 590291563 /nfs/dbraw/zinc/29/15/63/590291563.db2.gz LMJBRGDSHBTCGE-UHFFFAOYSA-N 1 2 227.254 2.542 20 10 BFCDLO CC1(C)C[NH+](Cc2ccc(F)c(F)c2O)C1 ZINC000877717761 590399030 /nfs/dbraw/zinc/39/90/30/590399030.db2.gz PTJYAGRZPLWSKO-UHFFFAOYSA-N 1 2 227.254 2.512 20 10 BFCDLO CC[N@H+](C[C@H]1CCO[C@H]1C)c1ccc(OC)cc1 ZINC000878219345 590525812 /nfs/dbraw/zinc/52/58/12/590525812.db2.gz KDXLQYTYLQYUBC-QWHCGFSZSA-N 1 2 249.354 2.947 20 10 BFCDLO CC[N@@H+](C[C@H]1CCO[C@H]1C)c1ccc(OC)cc1 ZINC000878219345 590525814 /nfs/dbraw/zinc/52/58/14/590525814.db2.gz KDXLQYTYLQYUBC-QWHCGFSZSA-N 1 2 249.354 2.947 20 10 BFCDLO CC[N@H+](C[C@@H]1CCO[C@H]1C)c1ccc(OC)cc1 ZINC000878219346 590526153 /nfs/dbraw/zinc/52/61/53/590526153.db2.gz KDXLQYTYLQYUBC-STQMWFEESA-N 1 2 249.354 2.947 20 10 BFCDLO CC[N@@H+](C[C@@H]1CCO[C@H]1C)c1ccc(OC)cc1 ZINC000878219346 590526155 /nfs/dbraw/zinc/52/61/55/590526155.db2.gz KDXLQYTYLQYUBC-STQMWFEESA-N 1 2 249.354 2.947 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2CCO[C@H]2C)cc1 ZINC000878801342 590624843 /nfs/dbraw/zinc/62/48/43/590624843.db2.gz JVRKSERFYAOWHH-NWDGAFQWSA-N 1 2 235.327 2.556 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2CCO[C@H]2C)cc1 ZINC000878801342 590624844 /nfs/dbraw/zinc/62/48/44/590624844.db2.gz JVRKSERFYAOWHH-NWDGAFQWSA-N 1 2 235.327 2.556 20 10 BFCDLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1c(O)cccc1F ZINC000886607135 592273619 /nfs/dbraw/zinc/27/36/19/592273619.db2.gz LMDBFPUVMTYJIU-SSDOTTSWSA-N 1 2 245.244 2.980 20 10 BFCDLO C[C@H]([NH2+][C@@H](C)C(F)F)c1c(O)cccc1F ZINC000886651966 592290152 /nfs/dbraw/zinc/29/01/52/592290152.db2.gz WCKHBXBHJVUGRH-BQBZGAKWSA-N 1 2 233.233 2.836 20 10 BFCDLO C[C@H]1CC[C@@H]1[NH2+]Cc1cccc(Cl)c1O ZINC000309063276 631830450 /nfs/dbraw/zinc/83/04/50/631830450.db2.gz XMTQRSYWHOSUMP-KWQFWETISA-N 1 2 225.719 2.934 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]Cc1ccccn1 ZINC000161607657 632104227 /nfs/dbraw/zinc/10/42/27/632104227.db2.gz MRBAJCWFQAHQPE-UHFFFAOYSA-N 1 2 248.713 2.730 20 10 BFCDLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1ccccc1O ZINC000309453396 633920684 /nfs/dbraw/zinc/92/06/84/633920684.db2.gz NAJUXHQUPDDSDX-MRVPVSSYSA-N 1 2 227.254 2.841 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]C1CC=CC1 ZINC000162703835 634297018 /nfs/dbraw/zinc/29/70/18/634297018.db2.gz LREZSIWADWPNRG-UHFFFAOYSA-N 1 2 223.703 2.854 20 10 BFCDLO C[C@@H]([NH2+][C@@H](C)C(F)F)c1cc(F)ccc1O ZINC000389967805 712692709 /nfs/dbraw/zinc/69/27/09/712692709.db2.gz OZOXKCGZAXSJDU-RQJHMYQMSA-N 1 2 233.233 2.836 20 10 BFCDLO COc1ccc(C[NH2+][C@@H](C)C(F)F)cc1C ZINC000389928583 711098848 /nfs/dbraw/zinc/09/88/48/711098848.db2.gz GKFCLGUPOXRQPI-VIFPVBQESA-N 1 2 229.270 2.747 20 10 BFCDLO C[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000703447868 712076174 /nfs/dbraw/zinc/07/61/74/712076174.db2.gz MNABAKRCWRDQRK-MRVPVSSYSA-N 1 2 227.254 2.512 20 10 BFCDLO C[C@@H]1CC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000703447868 712076176 /nfs/dbraw/zinc/07/61/76/712076176.db2.gz MNABAKRCWRDQRK-MRVPVSSYSA-N 1 2 227.254 2.512 20 10 BFCDLO Oc1c(C[NH+]2CCC(F)CC2)ccc(F)c1F ZINC000703610347 712081174 /nfs/dbraw/zinc/08/11/74/712081174.db2.gz MVGBDMLJHLBDLI-UHFFFAOYSA-N 1 2 245.244 2.604 20 10 BFCDLO CCC[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000708399232 712192866 /nfs/dbraw/zinc/19/28/66/712192866.db2.gz KDZYMRWYYDVQER-UHFFFAOYSA-N 1 2 215.243 2.512 20 10 BFCDLO CCC[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000708399232 712192868 /nfs/dbraw/zinc/19/28/68/712192868.db2.gz KDZYMRWYYDVQER-UHFFFAOYSA-N 1 2 215.243 2.512 20 10 BFCDLO CCC(F)(F)C[NH2+]Cc1cc(F)ccc1O ZINC000697627273 964355412 /nfs/dbraw/zinc/35/54/12/964355412.db2.gz MFEIOMXBBJZENR-UHFFFAOYSA-N 1 2 233.233 2.666 20 10 BFCDLO CN(c1ccc(N)cc1)c1ccn2cc[nH+]c2c1 ZINC001204998099 967283199 /nfs/dbraw/zinc/28/31/99/967283199.db2.gz UNDNZUMSUVWPEY-UHFFFAOYSA-N 1 2 238.294 2.684 20 10 BFCDLO CCC(F)(F)C[N@H+](C)Cc1ccccc1O ZINC000693746422 967444797 /nfs/dbraw/zinc/44/47/97/967444797.db2.gz YQBYCYOPWPAMBH-UHFFFAOYSA-N 1 2 229.270 2.869 20 10 BFCDLO CCC(F)(F)C[N@@H+](C)Cc1ccccc1O ZINC000693746422 967444808 /nfs/dbraw/zinc/44/48/08/967444808.db2.gz YQBYCYOPWPAMBH-UHFFFAOYSA-N 1 2 229.270 2.869 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]C/C=C\Cl ZINC001207739010 968871160 /nfs/dbraw/zinc/87/11/60/968871160.db2.gz UMSUHFWRLIDRMJ-DJWKRKHSSA-N 1 2 232.110 2.888 20 10 BFCDLO C[C@H]1CC[N@@H+]1Cc1c(O)ccc(F)c1Cl ZINC001237122735 979821490 /nfs/dbraw/zinc/82/14/90/979821490.db2.gz XSSMFLUSJPNENH-ZETCQYMHSA-N 1 2 229.682 2.779 20 10 BFCDLO C[C@H]1CC[N@H+]1Cc1c(O)ccc(F)c1Cl ZINC001237122735 979821492 /nfs/dbraw/zinc/82/14/92/979821492.db2.gz XSSMFLUSJPNENH-ZETCQYMHSA-N 1 2 229.682 2.779 20 10 BFCDLO Cc1n[nH]c(C)c1-c1[nH+]ccc2c1ccn2C ZINC001240123570 981118521 /nfs/dbraw/zinc/11/85/21/981118521.db2.gz YVBXBLKQJJOJBP-UHFFFAOYSA-N 1 2 226.283 2.580 20 10 BFCDLO Cn1ccc2c1nccc2-c1ccc2[nH+]ccn2c1 ZINC001240220753 981173298 /nfs/dbraw/zinc/17/32/98/981173298.db2.gz AFRZYPKWFBZECA-UHFFFAOYSA-N 1 2 248.289 2.888 20 10 BFCDLO Cc1cc(C[N@@H+](C)Cc2ccccc2O)ns1 ZINC001249588793 989317675 /nfs/dbraw/zinc/31/76/75/989317675.db2.gz NALQWMGPLUZNBP-UHFFFAOYSA-N 1 2 248.351 2.789 20 10 BFCDLO Cc1cc(C[N@H+](C)Cc2ccccc2O)ns1 ZINC001249588793 989317688 /nfs/dbraw/zinc/31/76/88/989317688.db2.gz NALQWMGPLUZNBP-UHFFFAOYSA-N 1 2 248.351 2.789 20 10 BFCDLO C[C@]1(F)CCC[N@H+](Cc2c(O)cccc2F)C1 ZINC001137833110 990857369 /nfs/dbraw/zinc/85/73/69/990857369.db2.gz SZJSUMZGEPCNAB-ZDUSSCGKSA-N 1 2 241.281 2.855 20 10 BFCDLO C[C@]1(F)CCC[N@@H+](Cc2c(O)cccc2F)C1 ZINC001137833110 990857375 /nfs/dbraw/zinc/85/73/75/990857375.db2.gz SZJSUMZGEPCNAB-ZDUSSCGKSA-N 1 2 241.281 2.855 20 10 BFCDLO C[C@H]1CCC[N@@H+]1Cc1c(F)ccc(F)c1O ZINC001139685486 991313341 /nfs/dbraw/zinc/31/33/41/991313341.db2.gz LMMFERZSVWZYBE-QMMMGPOBSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@H]1CCC[N@H+]1Cc1c(F)ccc(F)c1O ZINC001139685486 991313354 /nfs/dbraw/zinc/31/33/54/991313354.db2.gz LMMFERZSVWZYBE-QMMMGPOBSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@@H]([NH2+]Cc1ccc(Cl)cc1O)C(F)F ZINC001560983221 991676391 /nfs/dbraw/zinc/67/63/91/991676391.db2.gz SIQZEGNNYZWQLF-ZCFIWIBFSA-N 1 2 235.661 2.789 20 10 BFCDLO C[C@H]([NH2+]Cc1ccc(Cl)cc1O)C(F)F ZINC001560983220 991677320 /nfs/dbraw/zinc/67/73/20/991677320.db2.gz SIQZEGNNYZWQLF-LURJTMIESA-N 1 2 235.661 2.789 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]C1CC(F)(F)C1 ZINC000277516809 187240069 /nfs/dbraw/zinc/24/00/69/187240069.db2.gz OXWAIKXCFCQAAC-UHFFFAOYSA-N 1 2 247.672 2.933 20 10 BFCDLO CC(C)C[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000191180315 355337847 /nfs/dbraw/zinc/33/78/47/355337847.db2.gz LJGYSGPZVMTFJH-QMMMGPOBSA-N 1 2 229.270 2.977 20 10 BFCDLO C[N@H+](Cc1cccc(F)c1O)C1CCCC1 ZINC000165408709 385119815 /nfs/dbraw/zinc/11/98/15/385119815.db2.gz WSLDBLMKIUDIKN-UHFFFAOYSA-N 1 2 223.291 2.906 20 10 BFCDLO C[N@@H+](Cc1cccc(F)c1O)C1CCCC1 ZINC000165408709 385119822 /nfs/dbraw/zinc/11/98/22/385119822.db2.gz WSLDBLMKIUDIKN-UHFFFAOYSA-N 1 2 223.291 2.906 20 10 BFCDLO CC(C)[N@H+](C)Cc1cccc(Cl)c1O ZINC000157753126 385520680 /nfs/dbraw/zinc/52/06/80/385520680.db2.gz UJHIEBCIYSLBPT-UHFFFAOYSA-N 1 2 213.708 2.886 20 10 BFCDLO CC(C)[N@@H+](C)Cc1cccc(Cl)c1O ZINC000157753126 385520682 /nfs/dbraw/zinc/52/06/82/385520682.db2.gz UJHIEBCIYSLBPT-UHFFFAOYSA-N 1 2 213.708 2.886 20 10 BFCDLO c1csc(SCCCn2cc[nH+]c2)n1 ZINC000180435923 385523137 /nfs/dbraw/zinc/52/31/37/385523137.db2.gz AWJHIICOIPWJQI-UHFFFAOYSA-N 1 2 225.342 2.522 20 10 BFCDLO C[C@H]([NH2+]C[C@@H]1C[C@H]1C)c1ccc(F)c(F)c1O ZINC000276928938 386392048 /nfs/dbraw/zinc/39/20/48/386392048.db2.gz NYDGXKMSCKXDRL-VGMNWLOBSA-N 1 2 241.281 2.977 20 10 BFCDLO CSC[C@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000162658887 388252048 /nfs/dbraw/zinc/25/20/48/388252048.db2.gz YBZFNWCYZYBNIB-QMMMGPOBSA-N 1 2 245.775 2.887 20 10 BFCDLO COCC[C@@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000162834807 174383945 /nfs/dbraw/zinc/38/39/45/174383945.db2.gz ONRAIBFUNFJZFV-SECBINFHSA-N 1 2 243.734 2.560 20 10 BFCDLO C[N@H+](CCC1CC1)Cc1cc(F)cc(F)c1O ZINC000894095017 583299913 /nfs/dbraw/zinc/29/99/13/583299913.db2.gz OAYVVCJUEIDFSO-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO C[N@@H+](CCC1CC1)Cc1cc(F)cc(F)c1O ZINC000894095017 583299915 /nfs/dbraw/zinc/29/99/15/583299915.db2.gz OAYVVCJUEIDFSO-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ccc(F)c(F)c1O ZINC000894861665 583535476 /nfs/dbraw/zinc/53/54/76/583535476.db2.gz LPLPJDNQLLDPQG-JGVFFNPUSA-N 1 2 227.254 2.511 20 10 BFCDLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ccc(F)c(F)c1O ZINC000894861665 583535478 /nfs/dbraw/zinc/53/54/78/583535478.db2.gz LPLPJDNQLLDPQG-JGVFFNPUSA-N 1 2 227.254 2.511 20 10 BFCDLO c1csc(Sc2[nH+]cnc3[nH]ccc32)n1 ZINC000726967065 583576259 /nfs/dbraw/zinc/57/62/59/583576259.db2.gz JTBNDTOMDUADGS-UHFFFAOYSA-N 1 2 234.309 2.566 20 10 BFCDLO C/C=C/C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000858536367 588962322 /nfs/dbraw/zinc/96/23/22/588962322.db2.gz HBCCJQNECQXNNB-RTMURIBGSA-N 1 2 227.254 2.897 20 10 BFCDLO COc1ccc2c(c1)CCC[N@H+]2CCC(C)(C)O ZINC000749828823 585207219 /nfs/dbraw/zinc/20/72/19/585207219.db2.gz OJEOJPAWCGOGIK-UHFFFAOYSA-N 1 2 249.354 2.609 20 10 BFCDLO COc1ccc2c(c1)CCC[N@@H+]2CCC(C)(C)O ZINC000749828823 585207220 /nfs/dbraw/zinc/20/72/20/585207220.db2.gz OJEOJPAWCGOGIK-UHFFFAOYSA-N 1 2 249.354 2.609 20 10 BFCDLO CN(C)c1ccc(CNc2cc(F)cc[nH+]2)cc1 ZINC000780906093 585786091 /nfs/dbraw/zinc/78/60/91/585786091.db2.gz IVEXSMVBHXUTAK-UHFFFAOYSA-N 1 2 245.301 2.899 20 10 BFCDLO CC1C[NH+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000802651621 586308089 /nfs/dbraw/zinc/30/80/89/586308089.db2.gz UEBIVSKCLCPUJT-UHFFFAOYSA-N 1 2 229.682 2.636 20 10 BFCDLO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)C(F)F ZINC000824510719 587272607 /nfs/dbraw/zinc/27/26/07/587272607.db2.gz ZDCCLOATNDKYAV-LBPRGKRZSA-N 1 2 242.313 2.886 20 10 BFCDLO Cc1cc(O)c(C[NH2+]CC(F)F)cc1Cl ZINC000825893092 587344234 /nfs/dbraw/zinc/34/42/34/587344234.db2.gz OMPLSZAGAKJAGM-UHFFFAOYSA-N 1 2 235.661 2.709 20 10 BFCDLO CCOc1ccc([N@H+](CC)CC[C@H](C)O)cc1 ZINC000828194291 587423483 /nfs/dbraw/zinc/42/34/83/587423483.db2.gz IIZGXXHSPBWAHR-LBPRGKRZSA-N 1 2 237.343 2.683 20 10 BFCDLO CCOc1ccc([N@@H+](CC)CC[C@H](C)O)cc1 ZINC000828194291 587423484 /nfs/dbraw/zinc/42/34/84/587423484.db2.gz IIZGXXHSPBWAHR-LBPRGKRZSA-N 1 2 237.343 2.683 20 10 BFCDLO COc1ccc2c(c1)CCCC[N@H+]2CC[C@H](C)O ZINC000828569773 587451336 /nfs/dbraw/zinc/45/13/36/587451336.db2.gz UJROBKKGLNOCNI-LBPRGKRZSA-N 1 2 249.354 2.609 20 10 BFCDLO COc1ccc2c(c1)CCCC[N@@H+]2CC[C@H](C)O ZINC000828569773 587451338 /nfs/dbraw/zinc/45/13/38/587451338.db2.gz UJROBKKGLNOCNI-LBPRGKRZSA-N 1 2 249.354 2.609 20 10 BFCDLO COCCC[N@H+](CC1CC1)c1ccc(OC)cc1 ZINC000831582747 587621034 /nfs/dbraw/zinc/62/10/34/587621034.db2.gz FNPPJRCLBQEXMP-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO COCCC[N@@H+](CC1CC1)c1ccc(OC)cc1 ZINC000831582747 587621036 /nfs/dbraw/zinc/62/10/36/587621036.db2.gz FNPPJRCLBQEXMP-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1ccc([N@H+](C[C@@H](C)CO)CC2CC2)cc1 ZINC000831587998 587621322 /nfs/dbraw/zinc/62/13/22/587621322.db2.gz QIEIJGZJNWDPQO-GFCCVEGCSA-N 1 2 249.354 2.540 20 10 BFCDLO COc1ccc([N@@H+](C[C@@H](C)CO)CC2CC2)cc1 ZINC000831587998 587621324 /nfs/dbraw/zinc/62/13/24/587621324.db2.gz QIEIJGZJNWDPQO-GFCCVEGCSA-N 1 2 249.354 2.540 20 10 BFCDLO Cc1cc(O)c(C[NH2+]CC(F)F)c(Cl)c1 ZINC000840947380 587931303 /nfs/dbraw/zinc/93/13/03/587931303.db2.gz QAVLOEMNWFJXAY-UHFFFAOYSA-N 1 2 235.661 2.709 20 10 BFCDLO Cc1cc(N(C)C)ccc1C[N@H+](C)CC(F)F ZINC000840911856 587929742 /nfs/dbraw/zinc/92/97/42/587929742.db2.gz BDTCGSILUFSIFC-UHFFFAOYSA-N 1 2 242.313 2.758 20 10 BFCDLO Cc1cc(N(C)C)ccc1C[N@@H+](C)CC(F)F ZINC000840911856 587929743 /nfs/dbraw/zinc/92/97/43/587929743.db2.gz BDTCGSILUFSIFC-UHFFFAOYSA-N 1 2 242.313 2.758 20 10 BFCDLO COCC1(C[N@H+](C)c2ccc(OC)cc2)CCC1 ZINC000844354802 588187196 /nfs/dbraw/zinc/18/71/96/588187196.db2.gz HBKSBKWXIOTGDN-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO COCC1(C[N@@H+](C)c2ccc(OC)cc2)CCC1 ZINC000844354802 588187197 /nfs/dbraw/zinc/18/71/97/588187197.db2.gz HBKSBKWXIOTGDN-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2C[C@@H]2C)cc1 ZINC000845997660 588253062 /nfs/dbraw/zinc/25/30/62/588253062.db2.gz BDUKHMMMYBLART-WDEREUQCSA-N 1 2 205.301 2.787 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2C[C@@H]2C)cc1 ZINC000845997660 588253063 /nfs/dbraw/zinc/25/30/63/588253063.db2.gz BDUKHMMMYBLART-WDEREUQCSA-N 1 2 205.301 2.787 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2C[C@H]2C)cc1 ZINC000845997658 588253172 /nfs/dbraw/zinc/25/31/72/588253172.db2.gz BDUKHMMMYBLART-MNOVXSKESA-N 1 2 205.301 2.787 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2C[C@H]2C)cc1 ZINC000845997658 588253173 /nfs/dbraw/zinc/25/31/73/588253173.db2.gz BDUKHMMMYBLART-MNOVXSKESA-N 1 2 205.301 2.787 20 10 BFCDLO CCn1c[nH+]cc1CN(C)c1ccc(OC)cc1 ZINC000845998786 588253194 /nfs/dbraw/zinc/25/31/94/588253194.db2.gz PURVANGECVDFPT-UHFFFAOYSA-N 1 2 245.326 2.548 20 10 BFCDLO Cc1ccc(C[NH2+]C2(C(F)F)CC2)c(O)c1 ZINC000877501111 590342121 /nfs/dbraw/zinc/34/21/21/590342121.db2.gz IDLIKAYKNLMRRK-UHFFFAOYSA-N 1 2 227.254 2.588 20 10 BFCDLO Cc1cnc(C[N@@H+]2Cc3cccc(O)c3C2)s1 ZINC000877702575 590395428 /nfs/dbraw/zinc/39/54/28/590395428.db2.gz BZVARBCYTQSQCU-UHFFFAOYSA-N 1 2 246.335 2.673 20 10 BFCDLO Cc1cnc(C[N@H+]2Cc3cccc(O)c3C2)s1 ZINC000877702575 590395429 /nfs/dbraw/zinc/39/54/29/590395429.db2.gz BZVARBCYTQSQCU-UHFFFAOYSA-N 1 2 246.335 2.673 20 10 BFCDLO CCOc1ccc([N@H+](C)C[C@@H]2CCO[C@@H]2C)cc1 ZINC000878124154 590500630 /nfs/dbraw/zinc/50/06/30/590500630.db2.gz HJMCVOMDHBNBFL-OLZOCXBDSA-N 1 2 249.354 2.947 20 10 BFCDLO CCOc1ccc([N@@H+](C)C[C@@H]2CCO[C@@H]2C)cc1 ZINC000878124154 590500632 /nfs/dbraw/zinc/50/06/32/590500632.db2.gz HJMCVOMDHBNBFL-OLZOCXBDSA-N 1 2 249.354 2.947 20 10 BFCDLO CCOc1ccc(C[NH2+][C@@H](C)C(F)F)c(O)c1 ZINC000883406996 591649762 /nfs/dbraw/zinc/64/97/62/591649762.db2.gz HYQTZDPLWMHXEN-QMMMGPOBSA-N 1 2 245.269 2.534 20 10 BFCDLO CCOC[C@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000162860996 633039982 /nfs/dbraw/zinc/03/99/82/633039982.db2.gz BCAJUCBDQDVPDX-VIFPVBQESA-N 1 2 243.734 2.560 20 10 BFCDLO Cc1ccc(O)c(CNc2cc[nH+]cc2F)c1 ZINC000192149380 641967354 /nfs/dbraw/zinc/96/73/54/641967354.db2.gz YSXQFUPQFZOVNJ-UHFFFAOYSA-N 1 2 232.258 2.847 20 10 BFCDLO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)C(F)F)c1 ZINC000389916364 711097571 /nfs/dbraw/zinc/09/75/71/711097571.db2.gz NDUKYIULPLVVJQ-YUMQZZPRSA-N 1 2 245.269 2.705 20 10 BFCDLO CCOc1cccc(C[NH2+][C@@H](C)C(F)F)c1O ZINC000389922289 711098443 /nfs/dbraw/zinc/09/84/43/711098443.db2.gz SFGIVGJLWBHDGR-QMMMGPOBSA-N 1 2 245.269 2.534 20 10 BFCDLO Oc1ccc(F)cc1C[NH2+][C@@H]1CCCC1(F)F ZINC000398145478 711403577 /nfs/dbraw/zinc/40/35/77/711403577.db2.gz XJXYMCPBCBRILD-LLVKDONJSA-N 1 2 245.244 2.809 20 10 BFCDLO CC[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708390973 712192018 /nfs/dbraw/zinc/19/20/18/712192018.db2.gz SCIZACYQMQRQLW-ZETCQYMHSA-N 1 2 215.243 2.559 20 10 BFCDLO CCC(C)(C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708394118 712192832 /nfs/dbraw/zinc/19/28/32/712192832.db2.gz OVUQNEVKNXSFNP-UHFFFAOYSA-N 1 2 229.270 2.949 20 10 BFCDLO CC(C)([NH2+]Cc1cc(F)cc(F)c1O)C1CC1 ZINC000708440916 712194763 /nfs/dbraw/zinc/19/47/63/712194763.db2.gz FQAUHKMMJNFQAC-UHFFFAOYSA-N 1 2 241.281 2.949 20 10 BFCDLO Oc1c(F)cc(F)cc1C[N@@H+]1CCC[C@H](F)C1 ZINC000708441507 712194791 /nfs/dbraw/zinc/19/47/91/712194791.db2.gz IQWPTORFJFJTAX-VIFPVBQESA-N 1 2 245.244 2.604 20 10 BFCDLO Oc1c(F)cc(F)cc1C[N@H+]1CCC[C@H](F)C1 ZINC000708441507 712194792 /nfs/dbraw/zinc/19/47/92/712194792.db2.gz IQWPTORFJFJTAX-VIFPVBQESA-N 1 2 245.244 2.604 20 10 BFCDLO CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)C1CC1 ZINC000708553716 712212871 /nfs/dbraw/zinc/21/28/71/712212871.db2.gz DNSYHWHCGIXVAE-GFCCVEGCSA-N 1 2 241.281 2.949 20 10 BFCDLO C[N@H+](CCCF)Cc1cccc(Cl)c1O ZINC000716627046 712567967 /nfs/dbraw/zinc/56/79/67/712567967.db2.gz IBZPBIOFYIICJO-UHFFFAOYSA-N 1 2 231.698 2.837 20 10 BFCDLO C[N@@H+](CCCF)Cc1cccc(Cl)c1O ZINC000716627046 712567968 /nfs/dbraw/zinc/56/79/68/712567968.db2.gz IBZPBIOFYIICJO-UHFFFAOYSA-N 1 2 231.698 2.837 20 10 BFCDLO CSCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000380316227 712882701 /nfs/dbraw/zinc/88/27/01/712882701.db2.gz IZKDLRBPRWCXPS-UHFFFAOYSA-N 1 2 249.738 2.637 20 10 BFCDLO C[N@H+](Cc1cc(F)cc(Cl)c1O)C1CC1 ZINC001237804656 980055276 /nfs/dbraw/zinc/05/52/76/980055276.db2.gz DUIZFLQFKFVJAO-UHFFFAOYSA-N 1 2 229.682 2.779 20 10 BFCDLO C[N@@H+](Cc1cc(F)cc(Cl)c1O)C1CC1 ZINC001237804656 980055287 /nfs/dbraw/zinc/05/52/87/980055287.db2.gz DUIZFLQFKFVJAO-UHFFFAOYSA-N 1 2 229.682 2.779 20 10 BFCDLO Oc1cc(F)cc(F)c1C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001140585365 960444196 /nfs/dbraw/zinc/44/41/96/960444196.db2.gz GXQHLDSENDJRPI-QPUJVOFHSA-N 1 2 239.265 2.655 20 10 BFCDLO Oc1cc(F)cc(F)c1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001140585365 960444204 /nfs/dbraw/zinc/44/42/04/960444204.db2.gz GXQHLDSENDJRPI-QPUJVOFHSA-N 1 2 239.265 2.655 20 10 BFCDLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2O)C[C@@H]1F ZINC001231909435 977789968 /nfs/dbraw/zinc/78/99/68/977789968.db2.gz NQAXASJJBBLNHC-KCJUWKMLSA-N 1 2 243.709 2.835 20 10 BFCDLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2O)C[C@@H]1F ZINC001231909435 977789970 /nfs/dbraw/zinc/78/99/70/977789970.db2.gz NQAXASJJBBLNHC-KCJUWKMLSA-N 1 2 243.709 2.835 20 10 BFCDLO Oc1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H]1CF ZINC001233336558 978567066 /nfs/dbraw/zinc/56/70/66/978567066.db2.gz PVQOTEXXZFWHEZ-MRVPVSSYSA-N 1 2 245.244 2.604 20 10 BFCDLO Oc1ccc(F)c(F)c1C[N@H+]1CCC[C@@H]1CF ZINC001233336558 978567070 /nfs/dbraw/zinc/56/70/70/978567070.db2.gz PVQOTEXXZFWHEZ-MRVPVSSYSA-N 1 2 245.244 2.604 20 10 BFCDLO COc1ccc(C[NH+]2CC(C)C2)c(O)c1Cl ZINC001236803685 979738848 /nfs/dbraw/zinc/73/88/48/979738848.db2.gz WCKIDKACDSPHNX-UHFFFAOYSA-N 1 2 241.718 2.506 20 10 BFCDLO Cc1cc2c(cccc2-c2c[nH+]cn2C)n1C ZINC001243070887 984497593 /nfs/dbraw/zinc/49/75/93/984497593.db2.gz AQAKKJSIHICKMG-UHFFFAOYSA-N 1 2 225.295 2.887 20 10 BFCDLO CNc1ccc(NCc2cccc(F)c2O)c[nH+]1 ZINC001578760987 985328665 /nfs/dbraw/zinc/32/86/65/985328665.db2.gz ZDOIHIHHTTWILD-UHFFFAOYSA-N 1 2 247.273 2.580 20 10 BFCDLO Cc1ccc(C)c(C[N@@H+]2CCC(F)(F)C2)c1O ZINC001140178501 991551654 /nfs/dbraw/zinc/55/16/54/991551654.db2.gz MTBJVKBQJSEBCC-UHFFFAOYSA-N 1 2 241.281 2.850 20 10 BFCDLO Cc1ccc(C)c(C[N@H+]2CCC(F)(F)C2)c1O ZINC001140178501 991551667 /nfs/dbraw/zinc/55/16/67/991551667.db2.gz MTBJVKBQJSEBCC-UHFFFAOYSA-N 1 2 241.281 2.850 20 10 BFCDLO CC[N@H+](Cc1c(O)cc(F)cc1F)C(C)C ZINC001140580172 991670521 /nfs/dbraw/zinc/67/05/21/991670521.db2.gz UHLHSELGPUEQMH-UHFFFAOYSA-N 1 2 229.270 2.901 20 10 BFCDLO CC[N@@H+](Cc1c(O)cc(F)cc1F)C(C)C ZINC001140580172 991670527 /nfs/dbraw/zinc/67/05/27/991670527.db2.gz UHLHSELGPUEQMH-UHFFFAOYSA-N 1 2 229.270 2.901 20 10 BFCDLO CC[N@H+](Cc1cccc(F)c1O)C(C)C ZINC000165412586 361839184 /nfs/dbraw/zinc/83/91/84/361839184.db2.gz ZFXSSDSUSAJALN-UHFFFAOYSA-N 1 2 211.280 2.762 20 10 BFCDLO CC[N@@H+](Cc1cccc(F)c1O)C(C)C ZINC000165412586 361839187 /nfs/dbraw/zinc/83/91/87/361839187.db2.gz ZFXSSDSUSAJALN-UHFFFAOYSA-N 1 2 211.280 2.762 20 10 BFCDLO Cc1cccc(C[N@H+](CC(F)F)C2CC2)c1O ZINC000180155130 179071107 /nfs/dbraw/zinc/07/11/07/179071107.db2.gz QVRAPPFUEOJZJZ-UHFFFAOYSA-N 1 2 241.281 2.930 20 10 BFCDLO Cc1cccc(C[N@@H+](CC(F)F)C2CC2)c1O ZINC000180155130 179071110 /nfs/dbraw/zinc/07/11/10/179071110.db2.gz QVRAPPFUEOJZJZ-UHFFFAOYSA-N 1 2 241.281 2.930 20 10 BFCDLO CO[C@@H](C)[C@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000191695129 355834437 /nfs/dbraw/zinc/83/44/37/355834437.db2.gz MYFWYORCCHRGSL-IUCAKERBSA-N 1 2 243.734 2.559 20 10 BFCDLO Cc1[nH]ncc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000038011208 384054745 /nfs/dbraw/zinc/05/47/45/384054745.db2.gz GKCPVRWLCSOZMS-LLVKDONJSA-N 1 2 245.326 2.583 20 10 BFCDLO C[C@@H]1C[C@H]1C[NH2+]Cc1cccc(Cl)c1O ZINC000162520958 384404519 /nfs/dbraw/zinc/40/45/19/384404519.db2.gz VPAQCOAEDVECNW-SCZZXKLOSA-N 1 2 225.719 2.791 20 10 BFCDLO CSC[C@@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000162659009 411298989 /nfs/dbraw/zinc/29/89/89/411298989.db2.gz YBZFNWCYZYBNIB-MRVPVSSYSA-N 1 2 245.775 2.887 20 10 BFCDLO CCOCC[N@H+](C)Cc1cccc(Cl)c1O ZINC000165418858 170390345 /nfs/dbraw/zinc/39/03/45/170390345.db2.gz AQVOEOCOQOYPPY-UHFFFAOYSA-N 1 2 243.734 2.514 20 10 BFCDLO CCOCC[N@@H+](C)Cc1cccc(Cl)c1O ZINC000165418858 170390346 /nfs/dbraw/zinc/39/03/46/170390346.db2.gz AQVOEOCOQOYPPY-UHFFFAOYSA-N 1 2 243.734 2.514 20 10 BFCDLO CC[N@@H+](Cc1cc(F)cc(F)c1O)CC1CC1 ZINC000894021404 583274963 /nfs/dbraw/zinc/27/49/63/583274963.db2.gz SHVVLNGYAOWNFD-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO CC[N@H+](Cc1cc(F)cc(F)c1O)CC1CC1 ZINC000894021404 583274966 /nfs/dbraw/zinc/27/49/66/583274966.db2.gz SHVVLNGYAOWNFD-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO Oc1c(C[N@@H+]2CC[C@H]3C[C@H]3C2)ccc(F)c1F ZINC000877635552 583340576 /nfs/dbraw/zinc/34/05/76/583340576.db2.gz WEJWIPYRRIOGLS-WPRPVWTQSA-N 1 2 239.265 2.512 20 10 BFCDLO Oc1c(C[N@H+]2CC[C@H]3C[C@H]3C2)ccc(F)c1F ZINC000877635552 583340579 /nfs/dbraw/zinc/34/05/79/583340579.db2.gz WEJWIPYRRIOGLS-WPRPVWTQSA-N 1 2 239.265 2.512 20 10 BFCDLO COc1ccc([N@H+](CCCO)CC(C)C)cc1 ZINC000728917481 583936571 /nfs/dbraw/zinc/93/65/71/583936571.db2.gz HEWZJDFPDUMLKY-UHFFFAOYSA-N 1 2 237.343 2.540 20 10 BFCDLO COc1ccc([N@@H+](CCCO)CC(C)C)cc1 ZINC000728917481 583936572 /nfs/dbraw/zinc/93/65/72/583936572.db2.gz HEWZJDFPDUMLKY-UHFFFAOYSA-N 1 2 237.343 2.540 20 10 BFCDLO Cc1cc(NCc2cc(C)c(C)cc2O)nc[nH+]1 ZINC000902194584 584536844 /nfs/dbraw/zinc/53/68/44/584536844.db2.gz HQVBEHYJNDVSKA-UHFFFAOYSA-N 1 2 243.310 2.720 20 10 BFCDLO CC[N@H+](CCC1(O)CCC1)c1ccc(OC)cc1 ZINC000839512660 585106074 /nfs/dbraw/zinc/10/60/74/585106074.db2.gz PVNPBISVOWYDHH-UHFFFAOYSA-N 1 2 249.354 2.827 20 10 BFCDLO CC[N@@H+](CCC1(O)CCC1)c1ccc(OC)cc1 ZINC000839512660 585106075 /nfs/dbraw/zinc/10/60/75/585106075.db2.gz PVNPBISVOWYDHH-UHFFFAOYSA-N 1 2 249.354 2.827 20 10 BFCDLO Cc1ccc([C@@H](C)[NH2+]Cc2ccn[nH]2)c(O)c1C ZINC000756552688 585321008 /nfs/dbraw/zinc/32/10/08/585321008.db2.gz GXHZRXMNYSHYOE-LLVKDONJSA-N 1 2 245.326 2.583 20 10 BFCDLO Cc1ccc([C@H](C)[NH2+]Cc2ccn[nH]2)c(O)c1C ZINC000756552712 585321079 /nfs/dbraw/zinc/32/10/79/585321079.db2.gz GXHZRXMNYSHYOE-NSHDSACASA-N 1 2 245.326 2.583 20 10 BFCDLO C[N@H+](Cc1cc(Cl)cc(F)c1O)C1CC1 ZINC000775652492 585682561 /nfs/dbraw/zinc/68/25/61/585682561.db2.gz LUDKOXRKPYOHIE-UHFFFAOYSA-N 1 2 229.682 2.779 20 10 BFCDLO C[N@@H+](Cc1cc(Cl)cc(F)c1O)C1CC1 ZINC000775652492 585682562 /nfs/dbraw/zinc/68/25/62/585682562.db2.gz LUDKOXRKPYOHIE-UHFFFAOYSA-N 1 2 229.682 2.779 20 10 BFCDLO COc1ccc(NCc2cccc(C)c2O)[nH+]c1 ZINC000776251454 585693939 /nfs/dbraw/zinc/69/39/39/585693939.db2.gz YPBJBXTUWOGNJD-UHFFFAOYSA-N 1 2 244.294 2.716 20 10 BFCDLO C[C@@H]1C[C@@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816535697 586739347 /nfs/dbraw/zinc/73/93/47/586739347.db2.gz XDCPYCVWFNJABL-HTQZYQBOSA-N 1 2 243.709 2.930 20 10 BFCDLO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)C(F)F ZINC000824508992 587272458 /nfs/dbraw/zinc/27/24/58/587272458.db2.gz ISYQFGLNTSVGEN-NSHDSACASA-N 1 2 241.281 2.755 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2CCO[C@@H](C)C2)cc1 ZINC000844355148 588187420 /nfs/dbraw/zinc/18/74/20/588187420.db2.gz LOHYTQUYQGXXOL-STQMWFEESA-N 1 2 249.354 2.947 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2CCO[C@@H](C)C2)cc1 ZINC000844355148 588187421 /nfs/dbraw/zinc/18/74/21/588187421.db2.gz LOHYTQUYQGXXOL-STQMWFEESA-N 1 2 249.354 2.947 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC000862443647 589214179 /nfs/dbraw/zinc/21/41/79/589214179.db2.gz RPYVOVJIFAHYOD-OCAPTIKFSA-N 1 2 241.693 2.636 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC000862443647 589214180 /nfs/dbraw/zinc/21/41/80/589214180.db2.gz RPYVOVJIFAHYOD-OCAPTIKFSA-N 1 2 241.693 2.636 20 10 BFCDLO C/C=C\C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000862530434 589218116 /nfs/dbraw/zinc/21/81/16/589218116.db2.gz MJTLSJUZQGWXNC-IHWYPQMZSA-N 1 2 229.682 2.850 20 10 BFCDLO CC(C)C1C[NH+](Cc2ccc(F)c(F)c2O)C1 ZINC000877486583 590338877 /nfs/dbraw/zinc/33/88/77/590338877.db2.gz LEALHHLQABVFMH-UHFFFAOYSA-N 1 2 241.281 2.758 20 10 BFCDLO Oc1c(C[NH2+][C@H]2[C@@H]3CCC[C@@H]32)ccc(F)c1F ZINC000877634324 590379763 /nfs/dbraw/zinc/37/97/63/590379763.db2.gz MTMZEOREZVZJMN-GDGBQDQQSA-N 1 2 239.265 2.559 20 10 BFCDLO Oc1c(C[NH2+][C@@H]2[C@@H]3CCC[C@@H]32)ccc(F)c1F ZINC000877634321 590380039 /nfs/dbraw/zinc/38/00/39/590380039.db2.gz MTMZEOREZVZJMN-BZBKMWRSSA-N 1 2 239.265 2.559 20 10 BFCDLO CC1(C)C[NH+](Cc2cccc(Cl)c2O)C1 ZINC000877718072 590400075 /nfs/dbraw/zinc/40/00/75/590400075.db2.gz WLXBGAGPRNNWTM-UHFFFAOYSA-N 1 2 225.719 2.887 20 10 BFCDLO CCOc1ccc([N@H+](C)C[C@H]2C[C@@H](OC)C2)cc1 ZINC000878125087 590502039 /nfs/dbraw/zinc/50/20/39/590502039.db2.gz MNYLYLBEKKGQFI-JNSHFYNHSA-N 1 2 249.354 2.947 20 10 BFCDLO CCOc1ccc([N@@H+](C)C[C@H]2C[C@@H](OC)C2)cc1 ZINC000878125087 590502041 /nfs/dbraw/zinc/50/20/41/590502041.db2.gz MNYLYLBEKKGQFI-JNSHFYNHSA-N 1 2 249.354 2.947 20 10 BFCDLO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C(F)F ZINC000883407328 591651643 /nfs/dbraw/zinc/65/16/43/591651643.db2.gz RTZSIROTQJWSGY-MRVPVSSYSA-N 1 2 246.276 2.635 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2C[C@@]23CCOC3)cc1 ZINC000886267775 592191240 /nfs/dbraw/zinc/19/12/40/592191240.db2.gz UXPUQOMRHKYZSV-IUODEOHRSA-N 1 2 247.338 2.558 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2C[C@@]23CCOC3)cc1 ZINC000886267775 592191242 /nfs/dbraw/zinc/19/12/42/592191242.db2.gz UXPUQOMRHKYZSV-IUODEOHRSA-N 1 2 247.338 2.558 20 10 BFCDLO COCCC[N@H+](C)Cc1cccc(Cl)c1O ZINC000162817168 633039425 /nfs/dbraw/zinc/03/94/25/633039425.db2.gz FCBQZTGJMJXOTL-UHFFFAOYSA-N 1 2 243.734 2.514 20 10 BFCDLO COCCC[N@@H+](C)Cc1cccc(Cl)c1O ZINC000162817168 633039438 /nfs/dbraw/zinc/03/94/38/633039438.db2.gz FCBQZTGJMJXOTL-UHFFFAOYSA-N 1 2 243.734 2.514 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH2+]C1CC=CC1 ZINC000309515254 633186496 /nfs/dbraw/zinc/18/64/96/633186496.db2.gz RFZCJEQMQJWTPD-UHFFFAOYSA-N 1 2 241.693 2.993 20 10 BFCDLO COCC(C)(C)[NH2+]Cc1cccc(Cl)c1O ZINC000162573285 634207787 /nfs/dbraw/zinc/20/77/87/634207787.db2.gz VZSNXWVIUFCDTM-UHFFFAOYSA-N 1 2 243.734 2.560 20 10 BFCDLO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)C(F)F ZINC000922339601 643976357 /nfs/dbraw/zinc/97/63/57/643976357.db2.gz TYIDAJZQJATWJK-SECBINFHSA-N 1 2 241.281 2.755 20 10 BFCDLO CC/C=C\C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708495489 712211967 /nfs/dbraw/zinc/21/19/67/712211967.db2.gz COIUAVUWCZMZAL-ARJAWSKDSA-N 1 2 227.254 2.726 20 10 BFCDLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1c(O)ccc(F)c1F ZINC001233331556 978560264 /nfs/dbraw/zinc/56/02/64/978560264.db2.gz BESULUWRBXQRIR-HTQZYQBOSA-N 1 2 245.244 2.603 20 10 BFCDLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1c(O)ccc(F)c1F ZINC001233331556 978560273 /nfs/dbraw/zinc/56/02/73/978560273.db2.gz BESULUWRBXQRIR-HTQZYQBOSA-N 1 2 245.244 2.603 20 10 BFCDLO Oc1c(Cl)cc(F)cc1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001237802048 980048966 /nfs/dbraw/zinc/04/89/66/980048966.db2.gz XFMXPCCFVPHXMZ-OCAPTIKFSA-N 1 2 241.693 2.636 20 10 BFCDLO Oc1c(Cl)cc(F)cc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001237802048 980048970 /nfs/dbraw/zinc/04/89/70/980048970.db2.gz XFMXPCCFVPHXMZ-OCAPTIKFSA-N 1 2 241.693 2.636 20 10 BFCDLO C[C@@H]1CCC[N@@H+]1Cc1c(O)cc(F)cc1F ZINC001140580368 958990882 /nfs/dbraw/zinc/99/08/82/958990882.db2.gz ZPQZTULOUCCGPY-MRVPVSSYSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@@H]1CCC[N@H+]1Cc1c(O)cc(F)cc1F ZINC001140580368 958990896 /nfs/dbraw/zinc/99/08/96/958990896.db2.gz ZPQZTULOUCCGPY-MRVPVSSYSA-N 1 2 227.254 2.655 20 10 BFCDLO CCCC[N@H+](C)Cc1c(O)cc(F)cc1F ZINC001140579903 960441430 /nfs/dbraw/zinc/44/14/30/960441430.db2.gz LNUANVPVARQCDQ-UHFFFAOYSA-N 1 2 229.270 2.902 20 10 BFCDLO CCCC[N@@H+](C)Cc1c(O)cc(F)cc1F ZINC001140579903 960441439 /nfs/dbraw/zinc/44/14/39/960441439.db2.gz LNUANVPVARQCDQ-UHFFFAOYSA-N 1 2 229.270 2.902 20 10 BFCDLO CC[N@H+](CC[C@H]1CCOC1)c1ccc(OC)cc1 ZINC001327984992 972842364 /nfs/dbraw/zinc/84/23/64/972842364.db2.gz MKZNQFRZXFXNFH-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO CC[N@@H+](CC[C@H]1CCOC1)c1ccc(OC)cc1 ZINC001327984992 972842368 /nfs/dbraw/zinc/84/23/68/972842368.db2.gz MKZNQFRZXFXNFH-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO Cc1cc(C)c(C[NH+]2C[C@@H](F)[C@H](F)C2)c(O)c1 ZINC001231841918 977760499 /nfs/dbraw/zinc/76/04/99/977760499.db2.gz GYEHKQICDMSDCY-VXGBXAGGSA-N 1 2 241.281 2.501 20 10 BFCDLO CC[N@H+](C)Cc1cccc(C(F)(F)F)c1O ZINC001233416067 978597006 /nfs/dbraw/zinc/59/70/06/978597006.db2.gz VMDPXCNNAVTEAQ-UHFFFAOYSA-N 1 2 233.233 2.863 20 10 BFCDLO CC[N@@H+](C)Cc1cccc(C(F)(F)F)c1O ZINC001233416067 978597014 /nfs/dbraw/zinc/59/70/14/978597014.db2.gz VMDPXCNNAVTEAQ-UHFFFAOYSA-N 1 2 233.233 2.863 20 10 BFCDLO Oc1c(F)cc(F)cc1C[NH2+][C@H]1C=CCCC1 ZINC001331291492 978980985 /nfs/dbraw/zinc/98/09/85/978980985.db2.gz YSKVQFZEKWTCBU-NSHDSACASA-N 1 2 239.265 2.869 20 10 BFCDLO Oc1cc(Cl)c(Cl)cc1C[NH+]1CCC1 ZINC001236794504 979738185 /nfs/dbraw/zinc/73/81/85/979738185.db2.gz SGGQTNAMCQFZKH-UHFFFAOYSA-N 1 2 232.110 2.905 20 10 BFCDLO C[C@H]1CC[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC001237617629 979976183 /nfs/dbraw/zinc/97/61/83/979976183.db2.gz TYULISVFBYXJOK-ZETCQYMHSA-N 1 2 229.682 2.779 20 10 BFCDLO C[C@H]1CC[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC001237617629 979976190 /nfs/dbraw/zinc/97/61/90/979976190.db2.gz TYULISVFBYXJOK-ZETCQYMHSA-N 1 2 229.682 2.779 20 10 BFCDLO Oc1cc(Cl)c(F)cc1C[N@@H+]1CC[C@@H](F)C1 ZINC001237934687 980115622 /nfs/dbraw/zinc/11/56/22/980115622.db2.gz MZDZSGPBOUBQDZ-MRVPVSSYSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1cc(Cl)c(F)cc1C[N@H+]1CC[C@@H](F)C1 ZINC001237934687 980115626 /nfs/dbraw/zinc/11/56/26/980115626.db2.gz MZDZSGPBOUBQDZ-MRVPVSSYSA-N 1 2 247.672 2.729 20 10 BFCDLO CC1CC([N@H+](C)Cc2cccc(F)c2O)C1 ZINC001138123860 990884522 /nfs/dbraw/zinc/88/45/22/990884522.db2.gz OPHIILJPCFIBDR-UHFFFAOYSA-N 1 2 223.291 2.762 20 10 BFCDLO CC1CC([N@@H+](C)Cc2cccc(F)c2O)C1 ZINC001138123860 990884525 /nfs/dbraw/zinc/88/45/25/990884525.db2.gz OPHIILJPCFIBDR-UHFFFAOYSA-N 1 2 223.291 2.762 20 10 BFCDLO CC[C@H]([NH2+]Cc1cn[nH]c1C)c1ccccc1O ZINC000038011121 343365625 /nfs/dbraw/zinc/36/56/25/343365625.db2.gz KHFNZNHEVVBYDZ-ZDUSSCGKSA-N 1 2 245.326 2.665 20 10 BFCDLO CC[N@H+](Cc1cccc(F)c1O)C1CC1 ZINC000272325803 351468682 /nfs/dbraw/zinc/46/86/82/351468682.db2.gz VGYYQQMBZLHMFK-UHFFFAOYSA-N 1 2 209.264 2.516 20 10 BFCDLO CC[N@@H+](Cc1cccc(F)c1O)C1CC1 ZINC000272325803 351468684 /nfs/dbraw/zinc/46/86/84/351468684.db2.gz VGYYQQMBZLHMFK-UHFFFAOYSA-N 1 2 209.264 2.516 20 10 BFCDLO CC(C)C[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000191180335 355337674 /nfs/dbraw/zinc/33/76/74/355337674.db2.gz LJGYSGPZVMTFJH-MRVPVSSYSA-N 1 2 229.270 2.977 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[NH2+]CC(F)F ZINC000298186083 183259092 /nfs/dbraw/zinc/25/90/92/183259092.db2.gz WFWIKABLDJXEOH-UHFFFAOYSA-N 1 2 239.624 2.539 20 10 BFCDLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000038011209 384052932 /nfs/dbraw/zinc/05/29/32/384052932.db2.gz GKCPVRWLCSOZMS-NSHDSACASA-N 1 2 245.326 2.583 20 10 BFCDLO Cc1ccc(O)c(C[N@H+](C)Cc2cscn2)c1 ZINC000120253864 384341819 /nfs/dbraw/zinc/34/18/19/384341819.db2.gz WGOMVZDRYXYIAY-UHFFFAOYSA-N 1 2 248.351 2.789 20 10 BFCDLO Cc1ccc(O)c(C[N@@H+](C)Cc2cscn2)c1 ZINC000120253864 384341829 /nfs/dbraw/zinc/34/18/29/384341829.db2.gz WGOMVZDRYXYIAY-UHFFFAOYSA-N 1 2 248.351 2.789 20 10 BFCDLO Cc1cccc(C[N@@H+]2CC[C@@H]2C(F)F)c1O ZINC000895431309 583670156 /nfs/dbraw/zinc/67/01/56/583670156.db2.gz LQHTXRDQIBJXJI-SNVBAGLBSA-N 1 2 227.254 2.540 20 10 BFCDLO Cc1cccc(C[N@H+]2CC[C@@H]2C(F)F)c1O ZINC000895431309 583670159 /nfs/dbraw/zinc/67/01/59/583670159.db2.gz LQHTXRDQIBJXJI-SNVBAGLBSA-N 1 2 227.254 2.540 20 10 BFCDLO Cc1ccc(O)c(C[N@@H+]2CC[C@H]2C(F)F)c1 ZINC000895430731 583670174 /nfs/dbraw/zinc/67/01/74/583670174.db2.gz HGKAONJYCBYZPY-JTQLQIEISA-N 1 2 227.254 2.540 20 10 BFCDLO Cc1ccc(O)c(C[N@H+]2CC[C@H]2C(F)F)c1 ZINC000895430731 583670177 /nfs/dbraw/zinc/67/01/77/583670177.db2.gz HGKAONJYCBYZPY-JTQLQIEISA-N 1 2 227.254 2.540 20 10 BFCDLO Cc1cc(O)c(CNc2cc[nH+]c(C)n2)cc1C ZINC000902125346 584528977 /nfs/dbraw/zinc/52/89/77/584528977.db2.gz QYZALBPGXBNVNW-UHFFFAOYSA-N 1 2 243.310 2.720 20 10 BFCDLO Oc1ccc(Cl)c(F)c1C[NH2+]CC(F)F ZINC000839089550 585090405 /nfs/dbraw/zinc/09/04/05/585090405.db2.gz ACXPBNRYASOPEG-UHFFFAOYSA-N 1 2 239.624 2.539 20 10 BFCDLO C[C@H]([NH2+]C1(C(F)F)CC1)c1ccc(F)cc1O ZINC000800502104 586223710 /nfs/dbraw/zinc/22/37/10/586223710.db2.gz MNPRPLSXHODROB-ZETCQYMHSA-N 1 2 245.244 2.980 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2CCO[C@@H](C)C2)cc1 ZINC000844355147 588186811 /nfs/dbraw/zinc/18/68/11/588186811.db2.gz LOHYTQUYQGXXOL-QWHCGFSZSA-N 1 2 249.354 2.947 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2CCO[C@@H](C)C2)cc1 ZINC000844355147 588186813 /nfs/dbraw/zinc/18/68/13/588186813.db2.gz LOHYTQUYQGXXOL-QWHCGFSZSA-N 1 2 249.354 2.947 20 10 BFCDLO COc1ccc([N@H+](C)CCC[C@@H]2CCOC2)cc1 ZINC000844355073 588187234 /nfs/dbraw/zinc/18/72/34/588187234.db2.gz KEHVDJRQJMLRIC-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1ccc([N@@H+](C)CCC[C@@H]2CCOC2)cc1 ZINC000844355073 588187236 /nfs/dbraw/zinc/18/72/36/588187236.db2.gz KEHVDJRQJMLRIC-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO Cc1cccc(O)c1C[N@H+](CC(F)F)C1CC1 ZINC000876715382 590232952 /nfs/dbraw/zinc/23/29/52/590232952.db2.gz NCPFGCPIMSSTIU-UHFFFAOYSA-N 1 2 241.281 2.930 20 10 BFCDLO Cc1cccc(O)c1C[N@@H+](CC(F)F)C1CC1 ZINC000876715382 590232953 /nfs/dbraw/zinc/23/29/53/590232953.db2.gz NCPFGCPIMSSTIU-UHFFFAOYSA-N 1 2 241.281 2.930 20 10 BFCDLO CC[N@H+](C[C@@H]1CCO[C@@H]1C)c1ccc(OC)cc1 ZINC000878219344 590525649 /nfs/dbraw/zinc/52/56/49/590525649.db2.gz KDXLQYTYLQYUBC-OLZOCXBDSA-N 1 2 249.354 2.947 20 10 BFCDLO CC[N@@H+](C[C@@H]1CCO[C@@H]1C)c1ccc(OC)cc1 ZINC000878219344 590525650 /nfs/dbraw/zinc/52/56/50/590525650.db2.gz KDXLQYTYLQYUBC-OLZOCXBDSA-N 1 2 249.354 2.947 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2CCO[C@@H]2C)cc1 ZINC000878801344 590625074 /nfs/dbraw/zinc/62/50/74/590625074.db2.gz JVRKSERFYAOWHH-VXGBXAGGSA-N 1 2 235.327 2.556 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2CCO[C@@H]2C)cc1 ZINC000878801344 590625075 /nfs/dbraw/zinc/62/50/75/590625075.db2.gz JVRKSERFYAOWHH-VXGBXAGGSA-N 1 2 235.327 2.556 20 10 BFCDLO C[C@H]([NH2+]CCCF)c1cc(F)cc(F)c1O ZINC000134936245 591962420 /nfs/dbraw/zinc/96/24/20/591962420.db2.gz DMWVRIUQJMPJMT-ZETCQYMHSA-N 1 2 233.233 2.681 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2C[C@]23CCOC3)cc1 ZINC000886267774 592191207 /nfs/dbraw/zinc/19/12/07/592191207.db2.gz UXPUQOMRHKYZSV-DOMZBBRYSA-N 1 2 247.338 2.558 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2C[C@]23CCOC3)cc1 ZINC000886267774 592191209 /nfs/dbraw/zinc/19/12/09/592191209.db2.gz UXPUQOMRHKYZSV-DOMZBBRYSA-N 1 2 247.338 2.558 20 10 BFCDLO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)C(F)F ZINC000886651967 592290595 /nfs/dbraw/zinc/29/05/95/592290595.db2.gz WCKHBXBHJVUGRH-NKWVEPMBSA-N 1 2 233.233 2.836 20 10 BFCDLO CC[C@@H](C)[N@H+](C)Cc1cccc(F)c1O ZINC000165410692 640570996 /nfs/dbraw/zinc/57/09/96/640570996.db2.gz PNSSHMFBSASXJT-SECBINFHSA-N 1 2 211.280 2.762 20 10 BFCDLO CC[C@@H](C)[N@@H+](C)Cc1cccc(F)c1O ZINC000165410692 640571005 /nfs/dbraw/zinc/57/10/05/640571005.db2.gz PNSSHMFBSASXJT-SECBINFHSA-N 1 2 211.280 2.762 20 10 BFCDLO Oc1ccc(Cl)c(F)c1C[N@H+]1CC=CCC1 ZINC000792173517 644794535 /nfs/dbraw/zinc/79/45/35/644794535.db2.gz BQAUAXKGVSDFAU-UHFFFAOYSA-N 1 2 241.693 2.947 20 10 BFCDLO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC=CCC1 ZINC000792173517 644794541 /nfs/dbraw/zinc/79/45/41/644794541.db2.gz BQAUAXKGVSDFAU-UHFFFAOYSA-N 1 2 241.693 2.947 20 10 BFCDLO C[C@H]([NH2+][C@@H](C)C(F)F)c1cc(F)ccc1O ZINC000389967801 712692803 /nfs/dbraw/zinc/69/28/03/712692803.db2.gz OZOXKCGZAXSJDU-BQBZGAKWSA-N 1 2 233.233 2.836 20 10 BFCDLO C[C@H]([NH2+][C@@H](C)C(F)F)c1ccc(F)cc1O ZINC000389967365 711100883 /nfs/dbraw/zinc/10/08/83/711100883.db2.gz OKQHSHVDPZIHKM-BQBZGAKWSA-N 1 2 233.233 2.836 20 10 BFCDLO CC1([NH2+]Cc2cc(F)cc(F)c2O)CC=CC1 ZINC000708388896 712191817 /nfs/dbraw/zinc/19/18/17/712191817.db2.gz JIKKVGLQZICUTC-UHFFFAOYSA-N 1 2 239.265 2.869 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH2+]CC1CC1 ZINC000308907982 959540690 /nfs/dbraw/zinc/54/06/90/959540690.db2.gz FGYSHIIISZHSLO-UHFFFAOYSA-N 1 2 229.682 2.684 20 10 BFCDLO COc1ccc(C[N@@H+]2CC[C@@H]2C)c(O)c1Cl ZINC001236801166 979741348 /nfs/dbraw/zinc/74/13/48/979741348.db2.gz GLRDHCXHLHHIND-QMMMGPOBSA-N 1 2 241.718 2.648 20 10 BFCDLO COc1ccc(C[N@H+]2CC[C@@H]2C)c(O)c1Cl ZINC001236801166 979741361 /nfs/dbraw/zinc/74/13/61/979741361.db2.gz GLRDHCXHLHHIND-QMMMGPOBSA-N 1 2 241.718 2.648 20 10 BFCDLO CC1C[NH+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237934647 980113587 /nfs/dbraw/zinc/11/35/87/980113587.db2.gz LUKBFQJSIIVZJD-UHFFFAOYSA-N 1 2 229.682 2.636 20 10 BFCDLO C[C@H]1C[C@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816535700 971942534 /nfs/dbraw/zinc/94/25/34/971942534.db2.gz XDCPYCVWFNJABL-YUMQZZPRSA-N 1 2 243.709 2.930 20 10 BFCDLO Oc1cc(F)c(F)cc1C[NH+]1CC2(CCC2)C1 ZINC001142508619 961466701 /nfs/dbraw/zinc/46/67/01/961466701.db2.gz FKHORGGJOQDXQR-UHFFFAOYSA-N 1 2 239.265 2.656 20 10 BFCDLO CCc1cccc(C[NH2+]C2(C(F)F)CC2)c1O ZINC000697420456 963913483 /nfs/dbraw/zinc/91/34/83/963913483.db2.gz FTGUBMHHAZMCEJ-UHFFFAOYSA-N 1 2 241.281 2.842 20 10 BFCDLO COc1ccc[nH+]c1NCc1cccc(C)c1O ZINC001160765163 964408147 /nfs/dbraw/zinc/40/81/47/964408147.db2.gz VKJQYGWYIHTVIP-UHFFFAOYSA-N 1 2 244.294 2.716 20 10 BFCDLO Oc1ccc(F)c(F)c1C[NH+]1CC2(CCC2)C1 ZINC001233332349 978567352 /nfs/dbraw/zinc/56/73/52/978567352.db2.gz HZAPBERKXRLYLA-UHFFFAOYSA-N 1 2 239.265 2.656 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]Cc1cc[nH]c1 ZINC001179772126 978748608 /nfs/dbraw/zinc/74/86/08/978748608.db2.gz WNAIDGZJQWIXSV-UHFFFAOYSA-N 1 2 236.702 2.664 20 10 BFCDLO CCc1ccc(N(C)Cc2ccccc2O)[nH+]c1 ZINC001348063527 981271434 /nfs/dbraw/zinc/27/14/34/981271434.db2.gz QTZRZILCUSETNE-UHFFFAOYSA-N 1 2 242.322 2.986 20 10 BFCDLO COc1ccncc1-c1[nH+]ccc2c1ccn2C ZINC001242055138 983260717 /nfs/dbraw/zinc/26/07/17/983260717.db2.gz UNXBUQZAGHKONN-UHFFFAOYSA-N 1 2 239.278 2.644 20 10 BFCDLO Cc1nocc1-c1[nH+]ccc2c1ccn2C ZINC001243674991 985166562 /nfs/dbraw/zinc/16/65/62/985166562.db2.gz SZWDXIIHUGHWCC-UHFFFAOYSA-N 1 2 213.240 2.537 20 10 BFCDLO Oc1c(F)cccc1C[N@@H+]1CCc2occc2C1 ZINC001138129557 990885675 /nfs/dbraw/zinc/88/56/75/990885675.db2.gz KCYZNMFNHQFYTG-UHFFFAOYSA-N 1 2 247.269 2.683 20 10 BFCDLO Oc1c(F)cccc1C[N@H+]1CCc2occc2C1 ZINC001138129557 990885677 /nfs/dbraw/zinc/88/56/77/990885677.db2.gz KCYZNMFNHQFYTG-UHFFFAOYSA-N 1 2 247.269 2.683 20 10 BFCDLO C[C@@H]1CCC[N@@H+]1Cc1c(F)ccc(F)c1O ZINC001139683789 991311374 /nfs/dbraw/zinc/31/13/74/991311374.db2.gz LMMFERZSVWZYBE-MRVPVSSYSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@@H]1CCC[N@H+]1Cc1c(F)ccc(F)c1O ZINC001139683789 991311389 /nfs/dbraw/zinc/31/13/89/991311389.db2.gz LMMFERZSVWZYBE-MRVPVSSYSA-N 1 2 227.254 2.655 20 10 BFCDLO CC[C@@H]1CC[N@H+](Cc2c(F)ccc(F)c2O)C1 ZINC001139689756 991318366 /nfs/dbraw/zinc/31/83/66/991318366.db2.gz LRRIQQMRPWYOEQ-SECBINFHSA-N 1 2 241.281 2.902 20 10 BFCDLO CC[C@@H]1CC[N@@H+](Cc2c(F)ccc(F)c2O)C1 ZINC001139689756 991318372 /nfs/dbraw/zinc/31/83/72/991318372.db2.gz LRRIQQMRPWYOEQ-SECBINFHSA-N 1 2 241.281 2.902 20 10 BFCDLO CC[N@@H+](Cc1ccc(N(C)C)cc1)CC(F)F ZINC000172188805 346853073 /nfs/dbraw/zinc/85/30/73/346853073.db2.gz QGSZJICHLIQKLE-UHFFFAOYSA-N 1 2 242.313 2.840 20 10 BFCDLO CC[N@H+](Cc1ccc(N(C)C)cc1)CC(F)F ZINC000172188805 346853076 /nfs/dbraw/zinc/85/30/76/346853076.db2.gz QGSZJICHLIQKLE-UHFFFAOYSA-N 1 2 242.313 2.840 20 10 BFCDLO Nc1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1 ZINC000166916236 344372972 /nfs/dbraw/zinc/37/29/72/344372972.db2.gz DZGOPTIULTVRRF-UHFFFAOYSA-N 1 2 224.267 2.889 20 10 BFCDLO CC[N@H+](CCC(C)(C)O)c1ccc(OC)cc1 ZINC000267422525 386541665 /nfs/dbraw/zinc/54/16/65/386541665.db2.gz LBNVKRDOIQTGDS-UHFFFAOYSA-N 1 2 237.343 2.683 20 10 BFCDLO CC[N@@H+](CCC(C)(C)O)c1ccc(OC)cc1 ZINC000267422525 386541671 /nfs/dbraw/zinc/54/16/71/386541671.db2.gz LBNVKRDOIQTGDS-UHFFFAOYSA-N 1 2 237.343 2.683 20 10 BFCDLO CC1CC([NH2+]Cc2cccc(Cl)c2O)C1 ZINC000162690553 168147524 /nfs/dbraw/zinc/14/75/24/168147524.db2.gz VWWHIBIZMJHREL-UHFFFAOYSA-N 1 2 225.719 2.934 20 10 BFCDLO CCOCCC[NH2+]Cc1cccc(Cl)c1O ZINC000162825972 170381542 /nfs/dbraw/zinc/38/15/42/170381542.db2.gz GOWPWBGPCJJNMB-UHFFFAOYSA-N 1 2 243.734 2.562 20 10 BFCDLO COc1cccc(CNc2ccc(C)[nH+]c2)c1O ZINC000083372613 175268567 /nfs/dbraw/zinc/26/85/67/175268567.db2.gz KOIKZVRMDNKNMQ-UHFFFAOYSA-N 1 2 244.294 2.716 20 10 BFCDLO C[C@H]1C[C@H]1C[NH2+]Cc1cccc(Cl)c1O ZINC000162521071 177382208 /nfs/dbraw/zinc/38/22/08/177382208.db2.gz VPAQCOAEDVECNW-WPRPVWTQSA-N 1 2 225.719 2.791 20 10 BFCDLO CCOc1ccc([N@H+](C)CC2CCOCC2)cc1 ZINC000739924416 585086436 /nfs/dbraw/zinc/08/64/36/585086436.db2.gz RTGDEGSJHQVISK-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO CCOc1ccc([N@@H+](C)CC2CCOCC2)cc1 ZINC000739924416 585086437 /nfs/dbraw/zinc/08/64/37/585086437.db2.gz RTGDEGSJHQVISK-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1cc[nH+]cc1CSc1nccs1 ZINC000804904822 585150199 /nfs/dbraw/zinc/15/01/99/585150199.db2.gz UXIDEZGWKBGUOE-UHFFFAOYSA-N 1 2 238.337 2.839 20 10 BFCDLO CCOc1ccc([N@H+](CC)C[C@H]2CCOC2)cc1 ZINC000746159556 585164256 /nfs/dbraw/zinc/16/42/56/585164256.db2.gz XJZYSKBKNPUEFJ-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO CCOc1ccc([N@@H+](CC)C[C@H]2CCOC2)cc1 ZINC000746159556 585164257 /nfs/dbraw/zinc/16/42/57/585164257.db2.gz XJZYSKBKNPUEFJ-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO C[C@H]([NH2+]C[C@H]1C[C@H]1C)c1cc(F)cc(F)c1O ZINC000756458562 585319941 /nfs/dbraw/zinc/31/99/41/585319941.db2.gz XMHVTCLHJRNETR-HRDYMLBCSA-N 1 2 241.281 2.977 20 10 BFCDLO CC[N@H+](C)Cc1cc(Cl)cc(F)c1O ZINC000775647902 585682565 /nfs/dbraw/zinc/68/25/65/585682565.db2.gz HGSGBDZFDRXTCW-UHFFFAOYSA-N 1 2 217.671 2.636 20 10 BFCDLO CC[N@@H+](C)Cc1cc(Cl)cc(F)c1O ZINC000775647902 585682566 /nfs/dbraw/zinc/68/25/66/585682566.db2.gz HGSGBDZFDRXTCW-UHFFFAOYSA-N 1 2 217.671 2.636 20 10 BFCDLO Cc1cc(O)c(C[N@@H+]2CCC(F)(F)C2)cc1C ZINC000776293998 585694819 /nfs/dbraw/zinc/69/48/19/585694819.db2.gz VFTHLXQOIHBSCP-UHFFFAOYSA-N 1 2 241.281 2.850 20 10 BFCDLO Cc1cc(O)c(C[N@H+]2CCC(F)(F)C2)cc1C ZINC000776293998 585694820 /nfs/dbraw/zinc/69/48/20/585694820.db2.gz VFTHLXQOIHBSCP-UHFFFAOYSA-N 1 2 241.281 2.850 20 10 BFCDLO COc1ccc(NCc2cc(F)ccc2O)[nH+]c1 ZINC000779092617 585744846 /nfs/dbraw/zinc/74/48/46/585744846.db2.gz KNZCOYDQJKNIBC-UHFFFAOYSA-N 1 2 248.257 2.547 20 10 BFCDLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1ccc(F)cc1O ZINC000800502103 586223467 /nfs/dbraw/zinc/22/34/67/586223467.db2.gz MNPRPLSXHODROB-SSDOTTSWSA-N 1 2 245.244 2.980 20 10 BFCDLO C[C@H]([NH2+]C1(C(F)F)CC1)c1cc(F)ccc1O ZINC000800503225 586223933 /nfs/dbraw/zinc/22/39/33/586223933.db2.gz PXDJIDKIHKLSHH-ZETCQYMHSA-N 1 2 245.244 2.980 20 10 BFCDLO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccn[nH]2)c(O)c1 ZINC000815577049 586688214 /nfs/dbraw/zinc/68/82/14/586688214.db2.gz FOKKSZDRKZICBN-LLVKDONJSA-N 1 2 245.326 2.583 20 10 BFCDLO CC(C)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816528603 586738993 /nfs/dbraw/zinc/73/89/93/586738993.db2.gz JVRJYYIAEPIDAH-UHFFFAOYSA-N 1 2 231.698 2.930 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[NH2+]C1CC=CC1 ZINC000816557739 586740368 /nfs/dbraw/zinc/74/03/68/586740368.db2.gz ZOMABVJKTAQWND-UHFFFAOYSA-N 1 2 241.693 2.993 20 10 BFCDLO C[N@H+](CCF)Cc1cc(Cl)cc(F)c1O ZINC000816640013 586747138 /nfs/dbraw/zinc/74/71/38/586747138.db2.gz PJCWIVPBWCOMME-UHFFFAOYSA-N 1 2 235.661 2.586 20 10 BFCDLO C[N@@H+](CCF)Cc1cc(Cl)cc(F)c1O ZINC000816640013 586747139 /nfs/dbraw/zinc/74/71/39/586747139.db2.gz PJCWIVPBWCOMME-UHFFFAOYSA-N 1 2 235.661 2.586 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@@H](F)C1 ZINC000824571154 587276931 /nfs/dbraw/zinc/27/69/31/587276931.db2.gz KSOQINVLZXWHFQ-SECBINFHSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@@H](F)C1 ZINC000824571154 587276932 /nfs/dbraw/zinc/27/69/32/587276932.db2.gz KSOQINVLZXWHFQ-SECBINFHSA-N 1 2 247.672 2.729 20 10 BFCDLO Cc1c[nH]c(CNc2ccccc2OCCF)[nH+]1 ZINC000850313162 588536191 /nfs/dbraw/zinc/53/61/91/588536191.db2.gz QQFCRNZLUDSKHB-UHFFFAOYSA-N 1 2 249.289 2.679 20 10 BFCDLO CC(C)[C@@H]1CC[N@@H+]1Cc1ccc(F)c(F)c1O ZINC000876879318 590253095 /nfs/dbraw/zinc/25/30/95/590253095.db2.gz PRRWMSGOBNQALD-NSHDSACASA-N 1 2 241.281 2.901 20 10 BFCDLO CC(C)[C@@H]1CC[N@H+]1Cc1ccc(F)c(F)c1O ZINC000876879318 590253096 /nfs/dbraw/zinc/25/30/96/590253096.db2.gz PRRWMSGOBNQALD-NSHDSACASA-N 1 2 241.281 2.901 20 10 BFCDLO COc1ccc([N@H+](C)CCC[C@@H]2CCO2)cc1 ZINC000877610410 590372450 /nfs/dbraw/zinc/37/24/50/590372450.db2.gz UYSVJMQWGJGOIF-CQSZACIVSA-N 1 2 235.327 2.701 20 10 BFCDLO COc1ccc([N@@H+](C)CCC[C@@H]2CCO2)cc1 ZINC000877610410 590372453 /nfs/dbraw/zinc/37/24/53/590372453.db2.gz UYSVJMQWGJGOIF-CQSZACIVSA-N 1 2 235.327 2.701 20 10 BFCDLO Cc1ccc(C[N@H+]2CCCC(F)(F)C2)c(O)c1 ZINC000877610956 590372770 /nfs/dbraw/zinc/37/27/70/590372770.db2.gz MTMFNWIXVJTBDQ-UHFFFAOYSA-N 1 2 241.281 2.932 20 10 BFCDLO Cc1cc(C[N@@H+]2Cc3cccc(O)c3C2)sn1 ZINC000877703166 590395713 /nfs/dbraw/zinc/39/57/13/590395713.db2.gz UKQPOGHFQDGNPM-UHFFFAOYSA-N 1 2 246.335 2.673 20 10 BFCDLO Cc1cc(C[N@H+]2Cc3cccc(O)c3C2)sn1 ZINC000877703166 590395716 /nfs/dbraw/zinc/39/57/16/590395716.db2.gz UKQPOGHFQDGNPM-UHFFFAOYSA-N 1 2 246.335 2.673 20 10 BFCDLO Cc1csc(C[N@H+]2Cc3cccc(O)c3C2)n1 ZINC000877702730 590395825 /nfs/dbraw/zinc/39/58/25/590395825.db2.gz FOSSKIKBCVPYRI-UHFFFAOYSA-N 1 2 246.335 2.673 20 10 BFCDLO CCOc1ccc(O)c(C[NH2+][C@H](C)C(F)F)c1 ZINC000883407593 591651102 /nfs/dbraw/zinc/65/11/02/591651102.db2.gz ZNTAIJKUDZFQPX-MRVPVSSYSA-N 1 2 245.269 2.534 20 10 BFCDLO CCC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000134900600 591958164 /nfs/dbraw/zinc/95/81/64/591958164.db2.gz OMVNBZAJRTWXTQ-ZETCQYMHSA-N 1 2 215.243 2.731 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2C[C@@]23CCOC3)cc1 ZINC000886267776 592190658 /nfs/dbraw/zinc/19/06/58/592190658.db2.gz UXPUQOMRHKYZSV-SWLSCSKDSA-N 1 2 247.338 2.558 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2C[C@@]23CCOC3)cc1 ZINC000886267776 592190661 /nfs/dbraw/zinc/19/06/61/592190661.db2.gz UXPUQOMRHKYZSV-SWLSCSKDSA-N 1 2 247.338 2.558 20 10 BFCDLO C[C@H]([NH2+]C1(C(F)F)CC1)c1ccccc1O ZINC000309453398 633086309 /nfs/dbraw/zinc/08/63/09/633086309.db2.gz NAJUXHQUPDDSDX-QMMMGPOBSA-N 1 2 227.254 2.841 20 10 BFCDLO CC[C@H](C)[N@H+](C)Cc1cccc(F)c1O ZINC000165410818 640568573 /nfs/dbraw/zinc/56/85/73/640568573.db2.gz PNSSHMFBSASXJT-VIFPVBQESA-N 1 2 211.280 2.762 20 10 BFCDLO CC[C@H](C)[N@@H+](C)Cc1cccc(F)c1O ZINC000165410818 640568586 /nfs/dbraw/zinc/56/85/86/640568586.db2.gz PNSSHMFBSASXJT-VIFPVBQESA-N 1 2 211.280 2.762 20 10 BFCDLO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)C(F)F ZINC000922339602 643975922 /nfs/dbraw/zinc/97/59/22/643975922.db2.gz TYIDAJZQJATWJK-VIFPVBQESA-N 1 2 241.281 2.755 20 10 BFCDLO CC(C)(F)C[NH2+]Cc1cccc(Cl)c1O ZINC000877663224 645806489 /nfs/dbraw/zinc/80/64/89/645806489.db2.gz LKFVUJRZOJEKCG-UHFFFAOYSA-N 1 2 231.698 2.883 20 10 BFCDLO Oc1c(C[NH+]2CCCCC2)ccc(F)c1F ZINC000703448077 712076123 /nfs/dbraw/zinc/07/61/23/712076123.db2.gz PRYQTLIPGNHNQN-UHFFFAOYSA-N 1 2 227.254 2.656 20 10 BFCDLO CC/C=C/C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708495491 712212087 /nfs/dbraw/zinc/21/20/87/712212087.db2.gz COIUAVUWCZMZAL-ONEGZZNKSA-N 1 2 227.254 2.726 20 10 BFCDLO C[C@@H]([NH2+][C@@H](C)C(F)F)c1ccc(F)cc1O ZINC000389967372 711101302 /nfs/dbraw/zinc/10/13/02/711101302.db2.gz OKQHSHVDPZIHKM-RQJHMYQMSA-N 1 2 233.233 2.836 20 10 BFCDLO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)C(F)F)c1 ZINC000389916357 711097130 /nfs/dbraw/zinc/09/71/30/711097130.db2.gz NDUKYIULPLVVJQ-HTQZYQBOSA-N 1 2 245.269 2.705 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+][C@H]1[C@@H]2CCC[C@@H]21 ZINC000390786142 711134420 /nfs/dbraw/zinc/13/44/20/711134420.db2.gz POYJGEFPBQIXBN-IAZYJMLFSA-N 1 2 237.730 2.934 20 10 BFCDLO C[C@@H]([NH2+]C1CCC1)c1cc(F)cc(F)c1O ZINC000393791703 711678519 /nfs/dbraw/zinc/67/85/19/711678519.db2.gz MMYYQZOXIXEHFF-SSDOTTSWSA-N 1 2 227.254 2.874 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]CC1CCC1 ZINC000162832472 711810191 /nfs/dbraw/zinc/81/01/91/711810191.db2.gz XNRAEVSQYOOBTB-UHFFFAOYSA-N 1 2 225.719 2.935 20 10 BFCDLO C[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000703447869 712075935 /nfs/dbraw/zinc/07/59/35/712075935.db2.gz MNABAKRCWRDQRK-QMMMGPOBSA-N 1 2 227.254 2.512 20 10 BFCDLO C[C@H]1CC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000703447869 712075937 /nfs/dbraw/zinc/07/59/37/712075937.db2.gz MNABAKRCWRDQRK-QMMMGPOBSA-N 1 2 227.254 2.512 20 10 BFCDLO C[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC000708442659 712194824 /nfs/dbraw/zinc/19/48/24/712194824.db2.gz NZCPOPJWYHOAGF-PELKAZGASA-N 1 2 241.281 2.949 20 10 BFCDLO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CC=CCC1 ZINC000708437653 712194907 /nfs/dbraw/zinc/19/49/07/712194907.db2.gz SMKBSEIMQGUMCZ-LLVKDONJSA-N 1 2 239.265 2.869 20 10 BFCDLO CC1(C)CC[C@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC000708440642 712195241 /nfs/dbraw/zinc/19/52/41/712195241.db2.gz DFHRUWDOXHFBEH-LLVKDONJSA-N 1 2 241.281 2.949 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+][C@@H]1CC12CC2 ZINC000715272254 712515462 /nfs/dbraw/zinc/51/54/62/712515462.db2.gz PWEXISVZEKCNBW-SNVBAGLBSA-N 1 2 223.703 2.688 20 10 BFCDLO Oc1cc(Cl)c(F)cc1C[NH+]1CC=CC1 ZINC001237933558 980115060 /nfs/dbraw/zinc/11/50/60/980115060.db2.gz CNJLBGTWWNDZJQ-UHFFFAOYSA-N 1 2 227.666 2.557 20 10 BFCDLO Cc1c(F)cc[nH+]c1NCc1ccc(O)c(O)c1 ZINC001158995331 963969512 /nfs/dbraw/zinc/96/95/12/963969512.db2.gz CWKSJTVNDHVFNE-UHFFFAOYSA-N 1 2 248.257 2.552 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+][C@@H]1C=CCC1 ZINC000698210860 965105150 /nfs/dbraw/zinc/10/51/50/965105150.db2.gz BFERCHLUNKUDJA-SNVBAGLBSA-N 1 2 223.703 2.854 20 10 BFCDLO CSc1cc[nH+]c(NCc2ccc(N)cc2)c1 ZINC001162787993 965169034 /nfs/dbraw/zinc/16/90/34/965169034.db2.gz WEFDQLBENOCTNJ-UHFFFAOYSA-N 1 2 245.351 2.998 20 10 BFCDLO COc1cc(C)c[nH+]c1NCc1ccc(N)cc1 ZINC001162787823 965170853 /nfs/dbraw/zinc/17/08/53/965170853.db2.gz REFWFUODJMIAIN-UHFFFAOYSA-N 1 2 243.310 2.593 20 10 BFCDLO Cc1cc(C)c(C[NH+]2CC(F)(C3CC3)C2)c(O)c1 ZINC001231842985 977762262 /nfs/dbraw/zinc/76/22/62/977762262.db2.gz REROOSQYDXAMES-UHFFFAOYSA-N 1 2 249.329 2.943 20 10 BFCDLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(Cl)c1O ZINC001231909317 977794107 /nfs/dbraw/zinc/79/41/07/977794107.db2.gz IRVMICQNQAIGAL-SCZZXKLOSA-N 1 2 243.709 2.978 20 10 BFCDLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(Cl)c1O ZINC001231909317 977794113 /nfs/dbraw/zinc/79/41/13/977794113.db2.gz IRVMICQNQAIGAL-SCZZXKLOSA-N 1 2 243.709 2.978 20 10 BFCDLO CC[N@H+](C)Cc1cc(F)cc(Cl)c1O ZINC001237811505 980059607 /nfs/dbraw/zinc/05/96/07/980059607.db2.gz ZZZYKRIECKVHLM-UHFFFAOYSA-N 1 2 217.671 2.636 20 10 BFCDLO CC[N@@H+](C)Cc1cc(F)cc(Cl)c1O ZINC001237811505 980059612 /nfs/dbraw/zinc/05/96/12/980059612.db2.gz ZZZYKRIECKVHLM-UHFFFAOYSA-N 1 2 217.671 2.636 20 10 BFCDLO C[N@H+](CCF)Cc1cc(F)c(Cl)cc1O ZINC001237944060 980113259 /nfs/dbraw/zinc/11/32/59/980113259.db2.gz RZGUNWIUXWBREN-UHFFFAOYSA-N 1 2 235.661 2.586 20 10 BFCDLO C[N@@H+](CCF)Cc1cc(F)c(Cl)cc1O ZINC001237944060 980113263 /nfs/dbraw/zinc/11/32/63/980113263.db2.gz RZGUNWIUXWBREN-UHFFFAOYSA-N 1 2 235.661 2.586 20 10 BFCDLO c1ccn(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001242015922 983214525 /nfs/dbraw/zinc/21/45/25/983214525.db2.gz RLXOOYRIEZWEHN-UHFFFAOYSA-N 1 2 209.252 2.867 20 10 BFCDLO CC[C@@H]([NH2+]Cc1cn[nH]c1C)c1ccccc1O ZINC000038011122 343365435 /nfs/dbraw/zinc/36/54/35/343365435.db2.gz KHFNZNHEVVBYDZ-CYBMUJFWSA-N 1 2 245.326 2.665 20 10 BFCDLO CC[N@@H+](Cc1cccc(C)c1O)CC(F)F ZINC000184090809 347914468 /nfs/dbraw/zinc/91/44/68/347914468.db2.gz PCDKIVTXZNTKOQ-UHFFFAOYSA-N 1 2 229.270 2.788 20 10 BFCDLO CC[N@H+](Cc1cccc(C)c1O)CC(F)F ZINC000184090809 347914471 /nfs/dbraw/zinc/91/44/71/347914471.db2.gz PCDKIVTXZNTKOQ-UHFFFAOYSA-N 1 2 229.270 2.788 20 10 BFCDLO CC(C)C[N@H+](C)Cc1cccc(F)c1O ZINC000165410966 358436186 /nfs/dbraw/zinc/43/61/86/358436186.db2.gz RHTVTUIXLNZPPM-UHFFFAOYSA-N 1 2 211.280 2.619 20 10 BFCDLO CC(C)C[N@@H+](C)Cc1cccc(F)c1O ZINC000165410966 358436190 /nfs/dbraw/zinc/43/61/90/358436190.db2.gz RHTVTUIXLNZPPM-UHFFFAOYSA-N 1 2 211.280 2.619 20 10 BFCDLO CCC[N@H+](C)Cc1cccc(Cl)c1O ZINC000157753964 169081919 /nfs/dbraw/zinc/08/19/19/169081919.db2.gz HJMVPLANSYVDHY-UHFFFAOYSA-N 1 2 213.708 2.887 20 10 BFCDLO CCC[N@@H+](C)Cc1cccc(Cl)c1O ZINC000157753964 169081923 /nfs/dbraw/zinc/08/19/23/169081923.db2.gz HJMVPLANSYVDHY-UHFFFAOYSA-N 1 2 213.708 2.887 20 10 BFCDLO Cc1ccc(O)c(C[N@H+](CC(F)F)C2CC2)c1 ZINC000093276803 384226391 /nfs/dbraw/zinc/22/63/91/384226391.db2.gz UNQCVUGJBAOYCF-UHFFFAOYSA-N 1 2 241.281 2.930 20 10 BFCDLO Cc1ccc(O)c(C[N@@H+](CC(F)F)C2CC2)c1 ZINC000093276803 384226395 /nfs/dbraw/zinc/22/63/95/384226395.db2.gz UNQCVUGJBAOYCF-UHFFFAOYSA-N 1 2 241.281 2.930 20 10 BFCDLO CC[N@H+](CCCOC)c1ccc(OC)cc1 ZINC000299408230 386448457 /nfs/dbraw/zinc/44/84/57/386448457.db2.gz YNVXZPSVGFRTDF-UHFFFAOYSA-N 1 2 223.316 2.558 20 10 BFCDLO CC[N@@H+](CCCOC)c1ccc(OC)cc1 ZINC000299408230 386448462 /nfs/dbraw/zinc/44/84/62/386448462.db2.gz YNVXZPSVGFRTDF-UHFFFAOYSA-N 1 2 223.316 2.558 20 10 BFCDLO CC[N@H+](CCCF)c1ccc(OC)cc1 ZINC000268933961 386723598 /nfs/dbraw/zinc/72/35/98/386723598.db2.gz ZUBGDJTZYPWIFO-UHFFFAOYSA-N 1 2 211.280 2.881 20 10 BFCDLO CC[N@@H+](CCCF)c1ccc(OC)cc1 ZINC000268933961 386723605 /nfs/dbraw/zinc/72/36/05/386723605.db2.gz ZUBGDJTZYPWIFO-UHFFFAOYSA-N 1 2 211.280 2.881 20 10 BFCDLO CC[NH+](CC)Cc1cccc(Cl)c1O ZINC000157701356 387866790 /nfs/dbraw/zinc/86/67/90/387866790.db2.gz VYDOVAONTTWCMD-UHFFFAOYSA-N 1 2 213.708 2.887 20 10 BFCDLO CS[C@@H](C)C[NH2+]Cc1cccc(Cl)c1O ZINC000162711743 388252521 /nfs/dbraw/zinc/25/25/21/388252521.db2.gz QRSHLMQDBZAUFN-QMMMGPOBSA-N 1 2 245.775 2.887 20 10 BFCDLO CC(C)OCC[NH2+]Cc1cccc(Cl)c1O ZINC000134125454 167242137 /nfs/dbraw/zinc/24/21/37/167242137.db2.gz AOXKOZKGHBFDCY-UHFFFAOYSA-N 1 2 243.734 2.560 20 10 BFCDLO CC[C@H](C[NH2+]Cc1cccc(Cl)c1O)OC ZINC000290927433 171438281 /nfs/dbraw/zinc/43/82/81/171438281.db2.gz ONPVVWFQIPEPHP-SNVBAGLBSA-N 1 2 243.734 2.560 20 10 BFCDLO CO[C@H](C)[C@@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000290908679 174843185 /nfs/dbraw/zinc/84/31/85/174843185.db2.gz MYFWYORCCHRGSL-RKDXNWHRSA-N 1 2 243.734 2.559 20 10 BFCDLO CCn1cc[nH+]c1CN(C)c1ccc(OC)cc1 ZINC000844352747 582580108 /nfs/dbraw/zinc/58/01/08/582580108.db2.gz GEIXGCMXGHITLO-UHFFFAOYSA-N 1 2 245.326 2.548 20 10 BFCDLO C[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2O)[C@H]1C ZINC000894861666 583535101 /nfs/dbraw/zinc/53/51/01/583535101.db2.gz LPLPJDNQLLDPQG-SFYZADRCSA-N 1 2 227.254 2.511 20 10 BFCDLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(F)c2O)[C@H]1C ZINC000894861666 583535104 /nfs/dbraw/zinc/53/51/04/583535104.db2.gz LPLPJDNQLLDPQG-SFYZADRCSA-N 1 2 227.254 2.511 20 10 BFCDLO Oc1c(F)cc(F)cc1C[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000895326878 583651548 /nfs/dbraw/zinc/65/15/48/583651548.db2.gz INFIPBBLGXHZDR-IUCAKERBSA-N 1 2 239.265 2.512 20 10 BFCDLO Oc1c(F)cc(F)cc1C[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000895326878 583651550 /nfs/dbraw/zinc/65/15/50/583651550.db2.gz INFIPBBLGXHZDR-IUCAKERBSA-N 1 2 239.265 2.512 20 10 BFCDLO Cc1cccc(O)c1C[N@@H+]1CC[C@H]1C(F)F ZINC000895432114 583670710 /nfs/dbraw/zinc/67/07/10/583670710.db2.gz UXMAAIJATDHHID-JTQLQIEISA-N 1 2 227.254 2.540 20 10 BFCDLO Cc1cccc(O)c1C[N@H+]1CC[C@H]1C(F)F ZINC000895432114 583670712 /nfs/dbraw/zinc/67/07/12/583670712.db2.gz UXMAAIJATDHHID-JTQLQIEISA-N 1 2 227.254 2.540 20 10 BFCDLO CCc1cccc(C[N@@H+]2CC[C@H]2C(F)F)c1O ZINC000895432411 583671275 /nfs/dbraw/zinc/67/12/75/583671275.db2.gz ZITTXCWKFJWBHC-NSHDSACASA-N 1 2 241.281 2.794 20 10 BFCDLO CCc1cccc(C[N@H+]2CC[C@H]2C(F)F)c1O ZINC000895432411 583671276 /nfs/dbraw/zinc/67/12/76/583671276.db2.gz ZITTXCWKFJWBHC-NSHDSACASA-N 1 2 241.281 2.794 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]CC1(F)CC1 ZINC000898218554 584093188 /nfs/dbraw/zinc/09/31/88/584093188.db2.gz JVDXDFUBTAWSHR-UHFFFAOYSA-N 1 2 229.682 2.637 20 10 BFCDLO CC(C)Oc1ccc([N@H+](C)C[C@@H]2CCOC2)cc1 ZINC000759933840 585382942 /nfs/dbraw/zinc/38/29/42/585382942.db2.gz RHMZTSJPDFZOQC-ZDUSSCGKSA-N 1 2 249.354 2.947 20 10 BFCDLO CC(C)Oc1ccc([N@@H+](C)C[C@@H]2CCOC2)cc1 ZINC000759933840 585382943 /nfs/dbraw/zinc/38/29/43/585382943.db2.gz RHMZTSJPDFZOQC-ZDUSSCGKSA-N 1 2 249.354 2.947 20 10 BFCDLO CC[N@H+](CC1CC1)c1ccc(OC)cc1 ZINC000763508893 585449336 /nfs/dbraw/zinc/44/93/36/585449336.db2.gz XLURACQKULLXNU-UHFFFAOYSA-N 1 2 205.301 2.932 20 10 BFCDLO CC[N@@H+](CC1CC1)c1ccc(OC)cc1 ZINC000763508893 585449337 /nfs/dbraw/zinc/44/93/37/585449337.db2.gz XLURACQKULLXNU-UHFFFAOYSA-N 1 2 205.301 2.932 20 10 BFCDLO C[C@H]1C[C@@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816535698 586739578 /nfs/dbraw/zinc/73/95/78/586739578.db2.gz XDCPYCVWFNJABL-JGVFFNPUSA-N 1 2 243.709 2.930 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[N@H+]1CC=CCC1 ZINC000816564730 586740319 /nfs/dbraw/zinc/74/03/19/586740319.db2.gz OKAREJHCISNUSG-UHFFFAOYSA-N 1 2 241.693 2.947 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC=CCC1 ZINC000816564730 586740322 /nfs/dbraw/zinc/74/03/22/586740322.db2.gz OKAREJHCISNUSG-UHFFFAOYSA-N 1 2 241.693 2.947 20 10 BFCDLO C[C@@H]([NH2+][C@@H]1CC12CC2)c1cc(F)cc(F)c1O ZINC000818356729 586889070 /nfs/dbraw/zinc/88/90/70/586889070.db2.gz QLCOFHAZTBNNJB-RDDDGLTNSA-N 1 2 239.265 2.874 20 10 BFCDLO CC[C@H]([NH2+]Cc1cc(F)ccc1O)C(F)F ZINC000824510630 587272772 /nfs/dbraw/zinc/27/27/72/587272772.db2.gz YKVGSKTUNTUEHI-VIFPVBQESA-N 1 2 233.233 2.665 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[NH+]1CC2(CC2)C1 ZINC000824533911 587274106 /nfs/dbraw/zinc/27/41/06/587274106.db2.gz SGPDDAWGOHTQOF-UHFFFAOYSA-N 1 2 241.693 2.781 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH+]1CC2(CC2)C1 ZINC000824534016 587274457 /nfs/dbraw/zinc/27/44/57/587274457.db2.gz XDMNOXUYCTWYCT-UHFFFAOYSA-N 1 2 241.693 2.781 20 10 BFCDLO COc1ccc2c(c1)CCCC[N@H+]2CC[C@@H](C)O ZINC000828569772 587451001 /nfs/dbraw/zinc/45/10/01/587451001.db2.gz UJROBKKGLNOCNI-GFCCVEGCSA-N 1 2 249.354 2.609 20 10 BFCDLO COc1ccc2c(c1)CCCC[N@@H+]2CC[C@@H](C)O ZINC000828569772 587451002 /nfs/dbraw/zinc/45/10/02/587451002.db2.gz UJROBKKGLNOCNI-GFCCVEGCSA-N 1 2 249.354 2.609 20 10 BFCDLO COc1ccc([N@H+](CC[C@H](C)O)CC2CC2)cc1 ZINC000831594381 587621994 /nfs/dbraw/zinc/62/19/94/587621994.db2.gz USRBOLNIVKNGKA-LBPRGKRZSA-N 1 2 249.354 2.683 20 10 BFCDLO COc1ccc([N@@H+](CC[C@H](C)O)CC2CC2)cc1 ZINC000831594381 587621996 /nfs/dbraw/zinc/62/19/96/587621996.db2.gz USRBOLNIVKNGKA-LBPRGKRZSA-N 1 2 249.354 2.683 20 10 BFCDLO Oc1cccc2c1[C@@H]([NH2+]C1(C(F)F)CC1)CC2 ZINC000834794484 587767078 /nfs/dbraw/zinc/76/70/78/587767078.db2.gz ZUUHMLBLDPXIFP-VIFPVBQESA-N 1 2 239.265 2.767 20 10 BFCDLO COCC(C)(C)C[N@H+](C)c1ccc(OC)cc1 ZINC000845998313 588253262 /nfs/dbraw/zinc/25/32/62/588253262.db2.gz LKWVHINVSZEVSX-UHFFFAOYSA-N 1 2 237.343 2.804 20 10 BFCDLO COCC(C)(C)C[N@@H+](C)c1ccc(OC)cc1 ZINC000845998313 588253263 /nfs/dbraw/zinc/25/32/63/588253263.db2.gz LKWVHINVSZEVSX-UHFFFAOYSA-N 1 2 237.343 2.804 20 10 BFCDLO CC[N@@H+](Cc1ccc(C)cc1O)CC(F)F ZINC000877330446 590313090 /nfs/dbraw/zinc/31/30/90/590313090.db2.gz CZCVDAZOKXZXKN-UHFFFAOYSA-N 1 2 229.270 2.788 20 10 BFCDLO CC[N@H+](Cc1ccc(C)cc1O)CC(F)F ZINC000877330446 590313093 /nfs/dbraw/zinc/31/30/93/590313093.db2.gz CZCVDAZOKXZXKN-UHFFFAOYSA-N 1 2 229.270 2.788 20 10 BFCDLO Oc1c(C[N@@H+]2CC[C@@H]2C2CC2)ccc(F)c1F ZINC000877562516 590359972 /nfs/dbraw/zinc/35/99/72/590359972.db2.gz VJSPBPISRRICIZ-LLVKDONJSA-N 1 2 239.265 2.655 20 10 BFCDLO Oc1c(C[N@H+]2CC[C@@H]2C2CC2)ccc(F)c1F ZINC000877562516 590359974 /nfs/dbraw/zinc/35/99/74/590359974.db2.gz VJSPBPISRRICIZ-LLVKDONJSA-N 1 2 239.265 2.655 20 10 BFCDLO Cc1ccc(O)c(CNc2nc[nH+]c(C)c2C)c1 ZINC000882652500 591406886 /nfs/dbraw/zinc/40/68/86/591406886.db2.gz ZXWNHWORCDWTBO-UHFFFAOYSA-N 1 2 243.310 2.720 20 10 BFCDLO CCC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000134900620 591958010 /nfs/dbraw/zinc/95/80/10/591958010.db2.gz OMVNBZAJRTWXTQ-SSDOTTSWSA-N 1 2 215.243 2.731 20 10 BFCDLO CSCC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000134908200 591958178 /nfs/dbraw/zinc/95/81/78/591958178.db2.gz IVKKSKWFNVXHBY-SSDOTTSWSA-N 1 2 247.310 2.684 20 10 BFCDLO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ncco1 ZINC000886276129 592195520 /nfs/dbraw/zinc/19/55/20/592195520.db2.gz XSXXDGKDEMZOBN-LLVKDONJSA-N 1 2 245.326 2.591 20 10 BFCDLO C[C@@H]([NH2+][C@@H](C)C(F)F)c1c(O)cccc1F ZINC000886651969 592291007 /nfs/dbraw/zinc/29/10/07/592291007.db2.gz WCKHBXBHJVUGRH-RQJHMYQMSA-N 1 2 233.233 2.836 20 10 BFCDLO COCCCC[NH2+]Cc1cccc(Cl)c1O ZINC000162828279 635136843 /nfs/dbraw/zinc/13/68/43/635136843.db2.gz IXRKJJIDDQJAIB-UHFFFAOYSA-N 1 2 243.734 2.562 20 10 BFCDLO C[C@H]([NH2+]C[C@@H]1C[C@H]1C)c1cc(F)cc(F)c1O ZINC000756458565 644628065 /nfs/dbraw/zinc/62/80/65/644628065.db2.gz XMHVTCLHJRNETR-VGMNWLOBSA-N 1 2 241.281 2.977 20 10 BFCDLO C[C@@H]([NH2+]CC(C)(F)F)c1cc(F)ccc1O ZINC000393508319 710608845 /nfs/dbraw/zinc/60/88/45/710608845.db2.gz INTIDWCVKXJPTM-SSDOTTSWSA-N 1 2 233.233 2.837 20 10 BFCDLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)C(F)F ZINC000389967368 711101083 /nfs/dbraw/zinc/10/10/83/711101083.db2.gz OKQHSHVDPZIHKM-NKWVEPMBSA-N 1 2 233.233 2.836 20 10 BFCDLO CC(C)(C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708392243 712192035 /nfs/dbraw/zinc/19/20/35/712192035.db2.gz ZLYIFIKCQJYZDW-UHFFFAOYSA-N 1 2 215.243 2.559 20 10 BFCDLO Oc1ccc(F)c(Cl)c1C[NH+]1CC=CC1 ZINC001237122377 979820515 /nfs/dbraw/zinc/82/05/15/979820515.db2.gz ULRPRDNSDNOIOW-UHFFFAOYSA-N 1 2 227.666 2.557 20 10 BFCDLO C[C@@H]1CC[N@@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237933383 980112799 /nfs/dbraw/zinc/11/27/99/980112799.db2.gz ASCLHFSYNFYISE-SSDOTTSWSA-N 1 2 229.682 2.779 20 10 BFCDLO C[C@@H]1CC[N@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237933383 980112805 /nfs/dbraw/zinc/11/28/05/980112805.db2.gz ASCLHFSYNFYISE-SSDOTTSWSA-N 1 2 229.682 2.779 20 10 BFCDLO Oc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1CF ZINC001142534740 964374920 /nfs/dbraw/zinc/37/49/20/964374920.db2.gz UQGHKCUOPFOOQY-SECBINFHSA-N 1 2 245.244 2.604 20 10 BFCDLO Oc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1CF ZINC001142534740 964374932 /nfs/dbraw/zinc/37/49/32/964374932.db2.gz UQGHKCUOPFOOQY-SECBINFHSA-N 1 2 245.244 2.604 20 10 BFCDLO Cc1c(F)cc[nH+]c1NCc1ccc(N)cc1 ZINC001162785598 965169158 /nfs/dbraw/zinc/16/91/58/965169158.db2.gz JFSSZOIHUFBRDF-UHFFFAOYSA-N 1 2 231.274 2.723 20 10 BFCDLO Nc1ccc(CNc2cc(N)cc(Cl)[nH+]2)cc1 ZINC001162783931 965169939 /nfs/dbraw/zinc/16/99/39/965169939.db2.gz CPTHQULDBQUITA-UHFFFAOYSA-N 1 2 248.717 2.512 20 10 BFCDLO C[C@H]1CC[N@H+](Cc2ccccc2O)CC1(F)F ZINC001203550520 966677905 /nfs/dbraw/zinc/67/79/05/966677905.db2.gz XGLJDIFDCJZXAE-JTQLQIEISA-N 1 2 241.281 2.869 20 10 BFCDLO C[C@H]1CC[N@@H+](Cc2ccccc2O)CC1(F)F ZINC001203550520 966677922 /nfs/dbraw/zinc/67/79/22/966677922.db2.gz XGLJDIFDCJZXAE-JTQLQIEISA-N 1 2 241.281 2.869 20 10 BFCDLO C[C@@H]1CC[N@H+](Cc2ccccc2O)CC1(F)F ZINC001203550521 966683839 /nfs/dbraw/zinc/68/38/39/966683839.db2.gz XGLJDIFDCJZXAE-SNVBAGLBSA-N 1 2 241.281 2.869 20 10 BFCDLO C[C@@H]1CC[N@@H+](Cc2ccccc2O)CC1(F)F ZINC001203550521 966683846 /nfs/dbraw/zinc/68/38/46/966683846.db2.gz XGLJDIFDCJZXAE-SNVBAGLBSA-N 1 2 241.281 2.869 20 10 BFCDLO Cn1c[nH+]cc1-c1ccc(-n2cccc2)cc1 ZINC001243069860 984495831 /nfs/dbraw/zinc/49/58/31/984495831.db2.gz ZLSYJTLHWNRAFQ-UHFFFAOYSA-N 1 2 223.279 2.878 20 10 BFCDLO C[C@@H]([NH2+]CC1CC1)c1ccc(F)c(F)c1O ZINC000191196813 355343044 /nfs/dbraw/zinc/34/30/44/355343044.db2.gz IWINXINIRIPOHB-SSDOTTSWSA-N 1 2 227.254 2.731 20 10 BFCDLO CCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293825159 169265895 /nfs/dbraw/zinc/26/58/95/169265895.db2.gz DOIDQYJLVOUBPB-UHFFFAOYSA-N 1 2 217.671 2.684 20 10 BFCDLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000038011343 384052901 /nfs/dbraw/zinc/05/29/01/384052901.db2.gz IPYBYFUQDHMAEV-NSHDSACASA-N 1 2 245.326 2.583 20 10 BFCDLO CC[C@H](COC)[NH2+]Cc1cccc(Cl)c1O ZINC000162867866 384700542 /nfs/dbraw/zinc/70/05/42/384700542.db2.gz MCLCZRGJCLBGGS-SNVBAGLBSA-N 1 2 243.734 2.560 20 10 BFCDLO CO[C@H](C)C[N@H+](C)Cc1cccc(Cl)c1O ZINC000289545238 386326457 /nfs/dbraw/zinc/32/64/57/386326457.db2.gz IGIMSKCFQWLNOK-SECBINFHSA-N 1 2 243.734 2.512 20 10 BFCDLO CO[C@H](C)C[N@@H+](C)Cc1cccc(Cl)c1O ZINC000289545238 386326460 /nfs/dbraw/zinc/32/64/60/386326460.db2.gz IGIMSKCFQWLNOK-SECBINFHSA-N 1 2 243.734 2.512 20 10 BFCDLO C[C@H]([NH2+]C[C@H]1C[C@@H]1C)c1ccc(F)c(F)c1O ZINC000276928939 386391664 /nfs/dbraw/zinc/39/16/64/386391664.db2.gz NYDGXKMSCKXDRL-XHNCKOQMSA-N 1 2 241.281 2.977 20 10 BFCDLO CSCCC[NH2+]Cc1cccc(Cl)c1O ZINC000162867367 388253908 /nfs/dbraw/zinc/25/39/08/388253908.db2.gz WHVMACDGDHHIHM-UHFFFAOYSA-N 1 2 245.775 2.888 20 10 BFCDLO CC(C)Oc1ccc(N(C)Cc2c[nH+]c[nH]2)cc1 ZINC000894568333 583485314 /nfs/dbraw/zinc/48/53/14/583485314.db2.gz ZZKKRFFPDXGNHV-UHFFFAOYSA-N 1 2 245.326 2.833 20 10 BFCDLO CC(C)Oc1ccc(N(C)Cc2c[nH]c[nH+]2)cc1 ZINC000894568333 583485316 /nfs/dbraw/zinc/48/53/16/583485316.db2.gz ZZKKRFFPDXGNHV-UHFFFAOYSA-N 1 2 245.326 2.833 20 10 BFCDLO CC1(C)C[NH+](Cc2cc(F)cc(F)c2O)C1 ZINC000895458164 583677410 /nfs/dbraw/zinc/67/74/10/583677410.db2.gz UQJGOIHYJPHKTL-UHFFFAOYSA-N 1 2 227.254 2.512 20 10 BFCDLO C[N@H+](CCCF)Cc1cc(Cl)cc(F)c1O ZINC000895896213 583743666 /nfs/dbraw/zinc/74/36/66/583743666.db2.gz RAMYGWUQPFSBJD-UHFFFAOYSA-N 1 2 249.688 2.976 20 10 BFCDLO C[N@@H+](CCCF)Cc1cc(Cl)cc(F)c1O ZINC000895896213 583743668 /nfs/dbraw/zinc/74/36/68/583743668.db2.gz RAMYGWUQPFSBJD-UHFFFAOYSA-N 1 2 249.688 2.976 20 10 BFCDLO C/C=C\C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000858536370 588962237 /nfs/dbraw/zinc/96/22/37/588962237.db2.gz HBCCJQNECQXNNB-VEMNSZJBSA-N 1 2 227.254 2.897 20 10 BFCDLO Oc1ccccc1C[N@@H+](CCF)Cc1ccco1 ZINC000759347194 585370661 /nfs/dbraw/zinc/37/06/61/585370661.db2.gz KMJRWELGSYBUOT-UHFFFAOYSA-N 1 2 249.285 2.957 20 10 BFCDLO CCOc1ccc([N@H+](CC)C[C@H](C)CO)cc1 ZINC000766914337 585511593 /nfs/dbraw/zinc/51/15/93/585511593.db2.gz JAHGDMWWZMJOLN-LBPRGKRZSA-N 1 2 237.343 2.540 20 10 BFCDLO CCOc1ccc([N@@H+](CC)C[C@H](C)CO)cc1 ZINC000766914337 585511594 /nfs/dbraw/zinc/51/15/94/585511594.db2.gz JAHGDMWWZMJOLN-LBPRGKRZSA-N 1 2 237.343 2.540 20 10 BFCDLO CC[N@H+](C[C@@H]1CCCOC1)c1ccc(OC)cc1 ZINC000768542148 585540125 /nfs/dbraw/zinc/54/01/25/585540125.db2.gz NMIMXVCXJLAYIQ-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO CC[N@@H+](C[C@@H]1CCCOC1)c1ccc(OC)cc1 ZINC000768542148 585540126 /nfs/dbraw/zinc/54/01/26/585540126.db2.gz NMIMXVCXJLAYIQ-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO CN(C)c1ccc(C[NH2+]CC(C)(F)F)cc1F ZINC000815146992 586670169 /nfs/dbraw/zinc/67/01/69/586670169.db2.gz OBBVDQXNRVIPSX-UHFFFAOYSA-N 1 2 246.276 2.637 20 10 BFCDLO CCOc1ccc(O)c(C[NH2+]CC(C)(F)F)c1 ZINC000815146923 586670456 /nfs/dbraw/zinc/67/04/56/586670456.db2.gz LTVSGZUGWIBYFV-UHFFFAOYSA-N 1 2 245.269 2.536 20 10 BFCDLO COc1ccc([N@H+](C)C[C@H]2CCCOC2)cc1 ZINC000844353343 588186949 /nfs/dbraw/zinc/18/69/49/588186949.db2.gz SGKPCXISOFNJEL-GFCCVEGCSA-N 1 2 235.327 2.558 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@H]2CCCOC2)cc1 ZINC000844353343 588186951 /nfs/dbraw/zinc/18/69/51/588186951.db2.gz SGKPCXISOFNJEL-GFCCVEGCSA-N 1 2 235.327 2.558 20 10 BFCDLO COc1ccc([N@H+](C)CCC[C@H]2CCOC2)cc1 ZINC000844355074 588187402 /nfs/dbraw/zinc/18/74/02/588187402.db2.gz KEHVDJRQJMLRIC-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1ccc([N@@H+](C)CCC[C@H]2CCOC2)cc1 ZINC000844355074 588187403 /nfs/dbraw/zinc/18/74/03/588187403.db2.gz KEHVDJRQJMLRIC-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1ccc([N@H+](C)CC2(C)CC2)cc1 ZINC000845999750 588253066 /nfs/dbraw/zinc/25/30/66/588253066.db2.gz YTPQSDRODAGVKY-UHFFFAOYSA-N 1 2 205.301 2.932 20 10 BFCDLO COc1ccc([N@@H+](C)CC2(C)CC2)cc1 ZINC000845999750 588253067 /nfs/dbraw/zinc/25/30/67/588253067.db2.gz YTPQSDRODAGVKY-UHFFFAOYSA-N 1 2 205.301 2.932 20 10 BFCDLO Cn1cc[nH+]c1CSc1ncc(Cl)s1 ZINC000849998630 588513153 /nfs/dbraw/zinc/51/31/53/588513153.db2.gz HHPUQEPUKLNVNL-UHFFFAOYSA-N 1 2 245.760 2.822 20 10 BFCDLO CCc1cc(N[C@@H](C)c2ccccc2O)nc[nH+]1 ZINC000866237426 589482123 /nfs/dbraw/zinc/48/21/23/589482123.db2.gz JANDWGGKDZWFOI-JTQLQIEISA-N 1 2 243.310 2.918 20 10 BFCDLO CC[N@@H+](Cc1c(C)cccc1O)CC(F)F ZINC000877331414 590318211 /nfs/dbraw/zinc/31/82/11/590318211.db2.gz OJTSSBSDGCQSRC-UHFFFAOYSA-N 1 2 229.270 2.788 20 10 BFCDLO CC[N@H+](Cc1c(C)cccc1O)CC(F)F ZINC000877331414 590318213 /nfs/dbraw/zinc/31/82/13/590318213.db2.gz OJTSSBSDGCQSRC-UHFFFAOYSA-N 1 2 229.270 2.788 20 10 BFCDLO CC[N@H+](C[C@H]1CCO[C@@H]1C)c1ccc(OC)cc1 ZINC000878219343 590525826 /nfs/dbraw/zinc/52/58/26/590525826.db2.gz KDXLQYTYLQYUBC-CHWSQXEVSA-N 1 2 249.354 2.947 20 10 BFCDLO CC[N@@H+](C[C@H]1CCO[C@@H]1C)c1ccc(OC)cc1 ZINC000878219343 590525829 /nfs/dbraw/zinc/52/58/29/590525829.db2.gz KDXLQYTYLQYUBC-CHWSQXEVSA-N 1 2 249.354 2.947 20 10 BFCDLO Cn1c[nH+]c(CSc2ncc(Cl)s2)c1 ZINC000882238381 591319278 /nfs/dbraw/zinc/31/92/78/591319278.db2.gz NOWWTVRCVJINGB-UHFFFAOYSA-N 1 2 245.760 2.822 20 10 BFCDLO COC(C)(C)C[NH2+]Cc1cccc(Cl)c1O ZINC000133898889 591867683 /nfs/dbraw/zinc/86/76/83/591867683.db2.gz AXXXTNFZGZNQDH-UHFFFAOYSA-N 1 2 243.734 2.560 20 10 BFCDLO CSCC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000134908179 591957942 /nfs/dbraw/zinc/95/79/42/591957942.db2.gz IVKKSKWFNVXHBY-ZETCQYMHSA-N 1 2 247.310 2.684 20 10 BFCDLO CC(C)C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000134902388 591958143 /nfs/dbraw/zinc/95/81/43/591958143.db2.gz YJXIPNJUQRDNPO-QMMMGPOBSA-N 1 2 229.270 2.977 20 10 BFCDLO C[C@H]([NH2+]CC1CC1)c1cc(F)cc(F)c1O ZINC000134912450 591959225 /nfs/dbraw/zinc/95/92/25/591959225.db2.gz APXBXPMSRZGLEB-ZETCQYMHSA-N 1 2 227.254 2.731 20 10 BFCDLO CCc1nc(N[C@H](C)c2ccccc2O)cc[nH+]1 ZINC000884574700 591985123 /nfs/dbraw/zinc/98/51/23/591985123.db2.gz RCIGMFBECZXGLO-SNVBAGLBSA-N 1 2 243.310 2.918 20 10 BFCDLO C[C@@H]([NH2+]CC(C)(F)F)c1c(O)cccc1F ZINC000886615547 592276120 /nfs/dbraw/zinc/27/61/20/592276120.db2.gz IUWNGTCFNGKPGN-SSDOTTSWSA-N 1 2 233.233 2.837 20 10 BFCDLO CC[C@@H]([NH2+]CCOC)c1cccc(Cl)c1O ZINC000310038260 634102626 /nfs/dbraw/zinc/10/26/26/634102626.db2.gz VXLHOTSYHMPOEM-LLVKDONJSA-N 1 2 243.734 2.733 20 10 BFCDLO COc1ccc([N@H+](C)CC2CCC(=O)CC2)cc1 ZINC000258936533 635225015 /nfs/dbraw/zinc/22/50/15/635225015.db2.gz PBXBVYHQWBPGQM-UHFFFAOYSA-N 1 2 247.338 2.891 20 10 BFCDLO COc1ccc([N@@H+](C)CC2CCC(=O)CC2)cc1 ZINC000258936533 635225019 /nfs/dbraw/zinc/22/50/19/635225019.db2.gz PBXBVYHQWBPGQM-UHFFFAOYSA-N 1 2 247.338 2.891 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]CC1CC1 ZINC000157757110 640730930 /nfs/dbraw/zinc/73/09/30/640730930.db2.gz PCTBMJUYHKSLSB-UHFFFAOYSA-N 1 2 211.692 2.545 20 10 BFCDLO CC(C)([NH2+]Cc1cc(F)ccc1O)C(F)F ZINC000381395402 710632303 /nfs/dbraw/zinc/63/23/03/710632303.db2.gz OPLIZUNARPVHSL-UHFFFAOYSA-N 1 2 233.233 2.665 20 10 BFCDLO COc1ccc(C[NH2+]CC(C)(F)F)cc1C ZINC000382111157 710787860 /nfs/dbraw/zinc/78/78/60/710787860.db2.gz DUVQWNNVBIUPNF-UHFFFAOYSA-N 1 2 229.270 2.748 20 10 BFCDLO CC(F)(F)C[NH2+]Cc1cc(Cl)ccc1O ZINC000382384626 711573298 /nfs/dbraw/zinc/57/32/98/711573298.db2.gz KKUBVELYTDBMIQ-UHFFFAOYSA-N 1 2 235.661 2.790 20 10 BFCDLO CCC1([NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000708501784 712211886 /nfs/dbraw/zinc/21/18/86/712211886.db2.gz IYKIFXBVDLOFCZ-UHFFFAOYSA-N 1 2 227.254 2.703 20 10 BFCDLO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)C(F)F ZINC000389967802 712692725 /nfs/dbraw/zinc/69/27/25/712692725.db2.gz OZOXKCGZAXSJDU-NKWVEPMBSA-N 1 2 233.233 2.836 20 10 BFCDLO CC1C[NH+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001237119851 979820664 /nfs/dbraw/zinc/82/06/64/979820664.db2.gz GTPFLKFEMWXBBY-UHFFFAOYSA-N 1 2 229.682 2.636 20 10 BFCDLO CC(C)C[N@H+](C)Cc1c(O)cc(F)cc1F ZINC001140579773 960441367 /nfs/dbraw/zinc/44/13/67/960441367.db2.gz FUQUVAUMUJVBPH-UHFFFAOYSA-N 1 2 229.270 2.758 20 10 BFCDLO CC(C)C[N@@H+](C)Cc1c(O)cc(F)cc1F ZINC001140579773 960441375 /nfs/dbraw/zinc/44/13/75/960441375.db2.gz FUQUVAUMUJVBPH-UHFFFAOYSA-N 1 2 229.270 2.758 20 10 BFCDLO Cc1ccc(O)c(C[NH+]2CC(F)(C3CC3)C2)c1 ZINC001140617289 960458438 /nfs/dbraw/zinc/45/84/38/960458438.db2.gz LEFHJEFWUQGVOK-UHFFFAOYSA-N 1 2 235.302 2.635 20 10 BFCDLO Cc1ccc(C[N@@H+]2Cc3cccnc3C2)c(O)c1 ZINC001140948721 960749854 /nfs/dbraw/zinc/74/98/54/960749854.db2.gz XODVLMOGTWMRFG-UHFFFAOYSA-N 1 2 240.306 2.611 20 10 BFCDLO Cc1ccc(C[N@H+]2Cc3cccnc3C2)c(O)c1 ZINC001140948721 960749867 /nfs/dbraw/zinc/74/98/67/960749867.db2.gz XODVLMOGTWMRFG-UHFFFAOYSA-N 1 2 240.306 2.611 20 10 BFCDLO COc1ncc(-c2[nH+]ccc3c2ccn3C)s1 ZINC001241410141 968993742 /nfs/dbraw/zinc/99/37/42/968993742.db2.gz CIDUYIVMKXJHJT-UHFFFAOYSA-N 1 2 245.307 2.705 20 10 BFCDLO CCC[N@H+](C)Cc1ccc(OC)c(Cl)c1O ZINC001236805571 979736306 /nfs/dbraw/zinc/73/63/06/979736306.db2.gz IDGFXTZRJFUYHS-UHFFFAOYSA-N 1 2 243.734 2.896 20 10 BFCDLO CCC[N@@H+](C)Cc1ccc(OC)c(Cl)c1O ZINC001236805571 979736314 /nfs/dbraw/zinc/73/63/14/979736314.db2.gz IDGFXTZRJFUYHS-UHFFFAOYSA-N 1 2 243.734 2.896 20 10 BFCDLO C[C@@H]1CC[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC001237617616 979975754 /nfs/dbraw/zinc/97/57/54/979975754.db2.gz TYULISVFBYXJOK-SSDOTTSWSA-N 1 2 229.682 2.779 20 10 BFCDLO C[C@@H]1CC[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC001237617616 979975757 /nfs/dbraw/zinc/97/57/57/979975757.db2.gz TYULISVFBYXJOK-SSDOTTSWSA-N 1 2 229.682 2.779 20 10 BFCDLO Cc1nn(C)c(C)c1-c1[nH+]ccc2c1ccn2C ZINC001240140447 981139558 /nfs/dbraw/zinc/13/95/58/981139558.db2.gz RWPBUBDOPFCRQQ-UHFFFAOYSA-N 1 2 240.310 2.591 20 10 BFCDLO Cn1ccc2ncc(-c3ccc4[nH+]ccn4c3)cc21 ZINC001240218423 981170961 /nfs/dbraw/zinc/17/09/61/981170961.db2.gz CRRQVMIEVDJVMV-UHFFFAOYSA-N 1 2 248.289 2.888 20 10 BFCDLO Cn1ccc2c1cc[nH+]c2-c1cc(F)ccc1N ZINC001244393634 986037621 /nfs/dbraw/zinc/03/76/21/986037621.db2.gz JCTUICBCQJDESI-UHFFFAOYSA-N 1 2 241.269 2.962 20 10 BFCDLO Cc1ccc(C)c(C[NH+]2CC(F)(C3CC3)C2)c1O ZINC001140178556 991549693 /nfs/dbraw/zinc/54/96/93/991549693.db2.gz OMFFMLDORRQUEK-UHFFFAOYSA-N 1 2 249.329 2.943 20 10 BFCDLO CCC[N@H+](Cc1cccc(F)c1O)C1CC1 ZINC000272286169 169174922 /nfs/dbraw/zinc/17/49/22/169174922.db2.gz NMNRIKZUYKXPIZ-UHFFFAOYSA-N 1 2 223.291 2.906 20 10 BFCDLO CCC[N@@H+](Cc1cccc(F)c1O)C1CC1 ZINC000272286169 169174925 /nfs/dbraw/zinc/17/49/25/169174925.db2.gz NMNRIKZUYKXPIZ-UHFFFAOYSA-N 1 2 223.291 2.906 20 10 BFCDLO Oc1ccccc1CNc1cc[nH+]c(C2CC2)n1 ZINC000264893337 183303924 /nfs/dbraw/zinc/30/39/24/183303924.db2.gz UBBNFGUKDRPJSB-UHFFFAOYSA-N 1 2 241.294 2.672 20 10 BFCDLO CC[C@@H](C[NH2+]Cc1cccc(Cl)c1O)OC ZINC000290927412 384961344 /nfs/dbraw/zinc/96/13/44/384961344.db2.gz ONPVVWFQIPEPHP-JTQLQIEISA-N 1 2 243.734 2.560 20 10 BFCDLO C[C@@H](C1CC1)[N@H+](C)Cc1cccc(F)c1O ZINC000272345015 385896479 /nfs/dbraw/zinc/89/64/79/385896479.db2.gz ZKLTWAKJYXRKBF-VIFPVBQESA-N 1 2 223.291 2.762 20 10 BFCDLO C[C@@H](C1CC1)[N@@H+](C)Cc1cccc(F)c1O ZINC000272345015 385896483 /nfs/dbraw/zinc/89/64/83/385896483.db2.gz ZKLTWAKJYXRKBF-VIFPVBQESA-N 1 2 223.291 2.762 20 10 BFCDLO CC[C@@H](COC)[NH2+]Cc1cccc(Cl)c1O ZINC000162867749 170848613 /nfs/dbraw/zinc/84/86/13/170848613.db2.gz MCLCZRGJCLBGGS-JTQLQIEISA-N 1 2 243.734 2.560 20 10 BFCDLO COc1ccc([N@H+](CCCO)[C@@H](C)C2CC2)cc1 ZINC000264598699 175137201 /nfs/dbraw/zinc/13/72/01/175137201.db2.gz JGWVKXNGEPUUHW-LBPRGKRZSA-N 1 2 249.354 2.683 20 10 BFCDLO COc1ccc([N@@H+](CCCO)[C@@H](C)C2CC2)cc1 ZINC000264598699 175137204 /nfs/dbraw/zinc/13/72/04/175137204.db2.gz JGWVKXNGEPUUHW-LBPRGKRZSA-N 1 2 249.354 2.683 20 10 BFCDLO C[C@@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000162816793 176175469 /nfs/dbraw/zinc/17/54/69/176175469.db2.gz ZZWJUABBVOGTQA-SECBINFHSA-N 1 2 225.719 2.887 20 10 BFCDLO C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000162816793 176175471 /nfs/dbraw/zinc/17/54/71/176175471.db2.gz ZZWJUABBVOGTQA-SECBINFHSA-N 1 2 225.719 2.887 20 10 BFCDLO C[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2O)[C@@H]1C ZINC000894861664 583535340 /nfs/dbraw/zinc/53/53/40/583535340.db2.gz LPLPJDNQLLDPQG-HTQZYQBOSA-N 1 2 227.254 2.511 20 10 BFCDLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(F)c2O)[C@@H]1C ZINC000894861664 583535341 /nfs/dbraw/zinc/53/53/41/583535341.db2.gz LPLPJDNQLLDPQG-HTQZYQBOSA-N 1 2 227.254 2.511 20 10 BFCDLO Oc1c(F)cc(F)cc1C[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000895326879 583651897 /nfs/dbraw/zinc/65/18/97/583651897.db2.gz INFIPBBLGXHZDR-RKDXNWHRSA-N 1 2 239.265 2.512 20 10 BFCDLO Oc1c(F)cc(F)cc1C[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000895326879 583651899 /nfs/dbraw/zinc/65/18/99/583651899.db2.gz INFIPBBLGXHZDR-RKDXNWHRSA-N 1 2 239.265 2.512 20 10 BFCDLO Cc1cccc(C[N@@H+]2CC[C@H]2C(F)F)c1O ZINC000895431308 583670086 /nfs/dbraw/zinc/67/00/86/583670086.db2.gz LQHTXRDQIBJXJI-JTQLQIEISA-N 1 2 227.254 2.540 20 10 BFCDLO Cc1cccc(C[N@H+]2CC[C@H]2C(F)F)c1O ZINC000895431308 583670087 /nfs/dbraw/zinc/67/00/87/583670087.db2.gz LQHTXRDQIBJXJI-JTQLQIEISA-N 1 2 227.254 2.540 20 10 BFCDLO COc1cccc([C@@H](C)[NH2+][C@@H](C)C(F)F)c1O ZINC000883400974 583795127 /nfs/dbraw/zinc/79/51/27/583795127.db2.gz ZAVGGBPNPDQFLX-SFYZADRCSA-N 1 2 245.269 2.705 20 10 BFCDLO CCC(F)(F)C[NH2+]Cc1c(O)cccc1OC ZINC000858259089 588941102 /nfs/dbraw/zinc/94/11/02/588941102.db2.gz ONZXHFNNBWUSQP-UHFFFAOYSA-N 1 2 245.269 2.536 20 10 BFCDLO CCOc1ccc([N@H+](C)C[C@H]2CCOC2)cc1 ZINC000739923943 585086540 /nfs/dbraw/zinc/08/65/40/585086540.db2.gz OAUPXVMUFGIGSM-GFCCVEGCSA-N 1 2 235.327 2.558 20 10 BFCDLO CCOc1ccc([N@@H+](C)C[C@H]2CCOC2)cc1 ZINC000739923943 585086541 /nfs/dbraw/zinc/08/65/41/585086541.db2.gz OAUPXVMUFGIGSM-GFCCVEGCSA-N 1 2 235.327 2.558 20 10 BFCDLO CCOc1ccc([N@H+](CC)CC2(C)COC2)cc1 ZINC000744391847 585149776 /nfs/dbraw/zinc/14/97/76/585149776.db2.gz MMMHVJYIXKGDFO-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO CCOc1ccc([N@@H+](CC)CC2(C)COC2)cc1 ZINC000744391847 585149777 /nfs/dbraw/zinc/14/97/77/585149777.db2.gz MMMHVJYIXKGDFO-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO CC(C)Oc1ccc([N@H+](C)C[C@H](C)CO)cc1 ZINC000759927216 585382931 /nfs/dbraw/zinc/38/29/31/585382931.db2.gz ADVHUSZIXGPQAK-LBPRGKRZSA-N 1 2 237.343 2.538 20 10 BFCDLO CC(C)Oc1ccc([N@@H+](C)C[C@H](C)CO)cc1 ZINC000759927216 585382932 /nfs/dbraw/zinc/38/29/32/585382932.db2.gz ADVHUSZIXGPQAK-LBPRGKRZSA-N 1 2 237.343 2.538 20 10 BFCDLO CC[N@@H+]1CCCCc2cc(OC)ccc21 ZINC000766269691 585499618 /nfs/dbraw/zinc/49/96/18/585499618.db2.gz NGTLTBUKQXDIQX-UHFFFAOYSA-N 1 2 205.301 2.858 20 10 BFCDLO CC[N@H+]1CCCCc2cc(OC)ccc21 ZINC000766269691 585499619 /nfs/dbraw/zinc/49/96/19/585499619.db2.gz NGTLTBUKQXDIQX-UHFFFAOYSA-N 1 2 205.301 2.858 20 10 BFCDLO CCOc1ccc([N@H+](C)C[C@H]2CCCOC2)cc1 ZINC000768531288 585539813 /nfs/dbraw/zinc/53/98/13/585539813.db2.gz ZWSYVKHLUOYCNN-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO CCOc1ccc([N@@H+](C)C[C@H]2CCCOC2)cc1 ZINC000768531288 585539814 /nfs/dbraw/zinc/53/98/14/585539814.db2.gz ZWSYVKHLUOYCNN-CYBMUJFWSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1ccc(NCc2cc(C)ccc2O)[nH+]c1 ZINC000769405589 585555780 /nfs/dbraw/zinc/55/57/80/585555780.db2.gz JENUTGAKYWEEQH-UHFFFAOYSA-N 1 2 244.294 2.716 20 10 BFCDLO CC1C[NH+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000802651626 586308272 /nfs/dbraw/zinc/30/82/72/586308272.db2.gz UIDALBYUDPVPHB-UHFFFAOYSA-N 1 2 229.682 2.636 20 10 BFCDLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2O)[C@@H]1C ZINC000816648223 586750242 /nfs/dbraw/zinc/75/02/42/586750242.db2.gz GYGXBQWSSWFIKW-RKDXNWHRSA-N 1 2 225.719 2.886 20 10 BFCDLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2O)[C@@H]1C ZINC000816648223 586750243 /nfs/dbraw/zinc/75/02/43/586750243.db2.gz GYGXBQWSSWFIKW-RKDXNWHRSA-N 1 2 225.719 2.886 20 10 BFCDLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2O)[C@H]1C ZINC000816648220 586750320 /nfs/dbraw/zinc/75/03/20/586750320.db2.gz GYGXBQWSSWFIKW-BDAKNGLRSA-N 1 2 225.719 2.886 20 10 BFCDLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2O)[C@H]1C ZINC000816648220 586750323 /nfs/dbraw/zinc/75/03/23/586750323.db2.gz GYGXBQWSSWFIKW-BDAKNGLRSA-N 1 2 225.719 2.886 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CC12CC2 ZINC000822497905 587171692 /nfs/dbraw/zinc/17/16/92/587171692.db2.gz NVSQUMRXOQFCSI-LLVKDONJSA-N 1 2 241.693 2.827 20 10 BFCDLO Oc1ccc(Cl)c(F)c1C[NH+]1CC2(CC2)C1 ZINC000824534006 587274255 /nfs/dbraw/zinc/27/42/55/587274255.db2.gz WVCTVYWHGBLOMA-UHFFFAOYSA-N 1 2 241.693 2.781 20 10 BFCDLO CCOC1CC(C[N@H+](C)c2ccc(OC)cc2)C1 ZINC000844354349 588186759 /nfs/dbraw/zinc/18/67/59/588186759.db2.gz BRYHYMKFOHIUAT-UHFFFAOYSA-N 1 2 249.354 2.947 20 10 BFCDLO CCOC1CC(C[N@@H+](C)c2ccc(OC)cc2)C1 ZINC000844354349 588186760 /nfs/dbraw/zinc/18/67/60/588186760.db2.gz BRYHYMKFOHIUAT-UHFFFAOYSA-N 1 2 249.354 2.947 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2CCCOC2)cc1 ZINC000844353344 588187069 /nfs/dbraw/zinc/18/70/69/588187069.db2.gz SGKPCXISOFNJEL-LBPRGKRZSA-N 1 2 235.327 2.558 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2CCCOC2)cc1 ZINC000844353344 588187070 /nfs/dbraw/zinc/18/70/70/588187070.db2.gz SGKPCXISOFNJEL-LBPRGKRZSA-N 1 2 235.327 2.558 20 10 BFCDLO COc1ccc([N@H+](C)CC2CCC2)cc1 ZINC000844355315 588187411 /nfs/dbraw/zinc/18/74/11/588187411.db2.gz NDGLWJHENTULAH-UHFFFAOYSA-N 1 2 205.301 2.932 20 10 BFCDLO COc1ccc([N@@H+](C)CC2CCC2)cc1 ZINC000844355315 588187412 /nfs/dbraw/zinc/18/74/12/588187412.db2.gz NDGLWJHENTULAH-UHFFFAOYSA-N 1 2 205.301 2.932 20 10 BFCDLO COc1ccc([N@H+](C)CC[C@@H]2CCOC2)cc1 ZINC000844355739 588187471 /nfs/dbraw/zinc/18/74/71/588187471.db2.gz SBCRBFROTWFMMN-GFCCVEGCSA-N 1 2 235.327 2.558 20 10 BFCDLO COc1ccc([N@@H+](C)CC[C@@H]2CCOC2)cc1 ZINC000844355739 588187472 /nfs/dbraw/zinc/18/74/72/588187472.db2.gz SBCRBFROTWFMMN-GFCCVEGCSA-N 1 2 235.327 2.558 20 10 BFCDLO CCO[C@@H](CN(C)c1ccc([NH3+])cc1)C1CC1 ZINC000863558708 589298745 /nfs/dbraw/zinc/29/87/45/589298745.db2.gz ULHUTJZTKQKTRF-AWEZNQCLSA-N 1 2 234.343 2.520 20 10 BFCDLO Oc1c(C[N@@H+]2CC[C@H]2C2CC2)ccc(F)c1F ZINC000877562517 590360273 /nfs/dbraw/zinc/36/02/73/590360273.db2.gz VJSPBPISRRICIZ-NSHDSACASA-N 1 2 239.265 2.655 20 10 BFCDLO Oc1c(C[N@H+]2CC[C@H]2C2CC2)ccc(F)c1F ZINC000877562517 590360275 /nfs/dbraw/zinc/36/02/75/590360275.db2.gz VJSPBPISRRICIZ-NSHDSACASA-N 1 2 239.265 2.655 20 10 BFCDLO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)C(F)F ZINC000895726016 636175399 /nfs/dbraw/zinc/17/53/99/636175399.db2.gz XAVYVGAZWSOYHV-JTQLQIEISA-N 1 2 242.313 2.804 20 10 BFCDLO C[C@@H]1CC[C@H]1[NH2+]Cc1cccc(Cl)c1O ZINC000309063277 631831367 /nfs/dbraw/zinc/83/13/67/631831367.db2.gz XMTQRSYWHOSUMP-LDYMZIIASA-N 1 2 225.719 2.934 20 10 BFCDLO Cn1c[nH+]cc1CSc1ncc(Cl)s1 ZINC000849999894 632589744 /nfs/dbraw/zinc/58/97/44/632589744.db2.gz BNQKNCOOIPGYMQ-UHFFFAOYSA-N 1 2 245.760 2.822 20 10 BFCDLO CCOC[C@@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000162860886 635144823 /nfs/dbraw/zinc/14/48/23/635144823.db2.gz BCAJUCBDQDVPDX-SECBINFHSA-N 1 2 243.734 2.560 20 10 BFCDLO Oc1ccc(F)cc1C[NH2+][C@H]1CCCC1(F)F ZINC000398145481 711403201 /nfs/dbraw/zinc/40/32/01/711403201.db2.gz XJXYMCPBCBRILD-NSHDSACASA-N 1 2 245.244 2.809 20 10 BFCDLO C[C@H]([NH2+]CC(C)(F)F)c1cc(F)ccc1O ZINC000393508323 711554547 /nfs/dbraw/zinc/55/45/47/711554547.db2.gz INTIDWCVKXJPTM-ZETCQYMHSA-N 1 2 233.233 2.837 20 10 BFCDLO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)C1CC1 ZINC000708393268 712191914 /nfs/dbraw/zinc/19/19/14/712191914.db2.gz AUXXMXYHQXZNLL-SSDOTTSWSA-N 1 2 227.254 2.559 20 10 BFCDLO CC1CC([NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000708391087 712192160 /nfs/dbraw/zinc/19/21/60/712192160.db2.gz TXVQSLSQFIQJFY-UHFFFAOYSA-N 1 2 227.254 2.559 20 10 BFCDLO Oc1c(F)cc(F)cc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000708441140 712194655 /nfs/dbraw/zinc/19/46/55/712194655.db2.gz IQWPTORFJFJTAX-SECBINFHSA-N 1 2 245.244 2.604 20 10 BFCDLO Oc1c(F)cc(F)cc1C[N@H+]1CCC[C@@H](F)C1 ZINC000708441140 712194656 /nfs/dbraw/zinc/19/46/56/712194656.db2.gz IQWPTORFJFJTAX-SECBINFHSA-N 1 2 245.244 2.604 20 10 BFCDLO C[C@@H]1CCC[C@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC000708442662 712194748 /nfs/dbraw/zinc/19/47/48/712194748.db2.gz NZCPOPJWYHOAGF-PRHODGIISA-N 1 2 241.281 2.949 20 10 BFCDLO C[C@H]1CCC[C@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC000708442665 712194850 /nfs/dbraw/zinc/19/48/50/712194850.db2.gz NZCPOPJWYHOAGF-QPUJVOFHSA-N 1 2 241.281 2.949 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+][C@H]1CC12CC2 ZINC000715272253 712515265 /nfs/dbraw/zinc/51/52/65/712515265.db2.gz PWEXISVZEKCNBW-JTQLQIEISA-N 1 2 223.703 2.688 20 10 BFCDLO CC1(C)C[NH+](Cc2c(O)ccc(F)c2F)C1 ZINC001233331653 978562481 /nfs/dbraw/zinc/56/24/81/978562481.db2.gz FMNOQLNFTZENKI-UHFFFAOYSA-N 1 2 227.254 2.512 20 10 BFCDLO Oc1ccccc1C[N@@H+]1CCCC(F)(F)C1 ZINC000404964748 971189092 /nfs/dbraw/zinc/18/90/92/971189092.db2.gz WTLZDBLQSAUXFJ-UHFFFAOYSA-N 1 2 227.254 2.623 20 10 BFCDLO Oc1ccccc1C[N@H+]1CCCC(F)(F)C1 ZINC000404964748 971189098 /nfs/dbraw/zinc/18/90/98/971189098.db2.gz WTLZDBLQSAUXFJ-UHFFFAOYSA-N 1 2 227.254 2.623 20 10 BFCDLO Cc1ccc(C)c(C[NH+]2CC(C)(F)C2)c1O ZINC001140178772 957719882 /nfs/dbraw/zinc/71/98/82/957719882.db2.gz XGZNPEZGKDSHNP-UHFFFAOYSA-N 1 2 223.291 2.553 20 10 BFCDLO CN(C)c1ccc(C[N@H+](C)CCF)c(Cl)c1 ZINC001140926985 960692736 /nfs/dbraw/zinc/69/27/36/960692736.db2.gz BSLPKTICTALXQZ-UHFFFAOYSA-N 1 2 244.741 2.807 20 10 BFCDLO CN(C)c1ccc(C[N@@H+](C)CCF)c(Cl)c1 ZINC001140926985 960692744 /nfs/dbraw/zinc/69/27/44/960692744.db2.gz BSLPKTICTALXQZ-UHFFFAOYSA-N 1 2 244.741 2.807 20 10 BFCDLO Nc1ccc(CNc2ccc(Cl)c(N)[nH+]2)cc1 ZINC001162790884 965177058 /nfs/dbraw/zinc/17/70/58/965177058.db2.gz XHSYPEDPCHMRTM-UHFFFAOYSA-N 1 2 248.717 2.512 20 10 BFCDLO C[N@H+](Cc1cccnc1)Cc1c(O)cccc1F ZINC001137831863 967822948 /nfs/dbraw/zinc/82/29/48/967822948.db2.gz QJXCQEKDMVTMRR-UHFFFAOYSA-N 1 2 246.285 2.558 20 10 BFCDLO C[N@@H+](Cc1cccnc1)Cc1c(O)cccc1F ZINC001137831863 967822956 /nfs/dbraw/zinc/82/29/56/967822956.db2.gz QJXCQEKDMVTMRR-UHFFFAOYSA-N 1 2 246.285 2.558 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]C/C=C/Cl ZINC001207739011 968872809 /nfs/dbraw/zinc/87/28/09/968872809.db2.gz UMSUHFWRLIDRMJ-GORDUTHDSA-N 1 2 232.110 2.888 20 10 BFCDLO COc1ccc(C[N@@H+]2CC[C@H]2C)c(O)c1Cl ZINC001236801165 979739326 /nfs/dbraw/zinc/73/93/26/979739326.db2.gz GLRDHCXHLHHIND-MRVPVSSYSA-N 1 2 241.718 2.648 20 10 BFCDLO COc1ccc(C[N@H+]2CC[C@H]2C)c(O)c1Cl ZINC001236801165 979739332 /nfs/dbraw/zinc/73/93/32/979739332.db2.gz GLRDHCXHLHHIND-MRVPVSSYSA-N 1 2 241.718 2.648 20 10 BFCDLO Cn1ccc2ccc(-c3ccc(N)[nH+]c3)cc21 ZINC001240574581 981487590 /nfs/dbraw/zinc/48/75/90/981487590.db2.gz SAJZEOVIXIOOLG-UHFFFAOYSA-N 1 2 223.279 2.823 20 10 BFCDLO C[N@H+](Cc1ccccn1)Cc1c(O)cccc1F ZINC001137832043 990855959 /nfs/dbraw/zinc/85/59/59/990855959.db2.gz YFQYTDUSXJRKPL-UHFFFAOYSA-N 1 2 246.285 2.558 20 10 BFCDLO C[N@@H+](Cc1ccccn1)Cc1c(O)cccc1F ZINC001137832043 990855960 /nfs/dbraw/zinc/85/59/60/990855960.db2.gz YFQYTDUSXJRKPL-UHFFFAOYSA-N 1 2 246.285 2.558 20 10 BFCDLO C[C@@H]1CC[N@H+](Cc2c(F)ccc(F)c2O)C1 ZINC001139685569 991320267 /nfs/dbraw/zinc/32/02/67/991320267.db2.gz OHUFZEQFVDWVKS-MRVPVSSYSA-N 1 2 227.254 2.512 20 10 BFCDLO C[C@@H]1CC[N@@H+](Cc2c(F)ccc(F)c2O)C1 ZINC001139685569 991320274 /nfs/dbraw/zinc/32/02/74/991320274.db2.gz OHUFZEQFVDWVKS-MRVPVSSYSA-N 1 2 227.254 2.512 20 10 BFCDLO CC[N@@H+](Cc1cccc(F)c1O)CC1CC1 ZINC000272334935 351469744 /nfs/dbraw/zinc/46/97/44/351469744.db2.gz XEAHQYZHDSPEKY-UHFFFAOYSA-N 1 2 223.291 2.763 20 10 BFCDLO CC[N@H+](Cc1cccc(F)c1O)CC1CC1 ZINC000272334935 351469746 /nfs/dbraw/zinc/46/97/46/351469746.db2.gz XEAHQYZHDSPEKY-UHFFFAOYSA-N 1 2 223.291 2.763 20 10 BFCDLO CC(C)[N@@H+](Cc1ccccc1O)CC(F)F ZINC000271453899 188089963 /nfs/dbraw/zinc/08/99/63/188089963.db2.gz VGZBLBKTRRCXLU-UHFFFAOYSA-N 1 2 229.270 2.868 20 10 BFCDLO CC(C)[N@H+](Cc1ccccc1O)CC(F)F ZINC000271453899 188089965 /nfs/dbraw/zinc/08/99/65/188089965.db2.gz VGZBLBKTRRCXLU-UHFFFAOYSA-N 1 2 229.270 2.868 20 10 BFCDLO CC1(C)C[C@@H]1[NH2+]Cc1cccc(Cl)c1O ZINC000162829508 202074657 /nfs/dbraw/zinc/07/46/57/202074657.db2.gz VNAZXKBKIFJWAL-JTQLQIEISA-N 1 2 225.719 2.934 20 10 BFCDLO CCCOc1ccc(C[NH2+]CC(F)F)c(O)c1 ZINC000298148215 169318343 /nfs/dbraw/zinc/31/83/43/169318343.db2.gz RGKVVGBWVWEPLU-UHFFFAOYSA-N 1 2 245.269 2.536 20 10 BFCDLO Cc1[nH]ncc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000038011342 384054555 /nfs/dbraw/zinc/05/45/55/384054555.db2.gz IPYBYFUQDHMAEV-LLVKDONJSA-N 1 2 245.326 2.583 20 10 BFCDLO C[C@H]([NH2+]C1CCC1)c1ccc(F)c(F)c1O ZINC000276976289 384627916 /nfs/dbraw/zinc/62/79/16/384627916.db2.gz VAIDOAGJWKEEIF-ZETCQYMHSA-N 1 2 227.254 2.874 20 10 BFCDLO CC[N@H+](CCOC)Cc1cccc(Cl)c1O ZINC000162809972 384690437 /nfs/dbraw/zinc/69/04/37/384690437.db2.gz MMRJHGNWULDVIV-UHFFFAOYSA-N 1 2 243.734 2.514 20 10 BFCDLO CC[N@@H+](CCOC)Cc1cccc(Cl)c1O ZINC000162809972 384690440 /nfs/dbraw/zinc/69/04/40/384690440.db2.gz MMRJHGNWULDVIV-UHFFFAOYSA-N 1 2 243.734 2.514 20 10 BFCDLO C[C@H](C1CC1)[N@H+](C)Cc1cccc(F)c1O ZINC000272345011 385895794 /nfs/dbraw/zinc/89/57/94/385895794.db2.gz ZKLTWAKJYXRKBF-SECBINFHSA-N 1 2 223.291 2.762 20 10 BFCDLO C[C@H](C1CC1)[N@@H+](C)Cc1cccc(F)c1O ZINC000272345011 385895799 /nfs/dbraw/zinc/89/57/99/385895799.db2.gz ZKLTWAKJYXRKBF-SECBINFHSA-N 1 2 223.291 2.762 20 10 BFCDLO CO[C@@H](C)C[N@H+](C)Cc1cccc(Cl)c1O ZINC000289545241 386327303 /nfs/dbraw/zinc/32/73/03/386327303.db2.gz IGIMSKCFQWLNOK-VIFPVBQESA-N 1 2 243.734 2.512 20 10 BFCDLO CO[C@@H](C)C[N@@H+](C)Cc1cccc(Cl)c1O ZINC000289545241 386327309 /nfs/dbraw/zinc/32/73/09/386327309.db2.gz IGIMSKCFQWLNOK-VIFPVBQESA-N 1 2 243.734 2.512 20 10 BFCDLO C[C@H]([NH2+]C[C@H]1C[C@H]1C)c1ccc(F)c(F)c1O ZINC000276928937 386392203 /nfs/dbraw/zinc/39/22/03/386392203.db2.gz NYDGXKMSCKXDRL-HRDYMLBCSA-N 1 2 241.281 2.977 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+][C@H]1CCSC1 ZINC000224889733 398103164 /nfs/dbraw/zinc/10/31/64/398103164.db2.gz KGEYVHPSDNUJGW-VIFPVBQESA-N 1 2 243.759 2.641 20 10 BFCDLO CO[C@H](C)CC[NH2+]Cc1cccc(Cl)c1O ZINC000271916180 174816940 /nfs/dbraw/zinc/81/69/40/174816940.db2.gz YWHXYRGYDYSZRX-SECBINFHSA-N 1 2 243.734 2.560 20 10 BFCDLO Cc1cc(O)c(C[N@@H+]2CC[C@@H]2C(F)F)cc1C ZINC000895430715 583669546 /nfs/dbraw/zinc/66/95/46/583669546.db2.gz GYUGFGZNLXBIAG-LLVKDONJSA-N 1 2 241.281 2.848 20 10 BFCDLO Cc1cc(O)c(C[N@H+]2CC[C@@H]2C(F)F)cc1C ZINC000895430715 583669547 /nfs/dbraw/zinc/66/95/47/583669547.db2.gz GYUGFGZNLXBIAG-LLVKDONJSA-N 1 2 241.281 2.848 20 10 BFCDLO CN(C)c1ccc(/C=C/C[NH2+]CC(F)F)cc1 ZINC000839093599 585090396 /nfs/dbraw/zinc/09/03/96/585090396.db2.gz UQGSEJQLOSTOLZ-ONEGZZNKSA-N 1 2 240.297 2.621 20 10 BFCDLO CCOCCC[N@H+](CC)c1ccc(OC)cc1 ZINC000741781946 585118450 /nfs/dbraw/zinc/11/84/50/585118450.db2.gz RPUXQQHZBURVJF-UHFFFAOYSA-N 1 2 237.343 2.948 20 10 BFCDLO CCOCCC[N@@H+](CC)c1ccc(OC)cc1 ZINC000741781946 585118451 /nfs/dbraw/zinc/11/84/51/585118451.db2.gz RPUXQQHZBURVJF-UHFFFAOYSA-N 1 2 237.343 2.948 20 10 BFCDLO CC(C)Oc1ccc([N@H+](C)C[C@@H](C)CO)cc1 ZINC000759927215 585382799 /nfs/dbraw/zinc/38/27/99/585382799.db2.gz ADVHUSZIXGPQAK-GFCCVEGCSA-N 1 2 237.343 2.538 20 10 BFCDLO CC(C)Oc1ccc([N@@H+](C)C[C@@H](C)CO)cc1 ZINC000759927215 585382800 /nfs/dbraw/zinc/38/28/00/585382800.db2.gz ADVHUSZIXGPQAK-GFCCVEGCSA-N 1 2 237.343 2.538 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH+]1CCCC1 ZINC000775638557 585682008 /nfs/dbraw/zinc/68/20/08/585682008.db2.gz LBCRHWLVWFASJW-UHFFFAOYSA-N 1 2 229.682 2.781 20 10 BFCDLO COc1ccc(N[C@H](C)c2ccccc2O)[nH+]c1 ZINC000783525540 585836033 /nfs/dbraw/zinc/83/60/33/585836033.db2.gz VMQRILPEPDKHAX-SNVBAGLBSA-N 1 2 244.294 2.969 20 10 BFCDLO CC[C@H]([NH2+]Cc1ccn[nH]1)c1ccc(C)cc1O ZINC000794808493 586049311 /nfs/dbraw/zinc/04/93/11/586049311.db2.gz ODSKGYVXRGGYGV-ZDUSSCGKSA-N 1 2 245.326 2.665 20 10 BFCDLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cccc(Cl)c1O ZINC000816648221 586750139 /nfs/dbraw/zinc/75/01/39/586750139.db2.gz GYGXBQWSSWFIKW-DTWKUNHWSA-N 1 2 225.719 2.886 20 10 BFCDLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cccc(Cl)c1O ZINC000816648221 586750142 /nfs/dbraw/zinc/75/01/42/586750142.db2.gz GYGXBQWSSWFIKW-DTWKUNHWSA-N 1 2 225.719 2.886 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH2+][C@@H]1CC12CC2 ZINC000822497565 587171935 /nfs/dbraw/zinc/17/19/35/587171935.db2.gz FQJDZCAFKDVAIP-SNVBAGLBSA-N 1 2 241.693 2.827 20 10 BFCDLO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)C(F)F ZINC000824510718 587272873 /nfs/dbraw/zinc/27/28/73/587272873.db2.gz ZDCCLOATNDKYAV-GFCCVEGCSA-N 1 2 242.313 2.886 20 10 BFCDLO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](F)C1 ZINC000824571949 587277130 /nfs/dbraw/zinc/27/71/30/587277130.db2.gz SNQCVDHWXDPWSS-SSDOTTSWSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](F)C1 ZINC000824571949 587277131 /nfs/dbraw/zinc/27/71/31/587277131.db2.gz SNQCVDHWXDPWSS-SSDOTTSWSA-N 1 2 247.672 2.729 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2CCSC2)cc1 ZINC000845999264 588253149 /nfs/dbraw/zinc/25/31/49/588253149.db2.gz VISYYNMOGAJJMJ-NSHDSACASA-N 1 2 237.368 2.885 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2CCSC2)cc1 ZINC000845999264 588253150 /nfs/dbraw/zinc/25/31/50/588253150.db2.gz VISYYNMOGAJJMJ-NSHDSACASA-N 1 2 237.368 2.885 20 10 BFCDLO CO[C@@H](CN(C)c1ccc([NH3+])cc1)C1CCCC1 ZINC000863558464 589298759 /nfs/dbraw/zinc/29/87/59/589298759.db2.gz JQMCPXKDDFOEGU-HNNXBMFYSA-N 1 2 248.370 2.910 20 10 BFCDLO Cc1ccc(CN(C)c2ccc(N)cc2)c(C)[nH+]1 ZINC000863558218 589299139 /nfs/dbraw/zinc/29/91/39/589299139.db2.gz AEXURLMVDORAJE-UHFFFAOYSA-N 1 2 241.338 2.917 20 10 BFCDLO CCc1cc(N[C@H](C)c2ccccc2O)nc[nH+]1 ZINC000866237428 589482174 /nfs/dbraw/zinc/48/21/74/589482174.db2.gz JANDWGGKDZWFOI-SNVBAGLBSA-N 1 2 243.310 2.918 20 10 BFCDLO CC(C)Nc1ccccc1NCc1[nH+]ccn1C ZINC000871846150 589824495 /nfs/dbraw/zinc/82/44/95/589824495.db2.gz SQTOUMIJFHRQQL-UHFFFAOYSA-N 1 2 244.342 2.853 20 10 BFCDLO Cc1cccc(O)c1C[N@@H+]1CCC(F)(F)C1 ZINC000877141688 590291733 /nfs/dbraw/zinc/29/17/33/590291733.db2.gz ZNRLQRFGHBVMBS-UHFFFAOYSA-N 1 2 227.254 2.542 20 10 BFCDLO Cc1cccc(O)c1C[N@H+]1CCC(F)(F)C1 ZINC000877141688 590291734 /nfs/dbraw/zinc/29/17/34/590291734.db2.gz ZNRLQRFGHBVMBS-UHFFFAOYSA-N 1 2 227.254 2.542 20 10 BFCDLO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(F)c(F)c1O ZINC000877486370 590338751 /nfs/dbraw/zinc/33/87/51/590338751.db2.gz IMWNIRKESUWPCY-YUMQZZPRSA-N 1 2 227.254 2.653 20 10 BFCDLO CCOc1ccc([N@H+](CCCO)CC2CC2)cc1 ZINC000879116903 590699769 /nfs/dbraw/zinc/69/97/69/590699769.db2.gz CYEQVXAAFPOHTA-UHFFFAOYSA-N 1 2 249.354 2.684 20 10 BFCDLO CCOc1ccc([N@@H+](CCCO)CC2CC2)cc1 ZINC000879116903 590699773 /nfs/dbraw/zinc/69/97/73/590699773.db2.gz CYEQVXAAFPOHTA-UHFFFAOYSA-N 1 2 249.354 2.684 20 10 BFCDLO CC(C)C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000134902408 591957859 /nfs/dbraw/zinc/95/78/59/591957859.db2.gz YJXIPNJUQRDNPO-MRVPVSSYSA-N 1 2 229.270 2.977 20 10 BFCDLO C[C@@H]([NH2+][C@H](C)C(F)F)c1c(O)cccc1F ZINC000886651968 592290953 /nfs/dbraw/zinc/29/09/53/592290953.db2.gz WCKHBXBHJVUGRH-RNFRBKRXSA-N 1 2 233.233 2.836 20 10 BFCDLO C[C@H]1CC[C@H]1[NH2+]Cc1cccc(Cl)c1O ZINC000309063274 631831066 /nfs/dbraw/zinc/83/10/66/631831066.db2.gz XMTQRSYWHOSUMP-GZMMTYOYSA-N 1 2 225.719 2.934 20 10 BFCDLO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)C(F)F)c1 ZINC000389916359 711097311 /nfs/dbraw/zinc/09/73/11/711097311.db2.gz NDUKYIULPLVVJQ-JGVFFNPUSA-N 1 2 245.269 2.705 20 10 BFCDLO CCOc1cccc(C[NH2+][C@H](C)C(F)F)c1O ZINC000389922287 711098103 /nfs/dbraw/zinc/09/81/03/711098103.db2.gz SFGIVGJLWBHDGR-MRVPVSSYSA-N 1 2 245.269 2.534 20 10 BFCDLO COc1ccc(C[NH2+][C@H](C)C(F)F)cc1C ZINC000389928578 711099100 /nfs/dbraw/zinc/09/91/00/711099100.db2.gz GKFCLGUPOXRQPI-SECBINFHSA-N 1 2 229.270 2.747 20 10 BFCDLO C[C@H](F)CC[NH2+]Cc1cccc(Cl)c1O ZINC000705670760 712135299 /nfs/dbraw/zinc/13/52/99/712135299.db2.gz WIJZAZHIQGQOGQ-QMMMGPOBSA-N 1 2 231.698 2.883 20 10 BFCDLO CC(C)=CC[NH2+]Cc1cc(F)cc(F)c1O ZINC000708391853 712192121 /nfs/dbraw/zinc/19/21/21/712192121.db2.gz WUDJGLDRMIGYKC-UHFFFAOYSA-N 1 2 227.254 2.726 20 10 BFCDLO CC(C)C[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000708400651 712192858 /nfs/dbraw/zinc/19/28/58/712192858.db2.gz ORLRJLNIQCXRHI-UHFFFAOYSA-N 1 2 229.270 2.758 20 10 BFCDLO CC(C)C[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000708400651 712192859 /nfs/dbraw/zinc/19/28/59/712192859.db2.gz ORLRJLNIQCXRHI-UHFFFAOYSA-N 1 2 229.270 2.758 20 10 BFCDLO Oc1c(F)cc(F)cc1C[NH+]1C2CCC1CC2 ZINC000708423606 712194212 /nfs/dbraw/zinc/19/42/12/712194212.db2.gz UEZTYJVSFMTVBO-UHFFFAOYSA-N 1 2 239.265 2.797 20 10 BFCDLO Oc1c(F)cc(F)cc1C[NH2+][C@]12C[C@H]1CCC2 ZINC000708496614 712212251 /nfs/dbraw/zinc/21/22/51/712212251.db2.gz MNMVWFCSQOBPLN-NOZJJQNGSA-N 1 2 239.265 2.703 20 10 BFCDLO Cc1c[nH+]cc(Nc2cccc(O)c2O)c1C ZINC001213530811 958234878 /nfs/dbraw/zinc/23/48/78/958234878.db2.gz MLNIDZDBJNLJJR-UHFFFAOYSA-N 1 2 230.267 2.853 20 10 BFCDLO C[N@H+](CCC1CC1)Cc1c(O)cc(F)cc1F ZINC001140584378 960443113 /nfs/dbraw/zinc/44/31/13/960443113.db2.gz PFRYNQPFHSIJNA-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO C[N@@H+](CCC1CC1)Cc1c(O)cc(F)cc1F ZINC001140584378 960443124 /nfs/dbraw/zinc/44/31/24/960443124.db2.gz PFRYNQPFHSIJNA-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO Cn1ccc2c1cccc2CCn1cc[nH+]c1 ZINC001250316741 967684717 /nfs/dbraw/zinc/68/47/17/967684717.db2.gz VLEILBKIRQJVNR-UHFFFAOYSA-N 1 2 225.295 2.618 20 10 BFCDLO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1C=CCCC1 ZINC001331291491 974674044 /nfs/dbraw/zinc/67/40/44/974674044.db2.gz YSKVQFZEKWTCBU-LLVKDONJSA-N 1 2 239.265 2.869 20 10 BFCDLO C[C@H]1CC[N@@H+]1Cc1cc(F)cc(Cl)c1O ZINC001237808517 980052296 /nfs/dbraw/zinc/05/22/96/980052296.db2.gz TVMCNRGKYYYICB-ZETCQYMHSA-N 1 2 229.682 2.779 20 10 BFCDLO C[C@H]1CC[N@H+]1Cc1cc(F)cc(Cl)c1O ZINC001237808517 980052304 /nfs/dbraw/zinc/05/23/04/980052304.db2.gz TVMCNRGKYYYICB-ZETCQYMHSA-N 1 2 229.682 2.779 20 10 BFCDLO Oc1c(Cl)cc(F)cc1C[NH+]1CC=CC1 ZINC001237807790 980056684 /nfs/dbraw/zinc/05/66/84/980056684.db2.gz LZIZUVXVWNEDGG-UHFFFAOYSA-N 1 2 227.666 2.557 20 10 BFCDLO Cn1ccc2c1cccc2-c1ccc[nH+]c1N ZINC001241822155 983075211 /nfs/dbraw/zinc/07/52/11/983075211.db2.gz ROQFKVDNWYNZOQ-UHFFFAOYSA-N 1 2 223.279 2.823 20 10 BFCDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000827506712 986898669 /nfs/dbraw/zinc/89/86/69/986898669.db2.gz KSUKFACHUJWLBD-ONGXEEELSA-N 1 2 237.730 2.887 20 10 BFCDLO Oc1c(Cl)cccc1C[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000827506712 986898672 /nfs/dbraw/zinc/89/86/72/986898672.db2.gz KSUKFACHUJWLBD-ONGXEEELSA-N 1 2 237.730 2.887 20 10 BFCDLO C[C@H]1CC[N@H+](Cc2c(F)ccc(F)c2O)C1 ZINC001139685570 991319874 /nfs/dbraw/zinc/31/98/74/991319874.db2.gz OHUFZEQFVDWVKS-QMMMGPOBSA-N 1 2 227.254 2.512 20 10 BFCDLO C[C@H]1CC[N@@H+](Cc2c(F)ccc(F)c2O)C1 ZINC001139685570 991319883 /nfs/dbraw/zinc/31/98/83/991319883.db2.gz OHUFZEQFVDWVKS-QMMMGPOBSA-N 1 2 227.254 2.512 20 10 BFCDLO C[C@H]([NH2+]CC1CC1)c1ccc(F)c(F)c1O ZINC000191196799 355342936 /nfs/dbraw/zinc/34/29/36/355342936.db2.gz IWINXINIRIPOHB-ZETCQYMHSA-N 1 2 227.254 2.731 20 10 BFCDLO CCC[NH2+]Cc1cccc(Br)c1O ZINC000042411482 169267660 /nfs/dbraw/zinc/26/76/60/169267660.db2.gz PHGNXJCDFKMSLG-UHFFFAOYSA-N 1 2 244.132 2.654 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]C1CCC1 ZINC000157757576 384485985 /nfs/dbraw/zinc/48/59/85/384485985.db2.gz QOOVZWTZBUMLOA-UHFFFAOYSA-N 1 2 211.692 2.688 20 10 BFCDLO COC[C@@H](C)[N@H+](C)Cc1cccc(Cl)c1O ZINC000162814736 384692268 /nfs/dbraw/zinc/69/22/68/384692268.db2.gz PVCYZYUSASWJJT-SECBINFHSA-N 1 2 243.734 2.512 20 10 BFCDLO COC[C@@H](C)[N@@H+](C)Cc1cccc(Cl)c1O ZINC000162814736 384692274 /nfs/dbraw/zinc/69/22/74/384692274.db2.gz PVCYZYUSASWJJT-SECBINFHSA-N 1 2 243.734 2.512 20 10 BFCDLO Oc1c(F)cccc1C[N@@H+]1CCC=C(F)C1 ZINC000274498826 386110832 /nfs/dbraw/zinc/11/08/32/386110832.db2.gz RDXLNVDQFYFCPX-UHFFFAOYSA-N 1 2 225.238 2.590 20 10 BFCDLO Oc1c(F)cccc1C[N@H+]1CCC=C(F)C1 ZINC000274498826 386110838 /nfs/dbraw/zinc/11/08/38/386110838.db2.gz RDXLNVDQFYFCPX-UHFFFAOYSA-N 1 2 225.238 2.590 20 10 BFCDLO CO[C@@H](C)CC[NH2+]Cc1cccc(Cl)c1O ZINC000271916181 389028137 /nfs/dbraw/zinc/02/81/37/389028137.db2.gz YWHXYRGYDYSZRX-VIFPVBQESA-N 1 2 243.734 2.560 20 10 BFCDLO C[C@@H]1C[C@@H]1C[NH2+]Cc1cccc(Cl)c1O ZINC000162520726 176396999 /nfs/dbraw/zinc/39/69/99/176396999.db2.gz VPAQCOAEDVECNW-PSASIEDQSA-N 1 2 225.719 2.791 20 10 BFCDLO C[C@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000162816890 177164474 /nfs/dbraw/zinc/16/44/74/177164474.db2.gz ZZWJUABBVOGTQA-VIFPVBQESA-N 1 2 225.719 2.887 20 10 BFCDLO C[C@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000162816890 177164476 /nfs/dbraw/zinc/16/44/76/177164476.db2.gz ZZWJUABBVOGTQA-VIFPVBQESA-N 1 2 225.719 2.887 20 10 BFCDLO C[C@H]1C[C@@H]1C[NH2+]Cc1cccc(Cl)c1O ZINC000162520853 177345423 /nfs/dbraw/zinc/34/54/23/177345423.db2.gz VPAQCOAEDVECNW-WCBMZHEXSA-N 1 2 225.719 2.791 20 10 BFCDLO C[C@@H](C1CC1)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000893946132 583257076 /nfs/dbraw/zinc/25/70/76/583257076.db2.gz LIIVZXLHYMZWNS-QMMMGPOBSA-N 1 2 241.281 2.901 20 10 BFCDLO C[C@@H](C1CC1)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000893946132 583257078 /nfs/dbraw/zinc/25/70/78/583257078.db2.gz LIIVZXLHYMZWNS-QMMMGPOBSA-N 1 2 241.281 2.901 20 10 BFCDLO Cc1cc(O)c(C[N@H+](C)CC(F)F)cc1C ZINC000103458793 585103614 /nfs/dbraw/zinc/10/36/14/585103614.db2.gz KZYJALNKOHEIBS-UHFFFAOYSA-N 1 2 229.270 2.706 20 10 BFCDLO Cc1cc(O)c(C[N@@H+](C)CC(F)F)cc1C ZINC000103458793 585103615 /nfs/dbraw/zinc/10/36/15/585103615.db2.gz KZYJALNKOHEIBS-UHFFFAOYSA-N 1 2 229.270 2.706 20 10 BFCDLO COc1ccc(O)c(C[NH2+]C(C)(C)C(F)F)c1 ZINC000793256884 586015398 /nfs/dbraw/zinc/01/53/98/586015398.db2.gz SZNLEVZQZRZJMB-UHFFFAOYSA-N 1 2 245.269 2.534 20 10 BFCDLO C[C@@H]([NH2+][C@H]1CC12CC2)c1cc(F)cc(F)c1O ZINC000818356728 586888847 /nfs/dbraw/zinc/88/88/47/586888847.db2.gz QLCOFHAZTBNNJB-HQJQHLMTSA-N 1 2 239.265 2.874 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CC12CC2 ZINC000822497906 587171831 /nfs/dbraw/zinc/17/18/31/587171831.db2.gz NVSQUMRXOQFCSI-NSHDSACASA-N 1 2 241.693 2.827 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH2+][C@H]1CC12CC2 ZINC000822497564 587172035 /nfs/dbraw/zinc/17/20/35/587172035.db2.gz FQJDZCAFKDVAIP-JTQLQIEISA-N 1 2 241.693 2.827 20 10 BFCDLO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)C(F)F ZINC000824508989 587272428 /nfs/dbraw/zinc/27/24/28/587272428.db2.gz ISYQFGLNTSVGEN-LLVKDONJSA-N 1 2 241.281 2.755 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+][C@@H]1[C@@H]2CCC[C@@H]21 ZINC000827489375 587382554 /nfs/dbraw/zinc/38/25/54/587382554.db2.gz POYJGEFPBQIXBN-PEGIJTEDSA-N 1 2 237.730 2.934 20 10 BFCDLO COc1ccc([N@H+](CC[C@@H](C)O)CC2CC2)cc1 ZINC000831594378 587621786 /nfs/dbraw/zinc/62/17/86/587621786.db2.gz USRBOLNIVKNGKA-GFCCVEGCSA-N 1 2 249.354 2.683 20 10 BFCDLO COc1ccc([N@@H+](CC[C@@H](C)O)CC2CC2)cc1 ZINC000831594378 587621788 /nfs/dbraw/zinc/62/17/88/587621788.db2.gz USRBOLNIVKNGKA-GFCCVEGCSA-N 1 2 249.354 2.683 20 10 BFCDLO Oc1cccc2c1[C@H]([NH2+]C1(C(F)F)CC1)CC2 ZINC000834794483 587767087 /nfs/dbraw/zinc/76/70/87/587767087.db2.gz ZUUHMLBLDPXIFP-SECBINFHSA-N 1 2 239.265 2.767 20 10 BFCDLO CC[N@H+](Cc1ccc(F)c(F)c1O)C1CC1 ZINC000876575502 590217542 /nfs/dbraw/zinc/21/75/42/590217542.db2.gz GVIACYAWLHDXAN-UHFFFAOYSA-N 1 2 227.254 2.655 20 10 BFCDLO CC[N@@H+](Cc1ccc(F)c(F)c1O)C1CC1 ZINC000876575502 590217543 /nfs/dbraw/zinc/21/75/43/590217543.db2.gz GVIACYAWLHDXAN-UHFFFAOYSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@H](C1CC1)[N@H+](C)Cc1ccc(F)c(F)c1O ZINC000876589019 590219226 /nfs/dbraw/zinc/21/92/26/590219226.db2.gz GODRWUVKKXGSRV-MRVPVSSYSA-N 1 2 241.281 2.901 20 10 BFCDLO C[C@H](C1CC1)[N@@H+](C)Cc1ccc(F)c(F)c1O ZINC000876589019 590219227 /nfs/dbraw/zinc/21/92/27/590219227.db2.gz GODRWUVKKXGSRV-MRVPVSSYSA-N 1 2 241.281 2.901 20 10 BFCDLO C[C@@H](C1CC1)[N@H+](C)Cc1ccc(F)c(F)c1O ZINC000876589020 590219544 /nfs/dbraw/zinc/21/95/44/590219544.db2.gz GODRWUVKKXGSRV-QMMMGPOBSA-N 1 2 241.281 2.901 20 10 BFCDLO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc(F)c(F)c1O ZINC000876589020 590219545 /nfs/dbraw/zinc/21/95/45/590219545.db2.gz GODRWUVKKXGSRV-QMMMGPOBSA-N 1 2 241.281 2.901 20 10 BFCDLO Cc1ccc(C[N@H+](C)Cc2cscn2)c(O)c1 ZINC000876642324 590225553 /nfs/dbraw/zinc/22/55/53/590225553.db2.gz XJMAPZUAAOLLCS-UHFFFAOYSA-N 1 2 248.351 2.789 20 10 BFCDLO Cc1ccc(C[N@@H+](C)Cc2cscn2)c(O)c1 ZINC000876642324 590225554 /nfs/dbraw/zinc/22/55/54/590225554.db2.gz XJMAPZUAAOLLCS-UHFFFAOYSA-N 1 2 248.351 2.789 20 10 BFCDLO CC[N@@H+](Cc1ccc(F)c(F)c1O)CC1CC1 ZINC000876731594 590234474 /nfs/dbraw/zinc/23/44/74/590234474.db2.gz KDSLRJSJFRTEPJ-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO CC[N@H+](Cc1ccc(F)c(F)c1O)CC1CC1 ZINC000876731594 590234476 /nfs/dbraw/zinc/23/44/76/590234476.db2.gz KDSLRJSJFRTEPJ-UHFFFAOYSA-N 1 2 241.281 2.902 20 10 BFCDLO Cc1cccc(O)c1C[N@H+]1CCCC(F)(F)C1 ZINC000877611430 590372256 /nfs/dbraw/zinc/37/22/56/590372256.db2.gz RFIJRNNTVSSRLL-UHFFFAOYSA-N 1 2 241.281 2.932 20 10 BFCDLO Oc1c(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)ccc(F)c1F ZINC000877635549 590381109 /nfs/dbraw/zinc/38/11/09/590381109.db2.gz WEJWIPYRRIOGLS-PSASIEDQSA-N 1 2 239.265 2.512 20 10 BFCDLO Oc1c(C[N@H+]2CC[C@@H]3C[C@@H]3C2)ccc(F)c1F ZINC000877635549 590381112 /nfs/dbraw/zinc/38/11/12/590381112.db2.gz WEJWIPYRRIOGLS-PSASIEDQSA-N 1 2 239.265 2.512 20 10 BFCDLO CCOc1ccc([N@H+](C)C[C@H]2CCO[C@H]2C)cc1 ZINC000878124160 590500484 /nfs/dbraw/zinc/50/04/84/590500484.db2.gz HJMCVOMDHBNBFL-QWHCGFSZSA-N 1 2 249.354 2.947 20 10 BFCDLO CCOc1ccc([N@@H+](C)C[C@H]2CCO[C@H]2C)cc1 ZINC000878124160 590500485 /nfs/dbraw/zinc/50/04/85/590500485.db2.gz HJMCVOMDHBNBFL-QWHCGFSZSA-N 1 2 249.354 2.947 20 10 BFCDLO CCc1nc(N[C@@H](C)c2ccccc2O)cc[nH+]1 ZINC000884574699 591985017 /nfs/dbraw/zinc/98/50/17/591985017.db2.gz RCIGMFBECZXGLO-JTQLQIEISA-N 1 2 243.310 2.918 20 10 BFCDLO C[C@H]([NH2+]C1CCC1)c1cc(F)cc(F)c1O ZINC000393791704 711678565 /nfs/dbraw/zinc/67/85/65/711678565.db2.gz MMYYQZOXIXEHFF-ZETCQYMHSA-N 1 2 227.254 2.874 20 10 BFCDLO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)C1CC1 ZINC000708393269 712191574 /nfs/dbraw/zinc/19/15/74/712191574.db2.gz AUXXMXYHQXZNLL-ZETCQYMHSA-N 1 2 227.254 2.559 20 10 BFCDLO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)C(F)F ZINC000389942060 711100128 /nfs/dbraw/zinc/10/01/28/711100128.db2.gz NNEFIJLZXBBFIK-ZCFIWIBFSA-N 1 2 235.661 2.789 20 10 BFCDLO C[C@H]1CCC[N@@H+]1Cc1ccc(F)c(F)c1O ZINC000703447872 712076198 /nfs/dbraw/zinc/07/61/98/712076198.db2.gz MOBWFWVUUGTRCG-QMMMGPOBSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@H]1CCC[N@H+]1Cc1ccc(F)c(F)c1O ZINC000703447872 712076200 /nfs/dbraw/zinc/07/62/00/712076200.db2.gz MOBWFWVUUGTRCG-QMMMGPOBSA-N 1 2 227.254 2.655 20 10 BFCDLO CC1([NH2+]Cc2cc(F)cc(F)c2O)CCC1 ZINC000708389457 712191617 /nfs/dbraw/zinc/19/16/17/712191617.db2.gz KURJFTSMUGKUSQ-UHFFFAOYSA-N 1 2 227.254 2.703 20 10 BFCDLO CC1(C)C[C@]1(C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708389952 712191849 /nfs/dbraw/zinc/19/18/49/712191849.db2.gz NLLQJGOPJQNAIZ-ZDUSSCGKSA-N 1 2 241.281 2.949 20 10 BFCDLO CC[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708390970 712191918 /nfs/dbraw/zinc/19/19/18/712191918.db2.gz SCIZACYQMQRQLW-SSDOTTSWSA-N 1 2 215.243 2.559 20 10 BFCDLO CC1(C)C[C@@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC000708393241 712192140 /nfs/dbraw/zinc/19/21/40/712192140.db2.gz AFWSPOMRZULJOK-JTQLQIEISA-N 1 2 227.254 2.559 20 10 BFCDLO COc1ccc(N(C)Cc2[nH]c(C)c(C)[nH+]2)cc1 ZINC000709063748 712206911 /nfs/dbraw/zinc/20/69/11/712206911.db2.gz FXLPGBFVNKRQCA-UHFFFAOYSA-N 1 2 245.326 2.672 20 10 BFCDLO CC1(C)C[NH+](Cc2cc(F)c(F)cc2O)C1 ZINC001142508946 961463755 /nfs/dbraw/zinc/46/37/55/961463755.db2.gz QMWWGALIORGMJH-UHFFFAOYSA-N 1 2 227.254 2.512 20 10 BFCDLO Cc1cc(C)c(C[N@@H+]2CCC(F)(F)C2)c(O)c1 ZINC001231843299 977762582 /nfs/dbraw/zinc/76/25/82/977762582.db2.gz VCHBGAJVTWWFEE-UHFFFAOYSA-N 1 2 241.281 2.850 20 10 BFCDLO Cc1cc(C)c(C[N@H+]2CCC(F)(F)C2)c(O)c1 ZINC001231843299 977762598 /nfs/dbraw/zinc/76/25/98/977762598.db2.gz VCHBGAJVTWWFEE-UHFFFAOYSA-N 1 2 241.281 2.850 20 10 BFCDLO C[C@@H]1CC[N@@H+]1Cc1cccc(Cl)c1O ZINC001231910203 977790834 /nfs/dbraw/zinc/79/08/34/977790834.db2.gz JTLJSRJJBDDQHK-MRVPVSSYSA-N 1 2 211.692 2.640 20 10 BFCDLO C[C@@H]1CC[N@H+]1Cc1cccc(Cl)c1O ZINC001231910203 977790841 /nfs/dbraw/zinc/79/08/41/977790841.db2.gz JTLJSRJJBDDQHK-MRVPVSSYSA-N 1 2 211.692 2.640 20 10 BFCDLO Oc1cc(F)cc(F)c1C[NH+]1C2CCC1CC2 ZINC001140583626 959016051 /nfs/dbraw/zinc/01/60/51/959016051.db2.gz OLIXOJGMSRMFBS-UHFFFAOYSA-N 1 2 239.265 2.797 20 10 BFCDLO COc1cc(Nc2cccc(O)c2O)cc(C)[nH+]1 ZINC001210781600 970029573 /nfs/dbraw/zinc/02/95/73/970029573.db2.gz XDUKUKRPAWVJOS-UHFFFAOYSA-N 1 2 246.266 2.553 20 10 BFCDLO Oc1ccc(Cl)c(Cl)c1C[NH+]1CCC1 ZINC001237077113 979816238 /nfs/dbraw/zinc/81/62/38/979816238.db2.gz CSZNOXLFANHCNX-UHFFFAOYSA-N 1 2 232.110 2.905 20 10 BFCDLO C[N@H+](CCF)Cc1cc(F)cc(Cl)c1O ZINC001237803955 980053992 /nfs/dbraw/zinc/05/39/92/980053992.db2.gz XDZVTCXSMJVXDC-UHFFFAOYSA-N 1 2 235.661 2.586 20 10 BFCDLO C[N@@H+](CCF)Cc1cc(F)cc(Cl)c1O ZINC001237803955 980054000 /nfs/dbraw/zinc/05/40/00/980054000.db2.gz XDZVTCXSMJVXDC-UHFFFAOYSA-N 1 2 235.661 2.586 20 10 BFCDLO Cn1ccc2ccc(CCn3cc[nH+]c3)cc21 ZINC001250315565 980757379 /nfs/dbraw/zinc/75/73/79/980757379.db2.gz PHQKQTORQWCSBD-UHFFFAOYSA-N 1 2 225.295 2.618 20 10 BFCDLO C/C(=C\C=C\[NH3+])c1ccc(N(C)C)cc1 ZINC001240915125 981966654 /nfs/dbraw/zinc/96/66/54/981966654.db2.gz ZKXHSHGYJYDAJN-ZVSIBQGLSA-N 1 2 202.301 2.628 20 10 BFCDLO Oc1c(Cl)cccc1C[N@@H+]1CCC[C@H]1CF ZINC000294076999 188213021 /nfs/dbraw/zinc/21/30/21/188213021.db2.gz QVRJBOXGLVXOLN-JTQLQIEISA-N 1 2 243.709 2.980 20 10 BFCDLO Oc1c(Cl)cccc1C[N@H+]1CCC[C@H]1CF ZINC000294076999 188213023 /nfs/dbraw/zinc/21/30/23/188213023.db2.gz QVRJBOXGLVXOLN-JTQLQIEISA-N 1 2 243.709 2.980 20 10 BFCDLO CO[C@H](C)[C@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000191695114 355833980 /nfs/dbraw/zinc/83/39/80/355833980.db2.gz MYFWYORCCHRGSL-DTWKUNHWSA-N 1 2 243.734 2.559 20 10 BFCDLO CS[C@H](C)C[NH2+]Cc1cccc(Cl)c1O ZINC000162711873 388252473 /nfs/dbraw/zinc/25/24/73/388252473.db2.gz QRSHLMQDBZAUFN-MRVPVSSYSA-N 1 2 245.775 2.887 20 10 BFCDLO CC[C@H](C)[NH2+]Cc1cccc(Cl)c1O ZINC000157755306 171343222 /nfs/dbraw/zinc/34/32/22/171343222.db2.gz UHVWRJLZPPXRMK-QMMMGPOBSA-N 1 2 213.708 2.934 20 10 BFCDLO CC[N@H+](CC1CCOCC1)c1ccc(OC)cc1 ZINC000732982038 584942305 /nfs/dbraw/zinc/94/23/05/584942305.db2.gz KUNWHTFGKBTPQC-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO CC[N@@H+](CC1CCOCC1)c1ccc(OC)cc1 ZINC000732982038 584942306 /nfs/dbraw/zinc/94/23/06/584942306.db2.gz KUNWHTFGKBTPQC-UHFFFAOYSA-N 1 2 249.354 2.948 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH2+]CC(F)F ZINC000839093566 585090577 /nfs/dbraw/zinc/09/05/77/585090577.db2.gz SWXZXWXNEVASDT-UHFFFAOYSA-N 1 2 239.624 2.539 20 10 BFCDLO CCOc1ccc([N@H+](C)CC2(C)COC2)cc1 ZINC000743851563 585140894 /nfs/dbraw/zinc/14/08/94/585140894.db2.gz VYRGBCPOLOCUFQ-UHFFFAOYSA-N 1 2 235.327 2.558 20 10 BFCDLO CCOc1ccc([N@@H+](C)CC2(C)COC2)cc1 ZINC000743851563 585140895 /nfs/dbraw/zinc/14/08/95/585140895.db2.gz VYRGBCPOLOCUFQ-UHFFFAOYSA-N 1 2 235.327 2.558 20 10 BFCDLO CCOc1ccc([N@H+](CC)C[C@@H]2CCOC2)cc1 ZINC000746159557 585163961 /nfs/dbraw/zinc/16/39/61/585163961.db2.gz XJZYSKBKNPUEFJ-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO CCOc1ccc([N@@H+](CC)C[C@@H]2CCOC2)cc1 ZINC000746159557 585163962 /nfs/dbraw/zinc/16/39/62/585163962.db2.gz XJZYSKBKNPUEFJ-ZDUSSCGKSA-N 1 2 249.354 2.948 20 10 BFCDLO COc1ccc2c(c1)CCC[N@H+]2CC1CC1 ZINC000763479515 585448704 /nfs/dbraw/zinc/44/87/04/585448704.db2.gz PVLNBAMOIZCUBT-UHFFFAOYSA-N 1 2 217.312 2.858 20 10 BFCDLO COc1ccc2c(c1)CCC[N@@H+]2CC1CC1 ZINC000763479515 585448705 /nfs/dbraw/zinc/44/87/05/585448705.db2.gz PVLNBAMOIZCUBT-UHFFFAOYSA-N 1 2 217.312 2.858 20 10 BFCDLO Oc1c(Cl)cccc1C[N@H+]1CC=CCC1 ZINC000779164604 585746200 /nfs/dbraw/zinc/74/62/00/585746200.db2.gz YLJATRAQHVQFQZ-UHFFFAOYSA-N 1 2 223.703 2.808 20 10 BFCDLO Oc1c(Cl)cccc1C[N@@H+]1CC=CCC1 ZINC000779164604 585746201 /nfs/dbraw/zinc/74/62/01/585746201.db2.gz YLJATRAQHVQFQZ-UHFFFAOYSA-N 1 2 223.703 2.808 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[N@H+]1CC=CCC1 ZINC000779159243 585746279 /nfs/dbraw/zinc/74/62/79/585746279.db2.gz CUXHAZUCLYXOEA-UHFFFAOYSA-N 1 2 241.693 2.947 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1CC=CCC1 ZINC000779159243 585746280 /nfs/dbraw/zinc/74/62/80/585746280.db2.gz CUXHAZUCLYXOEA-UHFFFAOYSA-N 1 2 241.693 2.947 20 10 BFCDLO COc1ccc(N[C@@H](C)c2ccccc2O)[nH+]c1 ZINC000783525539 585836055 /nfs/dbraw/zinc/83/60/55/585836055.db2.gz VMQRILPEPDKHAX-JTQLQIEISA-N 1 2 244.294 2.969 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@H](F)C1 ZINC000824570720 587277017 /nfs/dbraw/zinc/27/70/17/587277017.db2.gz FUHLEIHGYFDAPJ-QMMMGPOBSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@H](F)C1 ZINC000824570720 587277019 /nfs/dbraw/zinc/27/70/19/587277019.db2.gz FUHLEIHGYFDAPJ-QMMMGPOBSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@@H](F)C1 ZINC000824570719 587277233 /nfs/dbraw/zinc/27/72/33/587277233.db2.gz FUHLEIHGYFDAPJ-MRVPVSSYSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@@H](F)C1 ZINC000824570719 587277234 /nfs/dbraw/zinc/27/72/34/587277234.db2.gz FUHLEIHGYFDAPJ-MRVPVSSYSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1c(F)cc(Cl)cc1C[NH2+][C@H]1C=CCC1 ZINC000826941864 587366400 /nfs/dbraw/zinc/36/64/00/587366400.db2.gz LMUGSYMCLWQPAF-JTQLQIEISA-N 1 2 241.693 2.993 20 10 BFCDLO COc1ccc([N@H+](C)CC[C@H]2CCOC2)cc1 ZINC000844355740 588187524 /nfs/dbraw/zinc/18/75/24/588187524.db2.gz SBCRBFROTWFMMN-LBPRGKRZSA-N 1 2 235.327 2.558 20 10 BFCDLO COc1ccc([N@@H+](C)CC[C@H]2CCOC2)cc1 ZINC000844355740 588187525 /nfs/dbraw/zinc/18/75/25/588187525.db2.gz SBCRBFROTWFMMN-LBPRGKRZSA-N 1 2 235.327 2.558 20 10 BFCDLO C/C=C/C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000862530435 589218200 /nfs/dbraw/zinc/21/82/00/589218200.db2.gz MJTLSJUZQGWXNC-NSCUHMNNSA-N 1 2 229.682 2.850 20 10 BFCDLO Cc1ccc(C[N@H+](CC(F)F)C2CC2)c(O)c1 ZINC000876715611 590232867 /nfs/dbraw/zinc/23/28/67/590232867.db2.gz RLVSFDYVLXLKCU-UHFFFAOYSA-N 1 2 241.281 2.930 20 10 BFCDLO Cc1ccc(C[N@@H+](CC(F)F)C2CC2)c(O)c1 ZINC000876715611 590232869 /nfs/dbraw/zinc/23/28/69/590232869.db2.gz RLVSFDYVLXLKCU-UHFFFAOYSA-N 1 2 241.281 2.930 20 10 BFCDLO C[N@H+](Cc1ccc(F)c(F)c1O)C1CCC1 ZINC000876745809 590236453 /nfs/dbraw/zinc/23/64/53/590236453.db2.gz OWIDAXIEEPKNPX-UHFFFAOYSA-N 1 2 227.254 2.655 20 10 BFCDLO C[N@@H+](Cc1ccc(F)c(F)c1O)C1CCC1 ZINC000876745809 590236454 /nfs/dbraw/zinc/23/64/54/590236454.db2.gz OWIDAXIEEPKNPX-UHFFFAOYSA-N 1 2 227.254 2.655 20 10 BFCDLO C[C@@H]1C[C@H](C)[N@H+]1Cc1ccc(F)c(F)c1O ZINC000877486369 590338823 /nfs/dbraw/zinc/33/88/23/590338823.db2.gz IMWNIRKESUWPCY-OCAPTIKFSA-N 1 2 227.254 2.653 20 10 BFCDLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(F)c(F)c1O ZINC000877486369 590338825 /nfs/dbraw/zinc/33/88/25/590338825.db2.gz IMWNIRKESUWPCY-OCAPTIKFSA-N 1 2 227.254 2.653 20 10 BFCDLO COc1ccc([N@H+](C)C[C@@H]2CCO[C@H]2C)cc1 ZINC000878801343 590624902 /nfs/dbraw/zinc/62/49/02/590624902.db2.gz JVRKSERFYAOWHH-RYUDHWBXSA-N 1 2 235.327 2.556 20 10 BFCDLO COc1ccc([N@@H+](C)C[C@@H]2CCO[C@H]2C)cc1 ZINC000878801343 590624904 /nfs/dbraw/zinc/62/49/04/590624904.db2.gz JVRKSERFYAOWHH-RYUDHWBXSA-N 1 2 235.327 2.556 20 10 BFCDLO C[C@@H]([NH2+]CC1CC1)c1cc(F)cc(F)c1O ZINC000134912468 591959304 /nfs/dbraw/zinc/95/93/04/591959304.db2.gz APXBXPMSRZGLEB-SSDOTTSWSA-N 1 2 227.254 2.731 20 10 BFCDLO C[C@H]([NH2+]C1(C(F)F)CC1)c1c(O)cccc1F ZINC000886607136 592274148 /nfs/dbraw/zinc/27/41/48/592274148.db2.gz LMDBFPUVMTYJIU-ZETCQYMHSA-N 1 2 245.244 2.980 20 10 BFCDLO CCSCC[NH2+]Cc1cccc(Cl)c1O ZINC000308839978 631679262 /nfs/dbraw/zinc/67/92/62/631679262.db2.gz XWIYMTAICMPEQX-UHFFFAOYSA-N 1 2 245.775 2.888 20 10 BFCDLO CC[C@H]([NH2+]CCOC)c1cccc(Cl)c1O ZINC000310038261 632695972 /nfs/dbraw/zinc/69/59/72/632695972.db2.gz VXLHOTSYHMPOEM-NSHDSACASA-N 1 2 243.734 2.733 20 10 BFCDLO Oc1c(Cl)cccc1C[NH2+]Cc1ccncc1 ZINC000161608602 633009765 /nfs/dbraw/zinc/00/97/65/633009765.db2.gz ACPNKHPKESKROG-UHFFFAOYSA-N 1 2 248.713 2.730 20 10 BFCDLO Oc1ccc(F)cc1C[NH+]1CC(C(F)(F)F)C1 ZINC000894891408 635999476 /nfs/dbraw/zinc/99/94/76/635999476.db2.gz CHLULGQUDQJGJR-UHFFFAOYSA-N 1 2 249.207 2.525 20 10 BFCDLO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)C1(C)CC1 ZINC000708392249 712191945 /nfs/dbraw/zinc/19/19/45/712191945.db2.gz ZOURMVOJFWMELF-MRVPVSSYSA-N 1 2 241.281 2.949 20 10 BFCDLO CC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)C1CC1 ZINC000708553721 712212643 /nfs/dbraw/zinc/21/26/43/712212643.db2.gz DNSYHWHCGIXVAE-LBPRGKRZSA-N 1 2 241.281 2.949 20 10 BFCDLO C/C=C\C[NH2+]Cc1cccc(Cl)c1O ZINC000394977906 711199365 /nfs/dbraw/zinc/19/93/65/711199365.db2.gz CMBQTDYKWIEASI-IHWYPQMZSA-N 1 2 211.692 2.711 20 10 BFCDLO C[N@H+](Cc1cc(F)cc(F)c1O)C(C)(C)C ZINC000708402217 712192522 /nfs/dbraw/zinc/19/25/22/712192522.db2.gz VTMFVFFAMOOZHR-UHFFFAOYSA-N 1 2 229.270 2.901 20 10 BFCDLO C[N@@H+](Cc1cc(F)cc(F)c1O)C(C)(C)C ZINC000708402217 712192525 /nfs/dbraw/zinc/19/25/25/712192525.db2.gz VTMFVFFAMOOZHR-UHFFFAOYSA-N 1 2 229.270 2.901 20 10 BFCDLO CCC[N@H+](CC)Cc1cc(F)cc(F)c1O ZINC000708402198 712192555 /nfs/dbraw/zinc/19/25/55/712192555.db2.gz VOVWPYRBZWLPRN-UHFFFAOYSA-N 1 2 229.270 2.902 20 10 BFCDLO CCC[N@@H+](CC)Cc1cc(F)cc(F)c1O ZINC000708402198 712192557 /nfs/dbraw/zinc/19/25/57/712192557.db2.gz VOVWPYRBZWLPRN-UHFFFAOYSA-N 1 2 229.270 2.902 20 10 BFCDLO CCC[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708394437 712192814 /nfs/dbraw/zinc/19/28/14/712192814.db2.gz ZYWVFCPLWIICKE-MRVPVSSYSA-N 1 2 229.270 2.949 20 10 BFCDLO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CC=CCC1 ZINC000708437655 712194644 /nfs/dbraw/zinc/19/46/44/712194644.db2.gz SMKBSEIMQGUMCZ-NSHDSACASA-N 1 2 239.265 2.869 20 10 BFCDLO C[C@@H]([NH2+][C@H](C)C(F)F)c1cc(F)ccc1O ZINC000389967803 712692738 /nfs/dbraw/zinc/69/27/38/712692738.db2.gz OZOXKCGZAXSJDU-RNFRBKRXSA-N 1 2 233.233 2.836 20 10 BFCDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@H](F)C1 ZINC000689864959 960296518 /nfs/dbraw/zinc/29/65/18/960296518.db2.gz WNOWACAJNJUSDD-VIFPVBQESA-N 1 2 229.682 2.589 20 10 BFCDLO Oc1c(Cl)cccc1C[N@H+]1CC[C@H](F)C1 ZINC000689864959 960296521 /nfs/dbraw/zinc/29/65/21/960296521.db2.gz WNOWACAJNJUSDD-VIFPVBQESA-N 1 2 229.682 2.589 20 10 BFCDLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001142508512 961455589 /nfs/dbraw/zinc/45/55/89/961455589.db2.gz BINDNKCIOGEOEE-VXNVDRBHSA-N 1 2 245.244 2.603 20 10 BFCDLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc(F)c(F)cc1O ZINC001142508512 961455595 /nfs/dbraw/zinc/45/55/95/961455595.db2.gz BINDNKCIOGEOEE-VXNVDRBHSA-N 1 2 245.244 2.603 20 10 BFCDLO CN(c1ccc(N)cc1)c1cccc2[nH+]c[nH]c21 ZINC001213033809 964643562 /nfs/dbraw/zinc/64/35/62/964643562.db2.gz YNTKLOQLYDHHEV-UHFFFAOYSA-N 1 2 238.294 2.913 20 10 BFCDLO Oc1c(Cl)cccc1C[NH+]1CCC(F)CC1 ZINC000689907196 979061019 /nfs/dbraw/zinc/06/10/19/979061019.db2.gz DDIHKHMPCNVALM-UHFFFAOYSA-N 1 2 243.709 2.980 20 10 BFCDLO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@H](F)C1 ZINC001237121829 979821563 /nfs/dbraw/zinc/82/15/63/979821563.db2.gz PSFSRFRKUBRRFV-ZETCQYMHSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1ccc(F)c(Cl)c1C[N@H+]1CC[C@H](F)C1 ZINC001237121829 979821565 /nfs/dbraw/zinc/82/15/65/979821565.db2.gz PSFSRFRKUBRRFV-ZETCQYMHSA-N 1 2 247.672 2.729 20 10 BFCDLO Cc1cccc(O)c1C[NH+]1CC(F)(C2CC2)C1 ZINC001237482070 979910159 /nfs/dbraw/zinc/91/01/59/979910159.db2.gz JFHGOHLVGBQLOO-UHFFFAOYSA-N 1 2 235.302 2.635 20 10 BFCDLO Oc1cc(Cl)c(F)cc1C[N@@H+]1CC[C@H](F)C1 ZINC001237934688 980113457 /nfs/dbraw/zinc/11/34/57/980113457.db2.gz MZDZSGPBOUBQDZ-QMMMGPOBSA-N 1 2 247.672 2.729 20 10 BFCDLO Oc1cc(Cl)c(F)cc1C[N@H+]1CC[C@H](F)C1 ZINC001237934688 980113459 /nfs/dbraw/zinc/11/34/59/980113459.db2.gz MZDZSGPBOUBQDZ-QMMMGPOBSA-N 1 2 247.672 2.729 20 10 BFCDLO Cn1ccc2c1cc[nH+]c2-c1cncc(F)c1 ZINC001240233588 981187871 /nfs/dbraw/zinc/18/78/71/981187871.db2.gz WFIJAWSVNMHIFA-UHFFFAOYSA-N 1 2 227.242 2.774 20 10 BFCDLO C[N@H+](Cc1ccncc1)Cc1c(O)cccc1F ZINC001137831614 990854549 /nfs/dbraw/zinc/85/45/49/990854549.db2.gz HKLADBNHOJVSGR-UHFFFAOYSA-N 1 2 246.285 2.558 20 10 BFCDLO C[N@@H+](Cc1ccncc1)Cc1c(O)cccc1F ZINC001137831614 990854551 /nfs/dbraw/zinc/85/45/51/990854551.db2.gz HKLADBNHOJVSGR-UHFFFAOYSA-N 1 2 246.285 2.558 20 10 BFCDLO C[N@H+](Cc1cccc(F)c1O)C(C)(C)C ZINC000381934962 993432492 /nfs/dbraw/zinc/43/24/92/993432492.db2.gz SDGHWAVTGYHTSF-UHFFFAOYSA-N 1 2 211.280 2.762 20 10 BFCDLO C[N@@H+](Cc1cccc(F)c1O)C(C)(C)C ZINC000381934962 993432496 /nfs/dbraw/zinc/43/24/96/993432496.db2.gz SDGHWAVTGYHTSF-UHFFFAOYSA-N 1 2 211.280 2.762 20 10 BFCDLO