smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H]([NH2+][C@@H](C)C(C)(C)O)c1ccc(F)cc1O ZINC000393968981 711180873 /nfs/dbraw/zinc/18/08/73/711180873.db2.gz ITQPQXDEZFKNEC-BDAKNGLRSA-N 1 1 241.306 2.341 20 10 BECDMO Cc1cccc(C[N@H+](C)C[C@H]2CCCN2C)c1O ZINC000160248792 711806229 /nfs/dbraw/zinc/80/62/29/711806229.db2.gz MMQIZXUVCORDSQ-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(CN(C)C[C@H]2CCC[N@@H+]2C)c1O ZINC000160248792 711806230 /nfs/dbraw/zinc/80/62/30/711806230.db2.gz MMQIZXUVCORDSQ-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(CN(C)C[C@H]2CCC[N@H+]2C)c1O ZINC000160248792 711806231 /nfs/dbraw/zinc/80/62/31/711806231.db2.gz MMQIZXUVCORDSQ-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+](CCOC)Cc1cc2c(cc1O)CCC2 ZINC000921047259 711882306 /nfs/dbraw/zinc/88/23/06/711882306.db2.gz UYGJMZXCCJYEED-UHFFFAOYSA-N 1 1 249.354 2.349 20 10 BECDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H]3C[C@H]32)c1O ZINC000707054672 712164256 /nfs/dbraw/zinc/16/42/56/712164256.db2.gz PAKNPALNKVDUFC-TVQRCGJNSA-N 1 1 249.285 2.328 20 10 BECDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H]3C[C@H]32)c1O ZINC000707054672 712164258 /nfs/dbraw/zinc/16/42/58/712164258.db2.gz PAKNPALNKVDUFC-TVQRCGJNSA-N 1 1 249.285 2.328 20 10 BECDMO CSCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000708390041 712191811 /nfs/dbraw/zinc/19/18/11/712191811.db2.gz NQXSFARJIICWTD-UHFFFAOYSA-N 1 1 233.283 2.123 20 10 BECDMO CCOC[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708481270 712192794 /nfs/dbraw/zinc/19/27/94/712192794.db2.gz BPCADXVNLOTRBM-QMMMGPOBSA-N 1 1 245.269 2.185 20 10 BECDMO CC(C)[C@@H]1C[N@@H+](Cc2ccccc2O)CCO1 ZINC000709019188 712205844 /nfs/dbraw/zinc/20/58/44/712205844.db2.gz GXJYEBXZNFJUKE-AWEZNQCLSA-N 1 1 235.327 2.249 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2ccccc2O)C[C@H](C)O1 ZINC000709851982 712229858 /nfs/dbraw/zinc/22/98/58/712229858.db2.gz BRVUJGRFWDRTMO-NEPJUHHUSA-N 1 1 235.327 2.392 20 10 BECDMO C[C@@H]([NH2+]CCc1cn[nH]c1)c1ccc(F)cc1O ZINC000379591058 712389636 /nfs/dbraw/zinc/38/96/36/712389636.db2.gz WDIUQPASQOGHTH-SECBINFHSA-N 1 1 249.289 2.148 20 10 BECDMO Oc1c(F)cccc1C[NH2+]C[C@H]1CCC=CO1 ZINC000379958860 712636813 /nfs/dbraw/zinc/63/68/13/712636813.db2.gz ADLOUXBTRPRXIZ-LLVKDONJSA-N 1 1 237.274 2.314 20 10 BECDMO CC(F)(F)C[NH2+]Cc1ccccc1O ZINC000382190117 957621222 /nfs/dbraw/zinc/62/12/22/957621222.db2.gz CEXUMSYLGQYQLY-UHFFFAOYSA-N 1 1 201.216 2.137 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H](F)C2)c1O ZINC000689849234 1166365930 /nfs/dbraw/zinc/36/59/30/1166365930.db2.gz ODVBGAMLQWLFKH-NSHDSACASA-N 1 1 209.264 2.244 20 10 BECDMO C[C@H]1CC[N@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232258622 977968504 /nfs/dbraw/zinc/96/85/04/977968504.db2.gz BESJALAGDPXFGO-ZETCQYMHSA-N 1 1 227.691 2.345 20 10 BECDMO Cc1cc(F)cc(C[N@H+](C)[C@H]2CCOC2)c1O ZINC001238061426 980134671 /nfs/dbraw/zinc/13/46/71/980134671.db2.gz HVFRKQONQUKAQM-LBPRGKRZSA-N 1 1 239.290 2.060 20 10 BECDMO CC[C@@H](C)[N@@H+](C)Cc1c(O)cc(O)cc1O ZINC001144503762 972850957 /nfs/dbraw/zinc/85/09/57/972850957.db2.gz CEMPRJDYEDLODR-MRVPVSSYSA-N 1 1 225.288 2.034 20 10 BECDMO C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(N)cc2)CCN1C ZINC001345160853 957162787 /nfs/dbraw/zinc/16/27/87/957162787.db2.gz ZYEXCKMJQVDIBC-WFASDCNBSA-N 1 1 247.386 2.183 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](F)C2)c1 ZINC000689850289 959307784 /nfs/dbraw/zinc/30/77/84/959307784.db2.gz RFMVKGLSZIUGNJ-NSHDSACASA-N 1 1 209.264 2.244 20 10 BECDMO Cc1c(O)ccc(C[N@H+]2C[C@H]3CC[C@@H]2C3)c1O ZINC001140747637 959792967 /nfs/dbraw/zinc/79/29/67/959792967.db2.gz FGBFHJUIGGXPDM-CMPLNLGQSA-N 1 1 233.311 2.391 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](O)[C@@H](C)C2)c1 ZINC001140617672 960460788 /nfs/dbraw/zinc/46/07/88/960460788.db2.gz WBYOVIMOCMVWPW-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](C)[C@H]2CO)c1 ZINC001140617159 960462395 /nfs/dbraw/zinc/46/23/95/960462395.db2.gz HWINGZXDDLXFEV-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)Cc2cncnc2)c1 ZINC001140624335 960466780 /nfs/dbraw/zinc/46/67/80/960466780.db2.gz REVUMGSUWHMGKR-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2[C@@H]3CC[C@H]2CC(=O)C3)c1 ZINC001140619835 960467897 /nfs/dbraw/zinc/46/78/97/960467897.db2.gz REBORCSRQUOICS-BETUJISGSA-N 1 1 245.322 2.397 20 10 BECDMO Cc1c(O)ccc(C[N@H+]2CCC3(CC3)C2)c1O ZINC001140743910 960543533 /nfs/dbraw/zinc/54/35/33/960543533.db2.gz DTFHSFKFJNXVLO-UHFFFAOYSA-N 1 1 233.311 2.392 20 10 BECDMO Cc1ccc(C[N@H+]2CCC(=O)C[C@@H]2C)c(O)c1 ZINC001140947755 960740787 /nfs/dbraw/zinc/74/07/87/960740787.db2.gz DOYKBZKXWGMPHG-NSHDSACASA-N 1 1 233.311 2.254 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC(=O)C[C@@H]2C)c(O)c1 ZINC001140947755 960740794 /nfs/dbraw/zinc/74/07/94/960740794.db2.gz DOYKBZKXWGMPHG-NSHDSACASA-N 1 1 233.311 2.254 20 10 BECDMO Cc1ccc(C[N@H+](C)C2CCN(C)CC2)c(O)c1 ZINC001140948762 960744532 /nfs/dbraw/zinc/74/45/32/960744532.db2.gz ZDMQLNCBYQHPGE-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@@H](CO)CC[C@H]2C)c(O)c1 ZINC001140948119 960744696 /nfs/dbraw/zinc/74/46/96/960744696.db2.gz UFCIKYILMHABIK-OLZOCXBDSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@@](C)(O)C2)c(O)c1 ZINC001140947707 960745502 /nfs/dbraw/zinc/74/55/02/960745502.db2.gz BSOUBBRVDJNFJP-DOMZBBRYSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@](C)(O)C2)c(O)c1 ZINC001140947708 960747771 /nfs/dbraw/zinc/74/77/71/960747771.db2.gz BSOUBBRVDJNFJP-IUODEOHRSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2[C@@H](C)CC[C@H]2CO)c(O)c1 ZINC001140947826 960747977 /nfs/dbraw/zinc/74/79/77/960747977.db2.gz HHIKPBJSMJIYNG-AAEUAGOBSA-N 1 1 235.327 2.046 20 10 BECDMO CC(C)[N@@H+](C)Cc1ccc2c(c1)OCCN2C ZINC001141139462 960885154 /nfs/dbraw/zinc/88/51/54/960885154.db2.gz TXUCBWGZIAJQER-UHFFFAOYSA-N 1 1 234.343 2.355 20 10 BECDMO CN1CCOc2cc(C[N@@H+](C)CC3CC3)ccc21 ZINC001141141058 960887692 /nfs/dbraw/zinc/88/76/92/960887692.db2.gz SRJBRMGXWNIGRQ-UHFFFAOYSA-N 1 1 246.354 2.357 20 10 BECDMO C[C@@]1(F)CCC[N@@H+](Cc2cc(O)ccc2O)C1 ZINC001141156616 960889991 /nfs/dbraw/zinc/88/99/91/960889991.db2.gz OSGYWHRLDXGHDE-CYBMUJFWSA-N 1 1 239.290 2.422 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCC[C@H](F)CC2)c1 ZINC001141155979 960891146 /nfs/dbraw/zinc/89/11/46/960891146.db2.gz CTBPMAUGPWUSBT-NSHDSACASA-N 1 1 239.290 2.422 20 10 BECDMO C[C@@]1(CF)CC[N@@H+](Cc2cc(O)ccc2O)C1 ZINC001141156120 960893035 /nfs/dbraw/zinc/89/30/35/960893035.db2.gz FWVIWJOCBKZMNV-ZDUSSCGKSA-N 1 1 239.290 2.279 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCC[C@@H](CF)C2)c1 ZINC001141159954 960895650 /nfs/dbraw/zinc/89/56/50/960895650.db2.gz NCRFFVGWCFFXHA-JTQLQIEISA-N 1 1 239.290 2.279 20 10 BECDMO CC[C@@H](C)[N@@H+](C)Cc1cc(O)ccc1O ZINC001141157448 960896401 /nfs/dbraw/zinc/89/64/01/960896401.db2.gz IHAHLHBRGWHRPN-SECBINFHSA-N 1 1 209.289 2.328 20 10 BECDMO C[C@H]1C[N@@H+](Cc2cc(O)ccc2O)C2(CC2)C1 ZINC001141162353 960906582 /nfs/dbraw/zinc/90/65/82/960906582.db2.gz QPCPPKOLHVAXLP-SNVBAGLBSA-N 1 1 233.311 2.472 20 10 BECDMO CO[C@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000234888843 961644972 /nfs/dbraw/zinc/64/49/72/961644972.db2.gz ICYNKNKZVVSSAX-NSHDSACASA-N 1 1 241.718 2.266 20 10 BECDMO Oc1cc(C[N@H+]2CCC23CCCC3)cc(O)c1O ZINC001233011588 965454569 /nfs/dbraw/zinc/45/45/69/965454569.db2.gz ABLOPOXLYQNZBK-UHFFFAOYSA-N 1 1 249.310 2.322 20 10 BECDMO C[C@H]([NH2+][C@@H]1COC[C@H]1C)c1ccc(F)cc1O ZINC000699802978 966093547 /nfs/dbraw/zinc/09/35/47/966093547.db2.gz DEAMBFGWPBLOEM-VDDIYKPWSA-N 1 1 239.290 2.217 20 10 BECDMO CCc1ccc(C[N@@H+]2C[C@H](C)NC[C@@H]2C)c(O)c1 ZINC001236078886 966264225 /nfs/dbraw/zinc/26/42/25/966264225.db2.gz KBVYCIPZKAQAMU-RYUDHWBXSA-N 1 1 248.370 2.137 20 10 BECDMO CCc1ccc(C[N@H+]2C[C@H](C)NC[C@@H]2C)c(O)c1 ZINC001236078886 966264236 /nfs/dbraw/zinc/26/42/36/966264236.db2.gz KBVYCIPZKAQAMU-RYUDHWBXSA-N 1 1 248.370 2.137 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)CCCC1=O ZINC001203550057 966684072 /nfs/dbraw/zinc/68/40/72/966684072.db2.gz GFGLWDLWSBNSSJ-LLVKDONJSA-N 1 1 233.311 2.193 20 10 BECDMO CC(C)[N@@H+](C)[C@H]1CCN(Cc2ccccc2O)C1 ZINC001203561298 966689653 /nfs/dbraw/zinc/68/96/53/966689653.db2.gz PZLZETQIJPGWFB-AWEZNQCLSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)N(C)[C@H]1CC[N@H+](Cc2ccccc2O)C1 ZINC001203561298 966689658 /nfs/dbraw/zinc/68/96/58/966689658.db2.gz PZLZETQIJPGWFB-AWEZNQCLSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)N(C)[C@H]1CC[N@@H+](Cc2ccccc2O)C1 ZINC001203561298 966689662 /nfs/dbraw/zinc/68/96/62/966689662.db2.gz PZLZETQIJPGWFB-AWEZNQCLSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)[N@@H+](C)[C@@H]1CCN(Cc2ccccc2O)C1 ZINC001203561299 966692383 /nfs/dbraw/zinc/69/23/83/966692383.db2.gz PZLZETQIJPGWFB-CQSZACIVSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)N(C)[C@@H]1CC[N@H+](Cc2ccccc2O)C1 ZINC001203561299 966692398 /nfs/dbraw/zinc/69/23/98/966692398.db2.gz PZLZETQIJPGWFB-CQSZACIVSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2O)C1 ZINC001203561299 966692406 /nfs/dbraw/zinc/69/24/06/966692406.db2.gz PZLZETQIJPGWFB-CQSZACIVSA-N 1 1 248.370 2.307 20 10 BECDMO COc1cccc(C[N@H+](C)Cc2ccno2)c1O ZINC001203599988 966702936 /nfs/dbraw/zinc/70/29/36/966702936.db2.gz QTLCBXWVFOIQFJ-UHFFFAOYSA-N 1 1 248.282 2.021 20 10 BECDMO COc1cccc(C[N@@H+](C)Cc2ccno2)c1O ZINC001203599988 966702939 /nfs/dbraw/zinc/70/29/39/966702939.db2.gz QTLCBXWVFOIQFJ-UHFFFAOYSA-N 1 1 248.282 2.021 20 10 BECDMO COc1ccc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)c(O)c1 ZINC001203621227 966708752 /nfs/dbraw/zinc/70/87/52/966708752.db2.gz PXAVTJNLUYELCB-SKDRFNHKSA-N 1 1 239.290 2.191 20 10 BECDMO COc1ccc(O)c(C[N@H+]2C[C@@H](C)[C@@H](F)C2)c1 ZINC001203670701 966734318 /nfs/dbraw/zinc/73/43/18/966734318.db2.gz WXCZSSMLGWXXET-SKDRFNHKSA-N 1 1 239.290 2.191 20 10 BECDMO CCC[N@@H+](CC)Cc1ccc(O)c(O)c1 ZINC001203874120 966804785 /nfs/dbraw/zinc/80/47/85/966804785.db2.gz OSURFQIFBKAUDV-UHFFFAOYSA-N 1 1 209.289 2.330 20 10 BECDMO Oc1ccc(C[N@H+]2CCC[C@H]3C[C@H]32)cc1O ZINC001203878828 966805312 /nfs/dbraw/zinc/80/53/12/966805312.db2.gz DCNWXLXYFLOOIB-WDEREUQCSA-N 1 1 219.284 2.082 20 10 BECDMO CC1(C)[C@@H]2C[N@H+](Cc3ccc(O)c(O)c3)C[C@@H]21 ZINC001203880418 966810333 /nfs/dbraw/zinc/81/03/33/966810333.db2.gz ACCAAVLCSQPWFX-PHIMTYICSA-N 1 1 233.311 2.186 20 10 BECDMO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001203929974 966823711 /nfs/dbraw/zinc/82/37/11/966823711.db2.gz MIWDHVALHRGRNX-GFCCVEGCSA-N 1 1 246.354 2.306 20 10 BECDMO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001203929974 966823713 /nfs/dbraw/zinc/82/37/13/966823713.db2.gz MIWDHVALHRGRNX-GFCCVEGCSA-N 1 1 246.354 2.306 20 10 BECDMO C[C@H]1CCC[N@@H+](Cc2ccc(O)cc2O)C1 ZINC001204273077 966951717 /nfs/dbraw/zinc/95/17/17/966951717.db2.gz WTPWZYBAUYHBSA-JTQLQIEISA-N 1 1 221.300 2.330 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@@H](C)CC[C@@H]2CN)c1O ZINC001205829642 967841289 /nfs/dbraw/zinc/84/12/89/967841289.db2.gz PIBWAHPFZQWPTO-SMDDNHRTSA-N 1 1 248.370 2.260 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@H](C)CC[C@@H]1CN ZINC001205856020 967857836 /nfs/dbraw/zinc/85/78/36/967857836.db2.gz RXHHSQVWPOHPGS-DGCLKSJQSA-N 1 1 248.370 2.260 20 10 BECDMO CC[N@@H+](Cc1cn(C)cn1)Cc1ccccc1O ZINC001206242248 968165580 /nfs/dbraw/zinc/16/55/80/968165580.db2.gz JFXQARVHYMQPRS-UHFFFAOYSA-N 1 1 245.326 2.148 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCCC[C@H](C[NH3+])C1 ZINC001206640417 968427309 /nfs/dbraw/zinc/42/73/09/968427309.db2.gz JQNYGFKGKKBERE-CYBMUJFWSA-N 1 1 248.370 2.261 20 10 BECDMO CC[C@@H]1CCC[N@H+]1Cc1c(O)cc(O)cc1O ZINC001144509232 972858483 /nfs/dbraw/zinc/85/84/83/972858483.db2.gz PXLGFXUQBQQWIA-SECBINFHSA-N 1 1 237.299 2.178 20 10 BECDMO COc1ccc(N2CC[C@H]3[C@@H]2CC[N@H+]3C)c(C)c1 ZINC001277018352 974188320 /nfs/dbraw/zinc/18/83/20/974188320.db2.gz IUPLBAJDQOMMMZ-GJZGRUSLSA-N 1 1 246.354 2.286 20 10 BECDMO C[C@H]([NH2+]CCc1cn[nH]c1)c1c(O)cccc1F ZINC001331229225 974651489 /nfs/dbraw/zinc/65/14/89/974651489.db2.gz IZSBCRGVKLMICH-VIFPVBQESA-N 1 1 249.289 2.148 20 10 BECDMO Nc1ccc(C[N@H+]2CC[C@H]3CSC[C@@H]3C2)cc1 ZINC001335289566 976933980 /nfs/dbraw/zinc/93/39/80/976933980.db2.gz OVKSKTLMWWLUAQ-STQMWFEESA-N 1 1 248.395 2.454 20 10 BECDMO CC1CC([NH2+]Cc2c(O)cccc2F)C1 ZINC001355346834 1170017421 /nfs/dbraw/zinc/01/74/21/1170017421.db2.gz AIANGRWKVVRBME-UHFFFAOYSA-N 1 1 209.264 2.419 20 10 BECDMO CC(C)[N@H+]1CCCN(Cc2ccc(N)cc2)CC1 ZINC001336116615 977511280 /nfs/dbraw/zinc/51/12/80/977511280.db2.gz HKJWJPMCACEAKR-UHFFFAOYSA-N 1 1 247.386 2.185 20 10 BECDMO CC(C)N1CCC[N@H+](Cc2ccc(N)cc2)CC1 ZINC001336116615 977511290 /nfs/dbraw/zinc/51/12/90/977511290.db2.gz HKJWJPMCACEAKR-UHFFFAOYSA-N 1 1 247.386 2.185 20 10 BECDMO CC(C)N1CCC[N@@H+](Cc2ccc(N)cc2)CC1 ZINC001336116615 977511297 /nfs/dbraw/zinc/51/12/97/977511297.db2.gz HKJWJPMCACEAKR-UHFFFAOYSA-N 1 1 247.386 2.185 20 10 BECDMO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC1(N)CC1 ZINC001336262347 977604418 /nfs/dbraw/zinc/60/44/18/977604418.db2.gz MXXNIZBZODCUTK-MNOVXSKESA-N 1 1 246.354 2.330 20 10 BECDMO Nc1ccc(C[NH2+]Cc2cc(C3CC3)no2)cc1 ZINC001336285216 977614437 /nfs/dbraw/zinc/61/44/37/977614437.db2.gz JFOYNURUTROFIQ-UHFFFAOYSA-N 1 1 243.310 2.424 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@](C)(O)[C@@H](C)C2)c1O ZINC001231590594 977634147 /nfs/dbraw/zinc/63/41/47/977634147.db2.gz BQWQCLRGMRABNQ-SWLSCSKDSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@@H](O)[C@@H](C)C2)c1O ZINC001231590723 977642357 /nfs/dbraw/zinc/64/23/57/977642357.db2.gz GAYGXLIORJGJMP-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2CO)c1O ZINC001231590791 977642588 /nfs/dbraw/zinc/64/25/88/977642588.db2.gz HTYCQFAMATZVBW-CYBMUJFWSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)c1O ZINC001231595204 977643215 /nfs/dbraw/zinc/64/32/15/977643215.db2.gz QQZUCIGXTSYQJD-CHWSQXEVSA-N 1 1 233.311 2.064 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H]3OCC[C@H]32)c1O ZINC001231591447 977643585 /nfs/dbraw/zinc/64/35/85/977643585.db2.gz CUAPUISIXGVBDG-CHWSQXEVSA-N 1 1 233.311 2.064 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@H]3OC[C@@H](C)[C@H]3C2)c1O ZINC001231593698 977643692 /nfs/dbraw/zinc/64/36/92/977643692.db2.gz LDTJMVWURPELGW-MRVWCRGKSA-N 1 1 247.338 2.167 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)c1O ZINC001231591578 977643765 /nfs/dbraw/zinc/64/37/65/977643765.db2.gz HBDNTVHTVXYERD-RWMBFGLXSA-N 1 1 235.302 2.490 20 10 BECDMO COc1cc(C[N@H+]2CCCC23CC3)c(O)cc1O ZINC001231634067 977654767 /nfs/dbraw/zinc/65/47/67/977654767.db2.gz HIAIEZCOQPCECO-UHFFFAOYSA-N 1 1 249.310 2.235 20 10 BECDMO CCCC[N@@H+](C)Cc1cc(OC)c(O)cc1O ZINC001231635099 977656127 /nfs/dbraw/zinc/65/61/27/977656127.db2.gz VTUQWNNJORSEEN-UHFFFAOYSA-N 1 1 239.315 2.338 20 10 BECDMO Cc1cc(C)c(C[N@H+](C)CCN(C)C)c(O)c1 ZINC001231842029 977759655 /nfs/dbraw/zinc/75/96/55/977759655.db2.gz MQNRONOIZSSNOR-UHFFFAOYSA-N 1 1 236.359 2.002 20 10 BECDMO Cc1cc(C)c(CN(C)CC[NH+](C)C)c(O)c1 ZINC001231842029 977759669 /nfs/dbraw/zinc/75/96/69/977759669.db2.gz MQNRONOIZSSNOR-UHFFFAOYSA-N 1 1 236.359 2.002 20 10 BECDMO Cc1cc(C)c(C[N@H+]2[C@@H](C)CC[C@H]2CO)c(O)c1 ZINC001231843223 977762228 /nfs/dbraw/zinc/76/22/28/977762228.db2.gz SUVGZKAESGCZNR-STQMWFEESA-N 1 1 249.354 2.354 20 10 BECDMO Cc1cc(C)c(C[N@H+]2CCC3(COC3)C2)c(O)c1 ZINC001231842468 977762697 /nfs/dbraw/zinc/76/26/97/977762697.db2.gz MZFFAQJYMBHJGJ-UHFFFAOYSA-N 1 1 247.338 2.231 20 10 BECDMO Cc1cc(C)c(C[N@@H+]2CC[C@@H](CO)[C@H]2C)c(O)c1 ZINC001231842515 977764049 /nfs/dbraw/zinc/76/40/49/977764049.db2.gz NRZWZNBVUKQBBM-OLZOCXBDSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1cc(C)c(C[NH+]2CCC(=O)CC2)c(O)c1 ZINC001231842554 977764602 /nfs/dbraw/zinc/76/46/02/977764602.db2.gz ODOYCRCDMHTSLT-UHFFFAOYSA-N 1 1 233.311 2.174 20 10 BECDMO CC1(C)CCC[N@H+]1Cc1cc(O)c(O)c(O)c1 ZINC001233009824 978405641 /nfs/dbraw/zinc/40/56/41/978405641.db2.gz CLYOHOPBKVDBDW-UHFFFAOYSA-N 1 1 237.299 2.178 20 10 BECDMO CCCC[N@@H+](CC)Cc1cc(O)c(O)c(O)c1 ZINC001233010618 978407140 /nfs/dbraw/zinc/40/71/40/978407140.db2.gz RPYYIYWEKYXTLC-UHFFFAOYSA-N 1 1 239.315 2.425 20 10 BECDMO Oc1cc(C[NH+]2CC3(C2)CCCC3)cc(O)c1O ZINC001233014822 978412601 /nfs/dbraw/zinc/41/26/01/978412601.db2.gz XGFGMLNMGNAGAP-UHFFFAOYSA-N 1 1 249.310 2.179 20 10 BECDMO CC[C@H]1CCC[N@H+]1Cc1cc(O)c(O)c(O)c1 ZINC001233011536 978414727 /nfs/dbraw/zinc/41/47/27/978414727.db2.gz CMYNSHSTIVPTOT-JTQLQIEISA-N 1 1 237.299 2.178 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cc(O)c(O)c(O)c2)C2(CC2)C1 ZINC001233015308 978415110 /nfs/dbraw/zinc/41/51/10/978415110.db2.gz JWAPKCBTWJSPQG-VIFPVBQESA-N 1 1 249.310 2.178 20 10 BECDMO C[C@H]1CC[N@H+]1Cc1ccc(F)c(F)c1[O-] ZINC001233073816 978455890 /nfs/dbraw/zinc/45/58/90/978455890.db2.gz CZKILUILJFBLQS-ZETCQYMHSA-N 1 1 213.227 2.265 20 10 BECDMO C[N@H+](CCNCc1ccc(N)cc1)C1CCCC1 ZINC001337838259 978519735 /nfs/dbraw/zinc/51/97/35/978519735.db2.gz MXYGCTRHSXSDRT-UHFFFAOYSA-N 1 1 247.386 2.233 20 10 BECDMO C[N@@H+](CCNCc1ccc(N)cc1)C1CCCC1 ZINC001337838259 978519738 /nfs/dbraw/zinc/51/97/38/978519738.db2.gz MXYGCTRHSXSDRT-UHFFFAOYSA-N 1 1 247.386 2.233 20 10 BECDMO CC(C)(C)c1ccc(O)c(C[NH+]2CC(C)(O)C2)c1 ZINC001233283969 978529407 /nfs/dbraw/zinc/52/94/07/978529407.db2.gz CHUVSUNZFOYTGH-UHFFFAOYSA-N 1 1 249.354 2.256 20 10 BECDMO CC1(C)CCC[N@H+]1Cc1cc(O)c(O)cc1O ZINC001233483157 978612708 /nfs/dbraw/zinc/61/27/08/978612708.db2.gz PIQGCWDMBOZUJQ-UHFFFAOYSA-N 1 1 237.299 2.178 20 10 BECDMO Oc1cc(O)c(C[N@H+]2CCCCC23CC3)cc1O ZINC001233486663 978613406 /nfs/dbraw/zinc/61/34/06/978613406.db2.gz WYVIPBZGIDBMLS-UHFFFAOYSA-N 1 1 249.310 2.322 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccc(O)cc2O)C2(CC2)C1 ZINC001204279626 978950255 /nfs/dbraw/zinc/95/02/55/978950255.db2.gz CWCWMOZVWAKBDY-SNVBAGLBSA-N 1 1 233.311 2.472 20 10 BECDMO Cc1cccc(C[N@@H+]2CCNC[C@H]2C(C)C)c1O ZINC001235458113 979047832 /nfs/dbraw/zinc/04/78/32/979047832.db2.gz MFXCJVMODUHKND-AWEZNQCLSA-N 1 1 248.370 2.130 20 10 BECDMO Cc1cccc(CN2CC[NH2+]C[C@H]2C(C)C)c1O ZINC001235458113 979047837 /nfs/dbraw/zinc/04/78/37/979047837.db2.gz MFXCJVMODUHKND-AWEZNQCLSA-N 1 1 248.370 2.130 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCN[C@H](C(C)C)C2)c1 ZINC001235470650 979052642 /nfs/dbraw/zinc/05/26/42/979052642.db2.gz DGQAHXLLVGGAPK-AWEZNQCLSA-N 1 1 248.370 2.130 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCN[C@H](C(C)C)C2)c1 ZINC001235470650 979052649 /nfs/dbraw/zinc/05/26/49/979052649.db2.gz DGQAHXLLVGGAPK-AWEZNQCLSA-N 1 1 248.370 2.130 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](F)C2)c1 ZINC000689907776 979059905 /nfs/dbraw/zinc/05/99/05/979059905.db2.gz UMTOEMURSMMCES-NSHDSACASA-N 1 1 239.290 2.335 20 10 BECDMO C[N@@H+](CCCO)Cc1ccc(N2CCCC2)cc1 ZINC001235690592 979118441 /nfs/dbraw/zinc/11/84/41/979118441.db2.gz ATORAEDIXOULBC-UHFFFAOYSA-N 1 1 248.370 2.101 20 10 BECDMO Cn1ccc2c1cc[nH+]c2-c1cncc(O)c1 ZINC001236575750 979645442 /nfs/dbraw/zinc/64/54/42/979645442.db2.gz WYXUYRALUIISBG-UHFFFAOYSA-N 1 1 225.251 2.341 20 10 BECDMO CCc1ccc(C[N@H+]2C[C@@H](C)C[C@H]2CO)c(O)c1 ZINC001236782303 979730470 /nfs/dbraw/zinc/73/04/70/979730470.db2.gz AIJCNMWXBVOLGG-FZMZJTMJSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1ccc(C[N@H+]2CCOC[C@H](C)C2)c(O)c1 ZINC001236784055 979730835 /nfs/dbraw/zinc/73/08/35/979730835.db2.gz RPESDHDFVYYUNP-GFCCVEGCSA-N 1 1 249.354 2.423 20 10 BECDMO CCc1ccc(C[N@H+]2CC[C@H](O)[C@H](C)C2)c(O)c1 ZINC001236784764 979731248 /nfs/dbraw/zinc/73/12/48/979731248.db2.gz ZVLNMPUGRBXFCG-RISCZKNCSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1ccc(C[N@H+]2CCC[C@@](C)(O)C2)c(O)c1 ZINC001236787149 979732877 /nfs/dbraw/zinc/73/28/77/979732877.db2.gz AFESVGKCDQQHJF-OAHLLOKOSA-N 1 1 249.354 2.301 20 10 BECDMO CCc1ccc(CN2CC[NH+](CC)CC2)c(O)c1 ZINC001236784697 979733750 /nfs/dbraw/zinc/73/37/50/979733750.db2.gz YPAFPQWMBZWJQA-UHFFFAOYSA-N 1 1 248.370 2.092 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001203561334 979773549 /nfs/dbraw/zinc/77/35/49/979773549.db2.gz QPJASXWZRBVDBF-PWSUYJOCSA-N 1 1 203.285 2.377 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@](C)(O)[C@@H](C)C1 ZINC001237486243 979913389 /nfs/dbraw/zinc/91/33/89/979913389.db2.gz ZKXIUOMILAIBOL-WFASDCNBSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@]2(CCCO2)C1 ZINC001237484683 979913827 /nfs/dbraw/zinc/91/38/27/979913827.db2.gz HOWYZSIXLJNALB-HNNXBMFYSA-N 1 1 247.338 2.456 20 10 BECDMO CC(=O)[C@@H]1CCC[N@H+]1Cc1c(C)cccc1O ZINC001237496273 979921827 /nfs/dbraw/zinc/92/18/27/979921827.db2.gz XSBYPWBTQRTDLU-ZDUSSCGKSA-N 1 1 233.311 2.254 20 10 BECDMO CC[N@H+](Cc1cccc(F)c1O)CC(C)(C)O ZINC000272343660 980713264 /nfs/dbraw/zinc/71/32/64/980713264.db2.gz ZCSCLGNIBYKZJZ-UHFFFAOYSA-N 1 1 241.306 2.124 20 10 BECDMO CC[N@@H+](Cc1cccc(F)c1O)CC(C)(C)O ZINC000272343660 980713265 /nfs/dbraw/zinc/71/32/65/980713265.db2.gz ZCSCLGNIBYKZJZ-UHFFFAOYSA-N 1 1 241.306 2.124 20 10 BECDMO Oc1ccc(C[N@H+]2CCC[C@@H](F)CC2)cc1O ZINC001203875505 982559348 /nfs/dbraw/zinc/55/93/48/982559348.db2.gz OEFSMUJVCBOYOE-LLVKDONJSA-N 1 1 239.290 2.422 20 10 BECDMO COC1(C[N@@H+](C)Cc2ccccc2O)CCC1 ZINC001352826955 982592397 /nfs/dbraw/zinc/59/23/97/982592397.db2.gz ZCRKVWIIJLTLLL-UHFFFAOYSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@@H](C)CC[C@H]2CN)c1 ZINC001205831646 982679654 /nfs/dbraw/zinc/67/96/54/982679654.db2.gz YFWXFXZVJOEKDF-JSGCOSHPSA-N 1 1 248.370 2.260 20 10 BECDMO Oc1cc2c(cc1O)C[N@@H+](CC1CC1)CCC2 ZINC001201951412 983520119 /nfs/dbraw/zinc/52/01/19/983520119.db2.gz IXOJVARQRAOFLJ-UHFFFAOYSA-N 1 1 233.311 2.256 20 10 BECDMO CCc1cccc(C[N@@H+](C)[C@H]2CCOC2)c1O ZINC000692107125 985412563 /nfs/dbraw/zinc/41/25/63/985412563.db2.gz CFRFZJKVVGDYFQ-ZDUSSCGKSA-N 1 1 235.327 2.175 20 10 BECDMO C[C@@H]([NH2+][C@H]1CC[C@H](C)NC1)c1ccccc1O ZINC001246301696 987696281 /nfs/dbraw/zinc/69/62/81/987696281.db2.gz UZJWVTAPQAGZCU-TUAOUCFPSA-N 1 1 234.343 2.183 20 10 BECDMO Cc1cc(C)c(C[NH2+][C@@H]2CC[C@H](C)NC2)c(O)c1 ZINC001246344784 987752725 /nfs/dbraw/zinc/75/27/25/987752725.db2.gz SKSPSGCMNFKUPK-QWHCGFSZSA-N 1 1 248.370 2.239 20 10 BECDMO C[NH+](C)[C@@H]1CCCN(Cc2ccc(N)cc2)CC1 ZINC001120370810 989640740 /nfs/dbraw/zinc/64/07/40/989640740.db2.gz FUYZSSRDYCBDOR-OAHLLOKOSA-N 1 1 247.386 2.185 20 10 BECDMO Cc1c(C[N@H+](C)C2COC2)c2ccccc2n1C ZINC001138256771 990903411 /nfs/dbraw/zinc/90/34/11/990903411.db2.gz KAFDZKVKBNDRID-UHFFFAOYSA-N 1 1 244.338 2.317 20 10 BECDMO Cc1c(C[N@@H+](C)C2COC2)c2ccccc2n1C ZINC001138256771 990903427 /nfs/dbraw/zinc/90/34/27/990903427.db2.gz KAFDZKVKBNDRID-UHFFFAOYSA-N 1 1 244.338 2.317 20 10 BECDMO Oc1cccc(F)c1C[NH2+]Cc1ccns1 ZINC001308948595 991228420 /nfs/dbraw/zinc/22/84/20/991228420.db2.gz PSOWRPVJEJKFNR-UHFFFAOYSA-N 1 1 238.287 2.278 20 10 BECDMO Cc1cc(C[N@@H+]2C[C@@H]3C[C@H]2CO3)ccc1N(C)C ZINC001139673579 991311480 /nfs/dbraw/zinc/31/14/80/991311480.db2.gz UODAEJZFQQMDHO-KBPBESRZSA-N 1 1 246.354 2.034 20 10 BECDMO Cc1cc(C[N@H+]2C[C@@H]3C[C@H]2CO3)ccc1N(C)C ZINC001139673579 991311495 /nfs/dbraw/zinc/31/14/95/991311495.db2.gz UODAEJZFQQMDHO-KBPBESRZSA-N 1 1 246.354 2.034 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001140063562 991518082 /nfs/dbraw/zinc/51/80/82/991518082.db2.gz SIVZKRPOVJLTSQ-UWJYBYFXSA-N 1 1 239.265 2.321 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CC[C@@H](O)[C@H](C)C2)c1O ZINC001140178751 991551137 /nfs/dbraw/zinc/55/11/37/991551137.db2.gz WNVPYTMXXWNGCW-TZMCWYRMSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCC(=O)[C@H](C)C2)c1O ZINC001140178623 991551311 /nfs/dbraw/zinc/55/13/11/991551311.db2.gz QYXRWVNAFAOMJQ-GFCCVEGCSA-N 1 1 247.338 2.420 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCCOCC2)c1O ZINC001140178204 991553319 /nfs/dbraw/zinc/55/33/19/991553319.db2.gz CIYGZGMMQITXCD-UHFFFAOYSA-N 1 1 235.327 2.231 20 10 BECDMO CC[N@@H+](CCOC)Cc1c(C)ccc(C)c1O ZINC001140179989 991553640 /nfs/dbraw/zinc/55/36/40/991553640.db2.gz LERDTZBXRSNJTH-UHFFFAOYSA-N 1 1 237.343 2.477 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2C[C@@H]3CCO[C@@H]3C2)c1O ZINC001140184437 991555549 /nfs/dbraw/zinc/55/55/49/991555549.db2.gz UBOJWMLYIKVHTB-GXTWGEPZSA-N 1 1 247.338 2.230 20 10 BECDMO Cc1ccc(C)c(C[N@H+](C)[C@H]2CCOC2)c1O ZINC001140182245 991555677 /nfs/dbraw/zinc/55/56/77/991555677.db2.gz MGGHKLSXVOAHDB-LBPRGKRZSA-N 1 1 235.327 2.230 20 10 BECDMO Cc1ccc(C)c(C[N@@H+](C)CCF)c1O ZINC001140185136 991556486 /nfs/dbraw/zinc/55/64/86/991556486.db2.gz PPEJXBOEPGTXHJ-UHFFFAOYSA-N 1 1 211.280 2.410 20 10 BECDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2(C)CC2)c1 ZINC001320252694 992144627 /nfs/dbraw/zinc/14/46/27/992144627.db2.gz JEADPEXHQNAUTJ-VIFPVBQESA-N 1 1 249.310 2.382 20 10 BECDMO CNCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001261423621 992292413 /nfs/dbraw/zinc/29/24/13/992292413.db2.gz ANCZGBTVCGCZLO-MNOVXSKESA-N 1 1 234.343 2.058 20 10 BECDMO COC[C@H]1CCC[N@H+]1Cc1cccc(F)c1[O-] ZINC000702764999 994045950 /nfs/dbraw/zinc/04/59/50/994045950.db2.gz IJBAIHDOBYSTIH-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO COC[C@H]1CCC[N@@H+]1Cc1cccc(F)c1O ZINC000702764999 994045955 /nfs/dbraw/zinc/04/59/55/994045955.db2.gz IJBAIHDOBYSTIH-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO COC[C@H]1CCC[N@H+]1Cc1cccc(F)c1O ZINC000702764999 994045957 /nfs/dbraw/zinc/04/59/57/994045957.db2.gz IJBAIHDOBYSTIH-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO COC[C@@H]1CCC[N@H+]1Cc1cccc(F)c1[O-] ZINC000702765001 994047441 /nfs/dbraw/zinc/04/74/41/994047441.db2.gz IJBAIHDOBYSTIH-NSHDSACASA-N 1 1 239.290 2.142 20 10 BECDMO COC[C@@H]1CCC[N@@H+]1Cc1cccc(F)c1O ZINC000702765001 994047448 /nfs/dbraw/zinc/04/74/48/994047448.db2.gz IJBAIHDOBYSTIH-NSHDSACASA-N 1 1 239.290 2.142 20 10 BECDMO COC[C@@H]1CCC[N@H+]1Cc1cccc(F)c1O ZINC000702765001 994047455 /nfs/dbraw/zinc/04/74/55/994047455.db2.gz IJBAIHDOBYSTIH-NSHDSACASA-N 1 1 239.290 2.142 20 10 BECDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)[C@H](C)O ZINC001615686622 1170528031 /nfs/dbraw/zinc/52/80/31/1170528031.db2.gz RSROWVGUFAHEBF-RYUDHWBXSA-N 1 1 237.343 2.374 20 10 BECDMO CC(C)c1ccc(O)c(C[N@@H+](C)CCCO)c1 ZINC001621278894 1170762493 /nfs/dbraw/zinc/76/24/93/1170762493.db2.gz GDVDHZCIKZDENQ-UHFFFAOYSA-N 1 1 237.343 2.330 20 10 BECDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@@H](CF)C1 ZINC001621496701 1170827761 /nfs/dbraw/zinc/82/77/61/1170827761.db2.gz QCJSJZZQIDLZDT-QMMMGPOBSA-N 1 1 245.244 2.462 20 10 BECDMO Oc1cc(F)c(F)cc1C[N@H+]1CC[C@@H](CF)C1 ZINC001621496701 1170827765 /nfs/dbraw/zinc/82/77/65/1170827765.db2.gz QCJSJZZQIDLZDT-QMMMGPOBSA-N 1 1 245.244 2.462 20 10 BECDMO Nc1ccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)cc1 ZINC000041079487 1171166475 /nfs/dbraw/zinc/16/64/75/1171166475.db2.gz AQMVJAZMUFMUCN-CYBMUJFWSA-N 1 1 246.354 2.270 20 10 BECDMO COCC[N@H+](Cc1ccc(N)cc1)CC(C)C ZINC000044412273 1171382040 /nfs/dbraw/zinc/38/20/40/1171382040.db2.gz DUERCLLLAWNIPM-UHFFFAOYSA-N 1 1 236.359 2.373 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)CCN(C)C)cc1C ZINC000289870929 178196420 /nfs/dbraw/zinc/19/64/20/178196420.db2.gz RIXNOSVJHUKTNB-UHFFFAOYSA-N 1 1 236.359 2.002 20 10 BECDMO Cc1cc(O)c(CN(C)CC[NH+](C)C)cc1C ZINC000289870929 178196421 /nfs/dbraw/zinc/19/64/21/178196421.db2.gz RIXNOSVJHUKTNB-UHFFFAOYSA-N 1 1 236.359 2.002 20 10 BECDMO CC[C@@H](CO)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000294226461 398259213 /nfs/dbraw/zinc/25/92/13/398259213.db2.gz MDDLUDMKGRNLGP-QMMMGPOBSA-N 1 1 247.697 2.045 20 10 BECDMO Cc1n[nH]cc1C[N@H+](C)Cc1ccccc1O ZINC000091974714 398304049 /nfs/dbraw/zinc/30/40/49/398304049.db2.gz AUFNSYVHKPCMIS-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO CCC[N@@H+](Cc1ccccc1O)CC(C)(C)O ZINC000076074346 344021353 /nfs/dbraw/zinc/02/13/53/344021353.db2.gz MBLIDJUYUZSSHS-UHFFFAOYSA-N 1 1 237.343 2.375 20 10 BECDMO CC[N@@H+](Cc1cnn(C)c1)Cc1ccccc1O ZINC000179563164 346989279 /nfs/dbraw/zinc/98/92/79/346989279.db2.gz YMDKHMQKKJNBNQ-UHFFFAOYSA-N 1 1 245.326 2.148 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@@H](N(C)C)C2)c1O ZINC000124586244 179074878 /nfs/dbraw/zinc/07/48/78/179074878.db2.gz ZBDFLTSMOLXHLH-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(CN2CCC[C@@H]([NH+](C)C)C2)c1O ZINC000124586244 179074881 /nfs/dbraw/zinc/07/48/81/179074881.db2.gz ZBDFLTSMOLXHLH-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(C[N@H+](C)Cc2cnn(C)c2)c1O ZINC000179601687 179070164 /nfs/dbraw/zinc/07/01/64/179070164.db2.gz NDWZWOXONLAUDN-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO Cc1cccc(C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c1O ZINC000271870945 179067971 /nfs/dbraw/zinc/06/79/71/179067971.db2.gz SDKMYWDNMIWTEE-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1[nH+]ccn1CCSc1nccs1 ZINC000270554744 180263519 /nfs/dbraw/zinc/26/35/19/180263519.db2.gz CIFWIDNNFYEXTI-UHFFFAOYSA-N 1 1 225.342 2.440 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCCO[C@H](C)C2)c1 ZINC000134145277 358781716 /nfs/dbraw/zinc/78/17/16/358781716.db2.gz INRRTTGCCKHUSE-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@]3(CCOC3)C2)c1 ZINC000093820624 360281952 /nfs/dbraw/zinc/28/19/52/360281952.db2.gz KVMJAEPLCHWCBO-HNNXBMFYSA-N 1 1 247.338 2.313 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CCOC[C@@H]2C)cc1C ZINC000033824099 368262801 /nfs/dbraw/zinc/26/28/01/368262801.db2.gz HNOSYZMYQPLVFT-LBPRGKRZSA-N 1 1 235.327 2.230 20 10 BECDMO CCC[N@@H+](CC)Cc1cc2c(cc1O)OCO2 ZINC000112465867 169130557 /nfs/dbraw/zinc/13/05/57/169130557.db2.gz BEKIRISZTVCJEO-UHFFFAOYSA-N 1 1 237.299 2.353 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC000245605525 183300930 /nfs/dbraw/zinc/30/09/30/183300930.db2.gz MEDLBVSQORUUKF-ZFWWWQNUSA-N 1 1 247.338 2.393 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H](n2cccn2)C1 ZINC000291209626 183302488 /nfs/dbraw/zinc/30/24/88/183302488.db2.gz IIZAVNDUCMQKID-ZDUSSCGKSA-N 1 1 243.310 2.036 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1CF ZINC000293989893 183302533 /nfs/dbraw/zinc/30/25/33/183302533.db2.gz LOSMSUORXMGJJE-LLVKDONJSA-N 1 1 209.264 2.326 20 10 BECDMO Oc1ccccc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000378165189 183303302 /nfs/dbraw/zinc/30/33/02/183303302.db2.gz XJHUUJLFGHPGBC-LBPRGKRZSA-N 1 1 243.310 2.283 20 10 BECDMO Oc1ccccc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000378165184 183304014 /nfs/dbraw/zinc/30/40/14/183304014.db2.gz XJHUUJLFGHPGBC-GFCCVEGCSA-N 1 1 243.310 2.283 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)OC[C@@H]2C)c1 ZINC000132181601 384220855 /nfs/dbraw/zinc/22/08/55/384220855.db2.gz NWFYHKVFZGLUBI-RYUDHWBXSA-N 1 1 235.327 2.310 20 10 BECDMO CC(C)C[C@@H](CO)[NH2+]Cc1cccc(F)c1O ZINC000158733641 384287173 /nfs/dbraw/zinc/28/71/73/384287173.db2.gz ACUCQKSKQKGCNQ-NSHDSACASA-N 1 1 241.306 2.028 20 10 BECDMO C[N@@H+](Cc1cccc(Cl)c1[O-])[C@@H]1CCOC1 ZINC000162818167 384692717 /nfs/dbraw/zinc/69/27/17/384692717.db2.gz OBSHHSHJLVQNNC-SNVBAGLBSA-N 1 1 241.718 2.266 20 10 BECDMO COC[C@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062748388 385186283 /nfs/dbraw/zinc/18/62/83/385186283.db2.gz MTGLSTATKQTIDV-ZJUUUORDSA-N 1 1 241.306 2.464 20 10 BECDMO C[C@@H]([NH2+]C[C@@H](C)N(C)C)c1ccc(F)cc1O ZINC000062747900 385187966 /nfs/dbraw/zinc/18/79/66/385187966.db2.gz OPAHZPAKNZIYIE-NXEZZACHSA-N 1 1 240.322 2.132 20 10 BECDMO CO[C@@H](C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000191205589 385292703 /nfs/dbraw/zinc/29/27/03/385292703.db2.gz KNLXFFVCVJGPRN-DTWKUNHWSA-N 1 1 227.279 2.217 20 10 BECDMO C[C@@H]([NH2+]CCCCCO)c1ccc(F)cc1O ZINC000192931075 385376551 /nfs/dbraw/zinc/37/65/51/385376551.db2.gz JHHQSZLPIGSQIZ-SNVBAGLBSA-N 1 1 241.306 2.345 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2ccccc2O)C[C@H](C)O1 ZINC000179563391 385474766 /nfs/dbraw/zinc/47/47/66/385474766.db2.gz AKIIDPHMIZDKBI-WCQYABFASA-N 1 1 235.327 2.392 20 10 BECDMO COC[C@H]1CC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000211417174 385683917 /nfs/dbraw/zinc/68/39/17/385683917.db2.gz YLKYUGPFERIPNT-LBPRGKRZSA-N 1 1 235.327 2.169 20 10 BECDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccccc2O)C1 ZINC000230299915 385727816 /nfs/dbraw/zinc/72/78/16/385727816.db2.gz BHXRQSSZZCFJQD-AWEZNQCLSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2C[C@H](C)O)c1 ZINC000271204814 385803932 /nfs/dbraw/zinc/80/39/32/385803932.db2.gz VOZIKSISFUZGII-GXTWGEPZSA-N 1 1 249.354 2.436 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@@H]1CCCC[C@@H]1O ZINC000272587413 385915211 /nfs/dbraw/zinc/91/52/11/385915211.db2.gz HIJKCXIFKZCQPB-ZFWWWQNUSA-N 1 1 249.354 2.375 20 10 BECDMO CC[C@@H](CO)[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000285837258 385970276 /nfs/dbraw/zinc/97/02/76/385970276.db2.gz XETGJVAHULYNJV-JQWIXIFHSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1c[nH]nc1C[N@@H+](C)Cc1ccccc1O ZINC000290411181 386429836 /nfs/dbraw/zinc/42/98/36/386429836.db2.gz LIDDVIPIEAWYJI-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1c[nH]nc1C[N@H+](C)Cc1ccccc1O ZINC000290411181 386429838 /nfs/dbraw/zinc/42/98/38/386429838.db2.gz LIDDVIPIEAWYJI-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO C[N@@H+](CCCCCO)Cc1cc(F)ccc1O ZINC000279393837 386677123 /nfs/dbraw/zinc/67/71/23/386677123.db2.gz KLOXCDBNDHVDKN-UHFFFAOYSA-N 1 1 241.306 2.126 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)CC(C)(C)CO)c1 ZINC000294670924 386683507 /nfs/dbraw/zinc/68/35/07/386683507.db2.gz AVNQHXIQBJYJHW-UHFFFAOYSA-N 1 1 237.343 2.151 20 10 BECDMO C[C@H]([NH2+]CC1COC1)c1ccc(Cl)cc1O ZINC000528026153 387830787 /nfs/dbraw/zinc/83/07/87/387830787.db2.gz JVELVQIEXXZFEH-QMMMGPOBSA-N 1 1 241.718 2.343 20 10 BECDMO CN(C)c1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000237092972 388389833 /nfs/dbraw/zinc/38/98/33/388389833.db2.gz RAOCJOFVFROKMY-UHFFFAOYSA-N 1 1 231.299 2.030 20 10 BECDMO C[C@H]([NH2+]CCC(C)(C)O)c1ccc(F)cc1O ZINC000274809273 389049797 /nfs/dbraw/zinc/04/97/97/389049797.db2.gz UMNVLNUFBFXNTH-VIFPVBQESA-N 1 1 241.306 2.343 20 10 BECDMO CCOCC[N@@H+](CC)Cc1ccccc1O ZINC000132733176 170395807 /nfs/dbraw/zinc/39/58/07/170395807.db2.gz IYWBFCOYWXEONI-UHFFFAOYSA-N 1 1 223.316 2.251 20 10 BECDMO CCOCC[N@@H+](CC)Cc1ccc(N)cc1 ZINC000035361420 170396552 /nfs/dbraw/zinc/39/65/52/170396552.db2.gz AFMJTLIPFAQUNN-UHFFFAOYSA-N 1 1 222.332 2.127 20 10 BECDMO CC[C@H](C)[N@H+](C)CCNCc1ccccc1O ZINC000217390360 171305758 /nfs/dbraw/zinc/30/57/58/171305758.db2.gz WRSZXYPVJDZHBH-LBPRGKRZSA-N 1 1 236.359 2.212 20 10 BECDMO CC[C@H](C)[N@@H+](C)CCNCc1ccccc1O ZINC000217390360 171305760 /nfs/dbraw/zinc/30/57/60/171305760.db2.gz WRSZXYPVJDZHBH-LBPRGKRZSA-N 1 1 236.359 2.212 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](O)CC2)cc1 ZINC000293021045 172551948 /nfs/dbraw/zinc/55/19/48/172551948.db2.gz FMFWLXDZPXIIFO-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@@H](CO)[C@H]2C)c1O ZINC001652321038 1173060694 /nfs/dbraw/zinc/06/06/94/1173060694.db2.gz HACBOJHHAYOREO-RISCZKNCSA-N 1 1 249.354 2.157 20 10 BECDMO COCC1=CC[N@@H+](Cc2cc(C)ccc2O)CC1 ZINC000187616475 174116862 /nfs/dbraw/zinc/11/68/62/174116862.db2.gz MKCHODMNZHIJHP-UHFFFAOYSA-N 1 1 247.338 2.479 20 10 BECDMO COCC[N@@H+](C)Cc1c(O)cccc1Cl ZINC000132707327 174280717 /nfs/dbraw/zinc/28/07/17/174280717.db2.gz IWVQNVLNEJLDTG-UHFFFAOYSA-N 1 1 229.707 2.124 20 10 BECDMO COc1ccc(O)c(C[N@@H+](C)C2CCC2)c1 ZINC000180295134 175157038 /nfs/dbraw/zinc/15/70/38/175157038.db2.gz VZHMFPQIOFARNQ-UHFFFAOYSA-N 1 1 221.300 2.385 20 10 BECDMO COc1cccc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1O ZINC000093661110 175261055 /nfs/dbraw/zinc/26/10/55/175261055.db2.gz CTWXTNPESKNDEM-TXEJJXNPSA-N 1 1 247.338 2.489 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000226563343 176174672 /nfs/dbraw/zinc/17/46/72/176174672.db2.gz XTVZESCXSGFQMS-SECBINFHSA-N 1 1 209.264 2.373 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)C[C@H](C2CC2)O1 ZINC000366245721 176307225 /nfs/dbraw/zinc/30/72/25/176307225.db2.gz CQNMKKYRNFMGCC-IAQYHMDHSA-N 1 1 247.338 2.392 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)CC(C)(C)O1 ZINC000133105020 176307349 /nfs/dbraw/zinc/30/73/49/176307349.db2.gz IUAPEYFTTYJGDB-LLVKDONJSA-N 1 1 235.327 2.392 20 10 BECDMO C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2O)CCN1C ZINC000179579725 176371427 /nfs/dbraw/zinc/37/14/27/176371427.db2.gz HFPNXVCRNNKZCV-OCCSQVGLSA-N 1 1 248.370 2.307 20 10 BECDMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000174963591 177163422 /nfs/dbraw/zinc/16/34/22/177163422.db2.gz NEUDUOIUDCEPGY-VHSXEESVSA-N 1 1 249.310 2.351 20 10 BECDMO C[C@H]1C[N@@H+](Cc2cc(F)ccc2O)CCCO1 ZINC000180064053 177260420 /nfs/dbraw/zinc/26/04/20/177260420.db2.gz UNDXYICXCHROEC-JTQLQIEISA-N 1 1 239.290 2.142 20 10 BECDMO C[C@H]1C[N@H+](Cc2cccc(F)c2O)CCCO1 ZINC000160234751 177264265 /nfs/dbraw/zinc/26/42/65/177264265.db2.gz GXRHUIOCUKLJAM-JTQLQIEISA-N 1 1 239.290 2.142 20 10 BECDMO C[C@H]1C[N@@H+](Cc2cccc(F)c2O)CCCO1 ZINC000160234751 177264266 /nfs/dbraw/zinc/26/42/66/177264266.db2.gz GXRHUIOCUKLJAM-JTQLQIEISA-N 1 1 239.290 2.142 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccccc2O)C[C@@H](C2CC2)O1 ZINC000366245722 177266689 /nfs/dbraw/zinc/26/66/89/177266689.db2.gz CQNMKKYRNFMGCC-NHYWBVRUSA-N 1 1 247.338 2.392 20 10 BECDMO C[C@H]1COCC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000033882223 177292959 /nfs/dbraw/zinc/29/29/59/177292959.db2.gz QATLHXRCKJCWMN-NSHDSACASA-N 1 1 247.338 2.102 20 10 BECDMO C[C@H]1CSCC[N@H+]1Cc1ccccc1O ZINC000179575147 177305014 /nfs/dbraw/zinc/30/50/14/177305014.db2.gz YXOASKDNWHDQBA-JTQLQIEISA-N 1 1 223.341 2.330 20 10 BECDMO CNC[C@@H](C)[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000854233135 588781228 /nfs/dbraw/zinc/78/12/28/588781228.db2.gz YCKQDCJQKOQWDE-NEPJUHHUSA-N 1 1 236.359 2.268 20 10 BECDMO Cc1cc(O)c(C[N@H+](C[C@@H](C)O)C2CC2)cc1C ZINC000848929102 582815483 /nfs/dbraw/zinc/81/54/83/582815483.db2.gz STFUGQZFGKJPBM-GFCCVEGCSA-N 1 1 249.354 2.354 20 10 BECDMO CN(C)c1ccc(C[NH2+]Cc2ccno2)cc1 ZINC000219396478 583175456 /nfs/dbraw/zinc/17/54/56/583175456.db2.gz SKNCKNYKAHAXLB-UHFFFAOYSA-N 1 1 231.299 2.030 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](C)[C@@H](CO)C2)c1 ZINC000857061258 588884915 /nfs/dbraw/zinc/88/49/15/588884915.db2.gz NBBNZIYXJOKPNV-GXTWGEPZSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@H](O)C(C)(C)C1 ZINC000877462078 583314400 /nfs/dbraw/zinc/31/44/00/583314400.db2.gz NOBJVSUAZWYRAV-AWEZNQCLSA-N 1 1 249.354 2.293 20 10 BECDMO OC[C@H]1CCCCC[N@H+]1Cc1ccccc1O ZINC000895151504 583606378 /nfs/dbraw/zinc/60/63/78/583606378.db2.gz JZMZNGLDCRNTKS-CYBMUJFWSA-N 1 1 235.327 2.129 20 10 BECDMO c1c[nH]c(C[NH2+]Cc2ccc3c(c2)CCCO3)n1 ZINC000895705007 583710117 /nfs/dbraw/zinc/71/01/17/583710117.db2.gz ROYKSROIDCUHCT-UHFFFAOYSA-N 1 1 243.310 2.025 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000895847886 583736502 /nfs/dbraw/zinc/73/65/02/583736502.db2.gz XFGQLZLZJZRSCV-DZGCQCFKSA-N 1 1 247.338 2.393 20 10 BECDMO CC1(C)C[C@H]([NH2+]Cc2c(O)cccc2F)CO1 ZINC000896637561 583819597 /nfs/dbraw/zinc/81/95/97/583819597.db2.gz KLMAFXFVPQUBDZ-VIFPVBQESA-N 1 1 239.290 2.188 20 10 BECDMO CC[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2F)CO1 ZINC000896638041 583819761 /nfs/dbraw/zinc/81/97/61/583819761.db2.gz NRGSUMBCHXADSZ-VHSXEESVSA-N 1 1 239.290 2.188 20 10 BECDMO CCC[C@@H](C[NH2+]Cc1c(O)cccc1F)OC ZINC000896639084 583820005 /nfs/dbraw/zinc/82/00/05/583820005.db2.gz UGVZJJIRHLFTRZ-JTQLQIEISA-N 1 1 241.306 2.436 20 10 BECDMO CC(C)OC[C@@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896639551 583820368 /nfs/dbraw/zinc/82/03/68/583820368.db2.gz WDKHEYUENWTWMA-SNVBAGLBSA-N 1 1 241.306 2.434 20 10 BECDMO CC[C@](C)(C[NH2+]Cc1c(O)cccc1F)OC ZINC000896639808 583820373 /nfs/dbraw/zinc/82/03/73/583820373.db2.gz XWSZTLGHRAHXCZ-CYBMUJFWSA-N 1 1 241.306 2.436 20 10 BECDMO C[C@@H](CF)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858168855 588936555 /nfs/dbraw/zinc/93/65/55/588936555.db2.gz FPKIYHJHCLRGDM-QMMMGPOBSA-N 1 1 246.276 2.478 20 10 BECDMO CN(C)c1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1F ZINC000862441554 583962933 /nfs/dbraw/zinc/96/29/33/583962933.db2.gz SRZZWEOFEFBFAY-TXEJJXNPSA-N 1 1 234.318 2.343 20 10 BECDMO COc1ccc(CN[C@H]2CCC[NH2+]CC2)cc1C ZINC000841056770 584125743 /nfs/dbraw/zinc/12/57/43/584125743.db2.gz DUHQLJBONAXFEA-AWEZNQCLSA-N 1 1 248.370 2.235 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]CC2(N)CC2)c(O)c1C ZINC000902405605 584573126 /nfs/dbraw/zinc/57/31/26/584573126.db2.gz JHPZSTYJJQFVFH-LLVKDONJSA-N 1 1 234.343 2.151 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)C[C@@H]1CCOC1 ZINC000876788593 584886822 /nfs/dbraw/zinc/88/68/22/584886822.db2.gz FSUIVZMJKPJARP-LBPRGKRZSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)N)c(O)c1C ZINC000817971486 584993486 /nfs/dbraw/zinc/99/34/86/584993486.db2.gz DMKROIUVTWFNDM-MWLCHTKSSA-N 1 1 222.332 2.007 20 10 BECDMO CC[C@@H](N)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000817981144 584994471 /nfs/dbraw/zinc/99/44/71/584994471.db2.gz ZLPKZHHUUQCRDR-WDEREUQCSA-N 1 1 222.332 2.089 20 10 BECDMO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(F)ccc1O ZINC000839131511 585093753 /nfs/dbraw/zinc/09/37/53/585093753.db2.gz MGUOEXTXEHISII-TXEJJXNPSA-N 1 1 249.285 2.227 20 10 BECDMO CC(C)[C@@H](CO)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886536934 585149936 /nfs/dbraw/zinc/14/99/36/585149936.db2.gz QQJMCUZPADLJPL-GXSJLCMTSA-N 1 1 241.306 2.199 20 10 BECDMO C[N@H+](C[C@@H]1C[C@@]12CCOC2)c1ccc(N)cc1 ZINC000886841616 585184260 /nfs/dbraw/zinc/18/42/60/585184260.db2.gz QVVZQIWXXBUWIX-SMDDNHRTSA-N 1 1 232.327 2.132 20 10 BECDMO C[N@@H+](C[C@@H]1C[C@@]12CCOC2)c1ccc(N)cc1 ZINC000886841616 585184261 /nfs/dbraw/zinc/18/42/61/585184261.db2.gz QVVZQIWXXBUWIX-SMDDNHRTSA-N 1 1 232.327 2.132 20 10 BECDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cocn1 ZINC000758342532 585354453 /nfs/dbraw/zinc/35/44/53/585354453.db2.gz NPOMIQBLBXLBND-UHFFFAOYSA-N 1 1 245.326 2.339 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@H](C)O)C2)c1 ZINC000768518417 585539630 /nfs/dbraw/zinc/53/96/30/585539630.db2.gz FHYXHEGYJKYZLH-STQMWFEESA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@H](C)O)C2)c1 ZINC000768518416 585539662 /nfs/dbraw/zinc/53/96/62/585539662.db2.gz FHYXHEGYJKYZLH-QWHCGFSZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CCNC(C)(C)C2)cc1C ZINC000769191830 585550900 /nfs/dbraw/zinc/55/09/00/585550900.db2.gz PBWFHUZJIDNZOD-UHFFFAOYSA-N 1 1 248.370 2.193 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCNC(C)(C)C2)cc1C ZINC000769191830 585550901 /nfs/dbraw/zinc/55/09/01/585550901.db2.gz PBWFHUZJIDNZOD-UHFFFAOYSA-N 1 1 248.370 2.193 20 10 BECDMO COc1cccc(O)c1C[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000769448366 585556917 /nfs/dbraw/zinc/55/69/17/585556917.db2.gz MGPGVCQOYNFPHZ-PHIMTYICSA-N 1 1 235.327 2.489 20 10 BECDMO C[C@@H]1COCCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000769457714 585557602 /nfs/dbraw/zinc/55/76/02/585557602.db2.gz OZAQGOLMPTZTNC-CYBMUJFWSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CC[C@](C)(O)C2)cc1 ZINC000773757108 585642851 /nfs/dbraw/zinc/64/28/51/585642851.db2.gz YPGVXGFTJZYVTJ-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO CC(C)[N@H+]1CC[C@H](N(C)Cc2ccccc2O)C1 ZINC000775656464 585682343 /nfs/dbraw/zinc/68/23/43/585682343.db2.gz VBMVOUGAAMUFFU-AWEZNQCLSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)N1CC[C@H]([N@H+](C)Cc2ccccc2O)C1 ZINC000775656464 585682344 /nfs/dbraw/zinc/68/23/44/585682344.db2.gz VBMVOUGAAMUFFU-AWEZNQCLSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)N1CC[C@H]([N@@H+](C)Cc2ccccc2O)C1 ZINC000775656464 585682345 /nfs/dbraw/zinc/68/23/45/585682345.db2.gz VBMVOUGAAMUFFU-AWEZNQCLSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)[N@H+]1CC[C@@H](N(C)Cc2ccccc2O)C1 ZINC000775656465 585682370 /nfs/dbraw/zinc/68/23/70/585682370.db2.gz VBMVOUGAAMUFFU-CQSZACIVSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)N1CC[C@@H]([N@H+](C)Cc2ccccc2O)C1 ZINC000775656465 585682371 /nfs/dbraw/zinc/68/23/71/585682371.db2.gz VBMVOUGAAMUFFU-CQSZACIVSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)N1CC[C@@H]([N@@H+](C)Cc2ccccc2O)C1 ZINC000775656465 585682372 /nfs/dbraw/zinc/68/23/72/585682372.db2.gz VBMVOUGAAMUFFU-CQSZACIVSA-N 1 1 248.370 2.307 20 10 BECDMO Cc1cccc(C[N@H+]2CCN(C)[C@@H](C)[C@H]2C)c1O ZINC000775985816 585688862 /nfs/dbraw/zinc/68/88/62/585688862.db2.gz OLOBGHLCSWHDES-QWHCGFSZSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C)N(C)C[C@H]2C)c1 ZINC000775985169 585688953 /nfs/dbraw/zinc/68/89/53/585688953.db2.gz KJLNUJKFEFWKSP-CHWSQXEVSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@H](C)N(C)C[C@@H]2C)c1O ZINC000775987364 585689024 /nfs/dbraw/zinc/68/90/24/585689024.db2.gz VLONYJHUMXWEMV-STQMWFEESA-N 1 1 248.370 2.225 20 10 BECDMO Oc1ccccc1C[N@H+]1CCc2ncsc2C1 ZINC000783746058 585841924 /nfs/dbraw/zinc/84/19/24/585841924.db2.gz VIVYGZOFYHYAEJ-UHFFFAOYSA-N 1 1 246.335 2.407 20 10 BECDMO COCC1([N@@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC000785762891 585880015 /nfs/dbraw/zinc/88/00/15/585880015.db2.gz AERLOSABMWCRLD-UHFFFAOYSA-N 1 1 248.370 2.363 20 10 BECDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccccc1O ZINC000785988378 585884662 /nfs/dbraw/zinc/88/46/62/585884662.db2.gz MPBMLPUDKQYWMZ-MBNYWOFBSA-N 1 1 249.354 2.374 20 10 BECDMO C[C@H]1C[C@H](O)C[N@H+]1Cc1cc(Cl)ccc1O ZINC000788268503 585920156 /nfs/dbraw/zinc/92/01/56/585920156.db2.gz DVSFCMQEYSFKQB-KWQFWETISA-N 1 1 241.718 2.001 20 10 BECDMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000793228486 586014885 /nfs/dbraw/zinc/01/48/85/586014885.db2.gz MVULCRKFGCTXHZ-DTORHVGOSA-N 1 1 235.283 2.104 20 10 BECDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC000796216727 586099000 /nfs/dbraw/zinc/09/90/00/586099000.db2.gz IXMFXEISAZIESS-GASCZTMLSA-N 1 1 248.370 2.362 20 10 BECDMO CC[N@@H+](Cc1cc(Cl)ccc1O)[C@H](C)CO ZINC000814170592 586614270 /nfs/dbraw/zinc/61/42/70/586614270.db2.gz ZLFLAFDXPJGGFD-SECBINFHSA-N 1 1 243.734 2.248 20 10 BECDMO Cc1cc(C[N@@H+](C)C2CC(O)C2)ccc1N(C)C ZINC000815092457 586665625 /nfs/dbraw/zinc/66/56/25/586665625.db2.gz HRQFBRXMIJFJEL-UHFFFAOYSA-N 1 1 248.370 2.016 20 10 BECDMO C[C@H](O)CC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816591715 586743176 /nfs/dbraw/zinc/74/31/76/586743176.db2.gz LWBOJOWHHSHGPB-ZETCQYMHSA-N 1 1 247.697 2.045 20 10 BECDMO Cc1ccc(O)c(CN2CCC3(CC[NH2+]3)CC2)c1 ZINC000817866390 586831543 /nfs/dbraw/zinc/83/15/43/586831543.db2.gz ZLLBNNVLLXQZRP-UHFFFAOYSA-N 1 1 246.354 2.029 20 10 BECDMO C[C@H](NC1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817935073 586843730 /nfs/dbraw/zinc/84/37/30/586843730.db2.gz FVVRQBGBBNPQGP-LBPRGKRZSA-N 1 1 247.386 2.155 20 10 BECDMO C[C@@H]([NH2+]CCC[NH3+])c1cc(Cl)ccc1[O-] ZINC000817938186 586844491 /nfs/dbraw/zinc/84/44/91/586844491.db2.gz GLRDDGQVCLTYDT-MRVPVSSYSA-N 1 1 228.723 2.045 20 10 BECDMO CC[C@@H](N[C@H]1CCC[NH2+]C1)c1ccccc1O ZINC000817940141 586845271 /nfs/dbraw/zinc/84/52/71/586845271.db2.gz FXQXHEDRUIEBHX-WCQYABFASA-N 1 1 234.343 2.185 20 10 BECDMO CC[C@H](N[C@@H]1CCC[NH2+]C1)c1ccc(C)cc1O ZINC000817941982 586845456 /nfs/dbraw/zinc/84/54/56/586845456.db2.gz VHJKYVLQGTUYHE-OCCSQVGLSA-N 1 1 248.370 2.493 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCCN2)c(O)c1 ZINC000817949019 586847190 /nfs/dbraw/zinc/84/71/90/586847190.db2.gz GEMRZPWHLXRPQE-OLZOCXBDSA-N 1 1 248.370 2.493 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCCN2)c1 ZINC000817948492 586847296 /nfs/dbraw/zinc/84/72/96/586847296.db2.gz AMGQTWSNKKBPOL-STQMWFEESA-N 1 1 248.370 2.493 20 10 BECDMO CCNCC[NH2+][C@@H](CC)c1ccccc1O ZINC000817952189 586847595 /nfs/dbraw/zinc/84/75/95/586847595.db2.gz ONESFSPXZDBUJA-LBPRGKRZSA-N 1 1 222.332 2.042 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]CCNC2CC2)c(O)c1C ZINC000817952599 586847955 /nfs/dbraw/zinc/84/79/55/586847955.db2.gz GEXWWKSHKQDSML-GFCCVEGCSA-N 1 1 248.370 2.412 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]CCNC2CC2)c1 ZINC000817952382 586847969 /nfs/dbraw/zinc/84/79/69/586847969.db2.gz FKGJHFHABRACBR-LLVKDONJSA-N 1 1 234.343 2.103 20 10 BECDMO CC[C@@H]([NH2+]CC(C)(C)N)c1ccccc1O ZINC000817960906 586851225 /nfs/dbraw/zinc/85/12/25/586851225.db2.gz TZXIDJNZGGUQTB-LLVKDONJSA-N 1 1 222.332 2.170 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)N)c1 ZINC000817960628 586851277 /nfs/dbraw/zinc/85/12/77/586851277.db2.gz PAHKFXRJUZCPFB-JTQLQIEISA-N 1 1 222.332 2.089 20 10 BECDMO Cc1ccc(O)c([C@H](C)NCC(C)(C)[NH3+])c1 ZINC000817960628 586851278 /nfs/dbraw/zinc/85/12/78/586851278.db2.gz PAHKFXRJUZCPFB-JTQLQIEISA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@@H]([NH2+]C[C@@H](N)C(C)C)c1ccccc1O ZINC000817960175 586851875 /nfs/dbraw/zinc/85/18/75/586851875.db2.gz XZDCMESMHJHXHC-CHWSQXEVSA-N 1 1 236.359 2.416 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@H](N)C2CC2)c(O)c1C ZINC000817964923 586854182 /nfs/dbraw/zinc/85/41/82/586854182.db2.gz JHKADVUGKOQZEE-FZMZJTMJSA-N 1 1 248.370 2.397 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](N)C2CC2)c1 ZINC000817966047 586855734 /nfs/dbraw/zinc/85/57/34/586855734.db2.gz ZOGRYDIHZWKDCA-ZWNOBZJWSA-N 1 1 234.343 2.089 20 10 BECDMO Cc1ccc(O)c([C@@H](C)NC[C@@H]([NH3+])C2CC2)c1 ZINC000817966047 586855736 /nfs/dbraw/zinc/85/57/36/586855736.db2.gz ZOGRYDIHZWKDCA-ZWNOBZJWSA-N 1 1 234.343 2.089 20 10 BECDMO CCN[C@H](C)C[NH2+][C@@H](C)c1ccccc1O ZINC000817972916 586859071 /nfs/dbraw/zinc/85/90/71/586859071.db2.gz PPNOEVRHRLVQNU-MNOVXSKESA-N 1 1 222.332 2.041 20 10 BECDMO C[C@H](N)C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817972300 586859157 /nfs/dbraw/zinc/85/91/57/586859157.db2.gz KWUQPRCAKXBPIO-QWRGUYRKSA-N 1 1 248.370 2.269 20 10 BECDMO CCN[C@H](C)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000817972121 586859687 /nfs/dbraw/zinc/85/96/87/586859687.db2.gz JZURNNBSTONPEH-NEPJUHHUSA-N 1 1 236.359 2.349 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](C)N)c(O)c1 ZINC000817973600 586860478 /nfs/dbraw/zinc/86/04/78/586860478.db2.gz VMXFJSLVFFWSCV-MNOVXSKESA-N 1 1 222.332 2.007 20 10 BECDMO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)N)c(O)c1 ZINC000817973716 586860656 /nfs/dbraw/zinc/86/06/56/586860656.db2.gz VMXFJSLVFFWSCV-WDEREUQCSA-N 1 1 222.332 2.007 20 10 BECDMO CC[C@H](N)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000817978636 586861551 /nfs/dbraw/zinc/86/15/51/586861551.db2.gz CUEZHEJCLMHYSP-NEPJUHHUSA-N 1 1 236.359 2.397 20 10 BECDMO CC[C@@H](N)C[NH2+][C@H](CC)c1ccccc1O ZINC000817979377 586861619 /nfs/dbraw/zinc/86/16/19/586861619.db2.gz JYHQIRZUUXHMFT-ZYHUDNBSSA-N 1 1 222.332 2.170 20 10 BECDMO Cc1cccc(C[NH2+]C(CF)CF)c1O ZINC000824554213 587275985 /nfs/dbraw/zinc/27/59/85/587275985.db2.gz CMKCSFUTDAYOKF-UHFFFAOYSA-N 1 1 215.243 2.098 20 10 BECDMO CN(C)c1ccc(C[N@@H+]2CC[C@@H](F)C2)cc1F ZINC000824572204 587277193 /nfs/dbraw/zinc/27/71/93/587277193.db2.gz UQHHFMOHLOVWLU-LLVKDONJSA-N 1 1 240.297 2.436 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](F)C2)cc1F ZINC000824572204 587277195 /nfs/dbraw/zinc/27/71/95/587277195.db2.gz UQHHFMOHLOVWLU-LLVKDONJSA-N 1 1 240.297 2.436 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CC[C@H]1C1CC1 ZINC000824650673 587280769 /nfs/dbraw/zinc/28/07/69/587280769.db2.gz OTMOGWSEPCECRC-LBPRGKRZSA-N 1 1 233.311 2.385 20 10 BECDMO Oc1cc2c(cc1C[N@H+]1CC[C@H]1C1CC1)OCO2 ZINC000824649625 587281026 /nfs/dbraw/zinc/28/10/26/587281026.db2.gz DKVCPUYILOTGND-NSHDSACASA-N 1 1 247.294 2.105 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)Cc2cnc[nH]2)cc1C ZINC000826769071 587361741 /nfs/dbraw/zinc/36/17/41/587361741.db2.gz HGOUNAVVMKTOHQ-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)Cc2cnc[nH]2)cc1C ZINC000826769071 587361742 /nfs/dbraw/zinc/36/17/42/587361742.db2.gz HGOUNAVVMKTOHQ-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)Cc2c[nH]cn2)cc1C ZINC000826769071 587361743 /nfs/dbraw/zinc/36/17/43/587361743.db2.gz HGOUNAVVMKTOHQ-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)Cc2c[nH]cn2)cc1C ZINC000826769071 587361744 /nfs/dbraw/zinc/36/17/44/587361744.db2.gz HGOUNAVVMKTOHQ-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c1O ZINC000827282440 587375135 /nfs/dbraw/zinc/37/51/35/587375135.db2.gz MJHFVTPGBCOGSZ-UKRRQHHQSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H](O)C1 ZINC000840908306 587928450 /nfs/dbraw/zinc/92/84/50/587928450.db2.gz RSUPIPNBYJVUKN-HNNXBMFYSA-N 1 1 248.370 2.018 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCOC[C@H]1C ZINC000840911370 587929346 /nfs/dbraw/zinc/92/93/46/587929346.db2.gz XXHWXEBADMJVTH-CYBMUJFWSA-N 1 1 248.370 2.282 20 10 BECDMO COCC[N@@H+](C)Cc1ccc(N(C)C)cc1C ZINC000840910911 587929693 /nfs/dbraw/zinc/92/96/93/587929693.db2.gz XAQYLCBCZZBEQI-UHFFFAOYSA-N 1 1 236.359 2.139 20 10 BECDMO Cc1cc(O)c(C[NH2+]C[C@H](N)C(C)C)cc1C ZINC000841030772 587936669 /nfs/dbraw/zinc/93/66/69/587936669.db2.gz VAHDLRWSNVAGCV-ZDUSSCGKSA-N 1 1 236.359 2.082 20 10 BECDMO Cc1cc(O)c(CNC[C@H]([NH3+])C(C)C)cc1C ZINC000841030772 587936671 /nfs/dbraw/zinc/93/66/71/587936671.db2.gz VAHDLRWSNVAGCV-ZDUSSCGKSA-N 1 1 236.359 2.082 20 10 BECDMO C[C@@H](CN)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841062766 587941510 /nfs/dbraw/zinc/94/15/10/587941510.db2.gz DTZIUAAGRJNMPQ-ZDUSSCGKSA-N 1 1 247.386 2.114 20 10 BECDMO CC[C@@H]([NH3+])CNCc1cc(Cl)cc(C)c1O ZINC000841072952 587944517 /nfs/dbraw/zinc/94/45/17/587944517.db2.gz SYEYNKJTBXYRCC-LLVKDONJSA-N 1 1 242.750 2.181 20 10 BECDMO C[C@H](CCO)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000846113105 588257282 /nfs/dbraw/zinc/25/72/82/588257282.db2.gz ZHSIRBGUWCOZPH-SECBINFHSA-N 1 1 243.734 2.248 20 10 BECDMO CCc1cccc(C[N@H+]2CCC[C@](C)(O)C2)c1O ZINC000848888166 588415914 /nfs/dbraw/zinc/41/59/14/588415914.db2.gz NSHMXUUIOZUMAJ-HNNXBMFYSA-N 1 1 249.354 2.301 20 10 BECDMO CCOC1C[NH+](Cc2cccc(CC)c2O)C1 ZINC000848915045 588419912 /nfs/dbraw/zinc/41/99/12/588419912.db2.gz RCFGIRHXCQSPMT-UHFFFAOYSA-N 1 1 235.327 2.175 20 10 BECDMO CCc1cccc(C[N@@H+](C)[C@@H](C)CCO)c1O ZINC000848918617 588420667 /nfs/dbraw/zinc/42/06/67/588420667.db2.gz GAIHHRKWEKEPAL-NSHDSACASA-N 1 1 237.343 2.157 20 10 BECDMO CCc1cccc(C[NH2+]C(CF)CF)c1O ZINC000848917019 588421066 /nfs/dbraw/zinc/42/10/66/588421066.db2.gz ZPJLDYZTDOPCLP-UHFFFAOYSA-N 1 1 229.270 2.352 20 10 BECDMO Cc1cccc(C[N@H+](C[C@H](C)O)C2CC2)c1O ZINC000848929091 588421858 /nfs/dbraw/zinc/42/18/58/588421858.db2.gz SSAUGUZOBVMQQE-NSHDSACASA-N 1 1 235.327 2.046 20 10 BECDMO CC[C@H]([NH2+]C/C=C\CO)c1ccc(F)cc1O ZINC000850509736 588554883 /nfs/dbraw/zinc/55/48/83/588554883.db2.gz RJXLDASIUJHCEM-MVZIDQBPSA-N 1 1 239.290 2.121 20 10 BECDMO Cc1nnc([C@@H](C)[N@@H+](C)Cc2ccccc2O)o1 ZINC000109772745 588592430 /nfs/dbraw/zinc/59/24/30/588592430.db2.gz KEYFUXXBGJLIKE-SECBINFHSA-N 1 1 247.298 2.277 20 10 BECDMO CCC[N@H+](Cc1cnon1)Cc1ccccc1O ZINC000851793051 588629044 /nfs/dbraw/zinc/62/90/44/588629044.db2.gz VVFGTVIVHZYPLM-UHFFFAOYSA-N 1 1 247.298 2.187 20 10 BECDMO CCC[N@@H+](Cc1cnon1)Cc1ccccc1O ZINC000851793051 588629045 /nfs/dbraw/zinc/62/90/45/588629045.db2.gz VVFGTVIVHZYPLM-UHFFFAOYSA-N 1 1 247.298 2.187 20 10 BECDMO C[N@@H+](CCOC(F)F)Cc1ccccc1O ZINC000851841148 588634140 /nfs/dbraw/zinc/63/41/40/588634140.db2.gz NIWZAEROOTXRHK-UHFFFAOYSA-N 1 1 231.242 2.063 20 10 BECDMO CN(C)c1cc(F)c(C[NH2+]CCF)cc1F ZINC000862353629 589202243 /nfs/dbraw/zinc/20/22/43/589202243.db2.gz UOQSWQFOGRBQIZ-UHFFFAOYSA-N 1 1 232.249 2.090 20 10 BECDMO C[C@@H]([NH2+][C@H]1CC[C@@H](C)NC1)c1ccccc1O ZINC000863545550 589298037 /nfs/dbraw/zinc/29/80/37/589298037.db2.gz UZJWVTAPQAGZCU-UTUOFQBUSA-N 1 1 234.343 2.183 20 10 BECDMO C[C@@H]1CC[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)CN1 ZINC000863548027 589298418 /nfs/dbraw/zinc/29/84/18/589298418.db2.gz UEZQIWYCOUIPHR-RTXFEEFZSA-N 1 1 246.354 2.110 20 10 BECDMO Cc1nonc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000872135304 589878219 /nfs/dbraw/zinc/87/82/19/589878219.db2.gz FEQHGCGWNNLOGM-VIFPVBQESA-N 1 1 247.298 2.243 20 10 BECDMO C[N@@H+](CCC[C@@H]1CCO1)Cc1ccccc1O ZINC000876616149 590222442 /nfs/dbraw/zinc/22/24/42/590222442.db2.gz TUALWTMKQZEBGH-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1ccc(C[N@H+](C)Cc2cc[nH]n2)c(O)c1 ZINC000876722229 590233803 /nfs/dbraw/zinc/23/38/03/590233803.db2.gz QPVPTMZHWMMQDZ-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(C[N@@H+](C)Cc2cc[nH]n2)c(O)c1 ZINC000876722229 590233805 /nfs/dbraw/zinc/23/38/05/590233805.db2.gz QPVPTMZHWMMQDZ-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@](C)(O)C1 ZINC000876758484 590238772 /nfs/dbraw/zinc/23/87/72/590238772.db2.gz GSNXPUHGIJVIFD-AWEZNQCLSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c(O)c1 ZINC000876804920 590244324 /nfs/dbraw/zinc/24/43/24/590244324.db2.gz WCOSTJJWKMPLJR-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO CCOCC[N@@H+](C)Cc1ccc(C)cc1O ZINC000877172144 590296491 /nfs/dbraw/zinc/29/64/91/590296491.db2.gz LFWNCYZEVUDJNS-UHFFFAOYSA-N 1 1 223.316 2.169 20 10 BECDMO Cc1ccc(C[N@H+]2CCOCC3(CC3)C2)c(O)c1 ZINC000877194546 590299486 /nfs/dbraw/zinc/29/94/86/590299486.db2.gz QHGBLUVEWMUNJR-UHFFFAOYSA-N 1 1 247.338 2.313 20 10 BECDMO Cc1ccc(C[N@H+]2CCN(C)[C@@H](C)[C@H]2C)c(O)c1 ZINC000877409688 590324044 /nfs/dbraw/zinc/32/40/44/590324044.db2.gz XZEXVQYYXKPBCQ-QWHCGFSZSA-N 1 1 248.370 2.225 20 10 BECDMO CC[C@@]1(CO)CCC[N@H+]1Cc1ccc(C)cc1O ZINC000877463206 590332133 /nfs/dbraw/zinc/33/21/33/590332133.db2.gz AETVFCWZJRWNBW-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO CCN1CC[N@@H+](Cc2ccc(C)cc2O)[C@@H](C)C1 ZINC000877517019 590345499 /nfs/dbraw/zinc/34/54/99/590345499.db2.gz KTABGIIQIZGZQQ-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2ccc(C)cc2O)[C@@H](C)C1 ZINC000877517019 590345502 /nfs/dbraw/zinc/34/55/02/590345502.db2.gz KTABGIIQIZGZQQ-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2ccc(C)cc2O)[C@@H](C)C1 ZINC000877517019 590345505 /nfs/dbraw/zinc/34/55/05/590345505.db2.gz KTABGIIQIZGZQQ-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2c(C)cccc2O)C1 ZINC000877515393 590345577 /nfs/dbraw/zinc/34/55/77/590345577.db2.gz CSOWDVYNLYSKIM-TXEJJXNPSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1cccc(O)c1C[NH2+]CC(F)F ZINC000877516470 590345997 /nfs/dbraw/zinc/34/59/97/590345997.db2.gz AKLYWAGAXQWQMO-UHFFFAOYSA-N 1 1 201.216 2.055 20 10 BECDMO CC[N@@H+](Cc1c(C)cccc1O)[C@@H]1CCOC1 ZINC000877543502 590351586 /nfs/dbraw/zinc/35/15/86/590351586.db2.gz CLFRYOCGJUVLGG-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1ccc(C)cc1O ZINC000877561388 590359999 /nfs/dbraw/zinc/35/99/99/590359999.db2.gz LWMYCIMVRNTZAJ-KBPBESRZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H](CCCO)C1 ZINC000877576484 590363687 /nfs/dbraw/zinc/36/36/87/590363687.db2.gz LLDHTGDOBALOMA-CYBMUJFWSA-N 1 1 249.354 2.295 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@H]2COC[C@H]2C1 ZINC000877637465 590381537 /nfs/dbraw/zinc/38/15/37/590381537.db2.gz ILDOCCFIJZSDMB-QWHCGFSZSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c(O)c1 ZINC000877638023 590381685 /nfs/dbraw/zinc/38/16/85/590381685.db2.gz RKVOYVSJWOQJDO-KGLIPLIRSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@@H](C)[C@](C)(CO)C2)c(O)c1 ZINC000877640703 590381988 /nfs/dbraw/zinc/38/19/88/590381988.db2.gz QVOFAJNOBQLUCT-DOMZBBRYSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@H]2COC[C@@H]2C1 ZINC000877637466 590382037 /nfs/dbraw/zinc/38/20/37/590382037.db2.gz ILDOCCFIJZSDMB-STQMWFEESA-N 1 1 247.338 2.169 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@H](C)[C@H](CO)C2)c(O)c1 ZINC000877646505 590384266 /nfs/dbraw/zinc/38/42/66/590384266.db2.gz JFYSBXTVUDKAKH-JSGCOSHPSA-N 1 1 249.354 2.151 20 10 BECDMO C[C@H]1OCC[C@H]1C[N@@H+](C)Cc1ccccc1O ZINC000878241894 590528069 /nfs/dbraw/zinc/52/80/69/590528069.db2.gz JPZOQRFSRDSPEO-NEPJUHHUSA-N 1 1 235.327 2.249 20 10 BECDMO CC[C@@H]1COCC[N@H+]1Cc1cc(C)ccc1O ZINC000132331924 591702212 /nfs/dbraw/zinc/70/22/12/591702212.db2.gz MOAGNLCHLWNKGE-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO CC[C@H](C)N1CC[NH+](Cc2ccccc2O)CC1 ZINC000133814985 591860956 /nfs/dbraw/zinc/86/09/56/591860956.db2.gz LNOXWKCPXCQAPB-ZDUSSCGKSA-N 1 1 248.370 2.308 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)CCN2CCCC2)c1 ZINC000133905958 591867947 /nfs/dbraw/zinc/86/79/47/591867947.db2.gz LBHXOYMEZVBMHJ-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)CCN2CCCC2)c1 ZINC000133905958 591867951 /nfs/dbraw/zinc/86/79/51/591867951.db2.gz LBHXOYMEZVBMHJ-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO C[C@H]([NH2+]C[C@H]1CCOC1)c1c(O)cccc1F ZINC000886510894 592240101 /nfs/dbraw/zinc/24/01/01/592240101.db2.gz CBFAWXPHDJLODM-VHSXEESVSA-N 1 1 239.290 2.218 20 10 BECDMO COC[C@@H](C)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886512686 592240951 /nfs/dbraw/zinc/24/09/51/592240951.db2.gz LATLAVKGPWWYCC-VHSXEESVSA-N 1 1 241.306 2.464 20 10 BECDMO CC[C@](C)(O)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886524970 592245340 /nfs/dbraw/zinc/24/53/40/592245340.db2.gz UTPBSGQNABUZLE-ZANVPECISA-N 1 1 241.306 2.343 20 10 BECDMO CC[C@H](CCO)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886531149 592247863 /nfs/dbraw/zinc/24/78/63/592247863.db2.gz XHJLNLSZGFRFKG-NXEZZACHSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H]([NH2+]CCn1cccn1)c1c(O)cccc1F ZINC000886543249 592255334 /nfs/dbraw/zinc/25/53/34/592255334.db2.gz MDFQDBZQXJKVGN-SNVBAGLBSA-N 1 1 249.289 2.079 20 10 BECDMO C[C@H]([NH2+]CCn1cccn1)c1c(O)cccc1F ZINC000886543248 592256033 /nfs/dbraw/zinc/25/60/33/592256033.db2.gz MDFQDBZQXJKVGN-JTQLQIEISA-N 1 1 249.289 2.079 20 10 BECDMO C[C@H](O)C[C@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886588615 592271123 /nfs/dbraw/zinc/27/11/23/592271123.db2.gz WBJYBMBFIHNQKN-GUBZILKMSA-N 1 1 241.306 2.341 20 10 BECDMO CC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)[C@@H](C)O ZINC000886620470 592277348 /nfs/dbraw/zinc/27/73/48/592277348.db2.gz KQLZAJHKDCQOMW-KKZNHRDASA-N 1 1 241.306 2.341 20 10 BECDMO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ncc[nH]1 ZINC000139082305 592362437 /nfs/dbraw/zinc/36/24/37/592362437.db2.gz CUFQBBZKUULKNJ-NSHDSACASA-N 1 1 244.342 2.327 20 10 BECDMO CN(C)CCC[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000124215164 634401762 /nfs/dbraw/zinc/40/17/62/634401762.db2.gz TTXHWAGROATGGF-UHFFFAOYSA-N 1 1 248.370 2.053 20 10 BECDMO C[C@@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000096942638 631657353 /nfs/dbraw/zinc/65/73/53/631657353.db2.gz VQVDRPCXQLOKPX-SNVBAGLBSA-N 1 1 249.310 2.495 20 10 BECDMO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000934114642 631690750 /nfs/dbraw/zinc/69/07/50/631690750.db2.gz UZCHRRDPHWLWFD-GJZGRUSLSA-N 1 1 248.370 2.362 20 10 BECDMO COc1cc(C)cc(C[N@@H+](C)C2CC2)c1O ZINC000178853779 632112783 /nfs/dbraw/zinc/11/27/83/632112783.db2.gz RLJMXPPLEHXOFB-UHFFFAOYSA-N 1 1 221.300 2.303 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@@H](CO)CC2)c1O ZINC000294081431 633751756 /nfs/dbraw/zinc/75/17/56/633751756.db2.gz QZJLYEXRHCOHAD-CYBMUJFWSA-N 1 1 249.354 2.295 20 10 BECDMO Cc1cnc(C[NH2+]Cc2cc(C)ccc2O)o1 ZINC000235895006 636719548 /nfs/dbraw/zinc/71/95/48/636719548.db2.gz ZLEGFERLHIQXGB-UHFFFAOYSA-N 1 1 232.283 2.287 20 10 BECDMO CC(C)[N@H+]1CCC[C@H]1C(=O)Nc1ccc(N)cc1 ZINC000911659852 639692931 /nfs/dbraw/zinc/69/29/31/639692931.db2.gz FUOWLYWRGZXKIC-ZDUSSCGKSA-N 1 1 247.342 2.080 20 10 BECDMO CC[C@@H](CCO)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168793436 640827633 /nfs/dbraw/zinc/82/76/33/640827633.db2.gz HOKBFRDIURLYDV-ONGXEEELSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@H]([NH2+]CCn1cccn1)c1ccc(F)cc1O ZINC000062748150 641091270 /nfs/dbraw/zinc/09/12/70/641091270.db2.gz YFMBXGMVTOHYKQ-JTQLQIEISA-N 1 1 249.289 2.079 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCN(C)C(C)(C)C2)c1 ZINC000211483962 641506549 /nfs/dbraw/zinc/50/65/49/641506549.db2.gz DFRSVSXBWGSMQJ-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccccc1O ZINC000179575416 642725768 /nfs/dbraw/zinc/72/57/68/642725768.db2.gz GFRAFCAIAAKLRZ-MNOVXSKESA-N 1 1 221.300 2.001 20 10 BECDMO C[C@]1(O)CC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000180190262 642777281 /nfs/dbraw/zinc/77/72/81/642777281.db2.gz LHNIXFYWJOWYMD-LBPRGKRZSA-N 1 1 241.718 2.002 20 10 BECDMO Cc1cccc(C[N@@H+](CCCCO)C2CC2)c1O ZINC000180233289 642780994 /nfs/dbraw/zinc/78/09/94/642780994.db2.gz JDQCABAENXVECP-UHFFFAOYSA-N 1 1 249.354 2.438 20 10 BECDMO COc1cccc(C[N@H+]2C[C@@H](C)[C@H]2C)c1O ZINC000816647591 643553556 /nfs/dbraw/zinc/55/35/56/643553556.db2.gz VIQPEGIBVJQPLD-NXEZZACHSA-N 1 1 221.300 2.241 20 10 BECDMO C[N@H+](CC[C@H]1CCCO1)c1ccc(N)cc1 ZINC000083527396 643584827 /nfs/dbraw/zinc/58/48/27/643584827.db2.gz JWCPMCPZXSRQEZ-CYBMUJFWSA-N 1 1 220.316 2.274 20 10 BECDMO C[N@@H+](CC[C@H]1CCCO1)c1ccc(N)cc1 ZINC000083527396 643584830 /nfs/dbraw/zinc/58/48/30/643584830.db2.gz JWCPMCPZXSRQEZ-CYBMUJFWSA-N 1 1 220.316 2.274 20 10 BECDMO CC[N@@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000192992449 644203293 /nfs/dbraw/zinc/20/32/93/644203293.db2.gz YJINTFOYJCFLGE-UHFFFAOYSA-N 1 1 235.283 2.105 20 10 BECDMO CCN1CC[N@@H+](Cc2cc(C)ccc2O)C[C@H]1C ZINC000250198472 644748428 /nfs/dbraw/zinc/74/84/28/644748428.db2.gz BCFLPSZIVMVLGP-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2cc(C)ccc2O)C[C@H]1C ZINC000250198472 644748431 /nfs/dbraw/zinc/74/84/31/644748431.db2.gz BCFLPSZIVMVLGP-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2cc(C)ccc2O)C[C@H]1C ZINC000250198472 644748435 /nfs/dbraw/zinc/74/84/35/644748435.db2.gz BCFLPSZIVMVLGP-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO COc1cc(C[N@H+]2CC[C@@H](F)C2)c(O)cc1C ZINC000840105029 644866524 /nfs/dbraw/zinc/86/65/24/644866524.db2.gz WPKCUOWQOLVRJA-LLVKDONJSA-N 1 1 239.290 2.253 20 10 BECDMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc(C)ccc1O ZINC000824636621 645056810 /nfs/dbraw/zinc/05/68/10/645056810.db2.gz RWMSNHSHTJOTLC-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C[C@H](C)O)C2CC2)c1 ZINC000848928578 645444305 /nfs/dbraw/zinc/44/43/05/645444305.db2.gz HVJNZWFMZQXALN-NSHDSACASA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H]2OCC[C@@H]2C1 ZINC000877605956 645800945 /nfs/dbraw/zinc/80/09/45/645800945.db2.gz YFPFYLWUZJWOLQ-DOMZBBRYSA-N 1 1 247.338 2.311 20 10 BECDMO COC/C(C)=C/C[N@@H+](C)Cc1ccccc1O ZINC000929976820 646383328 /nfs/dbraw/zinc/38/33/28/646383328.db2.gz QIZZTMBJFBDAPP-XYOKQWHBSA-N 1 1 235.327 2.417 20 10 BECDMO CO[C@H]1C[C@@H](C[NH2+]Cc2cccc(F)c2O)C1 ZINC000708711476 712197778 /nfs/dbraw/zinc/19/77/78/712197778.db2.gz XRZGEVVTGGEWTR-JGZJWPJOSA-N 1 1 239.290 2.046 20 10 BECDMO COc1cccc(C[N@@H+](C)CCCF)c1O ZINC000716630724 712568274 /nfs/dbraw/zinc/56/82/74/712568274.db2.gz UBXOYAANAAYPJI-UHFFFAOYSA-N 1 1 227.279 2.192 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)C2(CN)CCC2)c1 ZINC000395383776 711209956 /nfs/dbraw/zinc/20/99/56/711209956.db2.gz KXLRXFNTWFKLER-UHFFFAOYSA-N 1 1 234.343 2.014 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)C2(CN)CCC2)c1 ZINC000395383776 711209958 /nfs/dbraw/zinc/20/99/58/711209958.db2.gz KXLRXFNTWFKLER-UHFFFAOYSA-N 1 1 234.343 2.014 20 10 BECDMO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)[C@@H](C)O ZINC000395646817 711214041 /nfs/dbraw/zinc/21/40/41/711214041.db2.gz DOJDAYIJJRAOID-LNLATYFQSA-N 1 1 241.306 2.341 20 10 BECDMO CO[C@H](C)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000381466293 710641539 /nfs/dbraw/zinc/64/15/39/710641539.db2.gz MQQRUTGSGXOKOV-SSDOTTSWSA-N 1 1 247.697 2.309 20 10 BECDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2O)C[C@H]1C[NH3+] ZINC000397322900 711380175 /nfs/dbraw/zinc/38/01/75/711380175.db2.gz TYSPKHNEKYQMHF-MBNYWOFBSA-N 1 1 248.370 2.197 20 10 BECDMO C[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2[O-])C[C@H]1C[NH3+] ZINC000397322900 711380177 /nfs/dbraw/zinc/38/01/77/711380177.db2.gz TYSPKHNEKYQMHF-MBNYWOFBSA-N 1 1 248.370 2.197 20 10 BECDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2[O-])C[C@H]1C[NH3+] ZINC000397322900 711380182 /nfs/dbraw/zinc/38/01/82/711380182.db2.gz TYSPKHNEKYQMHF-MBNYWOFBSA-N 1 1 248.370 2.197 20 10 BECDMO C[C@@H]1CSC[C@H]1[NH2+]Cc1cccc(F)c1O ZINC000309761899 711700786 /nfs/dbraw/zinc/70/07/86/711700786.db2.gz IVRDSOLDBHICMB-LDYMZIIASA-N 1 1 241.331 2.372 20 10 BECDMO CCO[C@H]1CC[N@@H+](Cc2ccccc2O)C1 ZINC000701660935 712026748 /nfs/dbraw/zinc/02/67/48/712026748.db2.gz FCJNFOIWZXOSLC-LBPRGKRZSA-N 1 1 221.300 2.003 20 10 BECDMO CO[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc(F)cc2O)C1 ZINC000706533189 712149523 /nfs/dbraw/zinc/14/95/23/712149523.db2.gz FTAUZNQHTQEXGB-LSJOCFKGSA-N 1 1 239.290 2.359 20 10 BECDMO [NH3+][C@@H]1CCCCCN(Cc2ccccc2O)C1 ZINC000709011924 712206035 /nfs/dbraw/zinc/20/60/35/712206035.db2.gz URLMCSLJENMPEG-CYBMUJFWSA-N 1 1 234.343 2.096 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CC[C@H](CF)C2)c1 ZINC000711492861 712307285 /nfs/dbraw/zinc/30/72/85/712307285.db2.gz UVVSSLSWNORSSR-SNVBAGLBSA-N 1 1 239.290 2.192 20 10 BECDMO Oc1cc(F)c(F)cc1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001142512836 961466591 /nfs/dbraw/zinc/46/65/91/961466591.db2.gz MXDYMFBYTHQTPF-OCAPTIKFSA-N 1 1 225.238 2.122 20 10 BECDMO Oc1cc(F)c(F)cc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001142512836 961466603 /nfs/dbraw/zinc/46/66/03/961466603.db2.gz MXDYMFBYTHQTPF-OCAPTIKFSA-N 1 1 225.238 2.122 20 10 BECDMO CCCC[N@@H+](C)Cc1ccc(O)cc1O ZINC001204271711 966950973 /nfs/dbraw/zinc/95/09/73/966950973.db2.gz CILCVZIUUCLMRY-UHFFFAOYSA-N 1 1 209.289 2.330 20 10 BECDMO Cc1ncc(C[NH2+]Cc2cccc(F)c2O)o1 ZINC000397906410 1167029928 /nfs/dbraw/zinc/02/99/28/1167029928.db2.gz ZCYQSUPREZRZGG-UHFFFAOYSA-N 1 1 236.246 2.118 20 10 BECDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N)cc2)[C@H](C)C1 ZINC000310035759 1167342152 /nfs/dbraw/zinc/34/21/52/1167342152.db2.gz KTYUTTRYVXYUMF-BXUZGUMPSA-N 1 1 234.343 2.268 20 10 BECDMO CSCC[N@H+](C)Cc1c(O)ccc(F)c1F ZINC001233335878 978567723 /nfs/dbraw/zinc/56/77/23/978567723.db2.gz PLTXTXXKAFVMBY-UHFFFAOYSA-N 1 1 247.310 2.465 20 10 BECDMO CSCC[N@@H+](C)Cc1c(O)ccc(F)c1F ZINC001233335878 978567730 /nfs/dbraw/zinc/56/77/30/978567730.db2.gz PLTXTXXKAFVMBY-UHFFFAOYSA-N 1 1 247.310 2.465 20 10 BECDMO C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2O)CCO1 ZINC000721438167 1169650254 /nfs/dbraw/zinc/65/02/54/1169650254.db2.gz NLAHGSRKXRGUAH-YPMHNXCESA-N 1 1 235.327 2.392 20 10 BECDMO Oc1cccc2c1C[N@H+]([C@@H]1CCCOCC1)CC2 ZINC001170831131 971950554 /nfs/dbraw/zinc/95/05/54/971950554.db2.gz MQMQYTBHWACYQD-CYBMUJFWSA-N 1 1 247.338 2.319 20 10 BECDMO C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(N)cc2)CCN1C ZINC001345160844 957162402 /nfs/dbraw/zinc/16/24/02/957162402.db2.gz ZYEXCKMJQVDIBC-SWLSCSKDSA-N 1 1 247.386 2.183 20 10 BECDMO CCc1ccc(C[N@H+]2[C@H](C)CNC[C@@H]2C)c(O)c1 ZINC001209887328 957556930 /nfs/dbraw/zinc/55/69/30/957556930.db2.gz VWNKVKAIHUTDSX-TXEJJXNPSA-N 1 1 248.370 2.137 20 10 BECDMO CCc1ccc(C[N@@H+]2[C@H](C)CNC[C@@H]2C)c(O)c1 ZINC001209887328 957556933 /nfs/dbraw/zinc/55/69/33/957556933.db2.gz VWNKVKAIHUTDSX-TXEJJXNPSA-N 1 1 248.370 2.137 20 10 BECDMO C[C@@H]1C[C@H](O)C[N@H+]1Cc1ccc(Cl)cc1O ZINC001140461138 958486080 /nfs/dbraw/zinc/48/60/80/958486080.db2.gz FIJDVYCSXXNGLS-KCJUWKMLSA-N 1 1 241.718 2.001 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@]3(CCO3)C2)c1 ZINC001140623047 959220638 /nfs/dbraw/zinc/22/06/38/959220638.db2.gz KSWXUKQYBMZXDE-OAHLLOKOSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@H]3OCC[C@@H]3C2)c1 ZINC000724813725 959686102 /nfs/dbraw/zinc/68/61/02/959686102.db2.gz GZLHDVCLYGEUPI-IUODEOHRSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1c(O)ccc(C[N@H+]2CCC[C@@H]3C[C@@H]32)c1O ZINC001140748156 959793266 /nfs/dbraw/zinc/79/32/66/959793266.db2.gz SMLNYYNGVIDNGI-PWSUYJOCSA-N 1 1 233.311 2.391 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1 ZINC000690788538 959810127 /nfs/dbraw/zinc/81/01/27/959810127.db2.gz FYXDOFHQKWXOGN-OCCSQVGLSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c1O ZINC000690789009 959838132 /nfs/dbraw/zinc/83/81/32/959838132.db2.gz HIOCNSHJCLNYGJ-UONOGXRCSA-N 1 1 247.338 2.169 20 10 BECDMO CC(C)C[N@@H+](C)Cc1cc(O)ccc1O ZINC001141155841 960407844 /nfs/dbraw/zinc/40/78/44/960407844.db2.gz LTNXUWKHNMDYSK-UHFFFAOYSA-N 1 1 209.289 2.186 20 10 BECDMO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000689882763 960423955 /nfs/dbraw/zinc/42/39/55/960423955.db2.gz CUGWPTLSUMVISS-LLVKDONJSA-N 1 1 227.254 2.465 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H](F)C1 ZINC000689882763 960423965 /nfs/dbraw/zinc/42/39/65/960423965.db2.gz CUGWPTLSUMVISS-LLVKDONJSA-N 1 1 227.254 2.465 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC(=O)C[C@@H]2C)c1 ZINC001140617100 960458119 /nfs/dbraw/zinc/45/81/19/960458119.db2.gz DTYHVFRQMBYFQI-NSHDSACASA-N 1 1 233.311 2.254 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC(=O)C[C@@H]2C)c1 ZINC001140617100 960458127 /nfs/dbraw/zinc/45/81/27/960458127.db2.gz DTYHVFRQMBYFQI-NSHDSACASA-N 1 1 233.311 2.254 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@](C)(O)[C@H](C)C2)c1 ZINC001140619366 960459390 /nfs/dbraw/zinc/45/93/90/960459390.db2.gz BVTRCICTEVFFHX-IUODEOHRSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC(=O)C[C@H]2C)c1 ZINC001140617099 960459523 /nfs/dbraw/zinc/45/95/23/960459523.db2.gz DTYHVFRQMBYFQI-LLVKDONJSA-N 1 1 233.311 2.254 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC(=O)C[C@H]2C)c1 ZINC001140617099 960459531 /nfs/dbraw/zinc/45/95/31/960459531.db2.gz DTYHVFRQMBYFQI-LLVKDONJSA-N 1 1 233.311 2.254 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](C)[C@](C)(O)C2)c1 ZINC001140619395 960459992 /nfs/dbraw/zinc/45/99/92/960459992.db2.gz CCNACWMWRHURHL-IUODEOHRSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1c(O)ccc(C[N@H+](C)CC(C)C)c1O ZINC001140741791 960541367 /nfs/dbraw/zinc/54/13/67/960541367.db2.gz CDRZCEAEHCTZEX-UHFFFAOYSA-N 1 1 223.316 2.494 20 10 BECDMO Cc1ccc(C[N@H+](C)C2CCOCC2)c(O)c1 ZINC001140948310 960743036 /nfs/dbraw/zinc/74/30/36/960743036.db2.gz CYSBXEAGPYCKFN-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(C[N@H+]2CCC(=O)C[C@H]2C)c(O)c1 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Cc1cccc(O)c1C[N@H+]1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001237486187 979908210 /nfs/dbraw/zinc/90/82/10/979908210.db2.gz WXVOZOSIQGSVQY-GVXVVHGQSA-N 1 1 235.302 2.490 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC[C@H](C)[C@@H]1CO ZINC001237486209 979909160 /nfs/dbraw/zinc/90/91/60/979909160.db2.gz XYZCKJQSGISREA-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H](C)[C@@H]1CO ZINC001237486210 979909435 /nfs/dbraw/zinc/90/94/35/979909435.db2.gz XYZCKJQSGISREA-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@](C)(O)[C@@H](C)C1 ZINC001237486242 979910110 /nfs/dbraw/zinc/91/01/10/979910110.db2.gz ZKXIUOMILAIBOL-SWLSCSKDSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC(=O)C[C@@H]1C ZINC001237485354 979911548 /nfs/dbraw/zinc/91/15/48/979911548.db2.gz OSRIOYBCCZFUTI-NSHDSACASA-N 1 1 233.311 2.254 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCOCC1(C)C ZINC001237489022 979919945 /nfs/dbraw/zinc/91/99/45/979919945.db2.gz CNFVUWPKVQSXPR-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO COCC[N@H+](C)Cc1cc(F)c(Cl)cc1O ZINC001237947977 980118447 /nfs/dbraw/zinc/11/84/47/980118447.db2.gz VVSUHNGCZMOFGE-UHFFFAOYSA-N 1 1 247.697 2.263 20 10 BECDMO COCC[N@@H+](C)Cc1cc(F)c(Cl)cc1O ZINC001237947977 980118450 /nfs/dbraw/zinc/11/84/50/980118450.db2.gz VVSUHNGCZMOFGE-UHFFFAOYSA-N 1 1 247.697 2.263 20 10 BECDMO Cc1cc(F)cc(C[N@H+]2CCCOCC2)c1O ZINC001238056211 980132142 /nfs/dbraw/zinc/13/21/42/980132142.db2.gz FNBWKOVYJLWYAF-UHFFFAOYSA-N 1 1 239.290 2.062 20 10 BECDMO COC1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000160199290 982515490 /nfs/dbraw/zinc/51/54/90/982515490.db2.gz DWOAUDHRNUEKPW-UHFFFAOYSA-N 1 1 239.290 2.142 20 10 BECDMO Nc1ccc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)cc1 ZINC001352788494 982576773 /nfs/dbraw/zinc/57/67/73/982576773.db2.gz FDYXGRMGFFWWSM-GFCCVEGCSA-N 1 1 238.281 2.500 20 10 BECDMO Cn1ccc2c1ccnc2C1=CCC[N@@H+](C)C1 ZINC001241565202 982807329 /nfs/dbraw/zinc/80/73/29/982807329.db2.gz HCJLDBDLIVTHBZ-UHFFFAOYSA-N 1 1 227.311 2.292 20 10 BECDMO CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001203935335 982930015 /nfs/dbraw/zinc/93/00/15/982930015.db2.gz FDGOSSICKUYPIQ-HNNXBMFYSA-N 1 1 246.354 2.306 20 10 BECDMO Cn1ccc2c1cc[nH+]c2-c1cccnc1N ZINC001243470691 985007442 /nfs/dbraw/zinc/00/74/42/985007442.db2.gz INSICJBNPYXUME-UHFFFAOYSA-N 1 1 224.267 2.218 20 10 BECDMO Cc1cc(C[N@@H+](C)CCN(C)C)ccc1N(C)C ZINC001139669641 990795792 /nfs/dbraw/zinc/79/57/92/990795792.db2.gz FNEOOALJJVWKSF-UHFFFAOYSA-N 1 1 249.402 2.054 20 10 BECDMO Cc1cc(C[N@H+](C)CCN(C)C)ccc1N(C)C ZINC001139669641 990795806 /nfs/dbraw/zinc/79/58/06/990795806.db2.gz FNEOOALJJVWKSF-UHFFFAOYSA-N 1 1 249.402 2.054 20 10 BECDMO Oc1cccc(F)c1C[N@@H+]1C[C@@H]2C[C@H]1C[C@@H]2F ZINC001137839245 990859035 /nfs/dbraw/zinc/85/90/35/990859035.db2.gz YAKUAMNQEZSYOD-AUTRQRHGSA-N 1 1 239.265 2.464 20 10 BECDMO Oc1cccc(F)c1C[N@H+]1C[C@@H]2C[C@H]1C[C@@H]2F ZINC001137839245 990859037 /nfs/dbraw/zinc/85/90/37/990859037.db2.gz YAKUAMNQEZSYOD-AUTRQRHGSA-N 1 1 239.265 2.464 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCC[C@@H](O)CC2)c1O ZINC001140178815 991548626 /nfs/dbraw/zinc/54/86/26/991548626.db2.gz YFZAWSXUKJJCTJ-CYBMUJFWSA-N 1 1 249.354 2.356 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCC[C@@H](CO)C2)c1O ZINC001140179934 991549297 /nfs/dbraw/zinc/54/92/97/991549297.db2.gz KFMOPXBWIGRQPN-CYBMUJFWSA-N 1 1 249.354 2.213 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCCC[C@H](O)C2)c1O ZINC001140178700 991550330 /nfs/dbraw/zinc/55/03/30/991550330.db2.gz VBISYAAPSKFXRJ-ZDUSSCGKSA-N 1 1 249.354 2.356 20 10 BECDMO Cc1ccc(C)c(C[NH+]2CCC(=O)CC2)c1O ZINC001140178235 991552216 /nfs/dbraw/zinc/55/22/16/991552216.db2.gz DTWRDQMGENTCDI-UHFFFAOYSA-N 1 1 233.311 2.174 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCCC23COC3)c1O ZINC001140182227 991557803 /nfs/dbraw/zinc/55/78/03/991557803.db2.gz LJOLVAWLIMKRIR-UHFFFAOYSA-N 1 1 247.338 2.374 20 10 BECDMO CC[N@@H+](Cc1ccncn1)Cc1ccccc1O ZINC001140350641 991627692 /nfs/dbraw/zinc/62/76/92/991627692.db2.gz ODECUBHNGGBUNY-UHFFFAOYSA-N 1 1 243.310 2.204 20 10 BECDMO CO[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140462939 991643241 /nfs/dbraw/zinc/64/32/41/991643241.db2.gz OSQCQUKVDPFGCA-NSHDSACASA-N 1 1 241.718 2.266 20 10 BECDMO OC[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001140462262 991643342 /nfs/dbraw/zinc/64/33/42/991643342.db2.gz COAFPFHAYSADAS-NSHDSACASA-N 1 1 241.718 2.002 20 10 BECDMO CN(C)CC[N@H+](C)Cc1ccc(Cl)cc1O ZINC001140461145 991644500 /nfs/dbraw/zinc/64/45/00/991644500.db2.gz FIVKDCGVIBLCHD-UHFFFAOYSA-N 1 1 242.750 2.039 20 10 BECDMO CN(C)CC[N@@H+](C)Cc1ccc(Cl)cc1O ZINC001140461145 991644504 /nfs/dbraw/zinc/64/45/04/991644504.db2.gz FIVKDCGVIBLCHD-UHFFFAOYSA-N 1 1 242.750 2.039 20 10 BECDMO C[N@@H+](CCF)Cc1ccc(Cl)cc1O ZINC001140468531 991646662 /nfs/dbraw/zinc/64/66/62/991646662.db2.gz NVBGXGUANMCIRC-UHFFFAOYSA-N 1 1 217.671 2.447 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2ccc(N)cc2)[C@H]1C ZINC000380642643 993342009 /nfs/dbraw/zinc/34/20/09/993342009.db2.gz UOWSZLMVDIYDJX-MNOVXSKESA-N 1 1 204.317 2.499 20 10 BECDMO CCO[C@@H]1CC[N@H+](Cc2cccc(F)c2O)C1 ZINC000701663435 993897651 /nfs/dbraw/zinc/89/76/51/993897651.db2.gz XWLNKAHITIFJEV-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO CCO[C@@H]1CC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000701663435 993897660 /nfs/dbraw/zinc/89/76/60/993897660.db2.gz XWLNKAHITIFJEV-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CC[C@H]([C@@H](C)O)C2)cc1C ZINC000180866727 178195608 /nfs/dbraw/zinc/19/56/08/178195608.db2.gz IYXIAGKTSKGXQK-OLZOCXBDSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H]([C@@H](C)O)C2)cc1C ZINC000180866746 178196391 /nfs/dbraw/zinc/19/63/91/178196391.db2.gz IYXIAGKTSKGXQK-CHWSQXEVSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@H](O)C(C)(C)C2)cc1C ZINC000280404123 178196798 /nfs/dbraw/zinc/19/67/98/178196798.db2.gz HJXBJFRIONOYMP-AWEZNQCLSA-N 1 1 249.354 2.212 20 10 BECDMO CC(C)N1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000020189047 342975855 /nfs/dbraw/zinc/97/58/55/342975855.db2.gz JWDJLWIDUKYVJI-UHFFFAOYSA-N 1 1 248.370 2.355 20 10 BECDMO C[C@H](CC[NH+](C)C)NCc1ccc2c(c1)CCO2 ZINC000049554400 343602782 /nfs/dbraw/zinc/60/27/82/343602782.db2.gz KJDKOLRGKLNUIC-GFCCVEGCSA-N 1 1 248.370 2.051 20 10 BECDMO C[C@H](CCN(C)C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000049554400 343602783 /nfs/dbraw/zinc/60/27/83/343602783.db2.gz KJDKOLRGKLNUIC-GFCCVEGCSA-N 1 1 248.370 2.051 20 10 BECDMO Cn1c[nH+]cc1CCSc1nccs1 ZINC000287530514 187346185 /nfs/dbraw/zinc/34/61/85/187346185.db2.gz MUOMWLKDICFDBZ-UHFFFAOYSA-N 1 1 225.342 2.211 20 10 BECDMO Cc1cc(N(C)Cc2ccccc2O)nc(C)[nH+]1 ZINC000133701169 187298760 /nfs/dbraw/zinc/29/87/60/187298760.db2.gz VDURIFKXKADKEN-UHFFFAOYSA-N 1 1 243.310 2.435 20 10 BECDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCCC[C@@H]1O ZINC000089912284 345565674 /nfs/dbraw/zinc/56/56/74/345565674.db2.gz LCQSRMMAEFABKW-OCCSQVGLSA-N 1 1 235.327 2.128 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)C[C@@H]2CCOC2)c1 ZINC000093840259 537969556 /nfs/dbraw/zinc/96/95/56/537969556.db2.gz PHBBMDNMPYWIJZ-LBPRGKRZSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1cccc(C[N@H+](C)Cc2ccon2)c1O ZINC000271759114 179068193 /nfs/dbraw/zinc/06/81/93/179068193.db2.gz DJIWLMOYXUVVRU-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1cccc(C[N@@H+](C)Cc2ccon2)c1O ZINC000271759114 179068196 /nfs/dbraw/zinc/06/81/96/179068196.db2.gz DJIWLMOYXUVVRU-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1cccc(C[N@@H+](C)C[C@@H]2CCOC2)c1O ZINC000180623975 179066994 /nfs/dbraw/zinc/06/69/94/179066994.db2.gz FOGCVITZBZCKLK-LBPRGKRZSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@](C)(O)CC2)c1O ZINC000279713693 179075949 /nfs/dbraw/zinc/07/59/49/179075949.db2.gz SVEHVORUJIDYKR-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1[nH+]ccn1Cc1ccc(N(C)C)cc1 ZINC000278819319 180269152 /nfs/dbraw/zinc/26/91/52/180269152.db2.gz IIZCIEBRRVEJTD-UHFFFAOYSA-N 1 1 215.300 2.306 20 10 BECDMO Oc1c(F)cccc1C[NH2+][C@@H]1CCSC1 ZINC000226613134 183255085 /nfs/dbraw/zinc/25/50/85/183255085.db2.gz GBIYKGUXWVOTOF-SECBINFHSA-N 1 1 227.304 2.126 20 10 BECDMO CCC[N@@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000171603621 169175958 /nfs/dbraw/zinc/17/59/58/169175958.db2.gz NKBYKBWIZZQZKN-UHFFFAOYSA-N 1 1 249.310 2.495 20 10 BECDMO Oc1ccccc1C[N@H+]1CCOC2(CCC2)C1 ZINC000179579604 183301452 /nfs/dbraw/zinc/30/14/52/183301452.db2.gz PUDBPACCXBKMBG-UHFFFAOYSA-N 1 1 233.311 2.147 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@@]12CCOC2 ZINC000375308563 183302134 /nfs/dbraw/zinc/30/21/34/183302134.db2.gz JBFPSKYYGONZQN-AWEZNQCLSA-N 1 1 233.311 2.147 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000361050125 183302223 /nfs/dbraw/zinc/30/22/23/183302223.db2.gz FUQBVQJKWDANNP-JSGCOSHPSA-N 1 1 247.338 2.251 20 10 BECDMO CCCN1CC[NH+](Cc2cccc(C)c2O)CC1 ZINC000124501376 169203591 /nfs/dbraw/zinc/20/35/91/169203591.db2.gz ZSTHQFCGEPLUDO-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO C[N@@H+](CCc1ccccn1)Cc1ccccc1O ZINC000111235558 383841930 /nfs/dbraw/zinc/84/19/30/383841930.db2.gz LDLOLWHSQNXUMS-UHFFFAOYSA-N 1 1 242.322 2.462 20 10 BECDMO CC[C@H](CCO)C[NH2+]Cc1cccc(F)c1O ZINC000158811685 384303132 /nfs/dbraw/zinc/30/31/32/384303132.db2.gz AWBHWSIJLPCVDF-SNVBAGLBSA-N 1 1 241.306 2.030 20 10 BECDMO Cc1n[nH]c(C)c1C[N@H+](C)Cc1ccccc1O ZINC000120073151 384326083 /nfs/dbraw/zinc/32/60/83/384326083.db2.gz IAFNXQMDIQAGPG-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO C[C@H](CCO)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000097439699 384519459 /nfs/dbraw/zinc/51/94/59/384519459.db2.gz ANJCELGHYRNSGT-ZJUUUORDSA-N 1 1 241.306 2.200 20 10 BECDMO C[C@@H]([NH2+]C[C@@H](C)CCO)c1ccc(F)cc1O ZINC000097439700 384520715 /nfs/dbraw/zinc/52/07/15/384520715.db2.gz ANJCELGHYRNSGT-VHSXEESVSA-N 1 1 241.306 2.200 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CCO1 ZINC000125493528 384723744 /nfs/dbraw/zinc/72/37/44/384723744.db2.gz DQMGZQBRMOSHNH-HNNXBMFYSA-N 1 1 248.370 2.363 20 10 BECDMO COC[C@H](C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062748390 385186859 /nfs/dbraw/zinc/18/68/59/385186859.db2.gz MTGLSTATKQTIDV-NXEZZACHSA-N 1 1 241.306 2.464 20 10 BECDMO C[C@@H]([NH2+]Cc1cnn(C)c1)c1ccc(F)cc1O ZINC000062748118 385187147 /nfs/dbraw/zinc/18/71/47/385187147.db2.gz QGDGKDODDILLFV-SECBINFHSA-N 1 1 249.289 2.116 20 10 BECDMO C[N@@H+](CCOCC(F)F)Cc1ccccc1O ZINC000189663257 385176774 /nfs/dbraw/zinc/17/67/74/385176774.db2.gz IEEMHOFKLAJOFY-UHFFFAOYSA-N 1 1 245.269 2.106 20 10 BECDMO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccccc1O ZINC000131487176 385338212 /nfs/dbraw/zinc/33/82/12/385338212.db2.gz PPIWFNPWUHFHMM-YPMHNXCESA-N 1 1 235.327 2.392 20 10 BECDMO C[C@H]([NH2+]CCF)c1ccc(F)cc1O ZINC000281127219 385402616 /nfs/dbraw/zinc/40/26/16/385402616.db2.gz SRAFZEIUTXIRLL-ZETCQYMHSA-N 1 1 201.216 2.151 20 10 BECDMO C[C@@H]([NH2+]CCF)c1ccc(F)cc1O ZINC000281127210 385403282 /nfs/dbraw/zinc/40/32/82/385403282.db2.gz SRAFZEIUTXIRLL-SSDOTTSWSA-N 1 1 201.216 2.151 20 10 BECDMO COC[C@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000179573837 385474486 /nfs/dbraw/zinc/47/44/86/385474486.db2.gz DTTDDZXKWNCNEE-LBPRGKRZSA-N 1 1 235.327 2.251 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000179570645 385474674 /nfs/dbraw/zinc/47/46/74/385474674.db2.gz BNAGLGGBTDPDIQ-GFCCVEGCSA-N 1 1 221.300 2.003 20 10 BECDMO C[C@H](O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000282088668 385731743 /nfs/dbraw/zinc/73/17/43/385731743.db2.gz VDBFJEYRSBHTEF-LBPRGKRZSA-N 1 1 248.370 2.098 20 10 BECDMO CCCC[N@H+](Cc1ccccc1O)C[C@H](C)O ZINC000282540624 385770464 /nfs/dbraw/zinc/77/04/64/385770464.db2.gz WADMFZDYNTZDJK-LBPRGKRZSA-N 1 1 237.343 2.375 20 10 BECDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H](C)O ZINC000282540621 385771538 /nfs/dbraw/zinc/77/15/38/385771538.db2.gz WADMFZDYNTZDJK-GFCCVEGCSA-N 1 1 237.343 2.375 20 10 BECDMO CCCC[N@@H+](CCO)Cc1cccc(F)c1[O-] ZINC000272338319 385896543 /nfs/dbraw/zinc/89/65/43/385896543.db2.gz YBZNDUWQRJVYHS-UHFFFAOYSA-N 1 1 241.306 2.126 20 10 BECDMO CCCC[N@H+](CCO)Cc1cccc(F)c1O ZINC000272338319 385896547 /nfs/dbraw/zinc/89/65/47/385896547.db2.gz YBZNDUWQRJVYHS-UHFFFAOYSA-N 1 1 241.306 2.126 20 10 BECDMO CCCC[N@@H+](CCO)Cc1cccc(F)c1O ZINC000272338319 385896548 /nfs/dbraw/zinc/89/65/48/385896548.db2.gz YBZNDUWQRJVYHS-UHFFFAOYSA-N 1 1 241.306 2.126 20 10 BECDMO CO[C@H](C)C[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000285164915 385903065 /nfs/dbraw/zinc/90/30/65/385903065.db2.gz PUBCRHYWBMOPMV-GFCCVEGCSA-N 1 1 237.343 2.476 20 10 BECDMO CS[C@H]1CC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000294957415 385926644 /nfs/dbraw/zinc/92/66/44/385926644.db2.gz DMZPUIDEPHGIKE-NSHDSACASA-N 1 1 241.331 2.469 20 10 BECDMO CO[C@H](C)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000294663061 385880321 /nfs/dbraw/zinc/88/03/21/385880321.db2.gz LPFUZFZNHGXBKS-SSDOTTSWSA-N 1 1 247.697 2.309 20 10 BECDMO Cc1nocc1C[N@H+](C)Cc1ccccc1O ZINC000295214089 385992598 /nfs/dbraw/zinc/99/25/98/385992598.db2.gz AWZFLSMVGKRNMD-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO CC[C@@H]([NH2+]CC[C@H](C)O)c1ccc(F)cc1O ZINC000285530966 385936248 /nfs/dbraw/zinc/93/62/48/385936248.db2.gz BQOKFDRPWBPVBG-JOYOIKCWSA-N 1 1 241.306 2.343 20 10 BECDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC2CC2)c1 ZINC000273405880 385997292 /nfs/dbraw/zinc/99/72/92/385997292.db2.gz OJNCODWVFISLLI-VIFPVBQESA-N 1 1 249.310 2.239 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)CCO)c1ccc(F)cc1O ZINC000286274921 386017024 /nfs/dbraw/zinc/01/70/24/386017024.db2.gz VMFFQTKSYCOWLK-CABZTGNLSA-N 1 1 241.306 2.343 20 10 BECDMO CO[C@H]1CC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000234884762 386111262 /nfs/dbraw/zinc/11/12/62/386111262.db2.gz LHARBENHAACHOE-VIFPVBQESA-N 1 1 241.718 2.266 20 10 BECDMO CC(C)[N@@H+](Cc1ccccc1O)C1COC1 ZINC000295976263 386118126 /nfs/dbraw/zinc/11/81/26/386118126.db2.gz JBSOQYOKJCJQOW-UHFFFAOYSA-N 1 1 221.300 2.001 20 10 BECDMO CC[C@@H]([NH2+]CCCCO)c1ccc(F)cc1O ZINC000287586826 386135086 /nfs/dbraw/zinc/13/50/86/386135086.db2.gz RJYQKGIQMFCIST-GFCCVEGCSA-N 1 1 241.306 2.345 20 10 BECDMO COC[C@H]1CC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000265857860 386378283 /nfs/dbraw/zinc/37/82/83/386378283.db2.gz WOZQYZKZQDMUSO-ZDUSSCGKSA-N 1 1 249.354 2.477 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCO[C@H]3CCC[C@H]32)c1 ZINC000228143556 386547948 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COc1ccc(O)c(C[N@@H+](C)Cc2ccc[nH]2)c1 ZINC000775734485 585683831 /nfs/dbraw/zinc/68/38/31/585683831.db2.gz QXMZHTQBRGFQMP-UHFFFAOYSA-N 1 1 246.310 2.361 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@H](C)N(C)C[C@H]2C)c1O ZINC000775987358 585688744 /nfs/dbraw/zinc/68/87/44/585688744.db2.gz VLONYJHUMXWEMV-QWHCGFSZSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C)N(C)C[C@@H]2C)c1 ZINC000775985170 585688948 /nfs/dbraw/zinc/68/89/48/585688948.db2.gz KJLNUJKFEFWKSP-OLZOCXBDSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)N(C)C[C@H]2C)c1 ZINC000775985171 585689015 /nfs/dbraw/zinc/68/90/15/585689015.db2.gz KJLNUJKFEFWKSP-QWHCGFSZSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2CCO)c1 ZINC000779202656 585747296 /nfs/dbraw/zinc/74/72/96/585747296.db2.gz RWCRBQZNWFSODB-ZDUSSCGKSA-N 1 1 235.327 2.047 20 10 BECDMO CC[C@@]1(O)CC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000779220088 585747548 /nfs/dbraw/zinc/74/75/48/585747548.db2.gz WQDAGQDRBRXILP-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCOCC3(CC3)C2)c1 ZINC000783599045 585837633 /nfs/dbraw/zinc/83/76/33/585837633.db2.gz HXRIJAACJQEWEC-UHFFFAOYSA-N 1 1 247.338 2.313 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)[C@H](C)[C@H](C)O1 ZINC000783738508 585841546 /nfs/dbraw/zinc/84/15/46/585841546.db2.gz WPPUDUOEXWEWPO-UTUOFQBUSA-N 1 1 235.327 2.390 20 10 BECDMO C[N@@H+](Cc1ccccc1O)CC1(F)CC1 ZINC000792787999 586005275 /nfs/dbraw/zinc/00/52/75/586005275.db2.gz MDTPIZYBEWZOJY-UHFFFAOYSA-N 1 1 209.264 2.326 20 10 BECDMO CC[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(F)cc1O ZINC000796756923 586111490 /nfs/dbraw/zinc/11/14/90/586111490.db2.gz ZFJOWAKEVNCFPC-LBPRGKRZSA-N 1 1 249.289 2.495 20 10 BECDMO CC[C@@H]([NH2+][C@H]1CCOC1)c1ccc(F)cc1O ZINC000796842327 586114658 /nfs/dbraw/zinc/11/46/58/586114658.db2.gz YTDVZGTUOQQYBX-CMPLNLGQSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@@H]1C[N@H+](Cc2cccc(F)c2O)[C@H]1C ZINC000816646812 586748808 /nfs/dbraw/zinc/74/88/08/586748808.db2.gz JHYPPZRXJGRMRM-BDAKNGLRSA-N 1 1 209.264 2.372 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cccc(F)c2O)[C@H]1C ZINC000816646812 586748810 /nfs/dbraw/zinc/74/88/10/586748810.db2.gz JHYPPZRXJGRMRM-BDAKNGLRSA-N 1 1 209.264 2.372 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@@H]1C ZINC000816647260 586748925 /nfs/dbraw/zinc/74/89/25/586748925.db2.gz QEBWYIIJBDHMDV-RKDXNWHRSA-N 1 1 209.264 2.372 20 10 BECDMO COc1ccc(O)c(C[N@H+]2C[C@@H](C)[C@@H]2C)c1 ZINC000816648722 586751938 /nfs/dbraw/zinc/75/19/38/586751938.db2.gz OAZCILCFXPCRTH-ZJUUUORDSA-N 1 1 221.300 2.241 20 10 BECDMO C[C@H]([NH2+]CCC[NH3+])c1cc(Cl)ccc1[O-] ZINC000817938187 586844520 /nfs/dbraw/zinc/84/45/20/586844520.db2.gz GLRDDGQVCLTYDT-QMMMGPOBSA-N 1 1 228.723 2.045 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]CCNC2CC2)c(O)c1 ZINC000817953562 586849114 /nfs/dbraw/zinc/84/91/14/586849114.db2.gz OGTJBWKBRVZBND-NSHDSACASA-N 1 1 234.343 2.103 20 10 BECDMO CC[C@H](NCC[NH2+]C1CC1)c1ccc(C)cc1O ZINC000817953988 586849418 /nfs/dbraw/zinc/84/94/18/586849418.db2.gz UNTYZYBUHLIJJS-AWEZNQCLSA-N 1 1 248.370 2.493 20 10 BECDMO C[C@H]([NH2+]CCNC1CC1)c1ccc(N(C)C)cc1 ZINC000817954578 586849818 /nfs/dbraw/zinc/84/98/18/586849818.db2.gz ZEURHTDRJYYVHX-LBPRGKRZSA-N 1 1 247.386 2.155 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+]CCNC2CC2)c(O)c1 ZINC000817954456 586850145 /nfs/dbraw/zinc/85/01/45/586850145.db2.gz YADJBZWIKGCVIW-LBPRGKRZSA-N 1 1 248.370 2.412 20 10 BECDMO Cc1cc(C)c([C@@H](C)[NH2+]CC(C)(C)N)c(O)c1 ZINC000817961230 586852491 /nfs/dbraw/zinc/85/24/91/586852491.db2.gz ZFYMEAJSOXYDDT-LLVKDONJSA-N 1 1 236.359 2.397 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+]CC(C)(C)N)c(O)c1 ZINC000817961231 586852961 /nfs/dbraw/zinc/85/29/61/586852961.db2.gz ZFYMEAJSOXYDDT-NSHDSACASA-N 1 1 236.359 2.397 20 10 BECDMO CC[C@H](NCC1C[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817964544 586853708 /nfs/dbraw/zinc/85/37/08/586853708.db2.gz CFUVOIRNOFPERE-HNNXBMFYSA-N 1 1 247.386 2.013 20 10 BECDMO CCN(C)c1ccc([C@@H](C)NCC2C[NH2+]C2)cc1 ZINC000817965632 586854888 /nfs/dbraw/zinc/85/48/88/586854888.db2.gz SQRLWWOHYIAZLL-GFCCVEGCSA-N 1 1 247.386 2.013 20 10 BECDMO C[C@H](N[C@@H]1C[NH2+]CC[C@@H]1C)c1ccccc1O ZINC000817967836 586856358 /nfs/dbraw/zinc/85/63/58/586856358.db2.gz MLBAJMPNWKQSPA-GMXVVIOVSA-N 1 1 234.343 2.041 20 10 BECDMO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)N)cc1 ZINC000817970985 586857321 /nfs/dbraw/zinc/85/73/21/586857321.db2.gz IWTRAHJWUNQALD-NEPJUHHUSA-N 1 1 235.375 2.141 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)C[NH3+])c1cccc(Cl)c1[O-] ZINC000817970362 586857831 /nfs/dbraw/zinc/85/78/31/586857831.db2.gz SCTFPGRUKIIBEK-KWQFWETISA-N 1 1 242.750 2.434 20 10 BECDMO CCN[C@H](C)C[NH2+][C@H](C)c1ccccc1O ZINC000817972915 586859004 /nfs/dbraw/zinc/85/90/04/586859004.db2.gz PPNOEVRHRLVQNU-GHMZBOCLSA-N 1 1 222.332 2.041 20 10 BECDMO CC[C@H](N)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000817978640 586862071 /nfs/dbraw/zinc/86/20/71/586862071.db2.gz CUEZHEJCLMHYSP-RYUDHWBXSA-N 1 1 236.359 2.397 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)[C@@H](C)N)c1ccccc1O ZINC000817978077 586862091 /nfs/dbraw/zinc/86/20/91/586862091.db2.gz VJHRNLROELEVHC-SCVCMEIPSA-N 1 1 222.332 2.169 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)[C@H](C)N)c1ccc(C)cc1O ZINC000817977332 586862191 /nfs/dbraw/zinc/86/21/91/586862191.db2.gz HXJLXUBPBDUAIV-GVXVVHGQSA-N 1 1 236.359 2.477 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](C)N)c(O)c1C ZINC000817977467 586862259 /nfs/dbraw/zinc/86/22/59/586862259.db2.gz KTPONUNOFFUSRZ-UTUOFQBUSA-N 1 1 236.359 2.395 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](F)C2)cc1 ZINC000824571910 587277229 /nfs/dbraw/zinc/27/72/29/587277229.db2.gz QVBIXBFWMIMYAI-GFCCVEGCSA-N 1 1 222.307 2.296 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)CO)cc1Cl ZINC000825922246 587345657 /nfs/dbraw/zinc/34/56/57/587345657.db2.gz MSKYQHZFBSNJJA-SECBINFHSA-N 1 1 243.734 2.167 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)Cc2cnc[nH]2)c1 ZINC000826769830 587361977 /nfs/dbraw/zinc/36/19/77/587361977.db2.gz SOIKXSQBNYQZFM-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)Cc2cnc[nH]2)c1 ZINC000826769830 587361978 /nfs/dbraw/zinc/36/19/78/587361978.db2.gz SOIKXSQBNYQZFM-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)Cc2c[nH]cn2)c1 ZINC000826769830 587361979 /nfs/dbraw/zinc/36/19/79/587361979.db2.gz SOIKXSQBNYQZFM-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)Cc2c[nH]cn2)c1 ZINC000826769830 587361980 /nfs/dbraw/zinc/36/19/80/587361980.db2.gz SOIKXSQBNYQZFM-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@H]3COC[C@]3(C)C2)c1O ZINC000827282443 587375079 /nfs/dbraw/zinc/37/50/79/587375079.db2.gz MJHFVTPGBCOGSZ-ZFWWWQNUSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@H]3COC[C@]3(C)C2)c1 ZINC000827285249 587375199 /nfs/dbraw/zinc/37/51/99/587375199.db2.gz YZAQCAOSWVFUNR-ZFWWWQNUSA-N 1 1 247.338 2.169 20 10 BECDMO C[N@@H+](Cc1cccc(Cl)c1[O-])C1(CO)CC1 ZINC000827903229 587408726 /nfs/dbraw/zinc/40/87/26/587408726.db2.gz GMUPJPYCJIEDKI-UHFFFAOYSA-N 1 1 241.718 2.002 20 10 BECDMO C[C@@H](CO)[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835053909 587779509 /nfs/dbraw/zinc/77/95/09/587779509.db2.gz QDZJIGZYAQCPCM-GFUIURDCSA-N 1 1 248.370 2.078 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+](C)CCN(C)C ZINC000840947095 587931311 /nfs/dbraw/zinc/93/13/11/587931311.db2.gz ZWYQJTJWGNDEIH-UHFFFAOYSA-N 1 1 249.402 2.054 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+](C)CCN(C)C ZINC000840947095 587931313 /nfs/dbraw/zinc/93/13/13/587931313.db2.gz ZWYQJTJWGNDEIH-UHFFFAOYSA-N 1 1 249.402 2.054 20 10 BECDMO CCCC[C@H](CN)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000841028587 587936350 /nfs/dbraw/zinc/93/63/50/587936350.db2.gz FEMXSBOSTNBXAM-CQSZACIVSA-N 1 1 248.370 2.229 20 10 BECDMO CCC([NH3+])(CC)CNCc1cc(C)ccc1O ZINC000841031442 587936407 /nfs/dbraw/zinc/93/64/07/587936407.db2.gz UFVNZHVJBDPTMX-UHFFFAOYSA-N 1 1 236.359 2.308 20 10 BECDMO CC(C)C[C@H](C[NH3+])NCc1ccc(N(C)C)cc1 ZINC000841039070 587938440 /nfs/dbraw/zinc/93/84/40/587938440.db2.gz ZFEZPMZYSBYMNA-CQSZACIVSA-N 1 1 249.402 2.216 20 10 BECDMO C[C@@H]([NH2+]CCCO)c1ccc(Cl)cc1O ZINC000841743706 587973833 /nfs/dbraw/zinc/97/38/33/587973833.db2.gz JSDVCHLIMLGAEZ-MRVPVSSYSA-N 1 1 229.707 2.079 20 10 BECDMO Cc1cccc(CN2CCCC[C@@H]2[C@@H](C)[NH3+])c1O ZINC000843046413 588076065 /nfs/dbraw/zinc/07/60/65/588076065.db2.gz VCHGGXVCFPVAGI-TZMCWYRMSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2[C@@H](C)N)c1O ZINC000843046413 588076067 /nfs/dbraw/zinc/07/60/67/588076067.db2.gz VCHGGXVCFPVAGI-TZMCWYRMSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cccc(C[N@@H+]2CCCC[C@@H]2[C@@H](C)N)c1O ZINC000843046413 588076069 /nfs/dbraw/zinc/07/60/69/588076069.db2.gz VCHGGXVCFPVAGI-TZMCWYRMSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@@H](C)[C@H]2CN)c1O ZINC000843052398 588076993 /nfs/dbraw/zinc/07/69/93/588076993.db2.gz SOEKPJDVWZKLTO-BXUZGUMPSA-N 1 1 248.370 2.260 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC000846109215 588256935 /nfs/dbraw/zinc/25/69/35/588256935.db2.gz COMJYGIZVPRTBV-AOOOYVTPSA-N 1 1 243.228 2.228 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c1O ZINC000846110585 588257030 /nfs/dbraw/zinc/25/70/30/588257030.db2.gz HSTREBTWGZZZHK-PHIMTYICSA-N 1 1 239.265 2.398 20 10 BECDMO COc1cccc([C@H](C)[NH2+]Cc2ccon2)c1O ZINC000846145653 588258511 /nfs/dbraw/zinc/25/85/11/588258511.db2.gz MJPAFJDTHGHPJG-VIFPVBQESA-N 1 1 248.282 2.240 20 10 BECDMO CCC[N@@H+](CCO)Cc1cccc(CC)c1O ZINC000848881771 588416338 /nfs/dbraw/zinc/41/63/38/588416338.db2.gz ZJPZIOGXKMQZAS-UHFFFAOYSA-N 1 1 237.343 2.159 20 10 BECDMO CCc1cccc(C[N@@H+](C)CC[C@H](C)O)c1O ZINC000848886865 588417320 /nfs/dbraw/zinc/41/73/20/588417320.db2.gz JPVSGDJGHBXDSY-NSHDSACASA-N 1 1 237.343 2.157 20 10 BECDMO CCc1cccc(C[N@H+]2C[C@H](O)[C@@H](CC)C2)c1O ZINC000848891465 588418142 /nfs/dbraw/zinc/41/81/42/588418142.db2.gz YPFYFBSFSRJPNR-JSGCOSHPSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@@H+](C)CC2CC(O)C2)c1O ZINC000848904907 588418388 /nfs/dbraw/zinc/41/83/88/588418388.db2.gz DAOCJVXYJWTWMZ-UHFFFAOYSA-N 1 1 249.354 2.157 20 10 BECDMO CC[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862215531 589194597 /nfs/dbraw/zinc/19/45/97/589194597.db2.gz KYKIFVUOUFPKFJ-UHFFFAOYSA-N 1 1 228.286 2.483 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C)NC2)c(O)c1 ZINC000863544939 589297833 /nfs/dbraw/zinc/29/78/33/589297833.db2.gz FMYSYDVWMDTUPA-FRRDWIJNSA-N 1 1 248.370 2.492 20 10 BECDMO COC(=O)CC1(C[N@@H+](C)c2ccc(N)cc2)CC1 ZINC000863558548 589299177 /nfs/dbraw/zinc/29/91/77/589299177.db2.gz MTSZSVSEUPQODV-UHFFFAOYSA-N 1 1 248.326 2.048 20 10 BECDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](C)CO ZINC000121093634 589498638 /nfs/dbraw/zinc/49/86/38/589498638.db2.gz KRZWXTYFTPUQPZ-GFCCVEGCSA-N 1 1 237.343 2.233 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCOC(C)(C)C1 ZINC000876613048 590221875 /nfs/dbraw/zinc/22/18/75/590221875.db2.gz GWOQXSXSDQJVGA-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO CC[C@@H]1COCC[N@H+]1Cc1ccc(C)cc1O ZINC000876617951 590222360 /nfs/dbraw/zinc/22/23/60/590222360.db2.gz XVGIUJDJNOBDOW-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO COCCC[N@@H+](C)Cc1ccc(C)cc1O ZINC000876646230 590225839 /nfs/dbraw/zinc/22/58/39/590225839.db2.gz UPGDYEJMPUIGOG-UHFFFAOYSA-N 1 1 223.316 2.169 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@](C)(O)C1 ZINC000876758486 590239170 /nfs/dbraw/zinc/23/91/70/590239170.db2.gz GSNXPUHGIJVIFD-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@](C)(O)C2)c(O)c1 ZINC000876760512 590239174 /nfs/dbraw/zinc/23/91/74/590239174.db2.gz SNLICNRGTLJDNX-AWEZNQCLSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[NH2+][C@@H](C)CCN(C)C)c(O)c1 ZINC000876992212 590266495 /nfs/dbraw/zinc/26/64/95/590266495.db2.gz NSIRLIGURLTXPK-LBPRGKRZSA-N 1 1 236.359 2.130 20 10 BECDMO Cc1nnc(C[NH2+]Cc2c(C)cccc2O)s1 ZINC000877185984 590298631 /nfs/dbraw/zinc/29/86/31/590298631.db2.gz PSBUCFMCAVGLEO-UHFFFAOYSA-N 1 1 249.339 2.150 20 10 BECDMO Cc1ccc(CN(C)CCC[NH+](C)C)c(O)c1 ZINC000877522619 590347268 /nfs/dbraw/zinc/34/72/68/590347268.db2.gz PMHSCWUCIHUIFT-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO CO[C@H](C)C[N@@H+](C)Cc1ccc(C)cc1O ZINC000877522823 590347311 /nfs/dbraw/zinc/34/73/11/590347311.db2.gz HDTWGBWNYCHEAQ-LLVKDONJSA-N 1 1 223.316 2.167 20 10 BECDMO CC[C@@H](C)[N@@H+](CCO)Cc1ccc(C)cc1O ZINC000877573423 590362798 /nfs/dbraw/zinc/36/27/98/590362798.db2.gz PIPNRXFGNIMVHU-GFCCVEGCSA-N 1 1 237.343 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@H](C)C[C@@H](CO)C2)c(O)c1 ZINC000877594863 590369939 /nfs/dbraw/zinc/36/99/39/590369939.db2.gz LGXCDSDYFDKNNN-CHWSQXEVSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@H](C)C[C@@H](CO)C1 ZINC000877595157 590369989 /nfs/dbraw/zinc/36/99/89/590369989.db2.gz UAKHETPPBSMPIP-DGCLKSJQSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)Cc1cnc[nH]1 ZINC000877620645 590375500 /nfs/dbraw/zinc/37/55/00/590375500.db2.gz VPWUISYEYJLJSH-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)Cc1c[nH]cn1 ZINC000877620645 590375506 /nfs/dbraw/zinc/37/55/06/590375506.db2.gz VPWUISYEYJLJSH-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)Cc1c[nH]cn1 ZINC000877620645 590375509 /nfs/dbraw/zinc/37/55/09/590375509.db2.gz VPWUISYEYJLJSH-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H]2COC[C@@H]2C1 ZINC000877637464 590381598 /nfs/dbraw/zinc/38/15/98/590381598.db2.gz ILDOCCFIJZSDMB-OLZOCXBDSA-N 1 1 247.338 2.169 20 10 BECDMO COCC(C)(C)C[N@H+]1Cc2cccc(O)c2C1 ZINC000877703117 590395702 /nfs/dbraw/zinc/39/57/02/590395702.db2.gz SAIHUAYSZZDOGV-UHFFFAOYSA-N 1 1 235.327 2.380 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@H](O)CC(C)(C)C2)c1O ZINC000877752105 590416151 /nfs/dbraw/zinc/41/61/51/590416151.db2.gz MYCCHBUQMCWGMN-CYBMUJFWSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@@H](O)CC(C)(C)C2)c1 ZINC000877752985 590416845 /nfs/dbraw/zinc/41/68/45/590416845.db2.gz KYLVOCHHBYJEFO-ZDUSSCGKSA-N 1 1 249.354 2.293 20 10 BECDMO CC(C)(C)OC1C[NH+](Cc2ccccc2O)C1 ZINC000877772280 590422397 /nfs/dbraw/zinc/42/23/97/590422397.db2.gz XDNREXZORPUJDG-UHFFFAOYSA-N 1 1 235.327 2.392 20 10 BECDMO CCC[N@@H+](CC(C)=O)Cc1ccccc1O ZINC000878151881 590506644 /nfs/dbraw/zinc/50/66/44/590506644.db2.gz RFWRJEUWRRVWGG-UHFFFAOYSA-N 1 1 221.300 2.193 20 10 BECDMO C[C@@H]1OCC[C@@H]1C[N@@H+](C)Cc1ccccc1O ZINC000878241895 590527906 /nfs/dbraw/zinc/52/79/06/590527906.db2.gz JPZOQRFSRDSPEO-NWDGAFQWSA-N 1 1 235.327 2.249 20 10 BECDMO CC(C)[C@H](O)CC[N@@H+](C)Cc1ccccc1O ZINC000878242317 590528487 /nfs/dbraw/zinc/52/84/87/590528487.db2.gz OMENLGARRXRUJZ-CYBMUJFWSA-N 1 1 237.343 2.231 20 10 BECDMO CCN1CC[N@@H+](Cc2cc(C)ccc2O)C[C@@H]1C ZINC000211382681 591163662 /nfs/dbraw/zinc/16/36/62/591163662.db2.gz BCFLPSZIVMVLGP-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2cc(C)ccc2O)C[C@@H]1C ZINC000211382681 591163665 /nfs/dbraw/zinc/16/36/65/591163665.db2.gz BCFLPSZIVMVLGP-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2cc(C)ccc2O)C[C@@H]1C ZINC000211382681 591163670 /nfs/dbraw/zinc/16/36/70/591163670.db2.gz BCFLPSZIVMVLGP-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CO[C@@H](C)[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883122381 591543566 /nfs/dbraw/zinc/54/35/66/591543566.db2.gz LPQNEFOQYMLFRJ-SFYZADRCSA-N 1 1 245.269 2.183 20 10 BECDMO COC[C@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886487600 592234578 /nfs/dbraw/zinc/23/45/78/592234578.db2.gz KSKHGCFECOURRZ-IUCAKERBSA-N 1 1 227.279 2.217 20 10 BECDMO COC[C@@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886487601 592234586 /nfs/dbraw/zinc/23/45/86/592234586.db2.gz KSKHGCFECOURRZ-RKDXNWHRSA-N 1 1 227.279 2.217 20 10 BECDMO COC[C@@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886487598 592234724 /nfs/dbraw/zinc/23/47/24/592234724.db2.gz KSKHGCFECOURRZ-BDAKNGLRSA-N 1 1 227.279 2.217 20 10 BECDMO C[C@H]([NH2+]C[C@@H]1CCOC1)c1c(O)cccc1F ZINC000886510893 592240319 /nfs/dbraw/zinc/24/03/19/592240319.db2.gz CBFAWXPHDJLODM-UWVGGRQHSA-N 1 1 239.290 2.218 20 10 BECDMO C[C@@H]([NH2+]C[C@H](C)N(C)C)c1c(O)cccc1F ZINC000886523050 592243819 /nfs/dbraw/zinc/24/38/19/592243819.db2.gz VZQGYXLSJUTAHV-VHSXEESVSA-N 1 1 240.322 2.132 20 10 BECDMO CC(C)[C@H](O)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886528235 592245753 /nfs/dbraw/zinc/24/57/53/592245753.db2.gz IXPBVEUIODWXJO-BXKDBHETSA-N 1 1 241.306 2.199 20 10 BECDMO C[C@H]([NH2+]CC(C)(C)CO)c1c(O)cccc1F ZINC000886553197 592259369 /nfs/dbraw/zinc/25/93/69/592259369.db2.gz FZKPGXKMMQOAPD-VIFPVBQESA-N 1 1 241.306 2.200 20 10 BECDMO C[C@H]([NH2+]CCF)c1c(O)cccc1F ZINC000886604744 592272162 /nfs/dbraw/zinc/27/21/62/592272162.db2.gz BQZAUTPJNZHAHH-ZETCQYMHSA-N 1 1 201.216 2.151 20 10 BECDMO C[C@H]([NH2+][C@H]1CCC[C@@H]1O)c1c(O)cccc1F ZINC000886646700 592287996 /nfs/dbraw/zinc/28/79/96/592287996.db2.gz QRQSITXPWXQDFK-LSJOCFKGSA-N 1 1 239.290 2.095 20 10 BECDMO COc1ccc(C[N@@H+](C)C2CC2)c(O)c1OC ZINC000891620152 631412156 /nfs/dbraw/zinc/41/21/56/631412156.db2.gz PWQJCEXDMJASRX-UHFFFAOYSA-N 1 1 237.299 2.004 20 10 BECDMO C[C@H]1C[C@H]([NH3+])CCN1Cc1ccc(N(C)C)cc1 ZINC000084946390 631454648 /nfs/dbraw/zinc/45/46/48/631454648.db2.gz WRCSVYMFXRWOAI-GXTWGEPZSA-N 1 1 247.386 2.064 20 10 BECDMO CC[N@@H+](Cc1cc(C)ccc1O)[C@H]1CCOC1 ZINC000310507164 632749987 /nfs/dbraw/zinc/74/99/87/632749987.db2.gz JJMIVVKMHNZHBA-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CC[C@H](O)C2(C)C)cc1 ZINC000258744122 635194298 /nfs/dbraw/zinc/19/42/98/635194298.db2.gz JQBVFRZQXZFQDR-AWEZNQCLSA-N 1 1 248.370 2.098 20 10 BECDMO COc1ccc(CNC[C@H]2CCC[NH2+]C2)cc1C ZINC000258924085 635225369 /nfs/dbraw/zinc/22/53/69/635225369.db2.gz GLNOOCWZPOYTPC-AWEZNQCLSA-N 1 1 248.370 2.093 20 10 BECDMO C[N@@H+](Cc1cc2c(cc1O)CCC2)C1CC1 ZINC000192562937 636869623 /nfs/dbraw/zinc/86/96/23/636869623.db2.gz PBAJWNJQSWVSRU-UHFFFAOYSA-N 1 1 217.312 2.475 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)[C@H](C)CO1 ZINC000128520313 637084997 /nfs/dbraw/zinc/08/49/97/637084997.db2.gz MFVBBFJZHCPSBN-CHWSQXEVSA-N 1 1 248.370 2.362 20 10 BECDMO CCN(CC)c1ccc(C[NH2+]CC2(N)CC2)cc1 ZINC000904450950 637417396 /nfs/dbraw/zinc/41/73/96/637417396.db2.gz UWODNYHHDAYYFW-UHFFFAOYSA-N 1 1 247.386 2.114 20 10 BECDMO Cc1cc(C)c(O)c(C[N@H+](C)[C@H]2CCOC2)c1 ZINC000164306901 640471264 /nfs/dbraw/zinc/47/12/64/640471264.db2.gz WVBRMMIFTRMTAN-ZDUSSCGKSA-N 1 1 235.327 2.230 20 10 BECDMO CCOC[C@H](C)[NH2+]Cc1cccc(F)c1O ZINC000165158584 640539580 /nfs/dbraw/zinc/53/95/80/640539580.db2.gz IOAWAMLZUSTBBC-VIFPVBQESA-N 1 1 227.279 2.046 20 10 BECDMO COC[C@H]1CCCC[N@H+]1Cc1ccccc1O ZINC000307781900 641200424 /nfs/dbraw/zinc/20/04/24/641200424.db2.gz QAXJMGXSXWZKDK-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO C[C@H](O)CC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000191068708 641899929 /nfs/dbraw/zinc/89/99/29/641899929.db2.gz CMPJTXSVEUTLBQ-ZETCQYMHSA-N 1 1 247.697 2.045 20 10 BECDMO C[N@@H+](CCOC1CC1)Cc1ccccc1O ZINC000929977553 642058793 /nfs/dbraw/zinc/05/87/93/642058793.db2.gz WDWOFTZHTALLEI-UHFFFAOYSA-N 1 1 221.300 2.003 20 10 BECDMO C[C@H]([NH2+][C@@H]1CCC[C@H]1O)c1ccc(F)cc1O ZINC000248491359 642389018 /nfs/dbraw/zinc/38/90/18/642389018.db2.gz IPILXKHCDRUQGR-XXILOJSOSA-N 1 1 239.290 2.095 20 10 BECDMO CCCC[N@@H+](CCO)Cc1cccc(C)c1O ZINC000305762152 642691329 /nfs/dbraw/zinc/69/13/29/642691329.db2.gz FKNDZLZRKHETEF-UHFFFAOYSA-N 1 1 237.343 2.295 20 10 BECDMO [NH3+]CC[C@@H]1CCCC[N@@H+]1Cc1ccccc1[O-] ZINC000070148364 642977789 /nfs/dbraw/zinc/97/77/89/642977789.db2.gz CMIMUNJHUNZBMC-ZDUSSCGKSA-N 1 1 234.343 2.096 20 10 BECDMO [NH3+]CC[C@@H]1CCCC[N@H+]1Cc1ccccc1[O-] ZINC000070148364 642977802 /nfs/dbraw/zinc/97/78/02/642977802.db2.gz CMIMUNJHUNZBMC-ZDUSSCGKSA-N 1 1 234.343 2.096 20 10 BECDMO Cc1ccc(O)c(CN2CCCC[C@H]2[C@@H](C)[NH3+])c1 ZINC000071409529 643143436 /nfs/dbraw/zinc/14/34/36/643143436.db2.gz BIAHQWNJYKKWRI-OCCSQVGLSA-N 1 1 248.370 2.402 20 10 BECDMO CC(C)(O)[C@H]1CCC[N@H+]1Cc1ccccc1O ZINC000185218796 643275086 /nfs/dbraw/zinc/27/50/86/643275086.db2.gz MGQIKRPJKKNVPJ-CYBMUJFWSA-N 1 1 235.327 2.128 20 10 BECDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1ccccc1O ZINC000185218780 643275258 /nfs/dbraw/zinc/27/52/58/643275258.db2.gz MGQIKRPJKKNVPJ-ZDUSSCGKSA-N 1 1 235.327 2.128 20 10 BECDMO Cc1noc([C@H](C)[NH2+]Cc2cc(C)ccc2O)n1 ZINC000733328212 643328863 /nfs/dbraw/zinc/32/88/63/643328863.db2.gz LFCVLRYSYSWDFV-VIFPVBQESA-N 1 1 247.298 2.243 20 10 BECDMO C[C@H]([NH2+][C@H]1CCC[C@@H]1O)c1ccc(F)cc1O ZINC000186066961 643436131 /nfs/dbraw/zinc/43/61/31/643436131.db2.gz IPILXKHCDRUQGR-UWJYBYFXSA-N 1 1 239.290 2.095 20 10 BECDMO CC[C@@H]1COCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000091980095 644644301 /nfs/dbraw/zinc/64/43/01/644644301.db2.gz BKKZVNQBPIXSFA-CQSZACIVSA-N 1 1 248.370 2.363 20 10 BECDMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1cc(C)ccc1O ZINC000824636617 645056897 /nfs/dbraw/zinc/05/68/97/645056897.db2.gz RWMSNHSHTJOTLC-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1c([O-])cccc1Cl ZINC000843129113 645267113 /nfs/dbraw/zinc/26/71/13/645267113.db2.gz MKEAGPQHWACYIY-BDAKNGLRSA-N 1 1 242.750 2.261 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@]2(C)CO)c(O)c1 ZINC000877459763 645796798 /nfs/dbraw/zinc/79/67/98/645796798.db2.gz KLYMLYORDMAADA-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO COCC[N@@H+](CCF)Cc1ccc(C)cc1O ZINC000877627079 645802455 /nfs/dbraw/zinc/80/24/55/645802455.db2.gz LULIJBZDURCQDO-UHFFFAOYSA-N 1 1 241.306 2.119 20 10 BECDMO CCOCCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000708485103 712211468 /nfs/dbraw/zinc/21/14/68/712211468.db2.gz KUENSDQODYMSIF-UHFFFAOYSA-N 1 1 245.269 2.187 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H](CF)C1 ZINC000711497347 712306919 /nfs/dbraw/zinc/30/69/19/712306919.db2.gz LWRUYKCSBNRBDB-JTQLQIEISA-N 1 1 209.264 2.184 20 10 BECDMO COCC(C)(C)C[NH2+]c1ccc(N)cc1 ZINC000389696564 711086336 /nfs/dbraw/zinc/08/63/36/711086336.db2.gz IXZXDSJSTXOSNT-UHFFFAOYSA-N 1 1 208.305 2.353 20 10 BECDMO Cc1cccc(C[NH2+][C@@H](C)C(F)F)c1O ZINC000389971814 711101077 /nfs/dbraw/zinc/10/10/77/711101077.db2.gz VRHKGWUBSAQCQB-QMMMGPOBSA-N 1 1 215.243 2.444 20 10 BECDMO C[C@H]([NH2+][C@@H](C)C(C)(C)O)c1ccc(F)cc1O ZINC000393968985 711180276 /nfs/dbraw/zinc/18/02/76/711180276.db2.gz ITQPQXDEZFKNEC-IUCAKERBSA-N 1 1 241.306 2.341 20 10 BECDMO C[C@H]([NH2+]Cc1cocn1)c1cc(F)ccc1O ZINC000397958474 711398349 /nfs/dbraw/zinc/39/83/49/711398349.db2.gz GOFUIVBGAVWBER-QMMMGPOBSA-N 1 1 236.246 2.370 20 10 BECDMO C[C@@H]1COCCC[N@H+]1Cc1ccccc1O ZINC000398870603 711416449 /nfs/dbraw/zinc/41/64/49/711416449.db2.gz PHBVPSWCFLKYAK-LLVKDONJSA-N 1 1 221.300 2.003 20 10 BECDMO CC[N@@H+](Cc1cccc(C)c1O)[C@@H]1CCOC1 ZINC000310473682 711777375 /nfs/dbraw/zinc/77/73/75/711777375.db2.gz BHCWTGNPJBDHOJ-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO CC[C@@H]([NH2+]Cc1ncccn1)c1ccccc1O ZINC000702326167 712047130 /nfs/dbraw/zinc/04/71/30/712047130.db2.gz ORLCWARTPFPKMQ-GFCCVEGCSA-N 1 1 243.310 2.423 20 10 BECDMO CC[C@H](COC)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708484231 712185779 /nfs/dbraw/zinc/18/57/79/712185779.db2.gz GAPGNUVBNFKVKN-SNVBAGLBSA-N 1 1 245.269 2.185 20 10 BECDMO C[C@@H]1C[C@H]1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708387029 712191759 /nfs/dbraw/zinc/19/17/59/712191759.db2.gz AALRLFISOXNCJR-SFYZADRCSA-N 1 1 227.254 2.416 20 10 BECDMO CC[N@H+](CCOC)Cc1cc(F)cc(F)c1O ZINC000708411915 712193424 /nfs/dbraw/zinc/19/34/24/712193424.db2.gz DILXHYXYMARTAG-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO CC[N@@H+](CCOC)Cc1cc(F)cc(F)c1O ZINC000708411915 712193427 /nfs/dbraw/zinc/19/34/27/712193427.db2.gz DILXHYXYMARTAG-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](CF)C1 ZINC000711488414 712306381 /nfs/dbraw/zinc/30/63/81/712306381.db2.gz DCCXOPCXAVFNKY-VIFPVBQESA-N 1 1 227.254 2.323 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](CF)C2)c1 ZINC000711492859 712307253 /nfs/dbraw/zinc/30/72/53/712307253.db2.gz UVVSSLSWNORSSR-JTQLQIEISA-N 1 1 239.290 2.192 20 10 BECDMO CC[N@@H+](Cc1ccccc1O)[C@H]1CCOC1 ZINC000390622220 712421781 /nfs/dbraw/zinc/42/17/81/712421781.db2.gz GCMLDAILGDROJP-LBPRGKRZSA-N 1 1 221.300 2.003 20 10 BECDMO Cc1ccc(C[N@@H+](C)CCCCCO)c(O)c1 ZINC000877485458 712631243 /nfs/dbraw/zinc/63/12/43/712631243.db2.gz VAAXYJUQJQUCSH-UHFFFAOYSA-N 1 1 237.343 2.295 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](CF)C2)c1 ZINC000711489850 1168408442 /nfs/dbraw/zinc/40/84/42/1168408442.db2.gz LMPVVMAWNBYWAM-NSHDSACASA-N 1 1 223.291 2.492 20 10 BECDMO Oc1cc2c(cc1C[NH+]1CCOCC1)CCCC2 ZINC000159464114 1169132140 /nfs/dbraw/zinc/13/21/40/1169132140.db2.gz IGNIVNLGCAQQHR-UHFFFAOYSA-N 1 1 247.338 2.103 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2ccccc2O)[C@@H](C)CO1 ZINC000403885656 971086374 /nfs/dbraw/zinc/08/63/74/971086374.db2.gz PBXOIKSCIMPETB-AAEUAGOBSA-N 1 1 235.327 2.392 20 10 BECDMO C[C@@H]1CCC[N@H+](Cc2ccccc2[O-])[C@H]1CC[NH3+] ZINC000404434785 971161965 /nfs/dbraw/zinc/16/19/65/971161965.db2.gz QRCJAHREEWVPJT-OCCSQVGLSA-N 1 1 248.370 2.342 20 10 BECDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])[C@H]1CC[NH3+] ZINC000404434785 971161974 /nfs/dbraw/zinc/16/19/74/971161974.db2.gz QRCJAHREEWVPJT-OCCSQVGLSA-N 1 1 248.370 2.342 20 10 BECDMO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](C)[C@@H](O)C2)c1O ZINC001140178460 957717732 /nfs/dbraw/zinc/71/77/32/957717732.db2.gz MCHFRLOBKQZAQL-RISCZKNCSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1ccc(C)c(C[N@@H+](C2CC2)C2COC2)c1O ZINC001140182329 957722443 /nfs/dbraw/zinc/72/24/43/957722443.db2.gz PAGFYNHECAXSAO-UHFFFAOYSA-N 1 1 247.338 2.372 20 10 BECDMO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc(Cl)cc1O ZINC001140461140 958480975 /nfs/dbraw/zinc/48/09/75/958480975.db2.gz FIJDVYCSXXNGLS-LDYMZIIASA-N 1 1 241.718 2.001 20 10 BECDMO C[N@H+](Cc1ccc(Cl)cc1O)CC1COC1 ZINC001140465650 958518479 /nfs/dbraw/zinc/51/84/79/958518479.db2.gz PSEYVJSDDMSYAR-UHFFFAOYSA-N 1 1 241.718 2.124 20 10 BECDMO Cc1c[nH]c(C[NH2+]Cc2ccc(N(C)C)cc2)n1 ZINC000693505293 958624605 /nfs/dbraw/zinc/62/46/05/958624605.db2.gz VPOYOUZLHSVUTM-UHFFFAOYSA-N 1 1 244.342 2.074 20 10 BECDMO C[N@@H+](Cc1cc[nH]c1)Cc1ccccc1O ZINC000091974459 958792131 /nfs/dbraw/zinc/79/21/31/958792131.db2.gz CLJAOPYGWJNREH-UHFFFAOYSA-N 1 1 216.284 2.352 20 10 BECDMO Cc1c(O)ccc(C[N@@H+]2CC[C@H](C)C2)c1O ZINC001140744370 959792834 /nfs/dbraw/zinc/79/28/34/959792834.db2.gz VJRKCWCLGPVMTJ-VIFPVBQESA-N 1 1 221.300 2.248 20 10 BECDMO CO[C@@]1(C)C[C@H]1[NH2+][C@@H](C)c1ccc(F)cc1O 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ZINC001140950251 960755835 /nfs/dbraw/zinc/75/58/35/960755835.db2.gz XFCZNFWDKRBCLL-UHFFFAOYSA-N 1 1 233.311 2.065 20 10 BECDMO Cc1ccc(C[N@H+]2CCCC(=O)CC2)c(O)c1 ZINC001140952031 960757177 /nfs/dbraw/zinc/75/71/77/960757177.db2.gz CBFBRITZQXPOCE-UHFFFAOYSA-N 1 1 233.311 2.256 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H]3OCC[C@@H]3C2)c(O)c1 ZINC001140957801 960758549 /nfs/dbraw/zinc/75/85/49/960758549.db2.gz OCDDOKXXQFIQBP-UKRRQHHQSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@]3(CCO3)C2)c(O)c1 ZINC001140950790 960764200 /nfs/dbraw/zinc/76/42/00/960764200.db2.gz JASUOLLAJKWHBS-HNNXBMFYSA-N 1 1 247.338 2.456 20 10 BECDMO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc(O)ccc1O ZINC001141156074 960890238 /nfs/dbraw/zinc/89/02/38/960890238.db2.gz DTPQJVNMAWUJSD-PSASIEDQSA-N 1 1 225.263 2.030 20 10 BECDMO C[C@@H]1CCC[N@H+]1Cc1cc(O)ccc1O ZINC001141155855 960890981 /nfs/dbraw/zinc/89/09/81/960890981.db2.gz MTILXIFCTDPWOB-SECBINFHSA-N 1 1 207.273 2.082 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCCC23CC3)c1 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CC(C)c1ccc(C[N@H+]2CCC23COC3)c(O)c1 ZINC001237053620 979811260 /nfs/dbraw/zinc/81/12/60/979811260.db2.gz OTDNMXBFSRNCPZ-UHFFFAOYSA-N 1 1 247.338 2.490 20 10 BECDMO CC(C)c1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c(O)c1 ZINC001237055372 979811695 /nfs/dbraw/zinc/81/16/95/979811695.db2.gz NLKNLUKEDGBYTH-DZGCQCFKSA-N 1 1 247.338 2.489 20 10 BECDMO CC(C)c1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c(O)c1 ZINC001237055372 979811699 /nfs/dbraw/zinc/81/16/99/979811699.db2.gz NLKNLUKEDGBYTH-DZGCQCFKSA-N 1 1 247.338 2.489 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCCC[C@](C)(O)C1 ZINC001237486216 979911870 /nfs/dbraw/zinc/91/18/70/979911870.db2.gz YHTVYSDIDAXXTB-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC001237490754 979916056 /nfs/dbraw/zinc/91/60/56/979916056.db2.gz ATOJHZBLULCMGU-NWDGAFQWSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@H]2CC[C@@H](C1)C2=O ZINC001237486987 979916350 /nfs/dbraw/zinc/91/63/50/979916350.db2.gz FECMEWYKCSQSEX-TXEJJXNPSA-N 1 1 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CCC[N@@H+](CCOC)Cc1cccc(F)c1O ZINC001138122493 990883652 /nfs/dbraw/zinc/88/36/52/990883652.db2.gz JCJMDJRYDQCONN-UHFFFAOYSA-N 1 1 241.306 2.390 20 10 BECDMO Oc1c(F)cccc1C[NH+]1CC2CC(C2)C1 ZINC001138129618 990886479 /nfs/dbraw/zinc/88/64/79/990886479.db2.gz NODVAQFNVKDWLB-UHFFFAOYSA-N 1 1 221.275 2.373 20 10 BECDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@H](O)C2)c1 ZINC001308580076 991048597 /nfs/dbraw/zinc/04/85/97/991048597.db2.gz MJPQVKXPCACNFQ-ZDUSSCGKSA-N 1 1 235.327 2.082 20 10 BECDMO CCC1(C[N@@H+](C)Cc2ccccc2O)COC1 ZINC001202963658 991339966 /nfs/dbraw/zinc/33/99/66/991339966.db2.gz DECGHOBOXNREHZ-UHFFFAOYSA-N 1 1 235.327 2.251 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)C[C@@H]1F ZINC001140057715 991510791 /nfs/dbraw/zinc/51/07/91/991510791.db2.gz LBWNNQDNCXTSNO-KCJUWKMLSA-N 1 1 227.254 2.321 20 10 BECDMO C[N@H+](Cc1ccc(N)cc1)C[C@@H]1CCCCO1 ZINC000036231130 991543605 /nfs/dbraw/zinc/54/36/05/991543605.db2.gz ZLUDKOHGCWNPHC-AWEZNQCLSA-N 1 1 234.343 2.270 20 10 BECDMO Cc1ccc(C)c(C[N@@H+]2CCOC[C@H]2C)c1O ZINC001140178509 991550525 /nfs/dbraw/zinc/55/05/25/991550525.db2.gz NDCFIRHVGRZKBA-GFCCVEGCSA-N 1 1 235.327 2.230 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCCC[C@H]2CO)c1O ZINC001140179202 991550885 /nfs/dbraw/zinc/55/08/85/991550885.db2.gz BSVMJTDEPLVBDB-ZDUSSCGKSA-N 1 1 249.354 2.356 20 10 BECDMO C[N@@H+](CCCCO)Cc1ccc(Cl)cc1O ZINC001560759943 991587717 /nfs/dbraw/zinc/58/77/17/991587717.db2.gz QYBJTDAKRVGGEE-UHFFFAOYSA-N 1 1 243.734 2.250 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@@H](C)[C@@H](O)C2)c1O ZINC001560811562 991611435 /nfs/dbraw/zinc/61/14/35/991611435.db2.gz PENYBKZLBABDDT-RISCZKNCSA-N 1 1 249.354 2.157 20 10 BECDMO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](O)C1 ZINC001140460988 991643521 /nfs/dbraw/zinc/64/35/21/991643521.db2.gz AJPAJJOHOFKPMM-LLVKDONJSA-N 1 1 241.718 2.002 20 10 BECDMO COCC[N@@H+](C)Cc1ccc(Cl)cc1O ZINC001140461000 991644548 /nfs/dbraw/zinc/64/45/48/991644548.db2.gz AUVYJZRHVJZJDM-UHFFFAOYSA-N 1 1 229.707 2.124 20 10 BECDMO CC[N@@H+](CCO)Cc1ccc(N2CCCC2)cc1 ZINC001320466152 992214044 /nfs/dbraw/zinc/21/40/44/992214044.db2.gz DUEJWQOERRQLMV-UHFFFAOYSA-N 1 1 248.370 2.101 20 10 BECDMO C[NH2+][C@H](C)CCN[C@H](C)c1ccc(N(C)C)cc1 ZINC001261424289 992297879 /nfs/dbraw/zinc/29/78/79/992297879.db2.gz QMDSUMTZCGOFCI-CHWSQXEVSA-N 1 1 249.402 2.401 20 10 BECDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)[C@@H](C)O ZINC001615686621 1170529191 /nfs/dbraw/zinc/52/91/91/1170529191.db2.gz RSROWVGUFAHEBF-NWDGAFQWSA-N 1 1 237.343 2.374 20 10 BECDMO Oc1cc(F)c(F)cc1C[N@H+]1CC=CCC1 ZINC001621200515 1170742865 /nfs/dbraw/zinc/74/28/65/1170742865.db2.gz MEXFHNSXJGLDJL-UHFFFAOYSA-N 1 1 225.238 2.432 20 10 BECDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC=CCC1 ZINC001621200515 1170742870 /nfs/dbraw/zinc/74/28/70/1170742870.db2.gz MEXFHNSXJGLDJL-UHFFFAOYSA-N 1 1 225.238 2.432 20 10 BECDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@H](CF)C1 ZINC001621496700 1170828363 /nfs/dbraw/zinc/82/83/63/1170828363.db2.gz QCJSJZZQIDLZDT-MRVPVSSYSA-N 1 1 245.244 2.462 20 10 BECDMO 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BECDMO CC[N@H+]1CCN(Cc2cccc(C)c2O)[C@@H](C)C1 ZINC000289560479 352189863 /nfs/dbraw/zinc/18/98/63/352189863.db2.gz IYVPFPHSCZOUIJ-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC1(C)OCC[C@H]1[NH2+]Cc1cccc(F)c1O ZINC000294822652 188269247 /nfs/dbraw/zinc/26/92/47/188269247.db2.gz PDCWNWASNBMOBA-LLVKDONJSA-N 1 1 239.290 2.188 20 10 BECDMO CC[N@H+](Cc1ccccc1O)C[C@H](C)OC ZINC000291150551 364770993 /nfs/dbraw/zinc/77/09/93/364770993.db2.gz ZJPZNXWOYXAKMF-NSHDSACASA-N 1 1 223.316 2.249 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H]1CF ZINC000293961245 183274641 /nfs/dbraw/zinc/27/46/41/183274641.db2.gz JNDQOEBQRCQMTC-NSHDSACASA-N 1 1 227.254 2.465 20 10 BECDMO Oc1c(F)cccc1C[NH2+]C1CC(F)(F)C1 ZINC000277377973 183255793 /nfs/dbraw/zinc/25/57/93/183255793.db2.gz GAQCOXFNTQWUAX-UHFFFAOYSA-N 1 1 231.217 2.419 20 10 BECDMO C[C@@H]([NH2+]Cc1nccn1C)c1ccc(F)cc1O ZINC000071273443 384157945 /nfs/dbraw/zinc/15/79/45/384157945.db2.gz MNEXBCCMVIVKIR-SECBINFHSA-N 1 1 249.289 2.116 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000091772170 384143121 /nfs/dbraw/zinc/14/31/21/384143121.db2.gz PRPZQXXWOQPUNR-OAHLLOKOSA-N 1 1 248.370 2.363 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2ccccc2O)CCO1 ZINC000132507919 384234905 /nfs/dbraw/zinc/23/49/05/384234905.db2.gz ZRVPLZLDIHUDNI-LBPRGKRZSA-N 1 1 221.300 2.003 20 10 BECDMO C[N@H+](Cc1ccccc1O)CC1CCOCC1 ZINC000096513990 384464788 /nfs/dbraw/zinc/46/47/88/384464788.db2.gz ODKWZJXNCLVTOG-UHFFFAOYSA-N 1 1 235.327 2.251 20 10 BECDMO CN(C)C1(C[N@@H+](C)Cc2ccccc2O)CCC1 ZINC000097934044 384577469 /nfs/dbraw/zinc/57/74/69/384577469.db2.gz CRKLPZRYPDCDTC-UHFFFAOYSA-N 1 1 248.370 2.308 20 10 BECDMO CN(Cc1ccccc1O)CC1([NH+](C)C)CCC1 ZINC000097934044 384577477 /nfs/dbraw/zinc/57/74/77/384577477.db2.gz CRKLPZRYPDCDTC-UHFFFAOYSA-N 1 1 248.370 2.308 20 10 BECDMO CC[N@H+](C)CCNCc1ccc(OC)c(C)c1 ZINC000049938121 384579433 /nfs/dbraw/zinc/57/94/33/384579433.db2.gz LOOPNUMZDNUJKR-UHFFFAOYSA-N 1 1 236.359 2.045 20 10 BECDMO CC[N@@H+](C)CCNCc1ccc(OC)c(C)c1 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385312755 /nfs/dbraw/zinc/31/27/55/385312755.db2.gz XOVSICGDKBWJSJ-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO CC[C@]1(C)C[N@@H+](Cc2ccccc2O)CCO1 ZINC000191148557 385286436 /nfs/dbraw/zinc/28/64/36/385286436.db2.gz JSBLLSAPXHMZCZ-CQSZACIVSA-N 1 1 235.327 2.393 20 10 BECDMO C[C@@H]1OCC[N@H+](Cc2cc(F)ccc2O)[C@H]1C ZINC000180158708 385386070 /nfs/dbraw/zinc/38/60/70/385386070.db2.gz GQFYFYAWQJJAET-UWVGGRQHSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@@H]1OCC[N@@H+](Cc2cc(F)ccc2O)[C@H]1C ZINC000180158708 385386072 /nfs/dbraw/zinc/38/60/72/385386072.db2.gz GQFYFYAWQJJAET-UWVGGRQHSA-N 1 1 239.290 2.141 20 10 BECDMO CCC[C@@H]1C[N@@H+](Cc2ccccc2O)CCO1 ZINC000179577244 385476271 /nfs/dbraw/zinc/47/62/71/385476271.db2.gz DRSIGUHCTOYEFJ-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO C[N@@H+](Cc1cc(F)ccc1O)[C@H]1CCSC1 ZINC000179928254 385500898 /nfs/dbraw/zinc/50/08/98/385500898.db2.gz BXPORSQPLSQJIK-NSHDSACASA-N 1 1 241.331 2.469 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)CCF)cc1 ZINC000269501309 385599394 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/nfs/dbraw/zinc/29/59/35/386295935.db2.gz NIQDWKIRTPAYJQ-GFCCVEGCSA-N 1 1 249.354 2.375 20 10 BECDMO Cc1cc(C[N@H+](C)Cc2ccccc2O)ncn1 ZINC000293253448 386794044 /nfs/dbraw/zinc/79/40/44/386794044.db2.gz ROVHFZIHRVUCEW-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO C[C@@H]([NH2+]CC1COC1)c1ccc(Cl)cc1O ZINC000528026150 387830979 /nfs/dbraw/zinc/83/09/79/387830979.db2.gz JVELVQIEXXZFEH-MRVPVSSYSA-N 1 1 241.718 2.343 20 10 BECDMO C[N@H+](Cc1cc(F)ccc1O)C[C@@H]1CCCO1 ZINC000179917864 398048713 /nfs/dbraw/zinc/04/87/13/398048713.db2.gz KLWZDGCTONPTSM-LBPRGKRZSA-N 1 1 239.290 2.142 20 10 BECDMO CCOc1ccc(O)c(C[N@@H+](C)CCF)c1 ZINC000293678821 398117236 /nfs/dbraw/zinc/11/72/36/398117236.db2.gz PNOLGVIWIAZFPH-UHFFFAOYSA-N 1 1 227.279 2.192 20 10 BECDMO CC[C@@H]1C[N@H+](Cc2cc(F)ccc2O)CCO1 ZINC000179908987 171089828 /nfs/dbraw/zinc/08/98/28/171089828.db2.gz YJEVCPAYEKIOBT-GFCCVEGCSA-N 1 1 239.290 2.142 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)CCO1 ZINC000179908987 171089832 /nfs/dbraw/zinc/08/98/32/171089832.db2.gz YJEVCPAYEKIOBT-GFCCVEGCSA-N 1 1 239.290 2.142 20 10 BECDMO CC[C@@](C)(O)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000087011628 171185252 /nfs/dbraw/zinc/18/52/52/171185252.db2.gz AXTWEHYLPVKTKP-TVQRCGJNSA-N 1 1 241.306 2.343 20 10 BECDMO COCC(C)(C)[N@H+](C)Cc1cccc(F)c1O ZINC000292791460 174080180 /nfs/dbraw/zinc/08/01/80/174080180.db2.gz MLPSFPLMSIFUGW-UHFFFAOYSA-N 1 1 241.306 2.388 20 10 BECDMO COCC(C)(C)[N@@H+](C)Cc1cccc(F)c1O ZINC000292791460 174080183 /nfs/dbraw/zinc/08/01/83/174080183.db2.gz MLPSFPLMSIFUGW-UHFFFAOYSA-N 1 1 241.306 2.388 20 10 BECDMO COc1cccc(C[N@@H+](C)C2CCC2)c1O ZINC000093475868 175253502 /nfs/dbraw/zinc/25/35/02/175253502.db2.gz WBABJXDVKQZWKV-UHFFFAOYSA-N 1 1 221.300 2.385 20 10 BECDMO COc1cccc(C[N@@H+](C)CC(C)C)c1O ZINC000132529005 175253784 /nfs/dbraw/zinc/25/37/84/175253784.db2.gz NWAXDGMNNLELEO-UHFFFAOYSA-N 1 1 223.316 2.489 20 10 BECDMO COc1cccc(C[N@H+]2CC[C@@H](C)C2)c1O ZINC000132668128 175259836 /nfs/dbraw/zinc/25/98/36/175259836.db2.gz ORBCCTSDSUJLLU-SNVBAGLBSA-N 1 1 221.300 2.243 20 10 BECDMO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)CCC1=O ZINC000283296978 176303996 /nfs/dbraw/zinc/30/39/96/176303996.db2.gz XDRMXOZUTPPWCZ-GFCCVEGCSA-N 1 1 246.354 2.164 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CCC1=O ZINC000283296978 176303998 /nfs/dbraw/zinc/30/39/98/176303998.db2.gz XDRMXOZUTPPWCZ-GFCCVEGCSA-N 1 1 246.354 2.164 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccccc2O)CCCO1 ZINC000132722358 177265722 /nfs/dbraw/zinc/26/57/22/177265722.db2.gz NKEHTLWNOQWLEV-NSHDSACASA-N 1 1 221.300 2.003 20 10 BECDMO CC[C@H]([NH2+][C@H](C)CNC)c1ccccc1O ZINC000854230875 588781001 /nfs/dbraw/zinc/78/10/01/588781001.db2.gz BAZUTJQVCOQEBQ-PWSUYJOCSA-N 1 1 222.332 2.041 20 10 BECDMO CC[C@@]1(O)CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000877691296 583342598 /nfs/dbraw/zinc/34/25/98/583342598.db2.gz MACGCPIZLRDXRJ-OAHLLOKOSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1ncoc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000894213626 583380711 /nfs/dbraw/zinc/38/07/11/583380711.db2.gz OMTFTIDKEIOWLH-UHFFFAOYSA-N 1 1 244.294 2.208 20 10 BECDMO COc1cc(C)cc(C[NH2+]C(CF)CF)c1O ZINC000894872019 583540276 /nfs/dbraw/zinc/54/02/76/583540276.db2.gz DLMQQZSBCSGWKU-UHFFFAOYSA-N 1 1 245.269 2.106 20 10 BECDMO Cc1n[nH]c(C[NH2+]Cc2c(O)cccc2F)c1C ZINC000896643189 583818562 /nfs/dbraw/zinc/81/85/62/583818562.db2.gz STCNJUMBIYAVKA-UHFFFAOYSA-N 1 1 249.289 2.161 20 10 BECDMO CC1(C[NH2+]Cc2c(O)cccc2F)CC1 ZINC000896638486 583819541 /nfs/dbraw/zinc/81/95/41/583819541.db2.gz VDXWMOAFYPBLLC-UHFFFAOYSA-N 1 1 209.264 2.421 20 10 BECDMO Oc1cccc(F)c1C[NH2+][C@@H]1CCCOCC1 ZINC000896637680 583819546 /nfs/dbraw/zinc/81/95/46/583819546.db2.gz PYGBBLPOYVUPDU-SNVBAGLBSA-N 1 1 239.290 2.190 20 10 BECDMO Oc1cccc(F)c1C[NH2+]C[C@@H]1CCSC1 ZINC000896638644 583819795 /nfs/dbraw/zinc/81/97/95/583819795.db2.gz XBEMVFYWQWKUIP-VIFPVBQESA-N 1 1 241.331 2.374 20 10 BECDMO C[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2F)CCO1 ZINC000896637511 583819909 /nfs/dbraw/zinc/81/99/09/583819909.db2.gz NYSCFAKKIXMKNQ-ZJUUUORDSA-N 1 1 239.290 2.188 20 10 BECDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccon2)c1 ZINC000148642085 584022230 /nfs/dbraw/zinc/02/22/30/584022230.db2.gz KRRZYEPCCSMJFP-VIFPVBQESA-N 1 1 248.282 2.240 20 10 BECDMO C[C@H]([NH2+][C@@H]1COC[C@@H]1C)c1c(O)cccc1F ZINC000903393064 584756137 /nfs/dbraw/zinc/75/61/37/584756137.db2.gz FLAJGTCENUTOLJ-ATZCPNFKSA-N 1 1 239.290 2.217 20 10 BECDMO C[C@@H]([NH2+][C@@H](C)C(C)(C)O)c1c(O)cccc1F ZINC000903391351 584756178 /nfs/dbraw/zinc/75/61/78/584756178.db2.gz XVIMCQBVXKZVKW-BDAKNGLRSA-N 1 1 241.306 2.341 20 10 BECDMO C[C@H]([NH2+][C@@H](C)C(C)(C)O)c1c(O)cccc1F ZINC000903391352 584756210 /nfs/dbraw/zinc/75/62/10/584756210.db2.gz XVIMCQBVXKZVKW-IUCAKERBSA-N 1 1 241.306 2.341 20 10 BECDMO CCC[N@@H+](Cc1ccccc1[O-])C[C@H]1C[C@@H]([NH3+])C1 ZINC000904315997 584862559 /nfs/dbraw/zinc/86/25/59/584862559.db2.gz IEQPKRQFEPATMU-XBXGTLAGSA-N 1 1 248.370 2.342 20 10 BECDMO CCC[N@H+](Cc1ccccc1[O-])C[C@H]1C[C@@H]([NH3+])C1 ZINC000904315997 584862560 /nfs/dbraw/zinc/86/25/60/584862560.db2.gz IEQPKRQFEPATMU-XBXGTLAGSA-N 1 1 248.370 2.342 20 10 BECDMO Cc1ccc(C[N@H+]2CCOCC2(C)C)c(O)c1 ZINC000876633984 584886535 /nfs/dbraw/zinc/88/65/35/584886535.db2.gz ZGEZZSTXZMMLKO-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO CC[C@H]([NH2+]C[C@H](N)C1CC1)c1ccccc1O ZINC000817966005 584993509 /nfs/dbraw/zinc/99/35/09/584993509.db2.gz YTLRAGTYFVQYQW-STQMWFEESA-N 1 1 234.343 2.170 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCC[C@@]2(C)CO)cc1 ZINC000789556579 585166475 /nfs/dbraw/zinc/16/64/75/585166475.db2.gz CWNCZVKSKAFLKL-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1cc(C)c(O)c(C[N@H+](C)Cc2cc[nH]n2)c1 ZINC000754725935 585290065 /nfs/dbraw/zinc/29/00/65/585290065.db2.gz HADHTNMQKSTROZ-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2cc[nH]n2)c1 ZINC000754725935 585290066 /nfs/dbraw/zinc/29/00/66/585290066.db2.gz HADHTNMQKSTROZ-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)CC2(O)CCC2)cc1C ZINC000761220787 585412441 /nfs/dbraw/zinc/41/24/41/585412441.db2.gz YADQDXMZUMGRDY-UHFFFAOYSA-N 1 1 249.354 2.356 20 10 BECDMO C[C@H]1COCCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000769457717 585557719 /nfs/dbraw/zinc/55/77/19/585557719.db2.gz OZAQGOLMPTZTNC-ZDUSSCGKSA-N 1 1 248.370 2.363 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)[C@@H]2CCCOC2)cc1 ZINC000771529734 585595824 /nfs/dbraw/zinc/59/58/24/585595824.db2.gz YKYHYRBWFQXIOI-OAHLLOKOSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(C)c1ccc(C[N@@H+]2CCO[C@H](C)C2)cc1 ZINC000773734952 585642935 /nfs/dbraw/zinc/64/29/35/585642935.db2.gz USFFZFXWROLHFA-CYBMUJFWSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CCO[C@H](C)C2)cc1 ZINC000773734952 585642936 /nfs/dbraw/zinc/64/29/36/585642936.db2.gz USFFZFXWROLHFA-CYBMUJFWSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2C[C@H](O)C[C@H]2C)cc1 ZINC000773815923 585644322 /nfs/dbraw/zinc/64/43/22/585644322.db2.gz KEAOCGUKYMLDJG-IUODEOHRSA-N 1 1 248.370 2.098 20 10 BECDMO CCN1C[C@H](C)[N@@H+](Cc2ccccc2O)C[C@H]1C ZINC000779017779 585743720 /nfs/dbraw/zinc/74/37/20/585743720.db2.gz BPIOVKMFFPRZPP-OLZOCXBDSA-N 1 1 248.370 2.307 20 10 BECDMO CC[N@@H+]1C[C@H](C)N(Cc2ccccc2O)C[C@H]1C ZINC000779017779 585743721 /nfs/dbraw/zinc/74/37/21/585743721.db2.gz BPIOVKMFFPRZPP-OLZOCXBDSA-N 1 1 248.370 2.307 20 10 BECDMO CC[N@H+]1C[C@H](C)N(Cc2ccccc2O)C[C@H]1C ZINC000779017779 585743722 /nfs/dbraw/zinc/74/37/22/585743722.db2.gz BPIOVKMFFPRZPP-OLZOCXBDSA-N 1 1 248.370 2.307 20 10 BECDMO Cc1cccc(C[N@@H+]2CC=CCC2)c1O ZINC000779159679 585746172 /nfs/dbraw/zinc/74/61/72/585746172.db2.gz QLUAJBLOHMLDHG-UHFFFAOYSA-N 1 1 203.285 2.463 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2CCO)cc1C ZINC000779202626 585747315 /nfs/dbraw/zinc/74/73/15/585747315.db2.gz QSPQVSKHMGSATJ-AWEZNQCLSA-N 1 1 249.354 2.356 20 10 BECDMO C[C@H]1C[C@@H](O)C[N@H+]1Cc1cc(Cl)ccc1O ZINC000788268501 585920411 /nfs/dbraw/zinc/92/04/11/585920411.db2.gz DVSFCMQEYSFKQB-GZMMTYOYSA-N 1 1 241.718 2.001 20 10 BECDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCOC1 ZINC000794550143 586043769 /nfs/dbraw/zinc/04/37/69/586043769.db2.gz KODRSMSYEGGOLU-HNNXBMFYSA-N 1 1 248.370 2.363 20 10 BECDMO CC[C@@H]([NH2+][C@@H]1CCOC1)c1ccc(F)cc1O ZINC000796842331 586114770 /nfs/dbraw/zinc/11/47/70/586114770.db2.gz YTDVZGTUOQQYBX-ZYHUDNBSSA-N 1 1 239.290 2.361 20 10 BECDMO COC[C@@H]1CC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000840082861 586423287 /nfs/dbraw/zinc/42/32/87/586423287.db2.gz KPCLNQHUTUQWGT-AWEZNQCLSA-N 1 1 247.338 2.102 20 10 BECDMO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cccc(F)c1O ZINC000816646813 586749235 /nfs/dbraw/zinc/74/92/35/586749235.db2.gz JHYPPZRXJGRMRM-DTWKUNHWSA-N 1 1 209.264 2.372 20 10 BECDMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cccc(F)c1O ZINC000816646813 586749238 /nfs/dbraw/zinc/74/92/38/586749238.db2.gz JHYPPZRXJGRMRM-DTWKUNHWSA-N 1 1 209.264 2.372 20 10 BECDMO Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@H]1[NH3+] ZINC000817893960 586834000 /nfs/dbraw/zinc/83/40/00/586834000.db2.gz JMXDBVVTBKTVBC-HUUCEWRRSA-N 1 1 247.386 2.030 20 10 BECDMO C[C@@H]([NH2+]CCN)c1ccc(N2CCCCC2)cc1 ZINC000817934652 586842892 /nfs/dbraw/zinc/84/28/92/586842892.db2.gz MGYLZWCOCFRQEN-CYBMUJFWSA-N 1 1 247.386 2.286 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@H]2CCCNC2)c(O)c1 ZINC000817942427 586845685 /nfs/dbraw/zinc/84/56/85/586845685.db2.gz YMAGPWCEAFAIKJ-RYUDHWBXSA-N 1 1 234.343 2.103 20 10 BECDMO C[C@@H]([NH2+]C[C@H]1CCCCN1)c1ccccc1O ZINC000817950066 586847364 /nfs/dbraw/zinc/84/73/64/586847364.db2.gz RKCIMZYHWXXODO-VXGBXAGGSA-N 1 1 234.343 2.185 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]C[C@H](N)C(C)C)c(O)c1 ZINC000817959903 586851200 /nfs/dbraw/zinc/85/12/00/586851200.db2.gz WLALWKCRVWQXSZ-YPMHNXCESA-N 1 1 236.359 2.335 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]CC(C)(C)N)c(O)c1 ZINC000817960806 586851240 /nfs/dbraw/zinc/85/12/40/586851240.db2.gz QUPQUPNEEAEPGO-JTQLQIEISA-N 1 1 222.332 2.089 20 10 BECDMO C[C@@H](NCC(C)(C)[NH3+])c1ccc(N(C)C)cc1 ZINC000817959930 586851465 /nfs/dbraw/zinc/85/14/65/586851465.db2.gz HVBRLGQHWGDFNG-LLVKDONJSA-N 1 1 235.375 2.141 20 10 BECDMO C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cc(Cl)ccc1[O-] ZINC000817961637 586853323 /nfs/dbraw/zinc/85/33/23/586853323.db2.gz BKVSRVGQBZVQES-DTWKUNHWSA-N 1 1 242.750 2.291 20 10 BECDMO CC[C@@H]([NH2+][C@@H](C)C[NH3+])c1cccc(Cl)c1[O-] ZINC000817970361 586857387 /nfs/dbraw/zinc/85/73/87/586857387.db2.gz SCTFPGRUKIIBEK-GZMMTYOYSA-N 1 1 242.750 2.434 20 10 BECDMO CC[C@H](NC[C@H](C)[NH3+])c1ccc(N(C)C)cc1 ZINC000817970867 586857635 /nfs/dbraw/zinc/85/76/35/586857635.db2.gz GLFUMVTYXRAJNB-FZMZJTMJSA-N 1 1 235.375 2.141 20 10 BECDMO CC[C@H]([NH2+]C[C@H](C)N)c1ccc(N(C)C)cc1 ZINC000817970867 586857637 /nfs/dbraw/zinc/85/76/37/586857637.db2.gz GLFUMVTYXRAJNB-FZMZJTMJSA-N 1 1 235.375 2.141 20 10 BECDMO CCN[C@H](C)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000817972125 586859450 /nfs/dbraw/zinc/85/94/50/586859450.db2.gz JZURNNBSTONPEH-VXGBXAGGSA-N 1 1 236.359 2.349 20 10 BECDMO CO[C@H]1CC[C@H]([N@@H+](C)Cc2ccccc2O)C1 ZINC000821392202 587115858 /nfs/dbraw/zinc/11/58/58/587115858.db2.gz VSNVAZMJIAPUQZ-STQMWFEESA-N 1 1 235.327 2.392 20 10 BECDMO CO[C@@H]1CC[C@H]([N@@H+](C)Cc2ccccc2O)C1 ZINC000821392201 587116021 /nfs/dbraw/zinc/11/60/21/587116021.db2.gz VSNVAZMJIAPUQZ-QWHCGFSZSA-N 1 1 235.327 2.392 20 10 BECDMO CC[N@@H+](CCO)Cc1cc(Cl)c(C)cc1O ZINC000824491091 587271820 /nfs/dbraw/zinc/27/18/20/587271820.db2.gz MBMMWFMGLZMSQO-UHFFFAOYSA-N 1 1 243.734 2.168 20 10 BECDMO COc1cccc(C[N@H+]2CC[C@@H]2C2CC2)c1O ZINC000824649699 587280989 /nfs/dbraw/zinc/28/09/89/587280989.db2.gz FKHXKIYEYQSIOA-GFCCVEGCSA-N 1 1 233.311 2.385 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CC[C@H]2C2CC2)c1 ZINC000824649089 587281106 /nfs/dbraw/zinc/28/11/06/587281106.db2.gz BCLQZKODKHJKFZ-ZDUSSCGKSA-N 1 1 233.311 2.385 20 10 BECDMO C[C@@]1(C2CC2)C[N@@H+](Cc2ccccc2O)CCO1 ZINC000826877172 587364701 /nfs/dbraw/zinc/36/47/01/587364701.db2.gz BSQXHQSVYKUDIR-HNNXBMFYSA-N 1 1 247.338 2.393 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c1O ZINC000827282434 587375271 /nfs/dbraw/zinc/37/52/71/587375271.db2.gz MJHFVTPGBCOGSZ-HIFRSBDPSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c1 ZINC000827285247 587375305 /nfs/dbraw/zinc/37/53/05/587375305.db2.gz YZAQCAOSWVFUNR-HIFRSBDPSA-N 1 1 247.338 2.169 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000827506789 587384800 /nfs/dbraw/zinc/38/48/00/587384800.db2.gz MFPGQEDMSDVEPM-JQWIXIFHSA-N 1 1 203.285 2.234 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000827506316 587384882 /nfs/dbraw/zinc/38/48/82/587384882.db2.gz GKXLBCBOBFZCQZ-UWVGGRQHSA-N 1 1 221.275 2.373 20 10 BECDMO C[N@@H+](Cc1cc(Cl)ccc1O)C1(CO)CC1 ZINC000827904301 587409168 /nfs/dbraw/zinc/40/91/68/587409168.db2.gz ZUIJVHGGFINTOB-UHFFFAOYSA-N 1 1 241.718 2.002 20 10 BECDMO C[C@@H]([NH2+][C@@H]1CCC[C@H]1O)c1ccc(F)cc1O ZINC000834913663 587770620 /nfs/dbraw/zinc/77/06/20/587770620.db2.gz IPILXKHCDRUQGR-GGZOMVNGSA-N 1 1 239.290 2.095 20 10 BECDMO CN(C)c1ccc(/C=C\C[N@@H+](C)CCCO)cc1 ZINC000835052133 587779745 /nfs/dbraw/zinc/77/97/45/587779745.db2.gz OFLWQZURWYOMBX-XQRVVYSFSA-N 1 1 248.370 2.080 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@H](O)C[C@H]1C ZINC000840942347 587931244 /nfs/dbraw/zinc/93/12/44/587931244.db2.gz ZPUHVCIXAUDNHX-IUODEOHRSA-N 1 1 248.370 2.016 20 10 BECDMO Cc1cc(Cl)cc(CNCC(C)(C)[NH3+])c1O ZINC000841030485 587936380 /nfs/dbraw/zinc/93/63/80/587936380.db2.gz JCNQNOUYSSKCPE-UHFFFAOYSA-N 1 1 242.750 2.181 20 10 BECDMO C[C@@H]([NH2+][C@@H](C)CCO)c1ccc(Cl)cc1O ZINC000841757651 587974500 /nfs/dbraw/zinc/97/45/00/587974500.db2.gz DWJXLMIURNFZKJ-DTWKUNHWSA-N 1 1 243.734 2.467 20 10 BECDMO CC[C@H](C[N@@H+](C)Cc1ccccc1O)OC ZINC000842153854 588003800 /nfs/dbraw/zinc/00/38/00/588003800.db2.gz RNFXWUDMSGHFFI-GFCCVEGCSA-N 1 1 223.316 2.249 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)N[C@@H](C)C2)cc1C ZINC000843048957 588076692 /nfs/dbraw/zinc/07/66/92/588076692.db2.gz BTKDXIWSYIMWFP-BETUJISGSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)N[C@@H](C)C2)cc1C ZINC000843048957 588076693 /nfs/dbraw/zinc/07/66/93/588076693.db2.gz BTKDXIWSYIMWFP-BETUJISGSA-N 1 1 248.370 2.191 20 10 BECDMO CC[N@@H+](C)CCN(C)c1ccc(OC)cc1 ZINC000844399082 588189365 /nfs/dbraw/zinc/18/93/65/588189365.db2.gz GBTAHRJHLYFTTA-UHFFFAOYSA-N 1 1 222.332 2.083 20 10 BECDMO CCC[N@@H+](C)CCN(C)c1ccc(OC)cc1 ZINC000844400244 588189886 /nfs/dbraw/zinc/18/98/86/588189886.db2.gz YCSRYMFPBPZTTP-UHFFFAOYSA-N 1 1 236.359 2.473 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)CCO)cc1C ZINC000846111888 588257394 /nfs/dbraw/zinc/25/73/94/588257394.db2.gz RUWOKMQGQSPNHA-LBPRGKRZSA-N 1 1 237.343 2.212 20 10 BECDMO CC[C@@H](C)[N@@H+](CCO)Cc1cc(F)ccc1O ZINC000862388207 589207195 /nfs/dbraw/zinc/20/71/95/589207195.db2.gz XXYQAOVUTXWLAL-SNVBAGLBSA-N 1 1 241.306 2.124 20 10 BECDMO CCC[N@H+](Cc1ccccc1O)C[C@H](C)CO ZINC000121093786 589498402 /nfs/dbraw/zinc/49/84/02/589498402.db2.gz KRZWXTYFTPUQPZ-LBPRGKRZSA-N 1 1 237.343 2.233 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)c(O)c1 ZINC000876598051 590220451 /nfs/dbraw/zinc/22/04/51/590220451.db2.gz TXCARNIGCULFQG-VXGBXAGGSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2C)c(O)c1 ZINC000876598045 590220580 /nfs/dbraw/zinc/22/05/80/590220580.db2.gz TXCARNIGCULFQG-NEPJUHHUSA-N 1 1 235.327 2.310 20 10 BECDMO C[N@@H+](Cc1ccns1)Cc1ccccc1O ZINC000876615367 590222243 /nfs/dbraw/zinc/22/22/43/590222243.db2.gz CCPRBVOXIRVDLI-UHFFFAOYSA-N 1 1 234.324 2.481 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](CCCO)C1CC1 ZINC000876730986 590234013 /nfs/dbraw/zinc/23/40/13/590234013.db2.gz CQBWPEKIINWKRH-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](CCCCO)C1CC1 ZINC000876732516 590234493 /nfs/dbraw/zinc/23/44/93/590234493.db2.gz XZEXPOOXPCOAAM-UHFFFAOYSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC[C@H]1C[C@H](C)O ZINC000876749440 590236834 /nfs/dbraw/zinc/23/68/34/590236834.db2.gz KCHIMTPVCBKKPU-STQMWFEESA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ccc(C[N@H+](C)CC2(O)CCCC2)c(O)c1 ZINC000876747834 590237008 /nfs/dbraw/zinc/23/70/08/590237008.db2.gz NXTYDIXXUWBMGW-UHFFFAOYSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H]1C[C@@H](C)O ZINC000876749434 590237284 /nfs/dbraw/zinc/23/72/84/590237284.db2.gz KCHIMTPVCBKKPU-CHWSQXEVSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCOC2(CCC2)C1 ZINC000876764387 590239785 /nfs/dbraw/zinc/23/97/85/590239785.db2.gz MOYJHPCNNGXGIE-UHFFFAOYSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)C[C@H]1CCC[C@H]1O ZINC000876802920 590243664 /nfs/dbraw/zinc/24/36/64/590243664.db2.gz BMSYNVIUQWYUAD-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cc(C[NH2+]Cc2c(C)cccc2O)no1 ZINC000876970887 590263025 /nfs/dbraw/zinc/26/30/25/590263025.db2.gz FLXDLKHMRKUIMN-UHFFFAOYSA-N 1 1 232.283 2.287 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CC=CCC1 ZINC000877168217 590295538 /nfs/dbraw/zinc/29/55/38/590295538.db2.gz PROGXNNVCNWCKH-UHFFFAOYSA-N 1 1 203.285 2.463 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCOCC2(CC2)C1 ZINC000877194917 590299691 /nfs/dbraw/zinc/29/96/91/590299691.db2.gz XRELGGGHQDHMIQ-UHFFFAOYSA-N 1 1 247.338 2.313 20 10 BECDMO CO[C@H](C)C[N@@H+](C)Cc1c(C)cccc1O ZINC000877522485 590345010 /nfs/dbraw/zinc/34/50/10/590345010.db2.gz FYYGPTIOBJMLPV-LLVKDONJSA-N 1 1 223.316 2.167 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)[C@@H]1CCCOC1 ZINC000877515777 590345469 /nfs/dbraw/zinc/34/54/69/590345469.db2.gz OXKLHKDKPWUWLN-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@H](CO)CC1 ZINC000877555712 590356309 /nfs/dbraw/zinc/35/63/09/590356309.db2.gz ZJFWODNISWZVCA-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@@H](C)C[C@H](CO)C2)c(O)c1 ZINC000877594866 590370369 /nfs/dbraw/zinc/37/03/69/590370369.db2.gz LGXCDSDYFDKNNN-STQMWFEESA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@H+](C)C[C@H]2CCCN2C)c(O)c1 ZINC000877595838 590370440 /nfs/dbraw/zinc/37/04/40/590370440.db2.gz CZQZNEZHFUHMPU-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN(C)C[C@H]2CCC[N@@H+]2C)c(O)c1 ZINC000877595838 590370443 /nfs/dbraw/zinc/37/04/43/590370443.db2.gz CZQZNEZHFUHMPU-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN(C)C[C@H]2CCC[N@H+]2C)c(O)c1 ZINC000877595838 590370445 /nfs/dbraw/zinc/37/04/45/590370445.db2.gz CZQZNEZHFUHMPU-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@H](C)C[C@H](CO)C1 ZINC000877595159 590370468 /nfs/dbraw/zinc/37/04/68/590370468.db2.gz UAKHETPPBSMPIP-YPMHNXCESA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@H+](C)Cc2cnc[nH]2)c(O)c1 ZINC000877620238 590375854 /nfs/dbraw/zinc/37/58/54/590375854.db2.gz QWWOMTDTISPIKN-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(C[N@@H+](C)Cc2cnc[nH]2)c(O)c1 ZINC000877620238 590375856 /nfs/dbraw/zinc/37/58/56/590375856.db2.gz QWWOMTDTISPIKN-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(C[N@H+](C)Cc2c[nH]cn2)c(O)c1 ZINC000877620238 590375858 /nfs/dbraw/zinc/37/58/58/590375858.db2.gz QWWOMTDTISPIKN-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(C[N@@H+](C)Cc2c[nH]cn2)c(O)c1 ZINC000877620238 590375859 /nfs/dbraw/zinc/37/58/59/590375859.db2.gz QWWOMTDTISPIKN-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@](C)(CO)C2)c(O)c1 ZINC000877640706 590382278 /nfs/dbraw/zinc/38/22/78/590382278.db2.gz QVOFAJNOBQLUCT-WFASDCNBSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](CO)C2)c(O)c1 ZINC000877646506 590384534 /nfs/dbraw/zinc/38/45/34/590384534.db2.gz JFYSBXTVUDKAKH-OCCSQVGLSA-N 1 1 249.354 2.151 20 10 BECDMO CC[C@]1(O)CCC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000877691999 590393054 /nfs/dbraw/zinc/39/30/54/590393054.db2.gz ZUNWCPZPZYKJGY-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO CC[C@@]1(O)CCC[N@@H+](Cc2ccccc2O)C1 ZINC000877691114 590393284 /nfs/dbraw/zinc/39/32/84/590393284.db2.gz IXFBTZGTKMQIGO-CQSZACIVSA-N 1 1 235.327 2.129 20 10 BECDMO C[C@H]1C[C@@H]1C[N@H+]1Cc2cccc(O)c2C1 ZINC000877703070 590395450 /nfs/dbraw/zinc/39/54/50/590395450.db2.gz PZBDWVGPBQULBN-GXSJLCMTSA-N 1 1 203.285 2.364 20 10 BECDMO Oc1cccc2c1C[N@@H+](C[C@H]1CCC=CO1)C2 ZINC000877702577 590396018 /nfs/dbraw/zinc/39/60/18/590396018.db2.gz CCGMSNHKRVRIDF-GFCCVEGCSA-N 1 1 231.295 2.401 20 10 BECDMO Oc1cccc2c1C[N@@H+](C[C@@H]1CCC=CO1)C2 ZINC000877702578 590396524 /nfs/dbraw/zinc/39/65/24/590396524.db2.gz CCGMSNHKRVRIDF-LBPRGKRZSA-N 1 1 231.295 2.401 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@H](O)CC(C)(C)C1 ZINC000877752270 590415574 /nfs/dbraw/zinc/41/55/74/590415574.db2.gz ODCZPUYGQZVJMS-GFCCVEGCSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1noc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)n1 ZINC000879648800 590841194 /nfs/dbraw/zinc/84/11/94/590841194.db2.gz FCVCRJMTFRRGCD-RKDXNWHRSA-N 1 1 247.298 2.495 20 10 BECDMO Cc1noc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000879651635 590843631 /nfs/dbraw/zinc/84/36/31/590843631.db2.gz FCVCRJMTFRRGCD-DTWKUNHWSA-N 1 1 247.298 2.495 20 10 BECDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000134957888 591962931 /nfs/dbraw/zinc/96/29/31/591962931.db2.gz XJQQACHLYWFCSF-ZJUUUORDSA-N 1 1 249.310 2.351 20 10 BECDMO C[C@H]([NH2+][C@H]1CCCOC1)c1c(O)cccc1F ZINC000886525159 592246480 /nfs/dbraw/zinc/24/64/80/592246480.db2.gz YRITXULCOBEVQB-UWVGGRQHSA-N 1 1 239.290 2.361 20 10 BECDMO CO[C@@H](C)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886596264 592271178 /nfs/dbraw/zinc/27/11/78/592271178.db2.gz AHIJPAZLOCUQLD-IUCAKERBSA-N 1 1 227.279 2.217 20 10 BECDMO C[C@H](O)CCC[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886603390 592272585 /nfs/dbraw/zinc/27/25/85/592272585.db2.gz MXUKHQQVTSMERK-UWVGGRQHSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H]([NH2+][C@@H]1CCC[C@H]1O)c1c(O)cccc1F ZINC000886623870 592278848 /nfs/dbraw/zinc/27/88/48/592278848.db2.gz QRQSITXPWXQDFK-FBIMIBRVSA-N 1 1 239.290 2.095 20 10 BECDMO C[C@H]([NH2+][C@H]1CO[C@H](C)C1)c1c(O)cccc1F ZINC000886631548 592282393 /nfs/dbraw/zinc/28/23/93/592282393.db2.gz PRBYOTAIPRYNJX-KXUCPTDWSA-N 1 1 239.290 2.359 20 10 BECDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ncc[nH]1 ZINC000139082404 592363315 /nfs/dbraw/zinc/36/33/15/592363315.db2.gz CUFQBBZKUULKNJ-LLVKDONJSA-N 1 1 244.342 2.327 20 10 BECDMO CO[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(F)c1O ZINC000158751377 632485215 /nfs/dbraw/zinc/48/52/15/632485215.db2.gz CIIAMQTXACGLSN-VXGBXAGGSA-N 1 1 239.290 2.188 20 10 BECDMO C[C@H]([NH2+]CC1(O)CCC1)c1ccc(F)cc1O ZINC000168762415 633146824 /nfs/dbraw/zinc/14/68/24/633146824.db2.gz WJPASLGUQGDNBC-VIFPVBQESA-N 1 1 239.290 2.097 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](CO)CC2)c1 ZINC000294209174 633755191 /nfs/dbraw/zinc/75/51/91/633755191.db2.gz YEKMUQPJCBLYBR-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO CC[N@@H+](Cc1cc(C)ccc1O)[C@@H]1CCOC1 ZINC000310507163 636239381 /nfs/dbraw/zinc/23/93/81/636239381.db2.gz JJMIVVKMHNZHBA-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO CCC(O)(CC)C[N@@H+](C)Cc1ccccc1O ZINC000305837344 636333807 /nfs/dbraw/zinc/33/38/07/636333807.db2.gz QGAOEZYNLFTKAF-UHFFFAOYSA-N 1 1 237.343 2.375 20 10 BECDMO CCN(CC)c1ccc(CNC2CC([NH3+])C2)cc1 ZINC000906507980 638179701 /nfs/dbraw/zinc/17/97/01/638179701.db2.gz FPJSLQWQJYLTKV-UHFFFAOYSA-N 1 1 247.386 2.112 20 10 BECDMO C[C@H]1OCC[C@]1(C)[NH2+]Cc1cccc(F)c1O ZINC000230392091 641049578 /nfs/dbraw/zinc/04/95/78/641049578.db2.gz BZMWWAOQYBIIMI-RNCFNFMXSA-N 1 1 239.290 2.188 20 10 BECDMO COc1cccc(C[N@H+]2CC[C@H]3C[C@H]3C2)c1O ZINC000827506358 641365849 /nfs/dbraw/zinc/36/58/49/641365849.db2.gz GRZTWKYFMFGTPN-JQWIXIFHSA-N 1 1 233.311 2.243 20 10 BECDMO C[C@H](CCO)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000191144192 641902338 /nfs/dbraw/zinc/90/23/38/641902338.db2.gz LECVYGLFLOWJSK-SSDOTTSWSA-N 1 1 247.697 2.045 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)CC2CC(O)C2)cc1C ZINC000191166517 641904044 /nfs/dbraw/zinc/90/40/44/641904044.db2.gz ACAARUPPTGWOSX-UHFFFAOYSA-N 1 1 249.354 2.212 20 10 BECDMO C[N@H+]1CCC[C@@H]1CSc1nccs1 ZINC000916759888 641975882 /nfs/dbraw/zinc/97/58/82/641975882.db2.gz VIHKYPKKZJGZNY-MRVPVSSYSA-N 1 1 214.359 2.329 20 10 BECDMO C[N@H+]1CCC[C@H]1CSc1nccs1 ZINC000916759889 641975194 /nfs/dbraw/zinc/97/51/94/641975194.db2.gz VIHKYPKKZJGZNY-QMMMGPOBSA-N 1 1 214.359 2.329 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)[C@@H](C)CO1 ZINC000253358178 642639581 /nfs/dbraw/zinc/63/95/81/642639581.db2.gz MFVBBFJZHCPSBN-QWHCGFSZSA-N 1 1 248.370 2.362 20 10 BECDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1ccccc1O ZINC000179576939 642731119 /nfs/dbraw/zinc/73/11/19/642731119.db2.gz QUXXBCZVROKWKP-YPMHNXCESA-N 1 1 235.327 2.128 20 10 BECDMO C[N@H+]1CC[C@H](CSc2nccs2)C1 ZINC000187682041 643216087 /nfs/dbraw/zinc/21/60/87/643216087.db2.gz QSACTAUWLWXVAS-QMMMGPOBSA-N 1 1 214.359 2.187 20 10 BECDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](F)C2)c1O ZINC000840104036 644865866 /nfs/dbraw/zinc/86/58/66/644865866.db2.gz GGESHDIQOMJESC-LLVKDONJSA-N 1 1 239.290 2.253 20 10 BECDMO CC[C@@H](N)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000817980057 644993180 /nfs/dbraw/zinc/99/31/80/644993180.db2.gz QXSABOSCHGXBHM-NWDGAFQWSA-N 1 1 236.359 2.397 20 10 BECDMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1cccc(C)c1O ZINC000824636281 645057045 /nfs/dbraw/zinc/05/70/45/645057045.db2.gz NWJLSJGFHXKKBI-KGLIPLIRSA-N 1 1 249.354 2.293 20 10 BECDMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cccc(C)c1O ZINC000824636283 645057085 /nfs/dbraw/zinc/05/70/85/645057085.db2.gz NWJLSJGFHXKKBI-ZIAGYGMSSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(CN(C)CCC[NH+](C)C)c1 ZINC000211423036 645837770 /nfs/dbraw/zinc/83/77/70/645837770.db2.gz VSSFOLATPZXJJK-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO COCCC[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000708415605 712194321 /nfs/dbraw/zinc/19/43/21/712194321.db2.gz ZRZTVROLVYUBRD-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO COCCC[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000708415605 712194322 /nfs/dbraw/zinc/19/43/22/712194322.db2.gz ZRZTVROLVYUBRD-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO CCc1cccc(C[N@@H+](CC)CCOC)c1O ZINC000709319588 712219872 /nfs/dbraw/zinc/21/98/72/712219872.db2.gz NGROTDVESGPNJU-UHFFFAOYSA-N 1 1 237.343 2.423 20 10 BECDMO CC[C@@H]([NH2+]CCOC)c1ccc(F)cc1O ZINC000381551188 710653861 /nfs/dbraw/zinc/65/38/61/710653861.db2.gz MULQNOVGSJGLPH-LLVKDONJSA-N 1 1 227.279 2.218 20 10 BECDMO CO[C@H]1C[C@@H](C[N@H+](C)c2ccc(N)cc2)C1 ZINC000721969640 710693739 /nfs/dbraw/zinc/69/37/39/710693739.db2.gz BWSUMFMHLUIMGC-GSJFWJNXSA-N 1 1 220.316 2.130 20 10 BECDMO CO[C@H]1C[C@@H](C[N@@H+](C)c2ccc(N)cc2)C1 ZINC000721969640 710693741 /nfs/dbraw/zinc/69/37/41/710693741.db2.gz BWSUMFMHLUIMGC-GSJFWJNXSA-N 1 1 220.316 2.130 20 10 BECDMO Oc1cccc2c1[C@H]([NH2+]Cc1cocn1)CC2 ZINC000397849109 711393866 /nfs/dbraw/zinc/39/38/66/711393866.db2.gz JDWDZURSSUVGOT-LLVKDONJSA-N 1 1 230.267 2.157 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]2OCC[C@@H]2C1 ZINC000724813891 711616523 /nfs/dbraw/zinc/61/65/23/711616523.db2.gz HWKSNURYTFCKSR-OCCSQVGLSA-N 1 1 233.311 2.003 20 10 BECDMO C[C@@H]([NH2+]Cc1ncccn1)c1ccccc1O ZINC000705437950 712131360 /nfs/dbraw/zinc/13/13/60/712131360.db2.gz CHSQOIGNZPIPKK-SNVBAGLBSA-N 1 1 229.283 2.033 20 10 BECDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H]3C[C@@H]32)c1O ZINC000707054670 712164337 /nfs/dbraw/zinc/16/43/37/712164337.db2.gz PAKNPALNKVDUFC-RNCFNFMXSA-N 1 1 249.285 2.328 20 10 BECDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H]3C[C@@H]32)c1O ZINC000707054670 712164338 /nfs/dbraw/zinc/16/43/38/712164338.db2.gz PAKNPALNKVDUFC-RNCFNFMXSA-N 1 1 249.285 2.328 20 10 BECDMO C[C@H]([NH2+]CCc1cn[nH]c1)c1ccc(F)cc1O ZINC000379591059 712389986 /nfs/dbraw/zinc/38/99/86/712389986.db2.gz WDIUQPASQOGHTH-VIFPVBQESA-N 1 1 249.289 2.148 20 10 BECDMO CCc1cccc(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c1O ZINC000718155565 712749708 /nfs/dbraw/zinc/74/97/08/712749708.db2.gz ORZHJVWMHMIBSI-OKILXGFUSA-N 1 1 247.338 2.033 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCO[C@@H](C)CC2)c1 ZINC000720483496 712846685 /nfs/dbraw/zinc/84/66/85/712846685.db2.gz OLBICXHWGZFZQW-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(C[N@H+]2CCO[C@@H](C)CC2)c1O ZINC000720485375 712846872 /nfs/dbraw/zinc/84/68/72/712846872.db2.gz UOLTUMFUISOZIF-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO CC[C@H]1CCC[N@H+]1Cc1ccc(O)cc1O ZINC001204275346 966950319 /nfs/dbraw/zinc/95/03/19/966950319.db2.gz OUSFQKYNESQLLF-NSHDSACASA-N 1 1 221.300 2.472 20 10 BECDMO C[C@@H]1CCC[N@@H+](Cc2ccc(O)cc2O)C1 ZINC001204273078 966953788 /nfs/dbraw/zinc/95/37/88/966953788.db2.gz WTPWZYBAUYHBSA-SNVBAGLBSA-N 1 1 221.300 2.330 20 10 BECDMO Oc1cccc(F)c1C[N@@H+]1CCC[C@@H]1CF ZINC001137841568 967966992 /nfs/dbraw/zinc/96/69/92/967966992.db2.gz JYTLOQLLQSLRGB-SECBINFHSA-N 1 1 227.254 2.465 20 10 BECDMO Oc1cccc(F)c1C[N@H+]1CCC[C@@H]1CF ZINC001137841568 967967019 /nfs/dbraw/zinc/96/70/19/967967019.db2.gz JYTLOQLLQSLRGB-SECBINFHSA-N 1 1 227.254 2.465 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@H]3OCC[C@H]32)c1 ZINC001140619964 1166328410 /nfs/dbraw/zinc/32/84/10/1166328410.db2.gz WQLJTYAHGDUCRR-TZMCWYRMSA-N 1 1 233.311 2.064 20 10 BECDMO C[C@H]1CSCC[N@@H+](Cc2ccc(N)cc2)C1 ZINC000379501763 1166739549 /nfs/dbraw/zinc/73/95/49/1166739549.db2.gz DTGZWCKHHNZSMN-LLVKDONJSA-N 1 1 236.384 2.454 20 10 BECDMO C[N@@H+](Cc1cc(O)c(O)c(O)c1)C(C)(C)C ZINC001233012836 978412303 /nfs/dbraw/zinc/41/23/03/978412303.db2.gz OFBNJFVRTBJTMX-UHFFFAOYSA-N 1 1 225.288 2.034 20 10 BECDMO CC[N@@H+](CCN(C)C)Cc1c(C)cccc1O ZINC001237482718 979910986 /nfs/dbraw/zinc/91/09/86/979910986.db2.gz OBEYQXAASUOBPL-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO CCN(CC[NH+](C)C)Cc1c(C)cccc1O ZINC001237482718 979910995 /nfs/dbraw/zinc/91/09/95/979910995.db2.gz OBEYQXAASUOBPL-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO COCC[N@H+](Cc1cccc(F)c1O)C(C)C ZINC000160254065 982545758 /nfs/dbraw/zinc/54/57/58/982545758.db2.gz LUHGEUQTENVGEF-UHFFFAOYSA-N 1 1 241.306 2.388 20 10 BECDMO COCC[N@@H+](Cc1cccc(F)c1O)C(C)C ZINC000160254065 982545767 /nfs/dbraw/zinc/54/57/67/982545767.db2.gz LUHGEUQTENVGEF-UHFFFAOYSA-N 1 1 241.306 2.388 20 10 BECDMO CCOCCC[N@H+](C)c1ccc(N)cc1 ZINC000083551692 1169166950 /nfs/dbraw/zinc/16/69/50/1169166950.db2.gz YKNXNBSFMCCBMD-UHFFFAOYSA-N 1 1 208.305 2.132 20 10 BECDMO CCOCCC[N@@H+](C)c1ccc(N)cc1 ZINC000083551692 1169166957 /nfs/dbraw/zinc/16/69/57/1169166957.db2.gz YKNXNBSFMCCBMD-UHFFFAOYSA-N 1 1 208.305 2.132 20 10 BECDMO CCCC[N@@H+](CC)Cc1c(O)cc(O)cc1O ZINC001144499852 972848554 /nfs/dbraw/zinc/84/85/54/972848554.db2.gz MESLWCJPVVMAOF-UHFFFAOYSA-N 1 1 239.315 2.425 20 10 BECDMO COC(C)(C)C[N@@H+](C)Cc1cc(F)ccc1O ZINC000404329345 971156961 /nfs/dbraw/zinc/15/69/61/971156961.db2.gz XINCHBAJJZYHMF-UHFFFAOYSA-N 1 1 241.306 2.388 20 10 BECDMO C[C@H]1CCC[N@H+](Cc2ccccc2[O-])[C@H]1CC[NH3+] ZINC000404434784 971163924 /nfs/dbraw/zinc/16/39/24/971163924.db2.gz QRCJAHREEWVPJT-JSGCOSHPSA-N 1 1 248.370 2.342 20 10 BECDMO C[C@H]1CCC[N@@H+](Cc2ccccc2[O-])[C@H]1CC[NH3+] ZINC000404434784 971163932 /nfs/dbraw/zinc/16/39/32/971163932.db2.gz QRCJAHREEWVPJT-JSGCOSHPSA-N 1 1 248.370 2.342 20 10 BECDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCCOCC1 ZINC001170831630 971950700 /nfs/dbraw/zinc/95/07/00/971950700.db2.gz QWVLOCLXRGMQPN-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2[C@H](C)CNC[C@@H]2C)c1O ZINC001209874897 957552483 /nfs/dbraw/zinc/55/24/83/957552483.db2.gz SZLLEXAVEGTIQW-BETUJISGSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1ccc(C)c(C[N@@H+]2[C@H](C)CNC[C@@H]2C)c1O ZINC001209874897 957552487 /nfs/dbraw/zinc/55/24/87/957552487.db2.gz SZLLEXAVEGTIQW-BETUJISGSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](C)[C@H](O)C2)c1O ZINC001140178459 957719361 /nfs/dbraw/zinc/71/93/61/957719361.db2.gz MCHFRLOBKQZAQL-BXUZGUMPSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000689850287 959306346 /nfs/dbraw/zinc/30/63/46/959306346.db2.gz RFMVKGLSZIUGNJ-LLVKDONJSA-N 1 1 209.264 2.244 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H]3OCC[C@H]3C2)c1 ZINC000724813726 959685695 /nfs/dbraw/zinc/68/56/95/959685695.db2.gz GZLHDVCLYGEUPI-WFASDCNBSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1c(O)ccc(C[N@H+]2CCC[C@H](F)C2)c1O ZINC001140746255 959792479 /nfs/dbraw/zinc/79/24/79/959792479.db2.gz XFOOSTBFRKUMHJ-NSHDSACASA-N 1 1 239.290 2.340 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c1O ZINC000690789006 959838580 /nfs/dbraw/zinc/83/85/80/959838580.db2.gz HIOCNSHJCLNYGJ-KBPBESRZSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](O)[C@@H](C)CC2)c1 ZINC001140617696 960460838 /nfs/dbraw/zinc/46/08/38/960460838.db2.gz YBKXZAIVSRCHDS-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@](C)(O)[C@@H](C)C2)c1 ZINC001140619370 960462690 /nfs/dbraw/zinc/46/26/90/960462690.db2.gz BVTRCICTEVFFHX-WFASDCNBSA-N 1 1 249.354 2.293 20 10 BECDMO CSCC[N@@H+](C)Cc1ccc(O)c(C)c1O ZINC001140749974 960552705 /nfs/dbraw/zinc/55/27/05/960552705.db2.gz QQKBRDBPCQUURQ-UHFFFAOYSA-N 1 1 241.356 2.201 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)c(O)c1 ZINC001140947698 960736777 /nfs/dbraw/zinc/73/67/77/960736777.db2.gz BAQPKSWFIIVBOM-NSHDSACASA-N 1 1 233.311 2.112 20 10 BECDMO Cc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C2)c(O)c1 ZINC001140947698 960736788 /nfs/dbraw/zinc/73/67/88/960736788.db2.gz BAQPKSWFIIVBOM-NSHDSACASA-N 1 1 233.311 2.112 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@@H]2CO)c(O)c1 ZINC001140948073 960742233 /nfs/dbraw/zinc/74/22/33/960742233.db2.gz RTKPHWCMESFYQO-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2CCCC[C@H]2CO)c(O)c1 ZINC001140948355 960743520 /nfs/dbraw/zinc/74/35/20/960743520.db2.gz GFPFPIQPGQGRAT-ZDUSSCGKSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[N@H+]2CCCC3(COC3)C2)c(O)c1 ZINC001140948105 960747634 /nfs/dbraw/zinc/74/76/34/960747634.db2.gz SXNOUBYCHQBPQY-UHFFFAOYSA-N 1 1 247.338 2.313 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H]3OCC[C@H]3C2)c(O)c1 ZINC001140957800 960754497 /nfs/dbraw/zinc/75/44/97/960754497.db2.gz OCDDOKXXQFIQBP-DZGCQCFKSA-N 1 1 247.338 2.311 20 10 BECDMO CC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(C)cc1O ZINC001140954658 960759112 /nfs/dbraw/zinc/75/91/12/960759112.db2.gz JRPMCBVKQWBNBS-ZDUSSCGKSA-N 1 1 233.311 2.254 20 10 BECDMO CC[N@H+](Cc1ncco1)Cc1ccccc1O ZINC001141011346 960818777 /nfs/dbraw/zinc/81/87/77/960818777.db2.gz YXZBTFSQSKUCTM-UHFFFAOYSA-N 1 1 232.283 2.402 20 10 BECDMO CC[N@@H+](Cc1ncco1)Cc1ccccc1O ZINC001141011346 960818791 /nfs/dbraw/zinc/81/87/91/960818791.db2.gz YXZBTFSQSKUCTM-UHFFFAOYSA-N 1 1 232.283 2.402 20 10 BECDMO C[C@@H]1CCCC[N@H+]1Cc1cc(O)ccc1O ZINC001141155592 960890063 /nfs/dbraw/zinc/89/00/63/960890063.db2.gz AEVBCASDNQCXNV-SNVBAGLBSA-N 1 1 221.300 2.472 20 10 BECDMO C[N@@H+](Cc1cc(O)ccc1O)C(C)(C)C ZINC001141158998 960894782 /nfs/dbraw/zinc/89/47/82/960894782.db2.gz VFDYZUSVKYBOKH-UHFFFAOYSA-N 1 1 209.289 2.328 20 10 BECDMO COc1ccc(C[N@@H+](C)CCSC)c(O)c1 ZINC000093509661 964160097 /nfs/dbraw/zinc/16/00/97/964160097.db2.gz AEGQIKMJASNZNL-UHFFFAOYSA-N 1 1 241.356 2.196 20 10 BECDMO COc1ccc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c(O)c1 ZINC000093661171 964175914 /nfs/dbraw/zinc/17/59/14/964175914.db2.gz TWLAYHIGGRRYCF-BETUJISGSA-N 1 1 247.338 2.489 20 10 BECDMO CCc1ccc(C[N@H+]2C[C@H](O)CC[C@H]2C)c(O)c1 ZINC001236784057 966534774 /nfs/dbraw/zinc/53/47/74/966534774.db2.gz RROHMQHVZIQSFL-BXUZGUMPSA-N 1 1 249.354 2.300 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccccc2O)CCCC1=O ZINC001203550058 966677411 /nfs/dbraw/zinc/67/74/11/966677411.db2.gz GFGLWDLWSBNSSJ-NSHDSACASA-N 1 1 233.311 2.193 20 10 BECDMO Oc1ccccc1C[N@H+]1CCCC2(COC2)C1 ZINC001203550190 966678523 /nfs/dbraw/zinc/67/85/23/966678523.db2.gz LBPUOMXMCOEDPN-UHFFFAOYSA-N 1 1 233.311 2.005 20 10 BECDMO C[C@H]1C[C@H]2C[N@@H+](Cc3ccccc3O)CC[C@H]2O1 ZINC001203551303 966681468 /nfs/dbraw/zinc/68/14/68/966681468.db2.gz BGQQJFDQWDCZID-CORIIIEPSA-N 1 1 247.338 2.392 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@]2(CCCO2)C1 ZINC001203550030 966682541 /nfs/dbraw/zinc/68/25/41/966682541.db2.gz FUBRDBXLUICSAR-CQSZACIVSA-N 1 1 233.311 2.147 20 10 BECDMO Cc1coc(C[N@@H+]2CCc3cccc(O)c3C2)n1 ZINC001237648333 966683088 /nfs/dbraw/zinc/68/30/88/966683088.db2.gz GGQZMPJXHAMLMC-UHFFFAOYSA-N 1 1 244.294 2.247 20 10 BECDMO Cc1coc(C[N@H+]2CCc3cccc(O)c3C2)n1 ZINC001237648333 966683099 /nfs/dbraw/zinc/68/30/99/966683099.db2.gz GGQZMPJXHAMLMC-UHFFFAOYSA-N 1 1 244.294 2.247 20 10 BECDMO CC(C)N1CC[N@@H+](Cc2ccccc2O)C[C@@H]1C ZINC001203562971 966688973 /nfs/dbraw/zinc/68/89/73/966688973.db2.gz RTBDZSRGQSTNKS-ZDUSSCGKSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)[N@@H+]1CCN(Cc2ccccc2O)C[C@@H]1C ZINC001203562971 966688990 /nfs/dbraw/zinc/68/89/90/966688990.db2.gz RTBDZSRGQSTNKS-ZDUSSCGKSA-N 1 1 248.370 2.307 20 10 BECDMO CC(C)[N@H+]1CCN(Cc2ccccc2O)C[C@@H]1C ZINC001203562971 966688998 /nfs/dbraw/zinc/68/89/98/966688998.db2.gz RTBDZSRGQSTNKS-ZDUSSCGKSA-N 1 1 248.370 2.307 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001203561332 966692744 /nfs/dbraw/zinc/69/27/44/966692744.db2.gz QPJASXWZRBVDBF-CMPLNLGQSA-N 1 1 203.285 2.377 20 10 BECDMO COc1ccc(C[N@H+]2CCC[C@@H]2CF)c(O)c1 ZINC001203635075 966713353 /nfs/dbraw/zinc/71/33/53/966713353.db2.gz JQUCYIMPNKCFIK-LLVKDONJSA-N 1 1 239.290 2.335 20 10 BECDMO CN(C)c1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)cc1 ZINC001203936835 966825278 /nfs/dbraw/zinc/82/52/78/966825278.db2.gz OZKZCGZSESHCGQ-HUUCEWRRSA-N 1 1 246.354 2.116 20 10 BECDMO CN(C)c1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)cc1 ZINC001203936835 966825287 /nfs/dbraw/zinc/82/52/87/966825287.db2.gz OZKZCGZSESHCGQ-HUUCEWRRSA-N 1 1 246.354 2.116 20 10 BECDMO 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C[C@H]1CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001203931063 982903421 /nfs/dbraw/zinc/90/34/21/982903421.db2.gz MOKXFCMKPACVOL-NSHDSACASA-N 1 1 204.317 2.347 20 10 BECDMO Cn1ccc2c1cc[nH+]c2-c1cncc(N)c1 ZINC001242498034 983816212 /nfs/dbraw/zinc/81/62/12/983816212.db2.gz AKOMLVYNMWYEGZ-UHFFFAOYSA-N 1 1 224.267 2.218 20 10 BECDMO CO[C@H]1CC[C@@H](C)[N@@H+](Cc2ccccc2O)C1 ZINC000687213448 985270755 /nfs/dbraw/zinc/27/07/55/985270755.db2.gz WABOOYGSNSVHGW-YPMHNXCESA-N 1 1 235.327 2.392 20 10 BECDMO CCc1cccc(C[N@@H+](C)C[C@@H](C)OC)c1O ZINC000692108854 985413805 /nfs/dbraw/zinc/41/38/05/985413805.db2.gz LHKAVFDDTOJNHJ-LLVKDONJSA-N 1 1 237.343 2.421 20 10 BECDMO CC(C)(C)[C@H](O)C[N@H+]1CCc2cccc(O)c2C1 ZINC001253729845 986342250 /nfs/dbraw/zinc/34/22/50/986342250.db2.gz LGHYASPQTSPEQP-CQSZACIVSA-N 1 1 249.354 2.157 20 10 BECDMO Oc1cc(F)c(F)cc1C[NH2+][C@@H]1CCSC1 ZINC001474493196 987737066 /nfs/dbraw/zinc/73/70/66/987737066.db2.gz JEOOIKZSRXFEMU-MRVPVSSYSA-N 1 1 245.294 2.266 20 10 BECDMO C[NH2+][C@@H](C)CCNCc1ccc(OC)c(C)c1 ZINC001326075234 989364939 /nfs/dbraw/zinc/36/49/39/989364939.db2.gz KBPLASVRFXFNFC-LBPRGKRZSA-N 1 1 236.359 2.091 20 10 BECDMO CCNCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001326473836 989574024 /nfs/dbraw/zinc/57/40/24/989574024.db2.gz OWPUZVNDLVYHRH-RYUDHWBXSA-N 1 1 248.370 2.448 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccc(N)cc2)C2(CCC2)CO1 ZINC001120269638 989624027 /nfs/dbraw/zinc/62/40/27/989624027.db2.gz WVLFOWDSWTXSJY-LBPRGKRZSA-N 1 1 246.354 2.412 20 10 BECDMO CC(=O)C[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC001139669804 990799380 /nfs/dbraw/zinc/79/93/80/990799380.db2.gz ORQXEKPAUQSPPU-UHFFFAOYSA-N 1 1 234.343 2.082 20 10 BECDMO CC(=O)C[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC001139669804 990799389 /nfs/dbraw/zinc/79/93/89/990799389.db2.gz ORQXEKPAUQSPPU-UHFFFAOYSA-N 1 1 234.343 2.082 20 10 BECDMO C[N@H+](Cc1c(O)cccc1F)C1CCOCC1 ZINC001137831683 990853895 /nfs/dbraw/zinc/85/38/95/990853895.db2.gz JYMICDIVVIMGEH-UHFFFAOYSA-N 1 1 239.290 2.142 20 10 BECDMO C[N@@H+](Cc1c(O)cccc1F)C1CCOCC1 ZINC001137831683 990853897 /nfs/dbraw/zinc/85/38/97/990853897.db2.gz JYMICDIVVIMGEH-UHFFFAOYSA-N 1 1 239.290 2.142 20 10 BECDMO Oc1cccc(F)c1C[NH+]1CCC(F)CC1 ZINC001137832053 990855262 /nfs/dbraw/zinc/85/52/62/990855262.db2.gz YUJSJYJNZMLAGY-UHFFFAOYSA-N 1 1 227.254 2.465 20 10 BECDMO C[C@H]1CC(=O)CCN1Cc1cccc(F)c1[O-] ZINC001138123891 990885990 /nfs/dbraw/zinc/88/59/90/990885990.db2.gz QBAXIEDZWHPKQZ-VIFPVBQESA-N 1 1 237.274 2.085 20 10 BECDMO Cc1cc[nH+]c(NCc2ccc(O)c(O)c2)c1 ZINC000083357309 991208601 /nfs/dbraw/zinc/20/86/01/991208601.db2.gz ALGBVNKTXUKXKH-UHFFFAOYSA-N 1 1 230.267 2.413 20 10 BECDMO Cc1cc(C[N@@H+](C)CC2COC2)ccc1N(C)C ZINC001139673015 991312560 /nfs/dbraw/zinc/31/25/60/991312560.db2.gz OGRLYQVPFXUNLY-UHFFFAOYSA-N 1 1 248.370 2.139 20 10 BECDMO Cc1cc(C[N@@H+](C)C2(C)COC2)ccc1N(C)C ZINC001139672874 991314563 /nfs/dbraw/zinc/31/45/63/991314563.db2.gz KZJWKODYUZAKEU-UHFFFAOYSA-N 1 1 248.370 2.282 20 10 BECDMO Cc1ccc(C)c(C[N@@H+]2CCOC[C@H](C)C2)c1O ZINC001140178244 991548927 /nfs/dbraw/zinc/54/89/27/991548927.db2.gz FDYHBCDFLHOCMP-LLVKDONJSA-N 1 1 249.354 2.477 20 10 BECDMO Cc1ccc(C)c(C[N@H+](C)C2(C)COC2)c1O ZINC001140181565 991549157 /nfs/dbraw/zinc/54/91/57/991549157.db2.gz DGEMKHAKNOHAFH-UHFFFAOYSA-N 1 1 235.327 2.230 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CC[C@@H](O)[C@@H](C)C2)c1O ZINC001140178748 991550774 /nfs/dbraw/zinc/55/07/74/991550774.db2.gz WNVPYTMXXWNGCW-GXTWGEPZSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1ccc(C)c(C[N@@H+]2CC[C@H](N(C)C)C2)c1O ZINC001140181059 991551794 /nfs/dbraw/zinc/55/17/94/991551794.db2.gz UZYWZMOQWHOFDV-ZDUSSCGKSA-N 1 1 248.370 2.145 20 10 BECDMO Cc1ccc(C)c(CN2CC[C@H]([NH+](C)C)C2)c1O ZINC001140181059 991551803 /nfs/dbraw/zinc/55/18/03/991551803.db2.gz UZYWZMOQWHOFDV-ZDUSSCGKSA-N 1 1 248.370 2.145 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCC[C@](C)(O)C2)c1O ZINC001140181548 991552269 /nfs/dbraw/zinc/55/22/69/991552269.db2.gz CZNAUWFWSZWYPU-HNNXBMFYSA-N 1 1 249.354 2.356 20 10 BECDMO Cc1ccc(C)c(C[N@H+](C)CC2(C)COC2)c1O ZINC001140182378 991558382 /nfs/dbraw/zinc/55/83/82/991558382.db2.gz RGRLOYHWGOLYMA-UHFFFAOYSA-N 1 1 249.354 2.477 20 10 BECDMO Cc1ccc(C)c(C[NH+]2CC(C)(N(C)C)C2)c1O ZINC001140182316 991558753 /nfs/dbraw/zinc/55/87/53/991558753.db2.gz ORLFLSQMEVSBMV-UHFFFAOYSA-N 1 1 248.370 2.145 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CC[C@@]23CCOC3)c1O ZINC001140184703 991559240 /nfs/dbraw/zinc/55/92/40/991559240.db2.gz FJHYHPRAIVZIIB-HNNXBMFYSA-N 1 1 247.338 2.374 20 10 BECDMO C[NH2+][C@@H](C)CCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC001261424292 992292556 /nfs/dbraw/zinc/29/25/56/992292556.db2.gz QMDSUMTZCGOFCI-STQMWFEESA-N 1 1 249.402 2.401 20 10 BECDMO CNCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001261423623 992298492 /nfs/dbraw/zinc/29/84/92/992298492.db2.gz ANCZGBTVCGCZLO-WDEREUQCSA-N 1 1 234.343 2.058 20 10 BECDMO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@H](O)[C@H]2C)c1 ZINC001262055390 992640044 /nfs/dbraw/zinc/64/00/44/992640044.db2.gz JATKRMJLDDWQRM-TZMCWYRMSA-N 1 1 249.354 2.354 20 10 BECDMO Nc1ccc(CN[C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001262487887 992892096 /nfs/dbraw/zinc/89/20/96/992892096.db2.gz JCWMUUWQXOIOQI-CQSZACIVSA-N 1 1 245.370 2.033 20 10 BECDMO Nc1ccc(CNCC2([NH3+])CCCCC2)cc1 ZINC001262487691 992892652 /nfs/dbraw/zinc/89/26/52/992892652.db2.gz ASSPYWXCQJPMKO-UHFFFAOYSA-N 1 1 233.359 2.020 20 10 BECDMO CC(C)[N@H+]1CC[C@@H](N(C)Cc2ccc(N)cc2)C1 ZINC001575697090 993094522 /nfs/dbraw/zinc/09/45/22/993094522.db2.gz PBUSYPPZSVBGLN-OAHLLOKOSA-N 1 1 247.386 2.183 20 10 BECDMO CC(C)N1CC[C@@H]([N@H+](C)Cc2ccc(N)cc2)C1 ZINC001575697090 993094527 /nfs/dbraw/zinc/09/45/27/993094527.db2.gz PBUSYPPZSVBGLN-OAHLLOKOSA-N 1 1 247.386 2.183 20 10 BECDMO CC(C)N1CC[C@@H]([N@@H+](C)Cc2ccc(N)cc2)C1 ZINC001575697090 993094533 /nfs/dbraw/zinc/09/45/33/993094533.db2.gz PBUSYPPZSVBGLN-OAHLLOKOSA-N 1 1 247.386 2.183 20 10 BECDMO CC(C)c1ccc(O)c(C[NH2+][C@@H](C)[C@H](C)N)c1 ZINC001575858986 993114602 /nfs/dbraw/zinc/11/46/02/993114602.db2.gz VVIUTNMMBOPKMO-QWRGUYRKSA-N 1 1 236.359 2.341 20 10 BECDMO CC(C)c1ccc(O)c(CN[C@@H](C)[C@H](C)[NH3+])c1 ZINC001575858986 993114610 /nfs/dbraw/zinc/11/46/10/993114610.db2.gz VVIUTNMMBOPKMO-QWRGUYRKSA-N 1 1 236.359 2.341 20 10 BECDMO CCCC[N@H+](C)CCNCc1ccc(N)cc1 ZINC001577445372 993662238 /nfs/dbraw/zinc/66/22/38/993662238.db2.gz OYELCGWPHULTSO-UHFFFAOYSA-N 1 1 235.375 2.090 20 10 BECDMO CCCC[N@@H+](C)CCNCc1ccc(N)cc1 ZINC001577445372 993662252 /nfs/dbraw/zinc/66/22/52/993662252.db2.gz OYELCGWPHULTSO-UHFFFAOYSA-N 1 1 235.375 2.090 20 10 BECDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)[C@@H](C)O ZINC001615686623 1170530315 /nfs/dbraw/zinc/53/03/15/1170530315.db2.gz RSROWVGUFAHEBF-VXGBXAGGSA-N 1 1 237.343 2.374 20 10 BECDMO CC[N@H+](Cc1ccc(N)cc1)C[C@@H]1CCOC1 ZINC000041079468 1171166671 /nfs/dbraw/zinc/16/66/71/1171166671.db2.gz XFHGNDXYZGRYRC-ZDUSSCGKSA-N 1 1 234.343 2.127 20 10 BECDMO CCn1cc(C[N@@H+](C)Cc2ccc(N)cc2)cn1 ZINC000050540160 1171814435 /nfs/dbraw/zinc/81/44/35/1171814435.db2.gz NAJAYDXCEORNHL-UHFFFAOYSA-N 1 1 244.342 2.117 20 10 BECDMO C[N@H+](Cc1ccc(N)cc1)CC1CCOCC1 ZINC000052173199 1171949175 /nfs/dbraw/zinc/94/91/75/1171949175.db2.gz FALPREIIGRUNCU-UHFFFAOYSA-N 1 1 234.343 2.127 20 10 BECDMO C[N@H+](Cc1ccccc1O)CC1=CCCOC1 ZINC000091974599 398304333 /nfs/dbraw/zinc/30/43/33/398304333.db2.gz VBIBCFMZPXMISH-UHFFFAOYSA-N 1 1 233.311 2.171 20 10 BECDMO [O-]c1c(F)cccc1C[N@H+]1CCCSCC1 ZINC000273444481 187336688 /nfs/dbraw/zinc/33/66/88/187336688.db2.gz XDLQXJOZCCLLTI-UHFFFAOYSA-N 1 1 241.331 2.470 20 10 BECDMO Oc1c(F)cccc1C[N@@H+]1CCCSCC1 ZINC000273444481 187336689 /nfs/dbraw/zinc/33/66/89/187336689.db2.gz XDLQXJOZCCLLTI-UHFFFAOYSA-N 1 1 241.331 2.470 20 10 BECDMO Oc1c(F)cccc1C[N@H+]1CCCSCC1 ZINC000273444481 187336691 /nfs/dbraw/zinc/33/66/91/187336691.db2.gz XDLQXJOZCCLLTI-UHFFFAOYSA-N 1 1 241.331 2.470 20 10 BECDMO CC(C)C[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000065943617 343836147 /nfs/dbraw/zinc/83/61/47/343836147.db2.gz QVTIQWBUSVOQIR-UHFFFAOYSA-N 1 1 237.299 2.209 20 10 BECDMO CC1(C)C[C@@H]1[NH2+]Cc1cccc(F)c1O ZINC000165159260 187357840 /nfs/dbraw/zinc/35/78/40/187357840.db2.gz PJMPJIPGJSOQTG-JTQLQIEISA-N 1 1 209.264 2.419 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)c1 ZINC000093483085 345674013 /nfs/dbraw/zinc/67/40/13/345674013.db2.gz VOZIKSISFUZGII-TZMCWYRMSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cccc(C[N@H+](C)[C@H]2CC[C@H](O)CC2)c1O ZINC000275905777 179068288 /nfs/dbraw/zinc/06/82/88/179068288.db2.gz DQRFDNPDLIXIFT-HDJSIYSDSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@H](O)C(C)(C)C2)c1O ZINC000276064257 179080255 /nfs/dbraw/zinc/08/02/55/179080255.db2.gz VLYRWSOOUGILOB-CYBMUJFWSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@@](C)(O)C2)c1O ZINC000180377112 179075511 /nfs/dbraw/zinc/07/55/11/179075511.db2.gz OQVLPMIPENTOQS-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1cc(C[NH2+]Cc2cc(C)ccc2O)no1 ZINC000071408657 188305876 /nfs/dbraw/zinc/30/58/76/188305876.db2.gz ZORABGRFAJQNRD-UHFFFAOYSA-N 1 1 232.283 2.287 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CCOC[C@H]2C)cc1C ZINC000033824100 368263278 /nfs/dbraw/zinc/26/32/78/368263278.db2.gz HNOSYZMYQPLVFT-GFCCVEGCSA-N 1 1 235.327 2.230 20 10 BECDMO Oc1ccccc1C[N@@H+](C[C@H]1CCOC1)C1CC1 ZINC000179556765 183301779 /nfs/dbraw/zinc/30/17/79/183301779.db2.gz ZYGFIGITLLNMLF-GFCCVEGCSA-N 1 1 247.338 2.393 20 10 BECDMO Oc1ccccc1C[NH+]1CCN(C2CCC2)CC1 ZINC000272226297 183302253 /nfs/dbraw/zinc/30/22/53/183302253.db2.gz CXGLEFKXYIKGKM-UHFFFAOYSA-N 1 1 246.354 2.062 20 10 BECDMO Oc1ccccc1C[N@H+]1CCN2CCCC[C@H]2C1 ZINC000245861354 183302687 /nfs/dbraw/zinc/30/26/87/183302687.db2.gz FLKNTPGSRCKZEA-AWEZNQCLSA-N 1 1 246.354 2.062 20 10 BECDMO Oc1ccccc1CN1CC[N@@H+]2CCCC[C@H]2C1 ZINC000245861354 183302689 /nfs/dbraw/zinc/30/26/89/183302689.db2.gz FLKNTPGSRCKZEA-AWEZNQCLSA-N 1 1 246.354 2.062 20 10 BECDMO Oc1ccccc1CN1CC[N@H+]2CCCC[C@H]2C1 ZINC000245861354 183302692 /nfs/dbraw/zinc/30/26/92/183302692.db2.gz FLKNTPGSRCKZEA-AWEZNQCLSA-N 1 1 246.354 2.062 20 10 BECDMO C[N@@H+](Cc1cncs1)Cc1ccccc1O ZINC000091956577 384157676 /nfs/dbraw/zinc/15/76/76/384157676.db2.gz WUYHAUJVMQKPHS-UHFFFAOYSA-N 1 1 234.324 2.481 20 10 BECDMO Cc1ccc(O)c(C[NH2+][C@H](C)CCN(C)C)c1 ZINC000071408489 384166989 /nfs/dbraw/zinc/16/69/89/384166989.db2.gz FXUUKEDRVXXHPN-GFCCVEGCSA-N 1 1 236.359 2.130 20 10 BECDMO CC[N@@H+](CCOC)Cc1cc(C)ccc1O ZINC000132694801 384244261 /nfs/dbraw/zinc/24/42/61/384244261.db2.gz JRJBKAPLFVZOAG-UHFFFAOYSA-N 1 1 223.316 2.169 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCOC[C@H]2C2CC2)c1 ZINC000093645756 384253080 /nfs/dbraw/zinc/25/30/80/384253080.db2.gz RPFOOMUXWWUGTG-AWEZNQCLSA-N 1 1 247.338 2.311 20 10 BECDMO C[C@@H](CCN(C)C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297598554 384307811 /nfs/dbraw/zinc/30/78/11/384307811.db2.gz HXJBMZKTLNPFDQ-WCQYABFASA-N 1 1 248.370 2.309 20 10 BECDMO C[N@@H+](Cc1cc2c(cc1O)OCO2)C1CCC1 ZINC000172963878 384641386 /nfs/dbraw/zinc/64/13/86/384641386.db2.gz FVRPGSQQRGKFHP-UHFFFAOYSA-N 1 1 235.283 2.105 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000126928925 384845388 /nfs/dbraw/zinc/84/53/88/384845388.db2.gz VBLVBNZSPSJVAL-TXEJJXNPSA-N 1 1 235.327 2.310 20 10 BECDMO C[C@@H]([NH2+]C[C@@H]1CCCO1)c1ccc(F)cc1O ZINC000062744939 385183329 /nfs/dbraw/zinc/18/33/29/385183329.db2.gz CTJSTKHOGADAFO-KOLCDFICSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)N(C)C ZINC000062747898 385187015 /nfs/dbraw/zinc/18/70/15/385187015.db2.gz OPAHZPAKNZIYIE-ZJUUUORDSA-N 1 1 240.322 2.132 20 10 BECDMO CCN(C)CC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062748478 385187190 /nfs/dbraw/zinc/18/71/90/385187190.db2.gz LDCFJWHGECCVMI-SNVBAGLBSA-N 1 1 240.322 2.134 20 10 BECDMO COC[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062748387 385187858 /nfs/dbraw/zinc/18/78/58/385187858.db2.gz MTGLSTATKQTIDV-UWVGGRQHSA-N 1 1 241.306 2.464 20 10 BECDMO C[C@@H]([NH2+]C[C@H]1CCOC1)c1ccc(F)cc1O ZINC000062747675 385188568 /nfs/dbraw/zinc/18/85/68/385188568.db2.gz URZNJPFJDJVXTC-NXEZZACHSA-N 1 1 239.290 2.218 20 10 BECDMO CO[C@H](C)CC[NH2+]Cc1cccc(F)c1O ZINC000272531034 385235701 /nfs/dbraw/zinc/23/57/01/385235701.db2.gz ZOHIHDOQTGKCDV-SECBINFHSA-N 1 1 227.279 2.046 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCO[C@@H](C3CC3)C2)c1 ZINC000368411169 385318025 /nfs/dbraw/zinc/31/80/25/385318025.db2.gz NBJNQJBPVNXGCL-OAHLLOKOSA-N 1 1 247.338 2.311 20 10 BECDMO CCOc1ccc(O)c(C[N@@H+](C)C2CC2)c1 ZINC000153791338 385282181 /nfs/dbraw/zinc/28/21/81/385282181.db2.gz GORSHKZTUXFJRV-UHFFFAOYSA-N 1 1 221.300 2.385 20 10 BECDMO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1cc(F)ccc1O ZINC000180158690 385385216 /nfs/dbraw/zinc/38/52/16/385385216.db2.gz GQFYFYAWQJJAET-ZJUUUORDSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1cc(F)ccc1O ZINC000180158690 385385220 /nfs/dbraw/zinc/38/52/20/385385220.db2.gz GQFYFYAWQJJAET-ZJUUUORDSA-N 1 1 239.290 2.141 20 10 BECDMO CC[C@H](CO)[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000285837262 385968063 /nfs/dbraw/zinc/96/80/63/385968063.db2.gz XETGJVAHULYNJV-PWSUYJOCSA-N 1 1 241.306 2.343 20 10 BECDMO CC[C@H](CO)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000295209183 386692725 /nfs/dbraw/zinc/69/27/25/386692725.db2.gz ZUKDENBNNMUVEL-CYBMUJFWSA-N 1 1 237.343 2.212 20 10 BECDMO COC[C@H]1CC[N@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC000293473918 386822969 /nfs/dbraw/zinc/82/29/69/386822969.db2.gz FDTCEYCBEASIPQ-CQSZACIVSA-N 1 1 248.370 2.282 20 10 BECDMO CC1(C)C[C@H]1[NH2+]Cc1cccc(F)c1O ZINC000165159350 386838720 /nfs/dbraw/zinc/83/87/20/386838720.db2.gz PJMPJIPGJSOQTG-SNVBAGLBSA-N 1 1 209.264 2.419 20 10 BECDMO CC(C)[C@H](O)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168775397 387801387 /nfs/dbraw/zinc/80/13/87/387801387.db2.gz CJIZHXASSOJQQW-NOZJJQNGSA-N 1 1 241.306 2.199 20 10 BECDMO CC[C@@]1(CO)CCC[N@@H+](Cc2ccccc2O)C1 ZINC000190212060 171210999 /nfs/dbraw/zinc/21/09/99/171210999.db2.gz GNBDFWBUMLCYJS-OAHLLOKOSA-N 1 1 249.354 2.377 20 10 BECDMO COCC[N@H+](Cc1ccccc1O)CC(C)C ZINC000132642954 174299385 /nfs/dbraw/zinc/29/93/85/174299385.db2.gz WXJXUAPIAYZUGD-UHFFFAOYSA-N 1 1 237.343 2.497 20 10 BECDMO COc1ccc(CNCC[NH+]2CCCC2)cc1C ZINC000035052694 175106582 /nfs/dbraw/zinc/10/65/82/175106582.db2.gz BFSHULINXIZIGK-UHFFFAOYSA-N 1 1 248.370 2.189 20 10 BECDMO COc1ccc(O)c(C[N@@H+](C)CC(C)C)c1 ZINC000132527553 175156981 /nfs/dbraw/zinc/15/69/81/175156981.db2.gz GDZVLILZJUGDDC-UHFFFAOYSA-N 1 1 223.316 2.489 20 10 BECDMO COc1ccc(O)c(C[N@H+]2C[C@H](C)[C@H](C)C2)c1 ZINC000211605078 175157239 /nfs/dbraw/zinc/15/72/39/175157239.db2.gz VPCKCIGYYXIMHN-PHIMTYICSA-N 1 1 235.327 2.489 20 10 BECDMO C[C@@H](c1cnccn1)[N@@H+](C)Cc1ccccc1O ZINC000184654850 176035562 /nfs/dbraw/zinc/03/55/62/176035562.db2.gz SGVQILPCPATLCR-NSHDSACASA-N 1 1 243.310 2.375 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)CCCO1 ZINC000180064037 176301120 /nfs/dbraw/zinc/30/11/20/176301120.db2.gz UNDXYICXCHROEC-SNVBAGLBSA-N 1 1 239.290 2.142 20 10 BECDMO C[C@@H]1C[N@H+](Cc2cccc(F)c2O)CCS1 ZINC000272320900 176306218 /nfs/dbraw/zinc/30/62/18/176306218.db2.gz UJWVMOULGCIIDP-SECBINFHSA-N 1 1 241.331 2.469 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cccc(F)c2O)CCS1 ZINC000272320900 176306219 /nfs/dbraw/zinc/30/62/19/176306219.db2.gz UJWVMOULGCIIDP-SECBINFHSA-N 1 1 241.331 2.469 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccccc2O)C[C@H]1C ZINC000132752577 176306918 /nfs/dbraw/zinc/30/69/18/176306918.db2.gz ZLYRARXNDQHOJF-PHIMTYICSA-N 1 1 205.301 2.480 20 10 BECDMO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cc(F)ccc1O ZINC000179938620 177260306 /nfs/dbraw/zinc/26/03/06/177260306.db2.gz SVKCQKLDCKVIQI-ZJUUUORDSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cc(F)ccc1O ZINC000179938620 177260308 /nfs/dbraw/zinc/26/03/08/177260308.db2.gz SVKCQKLDCKVIQI-ZJUUUORDSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@H]1CSCC[N@H+]1Cc1cc(F)ccc1O ZINC000180154558 177305364 /nfs/dbraw/zinc/30/53/64/177305364.db2.gz KIGIMRSJJKINNU-VIFPVBQESA-N 1 1 241.331 2.469 20 10 BECDMO Cc1ccc(O)c(C[NH2+]C(CF)CF)c1 ZINC000824555024 587276046 /nfs/dbraw/zinc/27/60/46/587276046.db2.gz PDTIUMAKGRXJTQ-UHFFFAOYSA-N 1 1 215.243 2.098 20 10 BECDMO CCO[C@@]1(C)C[C@H]1[NH2+]Cc1cccc(F)c1O ZINC000529650848 324372508 /nfs/dbraw/zinc/37/25/08/324372508.db2.gz HVYGJZLSWXLDGZ-YPMHNXCESA-N 1 1 239.290 2.188 20 10 BECDMO CNC[C@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000854232442 588781273 /nfs/dbraw/zinc/78/12/73/588781273.db2.gz PVGQMFBFBNCZRD-CMPLNLGQSA-N 1 1 236.359 2.268 20 10 BECDMO CNC[C@H](C)[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000854233136 588781302 /nfs/dbraw/zinc/78/13/02/588781302.db2.gz YCKQDCJQKOQWDE-NWDGAFQWSA-N 1 1 236.359 2.268 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCN(C)[C@@H](C)[C@@H]2C)c1 ZINC000775985519 583108475 /nfs/dbraw/zinc/10/84/75/583108475.db2.gz MBVSYYONAHWEBO-STQMWFEESA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](CO)[C@@H]2C)c1 ZINC000840979789 583214881 /nfs/dbraw/zinc/21/48/81/583214881.db2.gz URXWDUIMWHCAOK-QWHCGFSZSA-N 1 1 249.354 2.293 20 10 BECDMO CC[C@@]1(O)CC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000877440490 583314453 /nfs/dbraw/zinc/31/44/53/583314453.db2.gz ABUYPBIJPXSUBZ-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c(O)c1 ZINC000877615555 583340111 /nfs/dbraw/zinc/34/01/11/583340111.db2.gz SSKNMLFLUNNWMU-PHIMTYICSA-N 1 1 239.265 2.398 20 10 BECDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1c[nH]cn1 ZINC000894257103 583395285 /nfs/dbraw/zinc/39/52/85/583395285.db2.gz YZVMIPJSLUFFNP-UHFFFAOYSA-N 1 1 244.342 2.074 20 10 BECDMO COc1cc(C)cc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1O ZINC000895387302 583663287 /nfs/dbraw/zinc/66/32/87/583663287.db2.gz ACOFOILYVRHWPL-PHIMTYICSA-N 1 1 233.311 2.161 20 10 BECDMO CC1(C)CC[C@H](CO)[N@@H+](Cc2ccccc2O)C1 ZINC000895925629 583747692 /nfs/dbraw/zinc/74/76/92/583747692.db2.gz HAJDPRHRWCAEPQ-CYBMUJFWSA-N 1 1 249.354 2.375 20 10 BECDMO CC(C)OC1C[NH+](Cc2ccc(N(C)C)cc2)C1 ZINC000895951353 583751729 /nfs/dbraw/zinc/75/17/29/583751729.db2.gz DTDPUJRVPIRHAA-UHFFFAOYSA-N 1 1 248.370 2.362 20 10 BECDMO Cc1ccc(C[N@H+]2CCO[C@H](C)CC2)c(O)c1 ZINC000896579056 583814294 /nfs/dbraw/zinc/81/42/94/583814294.db2.gz MQBHDLFPCPZEKF-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO CN1CC[C@@H]([NH2+]Cc2ccccc2O)CC1(C)C ZINC000858120837 588933928 /nfs/dbraw/zinc/93/39/28/588933928.db2.gz NRAVGWLUTDOJSZ-CYBMUJFWSA-N 1 1 248.370 2.355 20 10 BECDMO CN1CC[C@H]([NH2+]Cc2ccccc2O)CC1(C)C ZINC000858120838 588934098 /nfs/dbraw/zinc/93/40/98/588934098.db2.gz NRAVGWLUTDOJSZ-ZDUSSCGKSA-N 1 1 248.370 2.355 20 10 BECDMO C[C@@H]([NH2+]Cc1c(O)cccc1F)[C@@H]1CCCO1 ZINC000896636383 583819016 /nfs/dbraw/zinc/81/90/16/583819016.db2.gz CENNIJMYZIHHAW-RNCFNFMXSA-N 1 1 239.290 2.188 20 10 BECDMO C[C@H]1COCC[C@H]1[NH2+]Cc1c(O)cccc1F ZINC000896636375 583819428 /nfs/dbraw/zinc/81/94/28/583819428.db2.gz CCCVCQUKEHKJFA-JOYOIKCWSA-N 1 1 239.290 2.046 20 10 BECDMO Oc1cccc(F)c1C[NH2+]C[C@@H]1CCC=CO1 ZINC000896637548 583819695 /nfs/dbraw/zinc/81/96/95/583819695.db2.gz OVDOJASUEFJGRD-JTQLQIEISA-N 1 1 237.274 2.314 20 10 BECDMO CO[C@@H](C[NH2+]Cc1c(O)cccc1F)C1CC1 ZINC000896638047 583820044 /nfs/dbraw/zinc/82/00/44/583820044.db2.gz NZDNWVGYKZCFTF-ZDUSSCGKSA-N 1 1 239.290 2.046 20 10 BECDMO C[C@@H]1OCC[C@H]1C[N@H+](C)c1ccc(N)cc1 ZINC000866667919 584121535 /nfs/dbraw/zinc/12/15/35/584121535.db2.gz BPSWTJWFBVRCKX-QWRGUYRKSA-N 1 1 220.316 2.130 20 10 BECDMO C[C@@H]1OCC[C@H]1C[N@@H+](C)c1ccc(N)cc1 ZINC000866667919 584121537 /nfs/dbraw/zinc/12/15/37/584121537.db2.gz BPSWTJWFBVRCKX-QWRGUYRKSA-N 1 1 220.316 2.130 20 10 BECDMO C/C=C/C[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O ZINC000858537758 588963913 /nfs/dbraw/zinc/96/39/13/588963913.db2.gz PRFDRGWQEFITBO-ORAHPGNNSA-N 1 1 249.310 2.406 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+]CC2(N)CC2)c(O)c1 ZINC000902406140 584573773 /nfs/dbraw/zinc/57/37/73/584573773.db2.gz LWPJYFCOFFTMGZ-NSHDSACASA-N 1 1 234.343 2.151 20 10 BECDMO OC[C@@H]1CC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000902628755 584646428 /nfs/dbraw/zinc/64/64/28/584646428.db2.gz DMWJLOJRKHASMP-LBPRGKRZSA-N 1 1 243.306 2.112 20 10 BECDMO C[C@H]([NH2+][C@@H]1COC[C@H]1C)c1c(O)cccc1F ZINC000903393066 584756013 /nfs/dbraw/zinc/75/60/13/584756013.db2.gz FLAJGTCENUTOLJ-WCABBAIRSA-N 1 1 239.290 2.217 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]CC2(N)CCC2)c1 ZINC000817964620 584992805 /nfs/dbraw/zinc/99/28/05/584992805.db2.gz FZODSRQWYMLXAI-NSHDSACASA-N 1 1 234.343 2.233 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)[C@@H](C)N)c(O)c1 ZINC000817977376 584994172 /nfs/dbraw/zinc/99/41/72/584994172.db2.gz JATZFBXBSZEMHT-WOPDTQHZSA-N 1 1 236.359 2.395 20 10 BECDMO CC[C@H](N)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000817981143 584994442 /nfs/dbraw/zinc/99/44/42/584994442.db2.gz ZLPKZHHUUQCRDR-QWRGUYRKSA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@@H]([NH2+]C[C@@H](N)CC)c1ccc(C)cc1O ZINC000817980067 584994578 /nfs/dbraw/zinc/99/45/78/584994578.db2.gz RACLEPHSZDDBHW-WCQYABFASA-N 1 1 236.359 2.479 20 10 BECDMO CCOC1(C)C[NH+](Cc2ccc(N(C)C)cc2)C1 ZINC000839143215 585094782 /nfs/dbraw/zinc/09/47/82/585094782.db2.gz OASYLRLZYAACRE-UHFFFAOYSA-N 1 1 248.370 2.363 20 10 BECDMO CC(C)[C@@H](CO)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886536935 585150021 /nfs/dbraw/zinc/15/00/21/585150021.db2.gz QQJMCUZPADLJPL-MWLCHTKSSA-N 1 1 241.306 2.199 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1C ZINC000769389223 585555248 /nfs/dbraw/zinc/55/52/48/585555248.db2.gz MCQNZZYBRWWKJE-JTQLQIEISA-N 1 1 221.300 2.385 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H]2CO)cc1 ZINC000773749341 585643135 /nfs/dbraw/zinc/64/31/35/585643135.db2.gz TUBOEBPYTCJRBF-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2C[C@@H](O)C[C@@H]2C)cc1 ZINC000773815934 585644341 /nfs/dbraw/zinc/64/43/41/585644341.db2.gz KEAOCGUKYMLDJG-WFASDCNBSA-N 1 1 248.370 2.098 20 10 BECDMO Cc1cccc(C[N@H+]2CCN(C)[C@@H](C)[C@@H]2C)c1O ZINC000775985818 585688692 /nfs/dbraw/zinc/68/86/92/585688692.db2.gz OLOBGHLCSWHDES-STQMWFEESA-N 1 1 248.370 2.225 20 10 BECDMO CCN1C[C@@H](C)[N@@H+](Cc2ccccc2O)C[C@@H]1C ZINC000779017780 585743980 /nfs/dbraw/zinc/74/39/80/585743980.db2.gz BPIOVKMFFPRZPP-QWHCGFSZSA-N 1 1 248.370 2.307 20 10 BECDMO CC[N@@H+]1C[C@@H](C)N(Cc2ccccc2O)C[C@@H]1C ZINC000779017780 585743981 /nfs/dbraw/zinc/74/39/81/585743981.db2.gz BPIOVKMFFPRZPP-QWHCGFSZSA-N 1 1 248.370 2.307 20 10 BECDMO CC[N@H+]1C[C@@H](C)N(Cc2ccccc2O)C[C@@H]1C ZINC000779017780 585743982 /nfs/dbraw/zinc/74/39/82/585743982.db2.gz BPIOVKMFFPRZPP-QWHCGFSZSA-N 1 1 248.370 2.307 20 10 BECDMO CC[C@@]1(O)CC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000779219356 585747350 /nfs/dbraw/zinc/74/73/50/585747350.db2.gz OBVDOGVSOYCDBX-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCC[C@@]2(C)CO)cc1C ZINC000789558000 585944050 /nfs/dbraw/zinc/94/40/50/585944050.db2.gz SBJUZERTFLIRJZ-HNNXBMFYSA-N 1 1 249.354 2.356 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](O)C2(C)C)c1 ZINC000812778123 586584048 /nfs/dbraw/zinc/58/40/48/586584048.db2.gz CCECIIGKZIULOI-ZDUSSCGKSA-N 1 1 235.327 2.046 20 10 BECDMO CC[N@@H+](CCO)Cc1ccc2ccccc2c1O ZINC000816480589 586735936 /nfs/dbraw/zinc/73/59/36/586735936.db2.gz QHURRMJRKHZTEW-UHFFFAOYSA-N 1 1 245.322 2.360 20 10 BECDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCOC1 ZINC000816557808 586740669 /nfs/dbraw/zinc/74/06/69/586740669.db2.gz BSKINCFRWVZVKK-MRVPVSSYSA-N 1 1 245.681 2.063 20 10 BECDMO COc1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H]2C)c1 ZINC000816648720 586751147 /nfs/dbraw/zinc/75/11/47/586751147.db2.gz OAZCILCFXPCRTH-UWVGGRQHSA-N 1 1 221.300 2.241 20 10 BECDMO CC[C@H]1CN(C)CC[N@H+]1Cc1cccc(C)c1O ZINC000816660762 586753551 /nfs/dbraw/zinc/75/35/51/586753551.db2.gz OKQFGORJYQWFIX-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cc(N(C)C)ccc1CN[C@H]1CCC[C@@H]1[NH3+] ZINC000817893959 586834093 /nfs/dbraw/zinc/83/40/93/586834093.db2.gz JMXDBVVTBKTVBC-GJZGRUSLSA-N 1 1 247.386 2.030 20 10 BECDMO Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@@H]1[NH3+] ZINC000817893961 586834140 /nfs/dbraw/zinc/83/41/40/586834140.db2.gz JMXDBVVTBKTVBC-LSDHHAIUSA-N 1 1 247.386 2.030 20 10 BECDMO CC[C@H]([NH2+]CCC[NH3+])c1cc(Cl)ccc1[O-] ZINC000817938033 586844640 /nfs/dbraw/zinc/84/46/40/586844640.db2.gz BSAVQIPHPUOTNL-NSHDSACASA-N 1 1 242.750 2.435 20 10 BECDMO CC[C@H](N[C@H]1CCC[NH2+]C1)c1ccccc1O ZINC000817940139 586845245 /nfs/dbraw/zinc/84/52/45/586845245.db2.gz FXQXHEDRUIEBHX-AAEUAGOBSA-N 1 1 234.343 2.185 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCNC2)c1 ZINC000817941157 586845552 /nfs/dbraw/zinc/84/55/52/586845552.db2.gz MWEWUJFWTRBAJE-VXGBXAGGSA-N 1 1 234.343 2.103 20 10 BECDMO CCNCC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000817951964 586847484 /nfs/dbraw/zinc/84/74/84/586847484.db2.gz MACLHASOAADBBG-LBPRGKRZSA-N 1 1 236.359 2.269 20 10 BECDMO CCNCC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000817952003 586847790 /nfs/dbraw/zinc/84/77/90/586847790.db2.gz MSVGGXYXYAXLGH-GFCCVEGCSA-N 1 1 236.359 2.269 20 10 BECDMO Nc1ccc(CC[NH2+][C@H]2CCCCC[C@@H]2N)cc1 ZINC000817958234 586850638 /nfs/dbraw/zinc/85/06/38/586850638.db2.gz UHEDDEZSWOAXNZ-GJZGRUSLSA-N 1 1 247.386 2.061 20 10 BECDMO C[C@H](NCC(C)(C)[NH3+])c1ccc(N(C)C)cc1 ZINC000817959931 586851545 /nfs/dbraw/zinc/85/15/45/586851545.db2.gz HVBRLGQHWGDFNG-NSHDSACASA-N 1 1 235.375 2.141 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]C[C@@H](N)C(C)C)c(O)c1 ZINC000817959901 586851617 /nfs/dbraw/zinc/85/16/17/586851617.db2.gz WLALWKCRVWQXSZ-DGCLKSJQSA-N 1 1 236.359 2.335 20 10 BECDMO C[C@@H](NCC1([NH3+])CCC1)c1ccc(N(C)C)cc1 ZINC000817965022 586854312 /nfs/dbraw/zinc/85/43/12/586854312.db2.gz NEJNWKMYWHUXJM-GFCCVEGCSA-N 1 1 247.386 2.285 20 10 BECDMO CC[C@H](NCC(F)(F)C[NH3+])c1ccccc1O ZINC000817965840 586854764 /nfs/dbraw/zinc/85/47/64/586854764.db2.gz DAHBPKGJZMDECO-JTQLQIEISA-N 1 1 244.285 2.027 20 10 BECDMO CC[C@H]([NH2+]C[C@@H](N)C1CC1)c1ccccc1O ZINC000817966003 586855170 /nfs/dbraw/zinc/85/51/70/586855170.db2.gz YTLRAGTYFVQYQW-OLZOCXBDSA-N 1 1 234.343 2.170 20 10 BECDMO Cc1ccc([C@H](C)N[C@@H]2C[NH2+]CC[C@@H]2C)c(O)c1 ZINC000817969334 586855900 /nfs/dbraw/zinc/85/59/00/586855900.db2.gz USFUTYMVDQJJMB-SGMGOOAPSA-N 1 1 248.370 2.349 20 10 BECDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)CN)cc1 ZINC000817970253 586857300 /nfs/dbraw/zinc/85/73/00/586857300.db2.gz PVDSDIKIKZAJEH-NWDGAFQWSA-N 1 1 235.375 2.141 20 10 BECDMO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)CN)cc1 ZINC000817970254 586857720 /nfs/dbraw/zinc/85/77/20/586857720.db2.gz PVDSDIKIKZAJEH-RYUDHWBXSA-N 1 1 235.375 2.141 20 10 BECDMO CC[C@@H](N[C@@H](C)C[NH3+])c1ccc(N(C)C)cc1 ZINC000817970563 586858405 /nfs/dbraw/zinc/85/84/05/586858405.db2.gz ZZEMRYNDGZXZNT-SMDDNHRTSA-N 1 1 235.375 2.141 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](C)N)c(O)c1C ZINC000817977465 586862283 /nfs/dbraw/zinc/86/22/83/586862283.db2.gz KTPONUNOFFUSRZ-SRVKXCTJSA-N 1 1 236.359 2.395 20 10 BECDMO N[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000818614447 586906715 /nfs/dbraw/zinc/90/67/15/586906715.db2.gz AVWUKHZUOVDVOO-JHJVBQTASA-N 1 1 246.354 2.239 20 10 BECDMO CCOc1ccc(C[NH2+]C(CF)CF)c(O)c1 ZINC000824554260 587275744 /nfs/dbraw/zinc/27/57/44/587275744.db2.gz DHWPSNURPXNXJL-UHFFFAOYSA-N 1 1 245.269 2.188 20 10 BECDMO CCc1cccc(C[N@H+](C)Cc2cnc[nH]2)c1O ZINC000826770393 587361839 /nfs/dbraw/zinc/36/18/39/587361839.db2.gz XNDVYLKDJYTAFH-UHFFFAOYSA-N 1 1 245.326 2.310 20 10 BECDMO CCc1cccc(C[N@@H+](C)Cc2cnc[nH]2)c1O ZINC000826770393 587361840 /nfs/dbraw/zinc/36/18/40/587361840.db2.gz XNDVYLKDJYTAFH-UHFFFAOYSA-N 1 1 245.326 2.310 20 10 BECDMO CCc1cccc(C[N@H+](C)Cc2c[nH]cn2)c1O ZINC000826770393 587361841 /nfs/dbraw/zinc/36/18/41/587361841.db2.gz XNDVYLKDJYTAFH-UHFFFAOYSA-N 1 1 245.326 2.310 20 10 BECDMO CCc1cccc(C[N@@H+](C)Cc2c[nH]cn2)c1O ZINC000826770393 587361842 /nfs/dbraw/zinc/36/18/42/587361842.db2.gz XNDVYLKDJYTAFH-UHFFFAOYSA-N 1 1 245.326 2.310 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CC[C@@H]3C[C@@H]3C2)c1 ZINC000827506063 587384904 /nfs/dbraw/zinc/38/49/04/587384904.db2.gz BWRWJVHPPFGNRX-GHMZBOCLSA-N 1 1 233.311 2.243 20 10 BECDMO C[C@@H](CO)[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835053911 587779606 /nfs/dbraw/zinc/77/96/06/587779606.db2.gz QDZJIGZYAQCPCM-SZZPACECSA-N 1 1 248.370 2.078 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@H]1CCOC1 ZINC000840913049 587929840 /nfs/dbraw/zinc/92/98/40/587929840.db2.gz DIKMNSOFZZDGFR-HNNXBMFYSA-N 1 1 248.370 2.282 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@@H]2CNCC[C@@H]2C)cc1C ZINC000841059984 587941111 /nfs/dbraw/zinc/94/11/11/587941111.db2.gz ZHWSVZKLAOUWNQ-IINYFYTJSA-N 1 1 248.370 2.097 20 10 BECDMO COc1ccc(CN[C@H]2CC[NH2+]C[C@@H]2C)cc1C ZINC000841063278 587941629 /nfs/dbraw/zinc/94/16/29/587941629.db2.gz HYKRIQVNXSRVFV-JSGCOSHPSA-N 1 1 248.370 2.091 20 10 BECDMO C[NH2+]CCC[N@@H+](C)Cc1cccc(Cl)c1[O-] ZINC000841103997 587946521 /nfs/dbraw/zinc/94/65/21/587946521.db2.gz LUNIWIFEBZXSIG-UHFFFAOYSA-N 1 1 242.750 2.087 20 10 BECDMO C[C@@H]([NH2+]CC[C@H](C)O)c1ccc(Cl)cc1O ZINC000841752495 587973842 /nfs/dbraw/zinc/97/38/42/587973842.db2.gz OZVOBYDZXXNQCA-DTWKUNHWSA-N 1 1 243.734 2.467 20 10 BECDMO C[C@H]([NH2+]CCCO)c1ccc(Cl)cc1O ZINC000841743708 587973863 /nfs/dbraw/zinc/97/38/63/587973863.db2.gz JSDVCHLIMLGAEZ-QMMMGPOBSA-N 1 1 229.707 2.079 20 10 BECDMO C[C@H]([NH2+][C@H]1C[C@@](C)(O)C1)c1ccc(F)cc1O ZINC000841757878 587974331 /nfs/dbraw/zinc/97/43/31/587974331.db2.gz BWBJEKLQUGIBIV-GMOODISLSA-N 1 1 239.290 2.095 20 10 BECDMO CCn1cncc1C[N@@H+](C)Cc1ccccc1O ZINC000841834374 587976954 /nfs/dbraw/zinc/97/69/54/587976954.db2.gz PQQLSIHOOLRQAW-UHFFFAOYSA-N 1 1 245.326 2.241 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)C2(CN)CCC2)cc1C ZINC000843124509 588083398 /nfs/dbraw/zinc/08/33/98/588083398.db2.gz BRBXHLIVSUFYRR-UHFFFAOYSA-N 1 1 248.370 2.322 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)C2(CN)CCC2)cc1C ZINC000843124509 588083400 /nfs/dbraw/zinc/08/34/00/588083400.db2.gz BRBXHLIVSUFYRR-UHFFFAOYSA-N 1 1 248.370 2.322 20 10 BECDMO CCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CC[NH2+]C1 ZINC000843358411 588104071 /nfs/dbraw/zinc/10/40/71/588104071.db2.gz NPPGBOBZTURGAI-CYBMUJFWSA-N 1 1 248.370 2.214 20 10 BECDMO CCC[N@H+](Cc1ccccc1[O-])C[C@@H]1CC[NH2+]C1 ZINC000843358411 588104072 /nfs/dbraw/zinc/10/40/72/588104072.db2.gz NPPGBOBZTURGAI-CYBMUJFWSA-N 1 1 248.370 2.214 20 10 BECDMO CCc1cccc(C[N@H+](CC)[C@@H](C)CO)c1O ZINC000848914939 588420054 /nfs/dbraw/zinc/42/00/54/588420054.db2.gz VPPPDYWHEKLMEG-NSHDSACASA-N 1 1 237.343 2.157 20 10 BECDMO CCc1cccc(C[N@@H+](C[C@H](C)O)C2CC2)c1O ZINC000848929720 588421897 /nfs/dbraw/zinc/42/18/97/588421897.db2.gz ZAARVAUHIJIYNK-NSHDSACASA-N 1 1 249.354 2.300 20 10 BECDMO CN(C)c1ccc(CNCC2([NH3+])CCCC2)cc1 ZINC000849350355 588474726 /nfs/dbraw/zinc/47/47/26/588474726.db2.gz XZUFBZYTJIEGFL-UHFFFAOYSA-N 1 1 247.386 2.114 20 10 BECDMO C[N@@H+](Cc1ccccn1)Cc1ccccc1O ZINC000109771139 588592191 /nfs/dbraw/zinc/59/21/91/588592191.db2.gz PCNRJOSPAQSUPB-UHFFFAOYSA-N 1 1 228.295 2.419 20 10 BECDMO CC[C@H](C)[N@@H+](CCO)Cc1cc(F)ccc1O ZINC000862388206 589207288 /nfs/dbraw/zinc/20/72/88/589207288.db2.gz XXYQAOVUTXWLAL-JTQLQIEISA-N 1 1 241.306 2.124 20 10 BECDMO CCOc1ccc(O)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1 ZINC000862440954 589213073 /nfs/dbraw/zinc/21/30/73/589213073.db2.gz MSGZIQDMGPFBAB-PHIMTYICSA-N 1 1 233.311 2.243 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@H]2CC[C@@H](C)NC2)cc1C ZINC000863484174 589293097 /nfs/dbraw/zinc/29/30/97/589293097.db2.gz HPZDHJOGURHQET-OCCSQVGLSA-N 1 1 248.370 2.239 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[C@@H](C)NC2)c1 ZINC000863545806 589297711 /nfs/dbraw/zinc/29/77/11/589297711.db2.gz HRRNOLHBWZJTGP-AGIUHOORSA-N 1 1 248.370 2.492 20 10 BECDMO Cc1cccc(C[NH2+]C[C@@H]2CCCN(C)C2)c1O ZINC000124811736 590090587 /nfs/dbraw/zinc/09/05/87/590090587.db2.gz NWARMTVKTUWSAM-ZDUSSCGKSA-N 1 1 248.370 2.132 20 10 BECDMO Cc1ccc(C[N@H+]2CCCO[C@@H](C)C2)c(O)c1 ZINC000876684428 590230053 /nfs/dbraw/zinc/23/00/53/590230053.db2.gz MXUKSPWPRKENLT-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO CCN1CC[N@@H+](Cc2c(C)cccc2O)C[C@@H]1C ZINC000876715765 590232717 /nfs/dbraw/zinc/23/27/17/590232717.db2.gz SKJVQPZWNCKKLH-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2c(C)cccc2O)C[C@@H]1C ZINC000876715765 590232719 /nfs/dbraw/zinc/23/27/19/590232719.db2.gz SKJVQPZWNCKKLH-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2c(C)cccc2O)C[C@@H]1C ZINC000876715765 590232721 /nfs/dbraw/zinc/23/27/21/590232721.db2.gz SKJVQPZWNCKKLH-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@H](CN(C)C)C2)c(O)c1 ZINC000876730619 590234024 /nfs/dbraw/zinc/23/40/24/590234024.db2.gz IAQOEOSPUWHAML-ZDUSSCGKSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)C)C2)c(O)c1 ZINC000876730619 590234025 /nfs/dbraw/zinc/23/40/25/590234025.db2.gz IAQOEOSPUWHAML-ZDUSSCGKSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)CCn1cccn1 ZINC000876732098 590234029 /nfs/dbraw/zinc/23/40/29/590234029.db2.gz WOSOHAHKUQWKPX-UHFFFAOYSA-N 1 1 245.326 2.029 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H](CN(C)C)C2)c(O)c1 ZINC000876730618 590234121 /nfs/dbraw/zinc/23/41/21/590234121.db2.gz IAQOEOSPUWHAML-CYBMUJFWSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)C)C2)c(O)c1 ZINC000876730618 590234123 /nfs/dbraw/zinc/23/41/23/590234123.db2.gz IAQOEOSPUWHAML-CYBMUJFWSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1ccc(C[N@@H+](CCCCO)C2CC2)c(O)c1 ZINC000876731962 590234515 /nfs/dbraw/zinc/23/45/15/590234515.db2.gz QCLWXPPCICAGBX-UHFFFAOYSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1ccc(C[N@@H+]2CCN(C)CC2(C)C)c(O)c1 ZINC000876747196 590237204 /nfs/dbraw/zinc/23/72/04/590237204.db2.gz XUOYQLOYJOYRLR-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN2CC[N@@H+](C)CC2(C)C)c(O)c1 ZINC000876747196 590237206 /nfs/dbraw/zinc/23/72/06/590237206.db2.gz XUOYQLOYJOYRLR-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN2CC[N@H+](C)CC2(C)C)c(O)c1 ZINC000876747196 590237207 /nfs/dbraw/zinc/23/72/07/590237207.db2.gz XUOYQLOYJOYRLR-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC[C@H]2C[C@@H](C)O)c(O)c1 ZINC000876748795 590237427 /nfs/dbraw/zinc/23/74/27/590237427.db2.gz FRMUARPXZOWQFC-OCCSQVGLSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ccc(C[N@H+]2CCOCC23CCC3)c(O)c1 ZINC000876750473 590238355 /nfs/dbraw/zinc/23/83/55/590238355.db2.gz UNDMMIYZAVQKLH-UHFFFAOYSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000876802918 590243838 /nfs/dbraw/zinc/24/38/38/590243838.db2.gz BMSYNVIUQWYUAD-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1nnc(C[NH2+]Cc2ccc(C)cc2O)s1 ZINC000877186274 590298586 /nfs/dbraw/zinc/29/85/86/590298586.db2.gz YQFURGJSRASIAG-UHFFFAOYSA-N 1 1 249.339 2.150 20 10 BECDMO COCC1=CC[N@@H+](Cc2ccc(C)cc2O)CC1 ZINC000877416717 590324875 /nfs/dbraw/zinc/32/48/75/590324875.db2.gz OUZWNEVMEXWZLR-UHFFFAOYSA-N 1 1 247.338 2.479 20 10 BECDMO CO[C@@H](C)C[N@@H+](C)Cc1c(C)cccc1O ZINC000877522486 590344776 /nfs/dbraw/zinc/34/47/76/590344776.db2.gz FYYGPTIOBJMLPV-NSHDSACASA-N 1 1 223.316 2.167 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)CCN(C)C1CC1 ZINC000877529103 590349267 /nfs/dbraw/zinc/34/92/67/590349267.db2.gz SQEGUIVPUKKQCX-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1CN(C)CC[N@H+](C)C1CC1 ZINC000877529103 590349269 /nfs/dbraw/zinc/34/92/69/590349269.db2.gz SQEGUIVPUKKQCX-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1CN(C)CC[N@@H+](C)C1CC1 ZINC000877529103 590349270 /nfs/dbraw/zinc/34/92/70/590349270.db2.gz SQEGUIVPUKKQCX-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)CC(C)(C)CO ZINC000877560903 590359986 /nfs/dbraw/zinc/35/99/86/590359986.db2.gz CZKVDJHIZRINFC-UHFFFAOYSA-N 1 1 237.343 2.151 20 10 BECDMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(C)cc1O ZINC000877561390 590360242 /nfs/dbraw/zinc/36/02/42/590360242.db2.gz LWMYCIMVRNTZAJ-UONOGXRCSA-N 1 1 249.354 2.293 20 10 BECDMO CC[C@H](C)[N@@H+](CCO)Cc1ccc(C)cc1O ZINC000877573425 590363257 /nfs/dbraw/zinc/36/32/57/590363257.db2.gz PIPNRXFGNIMVHU-LBPRGKRZSA-N 1 1 237.343 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@H](CCCO)C2)c(O)c1 ZINC000877576047 590364049 /nfs/dbraw/zinc/36/40/49/590364049.db2.gz DJRCXBAXGTYHBU-CYBMUJFWSA-N 1 1 249.354 2.295 20 10 BECDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1CSC1 ZINC000877634613 590380012 /nfs/dbraw/zinc/38/00/12/590380012.db2.gz NPOGGTZTGZOKHQ-UHFFFAOYSA-N 1 1 247.722 2.390 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)CC1(C)COC1 ZINC000877652116 590384858 /nfs/dbraw/zinc/38/48/58/590384858.db2.gz BBTGYPUFWDAVJS-UHFFFAOYSA-N 1 1 235.327 2.169 20 10 BECDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000877797343 590425328 /nfs/dbraw/zinc/42/53/28/590425328.db2.gz UFYGXRWXGHHTEO-ZDUSSCGKSA-N 1 1 249.354 2.375 20 10 BECDMO CC(C)[N@@H+](CCO)Cc1cc(Cl)ccc1O ZINC000128047676 590885169 /nfs/dbraw/zinc/88/51/69/590885169.db2.gz QOSJLKDPZOQSRC-UHFFFAOYSA-N 1 1 243.734 2.248 20 10 BECDMO CO[C@H](C)[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883100022 591539594 /nfs/dbraw/zinc/53/95/94/591539594.db2.gz LPQNEFOQYMLFRJ-JGVFFNPUSA-N 1 1 245.269 2.183 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](C)C2)c1 ZINC000132665437 591727987 /nfs/dbraw/zinc/72/79/87/591727987.db2.gz RUNWUJUKDWBTSH-SNVBAGLBSA-N 1 1 221.300 2.243 20 10 BECDMO Oc1ccccc1CN[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000217655182 592148568 /nfs/dbraw/zinc/14/85/68/592148568.db2.gz AWHVUWOKNHGRFW-KBPBESRZSA-N 1 1 246.354 2.109 20 10 BECDMO COC[C@H](C)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886512687 592240068 /nfs/dbraw/zinc/24/00/68/592240068.db2.gz LATLAVKGPWWYCC-ZJUUUORDSA-N 1 1 241.306 2.464 20 10 BECDMO CCC[C@@H](O)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886526494 592245885 /nfs/dbraw/zinc/24/58/85/592245885.db2.gz NBQWSDOKFZJRTL-VHSXEESVSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@H](CCCO)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886538484 592252181 /nfs/dbraw/zinc/25/21/81/592252181.db2.gz IYOWZMNGKKNRIA-NXEZZACHSA-N 1 1 241.306 2.343 20 10 BECDMO CO[C@H](C)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886596262 592270662 /nfs/dbraw/zinc/27/06/62/592270662.db2.gz AHIJPAZLOCUQLD-BDAKNGLRSA-N 1 1 227.279 2.217 20 10 BECDMO C[C@H]([NH2+][C@H]1C[C@@](C)(O)C1)c1c(O)cccc1F ZINC000886627108 592280841 /nfs/dbraw/zinc/28/08/41/592280841.db2.gz SVBWSDBAOWHXHI-MWODSPESSA-N 1 1 239.290 2.095 20 10 BECDMO CO[C@H]1C[C@H]([NH2+][C@@H](C)c2c(O)cccc2F)C1 ZINC000886645072 592286949 /nfs/dbraw/zinc/28/69/49/592286949.db2.gz QUYOUFGJONXASJ-GUBZILKMSA-N 1 1 239.290 2.359 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](CCCCO)C2CC2)c1 ZINC000093383285 634529408 /nfs/dbraw/zinc/52/94/08/634529408.db2.gz MAMMONPDMYSJLN-UHFFFAOYSA-N 1 1 249.354 2.438 20 10 BECDMO C[C@H]1CSC[C@H]1[NH2+]Cc1cccc(F)c1O ZINC000309761889 632666904 /nfs/dbraw/zinc/66/69/04/632666904.db2.gz IVRDSOLDBHICMB-GZMMTYOYSA-N 1 1 241.331 2.372 20 10 BECDMO COCCC[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000066371344 632896685 /nfs/dbraw/zinc/89/66/85/632896685.db2.gz JGTUDYMEWKBPBT-UHFFFAOYSA-N 1 1 237.343 2.477 20 10 BECDMO C[C@@H]([NH2+]Cc1cocn1)c1ccccc1O ZINC000309834256 633820086 /nfs/dbraw/zinc/82/00/86/633820086.db2.gz ZQAWHTIUENWKFJ-SECBINFHSA-N 1 1 218.256 2.231 20 10 BECDMO CCN(CC)c1ccc(CN[C@H]2C[C@H]([NH3+])C2)cc1 ZINC000906507838 638179521 /nfs/dbraw/zinc/17/95/21/638179521.db2.gz FPJSLQWQJYLTKV-HDJSIYSDSA-N 1 1 247.386 2.112 20 10 BECDMO Nc1ccc([NH2+]C[C@H]2CCSC2)cc1 ZINC000228546735 640879616 /nfs/dbraw/zinc/87/96/16/640879616.db2.gz XYXYCXZOUZUTQT-SECBINFHSA-N 1 1 208.330 2.434 20 10 BECDMO CCOc1ccc(C[NH2+]Cc2cocn2)c(O)c1 ZINC000730819424 641753234 /nfs/dbraw/zinc/75/32/34/641753234.db2.gz XFDRXMASMZLYKG-UHFFFAOYSA-N 1 1 248.282 2.069 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](O)[C@H](C)C2)cc1C ZINC000190056611 641830876 /nfs/dbraw/zinc/83/08/76/641830876.db2.gz FWELMNFXNUXWTQ-TZMCWYRMSA-N 1 1 249.354 2.212 20 10 BECDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1CC1 ZINC000190668824 641880607 /nfs/dbraw/zinc/88/06/07/641880607.db2.gz BLGGKSBNNRQTEE-UHFFFAOYSA-N 1 1 215.655 2.437 20 10 BECDMO C[C@@H]([NH2+]Cc1cncn1C)c1ccc(F)cc1O ZINC000290004242 642414805 /nfs/dbraw/zinc/41/48/05/642414805.db2.gz ZIZNIONSOLCSKS-SECBINFHSA-N 1 1 249.289 2.116 20 10 BECDMO C[C@H](O)C[C@H]1CCC[N@H+]1Cc1ccccc1O ZINC000179576947 642730847 /nfs/dbraw/zinc/73/08/47/642730847.db2.gz QUXXBCZVROKWKP-WCQYABFASA-N 1 1 235.327 2.128 20 10 BECDMO COc1ccc(O)c(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1 ZINC000180445205 642800156 /nfs/dbraw/zinc/80/01/56/642800156.db2.gz CEWGXDSBXWPLMK-BETUJISGSA-N 1 1 247.338 2.489 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)CCO1 ZINC000192596440 644167951 /nfs/dbraw/zinc/16/79/51/644167951.db2.gz NURKTLAVJHCPTM-LLVKDONJSA-N 1 1 247.338 2.102 20 10 BECDMO CC[C@H]1COCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000091980096 644644668 /nfs/dbraw/zinc/64/46/68/644644668.db2.gz BKKZVNQBPIXSFA-AWEZNQCLSA-N 1 1 248.370 2.363 20 10 BECDMO CCOCC[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000092885545 644670902 /nfs/dbraw/zinc/67/09/02/644670902.db2.gz KUJDFHIJAAKYNK-UHFFFAOYSA-N 1 1 237.343 2.477 20 10 BECDMO Cc1noc([C@H](C)[NH2+]Cc2cccc(C)c2O)n1 ZINC000792178248 644794793 /nfs/dbraw/zinc/79/47/93/644794793.db2.gz YUSZXQUXXPAGGC-VIFPVBQESA-N 1 1 247.298 2.243 20 10 BECDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@H](F)C1 ZINC000840104598 644866927 /nfs/dbraw/zinc/86/69/27/644866927.db2.gz UTWYYUWNAOFEAZ-NSHDSACASA-N 1 1 246.285 2.484 20 10 BECDMO Cc1ccc(O)c(C[NH2+][C@@H]2CCCC[C@H]2N)c1 ZINC000818431466 644996219 /nfs/dbraw/zinc/99/62/19/644996219.db2.gz NMBGVRFNBUWKST-CHWSQXEVSA-N 1 1 234.343 2.060 20 10 BECDMO C[C@@H](c1ncccn1)[N@H+](C)Cc1ccccc1O ZINC000929971536 646382932 /nfs/dbraw/zinc/38/29/32/646382932.db2.gz OJGKRVDYQGODSQ-NSHDSACASA-N 1 1 243.310 2.375 20 10 BECDMO C[C@@H](c1ncccn1)[N@@H+](C)Cc1ccccc1O ZINC000929971536 646382937 /nfs/dbraw/zinc/38/29/37/646382937.db2.gz OJGKRVDYQGODSQ-NSHDSACASA-N 1 1 243.310 2.375 20 10 BECDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCSC1 ZINC000708435902 712195227 /nfs/dbraw/zinc/19/52/27/712195227.db2.gz GRBALSZJNZCWKA-VIFPVBQESA-N 1 1 245.294 2.266 20 10 BECDMO Cc1cccc(C[N@@H+](C)CCCF)c1O ZINC000716625234 712568267 /nfs/dbraw/zinc/56/82/67/712568267.db2.gz BHJCTFWMUKKXIR-UHFFFAOYSA-N 1 1 211.280 2.492 20 10 BECDMO CC[N@@H+](CCOC)Cc1ccc(F)c(F)c1[O-] ZINC000703518469 712078097 /nfs/dbraw/zinc/07/80/97/712078097.db2.gz RELQMKXTGVVPNC-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO Oc1c(F)cc(F)cc1C[NH+]1CCCC1 ZINC000708400052 712192893 /nfs/dbraw/zinc/19/28/93/712192893.db2.gz MZZLPFUFCAEHCJ-UHFFFAOYSA-N 1 1 213.227 2.266 20 10 BECDMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2O)CCO1 ZINC000709019189 712206181 /nfs/dbraw/zinc/20/61/81/712206181.db2.gz GXJYEBXZNFJUKE-CQSZACIVSA-N 1 1 235.327 2.249 20 10 BECDMO Cc1ccc(O)c(CN2CCCCC[C@H]([NH3+])C2)c1 ZINC000709049621 712206619 /nfs/dbraw/zinc/20/66/19/712206619.db2.gz LJJFISTUNPATBF-AWEZNQCLSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCCCC[C@H](N)C2)c1 ZINC000709049621 712206620 /nfs/dbraw/zinc/20/66/20/712206620.db2.gz LJJFISTUNPATBF-AWEZNQCLSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCCCC[C@H](N)C2)c1 ZINC000709049621 712206621 /nfs/dbraw/zinc/20/66/21/712206621.db2.gz LJJFISTUNPATBF-AWEZNQCLSA-N 1 1 248.370 2.404 20 10 BECDMO CC(C)OCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000708487434 712211199 /nfs/dbraw/zinc/21/11/99/712211199.db2.gz XIKVSPVNZNIYOT-UHFFFAOYSA-N 1 1 245.269 2.185 20 10 BECDMO C[N@@H+](Cc1cc(F)c(F)cc1[O-])C1CC1 ZINC001142508770 964347716 /nfs/dbraw/zinc/34/77/16/964347716.db2.gz KYOWIAZYXFTBTF-UHFFFAOYSA-N 1 1 213.227 2.265 20 10 BECDMO C[N@H+](Cc1cc(F)c(F)cc1O)C1CC1 ZINC001142508770 964347727 /nfs/dbraw/zinc/34/77/27/964347727.db2.gz KYOWIAZYXFTBTF-UHFFFAOYSA-N 1 1 213.227 2.265 20 10 BECDMO C[N@@H+](Cc1cc(F)c(F)cc1O)C1CC1 ZINC001142508770 964347736 /nfs/dbraw/zinc/34/77/36/964347736.db2.gz KYOWIAZYXFTBTF-UHFFFAOYSA-N 1 1 213.227 2.265 20 10 BECDMO C[N@H+](Cc1c(O)ccc(F)c1F)C1CC1 ZINC001233332003 978562753 /nfs/dbraw/zinc/56/27/53/978562753.db2.gz SUDFOYFMPRAYJE-UHFFFAOYSA-N 1 1 213.227 2.265 20 10 BECDMO C[N@@H+](Cc1c(O)ccc(F)c1F)C1CC1 ZINC001233332003 978562754 /nfs/dbraw/zinc/56/27/54/978562754.db2.gz SUDFOYFMPRAYJE-UHFFFAOYSA-N 1 1 213.227 2.265 20 10 BECDMO CCC[C@@H](O)C[N@@H+](CC)Cc1ccccc1O ZINC001252789015 983885862 /nfs/dbraw/zinc/88/58/62/983885862.db2.gz MHYKCTRCTNMHQT-CYBMUJFWSA-N 1 1 237.343 2.375 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](CO)CC[C@H]2C)c1 ZINC000305740647 970785770 /nfs/dbraw/zinc/78/57/70/970785770.db2.gz CYOORYOUXQCRMA-OLZOCXBDSA-N 1 1 249.354 2.293 20 10 BECDMO Oc1cccc2c1C[N@H+]([C@H]1CCCOCC1)CC2 ZINC001170831132 971949320 /nfs/dbraw/zinc/94/93/20/971949320.db2.gz MQMQYTBHWACYQD-ZDUSSCGKSA-N 1 1 247.338 2.319 20 10 BECDMO Cc1cc(C)c(C[N@H+]2[C@H](C)CNC[C@@H]2C)c(O)c1 ZINC001209874027 957550025 /nfs/dbraw/zinc/55/00/25/957550025.db2.gz JYNSNHZUBWDBSG-BETUJISGSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(C)c(C[N@@H+]2[C@H](C)CNC[C@@H]2C)c(O)c1 ZINC001209874027 957550029 /nfs/dbraw/zinc/55/00/29/957550029.db2.gz JYNSNHZUBWDBSG-BETUJISGSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1c(O)ccc(C[N@H+]2CCC[C@@H](F)C2)c1O ZINC001140746254 959793314 /nfs/dbraw/zinc/79/33/14/959793314.db2.gz XFOOSTBFRKUMHJ-LLVKDONJSA-N 1 1 239.290 2.340 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](O)CC2)c(O)c1 ZINC001140948098 960124091 /nfs/dbraw/zinc/12/40/91/960124091.db2.gz SPSAMHXSCNGCAZ-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2C)c1O ZINC001140742196 960546593 /nfs/dbraw/zinc/54/65/93/960546593.db2.gz JUHAXOPTADDUEG-VIFPVBQESA-N 1 1 221.300 2.391 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H]3OCC[C@H]32)c(O)c1 ZINC001140947813 960745841 /nfs/dbraw/zinc/74/58/41/960745841.db2.gz GQOZJUXHOHGXPJ-TZMCWYRMSA-N 1 1 233.311 2.064 20 10 BECDMO Cc1ccc(C[N@H+]2CCCCC23COC3)c(O)c1 ZINC001140949645 960749059 /nfs/dbraw/zinc/74/90/59/960749059.db2.gz GURGXAJQGDNCPR-UHFFFAOYSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1ccc(C[N@@H+](C)Cc2cncnc2)c(O)c1 ZINC001140954729 960753711 /nfs/dbraw/zinc/75/37/11/960753711.db2.gz XIHQDUPUAOAGLL-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Cc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2CC(=O)C3)c(O)c1 ZINC001140952494 960764084 /nfs/dbraw/zinc/76/40/84/960764084.db2.gz UNYZSTKCODQBKU-BETUJISGSA-N 1 1 245.322 2.397 20 10 BECDMO CN1CCOc2cc(C[N@@H+](C)C3CC3)ccc21 ZINC001141140871 960885432 /nfs/dbraw/zinc/88/54/32/960885432.db2.gz QBBXVIAZTYEBLH-UHFFFAOYSA-N 1 1 232.327 2.109 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2ccc3c(c2)OCCN3C)C1 ZINC001141140894 960888416 /nfs/dbraw/zinc/88/84/16/960888416.db2.gz REECWXHLSZIUPT-GFCCVEGCSA-N 1 1 246.354 2.357 20 10 BECDMO C[C@]1(F)CCC[N@@H+](Cc2cc(O)ccc2O)C1 ZINC001141156617 960891635 /nfs/dbraw/zinc/89/16/35/960891635.db2.gz OSGYWHRLDXGHDE-ZDUSSCGKSA-N 1 1 239.290 2.422 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCC[C@@H](F)CC2)c1 ZINC001141155978 960892469 /nfs/dbraw/zinc/89/24/69/960892469.db2.gz CTBPMAUGPWUSBT-LLVKDONJSA-N 1 1 239.290 2.422 20 10 BECDMO CC1(C)CC[N@@H+](Cc2cc(O)ccc2O)C1 ZINC001141158755 960894735 /nfs/dbraw/zinc/89/47/35/960894735.db2.gz MHKCEALGSPZLKM-UHFFFAOYSA-N 1 1 221.300 2.330 20 10 BECDMO CCN(Cc1ccccc1O)c1[nH+]cccc1N ZINC001154890364 962883216 /nfs/dbraw/zinc/88/32/16/962883216.db2.gz XEESKNUYMSDHMA-UHFFFAOYSA-N 1 1 243.310 2.396 20 10 BECDMO CCN1CCc2cc(O[C@H]3CC[N@@H+](C)C3)ccc21 ZINC001233607473 965537758 /nfs/dbraw/zinc/53/77/58/965537758.db2.gz LFYQMPGAQTZQNX-AWEZNQCLSA-N 1 1 246.354 2.152 20 10 BECDMO CCN1CCc2cc(O[C@@H]3CC[N@@H+](C)C3)ccc21 ZINC001233607477 965538616 /nfs/dbraw/zinc/53/86/16/965538616.db2.gz LFYQMPGAQTZQNX-CQSZACIVSA-N 1 1 246.354 2.152 20 10 BECDMO Cc1[nH+]ccn1CCCN(C)c1ccc(N)cc1 ZINC000699545055 965968561 /nfs/dbraw/zinc/96/85/61/965968561.db2.gz LZICGUAPLUDGGX-UHFFFAOYSA-N 1 1 244.342 2.300 20 10 BECDMO Cc1cncc(C[N@H+](C)Cc2ccccc2O)n1 ZINC001203175206 966549431 /nfs/dbraw/zinc/54/94/31/966549431.db2.gz KTCNNLXXDQRPBN-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Oc1ccccc1C[N@@H+]1Cc2cccnc2C1 ZINC001203547786 966679700 /nfs/dbraw/zinc/67/97/00/966679700.db2.gz YKBHESHATKKJBZ-UHFFFAOYSA-N 1 1 226.279 2.303 20 10 BECDMO Oc1ccccc1C[N@H+]1Cc2cccnc2C1 ZINC001203547786 966679714 /nfs/dbraw/zinc/67/97/14/966679714.db2.gz YKBHESHATKKJBZ-UHFFFAOYSA-N 1 1 226.279 2.303 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2ccccc2O)CC[C@]1(C)O ZINC001203550362 966683787 /nfs/dbraw/zinc/68/37/87/966683787.db2.gz TWQILBFSKIMRGC-DOMZBBRYSA-N 1 1 249.354 2.375 20 10 BECDMO Oc1ccccc1C[N@H+]1CCc2ncccc2C1 ZINC001203556162 966691320 /nfs/dbraw/zinc/69/13/20/966691320.db2.gz LOOLFNMYLJYAQY-UHFFFAOYSA-N 1 1 240.306 2.346 20 10 BECDMO COc1cccc(C[N@H+]2CCC[C@@H]2CF)c1O ZINC001203601583 966701350 /nfs/dbraw/zinc/70/13/50/966701350.db2.gz BJFFXPFQXXVLEM-LLVKDONJSA-N 1 1 239.290 2.335 20 10 BECDMO 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CC[C@]1(CO)CCC[N@H+]1Cc1ccccc1O ZINC000191012494 517839761 /nfs/dbraw/zinc/83/97/61/517839761.db2.gz NINWNWMXCCTENU-CQSZACIVSA-N 1 1 235.327 2.129 20 10 BECDMO CN(C)c1ccc(OCCc2c[nH+]cn2C)cc1 ZINC000853692801 588757051 /nfs/dbraw/zinc/75/70/51/588757051.db2.gz JKAGPJSOBNBZIT-UHFFFAOYSA-N 1 1 245.326 2.108 20 10 BECDMO CC[C@@H]([NH2+][C@@H](C)CNC)c1ccc(C)cc1O ZINC000854231352 588781287 /nfs/dbraw/zinc/78/12/87/588781287.db2.gz GHITXXGFHBDPSQ-WCQYABFASA-N 1 1 236.359 2.349 20 10 BECDMO CCc1cccc(C[N@@H+](C2CC2)C2COC2)c1O ZINC000848913546 582814998 /nfs/dbraw/zinc/81/49/98/582814998.db2.gz ACNCYBHRECAYCY-UHFFFAOYSA-N 1 1 247.338 2.318 20 10 BECDMO Cc1cccc(C[N@@H+]2CC[C@H](C)[C@H](CO)C2)c1O ZINC000857060524 588884570 /nfs/dbraw/zinc/88/45/70/588884570.db2.gz ASTGYYBLIJAXSN-FZMZJTMJSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H](O)C(C)(C)C1 ZINC000877462079 583314376 /nfs/dbraw/zinc/31/43/76/583314376.db2.gz NOBJVSUAZWYRAV-CQSZACIVSA-N 1 1 249.354 2.293 20 10 BECDMO C[C@@H]1OCC[C@H]1C[N@@H+](C)Cc1ccccc1O ZINC000878241896 583368037 /nfs/dbraw/zinc/36/80/37/583368037.db2.gz JPZOQRFSRDSPEO-RYUDHWBXSA-N 1 1 235.327 2.249 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c(O)c1 ZINC000895776683 583725770 /nfs/dbraw/zinc/72/57/70/583725770.db2.gz JMHHOAMIHSGSQL-BETUJISGSA-N 1 1 249.379 2.495 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000895779146 583726355 /nfs/dbraw/zinc/72/63/55/583726355.db2.gz LPARUMOWNHPHRG-TXEJJXNPSA-N 1 1 249.379 2.495 20 10 BECDMO COc1cccc(O)c1C[N@@H+](C)CCCF ZINC000895897839 583741101 /nfs/dbraw/zinc/74/11/01/583741101.db2.gz FBDSAAQOCDCJJI-UHFFFAOYSA-N 1 1 227.279 2.192 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCO[C@@H](C)CC1 ZINC000896577762 583814841 /nfs/dbraw/zinc/81/48/41/583814841.db2.gz OMPUCGOYVQYPAL-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](N)C(C)(C)C2)cc1C ZINC000903986559 584835444 /nfs/dbraw/zinc/83/54/44/584835444.db2.gz MBEQSWRHWNRPJC-CQSZACIVSA-N 1 1 248.370 2.178 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@@H](N)C(C)(C)C2)cc1C ZINC000903986559 584835445 /nfs/dbraw/zinc/83/54/45/584835445.db2.gz MBEQSWRHWNRPJC-CQSZACIVSA-N 1 1 248.370 2.178 20 10 BECDMO CCOc1ccc(O)c(C[NH2+]Cc2cocn2)c1 ZINC000730819216 584917014 /nfs/dbraw/zinc/91/70/14/584917014.db2.gz QKJSJMOTHIVPSN-UHFFFAOYSA-N 1 1 248.282 2.069 20 10 BECDMO CCN(C)c1ccc(C[N@@H+]2CCOC[C@@H]2C)cc1 ZINC000741753419 584948623 /nfs/dbraw/zinc/94/86/23/584948623.db2.gz XROZBFALNUAFFX-ZDUSSCGKSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CCOC[C@@H]2C)cc1 ZINC000741753419 584948624 /nfs/dbraw/zinc/94/86/24/584948624.db2.gz XROZBFALNUAFFX-ZDUSSCGKSA-N 1 1 248.370 2.363 20 10 BECDMO CC[C@H](NCC[NH2+]C1CC1)c1ccccc1O ZINC000817952326 584991280 /nfs/dbraw/zinc/99/12/80/584991280.db2.gz DPZYGRWXEPPVLO-ZDUSSCGKSA-N 1 1 234.343 2.185 20 10 BECDMO CCN(CC)c1ccc(C[NH+]2CC(OC)C2)cc1 ZINC000839128734 585093858 /nfs/dbraw/zinc/09/38/58/585093858.db2.gz UDYJVDLENJUFIQ-UHFFFAOYSA-N 1 1 248.370 2.363 20 10 BECDMO CN(C)c1ccc(C[N@H+]2C[C@@H]3C[C@H]2CS3)cc1 ZINC000839190817 585097427 /nfs/dbraw/zinc/09/74/27/585097427.db2.gz DANSSWYOGSXRGF-KBPBESRZSA-N 1 1 248.395 2.442 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839190772 585097584 /nfs/dbraw/zinc/09/75/84/585097584.db2.gz AUMGIFFHMXHIES-QWRGUYRKSA-N 1 1 239.315 2.221 20 10 BECDMO COCC1([NH2+][C@H](C)c2ccc(F)cc2O)CC1 ZINC000756851266 585324388 /nfs/dbraw/zinc/32/43/88/585324388.db2.gz RESXLKJZDCTUJX-SECBINFHSA-N 1 1 239.290 2.361 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@H](C)[C@H]2CN)c1O ZINC000843052401 585333146 /nfs/dbraw/zinc/33/31/46/585333146.db2.gz SOEKPJDVWZKLTO-SMDDNHRTSA-N 1 1 248.370 2.260 20 10 BECDMO CCN(C)c1ccc(C[N@@H+](CCO)C2CC2)cc1 ZINC000773731264 585642837 /nfs/dbraw/zinc/64/28/37/585642837.db2.gz SWTYHZNUQBWFKT-UHFFFAOYSA-N 1 1 248.370 2.099 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]2CO)cc1 ZINC000773749342 585643310 /nfs/dbraw/zinc/64/33/10/585643310.db2.gz TUBOEBPYTCJRBF-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO CC(C)[C@H]1CC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000775763251 585684306 /nfs/dbraw/zinc/68/43/06/585684306.db2.gz FKBLJHNMDDUWNT-LLVKDONJSA-N 1 1 249.310 2.351 20 10 BECDMO CCN1C[C@@H](C)[N@@H+](Cc2ccccc2O)C[C@H]1C ZINC000779017776 585743937 /nfs/dbraw/zinc/74/39/37/585743937.db2.gz BPIOVKMFFPRZPP-CHWSQXEVSA-N 1 1 248.370 2.307 20 10 BECDMO CC[N@@H+]1C[C@@H](C)N(Cc2ccccc2O)C[C@H]1C ZINC000779017776 585743938 /nfs/dbraw/zinc/74/39/38/585743938.db2.gz BPIOVKMFFPRZPP-CHWSQXEVSA-N 1 1 248.370 2.307 20 10 BECDMO CC[N@H+]1C[C@@H](C)N(Cc2ccccc2O)C[C@H]1C ZINC000779017776 585743939 /nfs/dbraw/zinc/74/39/39/585743939.db2.gz BPIOVKMFFPRZPP-CHWSQXEVSA-N 1 1 248.370 2.307 20 10 BECDMO Oc1ccc(F)cc1C[N@@H+]1CC=CCC1 ZINC000779159371 585746331 /nfs/dbraw/zinc/74/63/31/585746331.db2.gz GWNZNIGPLJNNKN-UHFFFAOYSA-N 1 1 207.248 2.293 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2CCO)cc1C ZINC000779202627 585747220 /nfs/dbraw/zinc/74/72/20/585747220.db2.gz QSPQVSKHMGSATJ-CQSZACIVSA-N 1 1 249.354 2.356 20 10 BECDMO Cc1cccc(C[N@H+]2CCOCC3(CC3)C2)c1O ZINC000783599517 585837858 /nfs/dbraw/zinc/83/78/58/585837858.db2.gz QWDBWVOXYWMMTR-UHFFFAOYSA-N 1 1 247.338 2.313 20 10 BECDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccccc1O ZINC000785988376 585884667 /nfs/dbraw/zinc/88/46/67/585884667.db2.gz MPBMLPUDKQYWMZ-BZPMIXESSA-N 1 1 249.354 2.374 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@]2(C)CO)c1 ZINC000789557069 585944009 /nfs/dbraw/zinc/94/40/09/585944009.db2.gz FUQQNKSCIFFMBT-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO CO[C@@H](C)C[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000795750566 586091708 /nfs/dbraw/zinc/09/17/08/586091708.db2.gz LILZXQUPCHYHBT-LBPRGKRZSA-N 1 1 237.343 2.476 20 10 BECDMO CC[C@H]([NH2+][C@H]1CCOC1)c1ccc(F)cc1O ZINC000796842329 586114634 /nfs/dbraw/zinc/11/46/34/586114634.db2.gz YTDVZGTUOQQYBX-JQWIXIFHSA-N 1 1 239.290 2.361 20 10 BECDMO COC[C@H]1CC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000840082862 586423423 /nfs/dbraw/zinc/42/34/23/586423423.db2.gz KPCLNQHUTUQWGT-CQSZACIVSA-N 1 1 247.338 2.102 20 10 BECDMO COc1ccc(C[NH2+]Cc2cn(C)cn2)cc1C ZINC000808385318 586470160 /nfs/dbraw/zinc/47/01/60/586470160.db2.gz LRIZNIAGHIYGSF-UHFFFAOYSA-N 1 1 245.326 2.027 20 10 BECDMO Cc1cc(C[N@@H+](CCO)C2CC2)ccc1N(C)C ZINC000815017673 586664709 /nfs/dbraw/zinc/66/47/09/586664709.db2.gz SAXXRRUYUGVQBK-UHFFFAOYSA-N 1 1 248.370 2.018 20 10 BECDMO C[N@@H+](CCF)Cc1cc(Cl)ccc1O ZINC000816640588 586748198 /nfs/dbraw/zinc/74/81/98/586748198.db2.gz OUNUYFLCUJPNPN-UHFFFAOYSA-N 1 1 217.671 2.447 20 10 BECDMO CC[C@@H]1CN(C)CC[N@H+]1Cc1cc(C)ccc1O ZINC000816660379 586753368 /nfs/dbraw/zinc/75/33/68/586753368.db2.gz BHPHNKSMRIIOKQ-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCNC2)c(O)c1 ZINC000817942424 586844946 /nfs/dbraw/zinc/84/49/46/586844946.db2.gz YMAGPWCEAFAIKJ-NEPJUHHUSA-N 1 1 234.343 2.103 20 10 BECDMO CCN(C)c1ccc([C@H](C)NCCC[NH2+]C)cc1 ZINC000817941731 586845526 /nfs/dbraw/zinc/84/55/26/586845526.db2.gz VYRFXOPLKUZVOJ-ZDUSSCGKSA-N 1 1 249.402 2.403 20 10 BECDMO CCNCC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000817951962 586848183 /nfs/dbraw/zinc/84/81/83/586848183.db2.gz MACLHASOAADBBG-GFCCVEGCSA-N 1 1 236.359 2.269 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]C[C@H](N)C2CC2)c(O)c1 ZINC000817964714 586853836 /nfs/dbraw/zinc/85/38/36/586853836.db2.gz FPJHGHIJOPHFNX-MFKMUULPSA-N 1 1 234.343 2.089 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](N)C2CC2)c(O)c1 ZINC000817964700 586854410 /nfs/dbraw/zinc/85/44/10/586854410.db2.gz FHLZMHILBLIREO-AAEUAGOBSA-N 1 1 248.370 2.397 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](N)C2CC2)c1 ZINC000817966045 586854853 /nfs/dbraw/zinc/85/48/53/586854853.db2.gz ZOGRYDIHZWKDCA-GXFFZTMASA-N 1 1 234.343 2.089 20 10 BECDMO Cc1ccc(O)c([C@H](C)NC[C@@H]([NH3+])C2CC2)c1 ZINC000817966045 586854854 /nfs/dbraw/zinc/85/48/54/586854854.db2.gz ZOGRYDIHZWKDCA-GXFFZTMASA-N 1 1 234.343 2.089 20 10 BECDMO CC[C@H]([NH2+]C[C@@H](C)N)c1ccc(C)cc1O ZINC000817971658 586859798 /nfs/dbraw/zinc/85/97/98/586859798.db2.gz GAQGPGWQOAXZCJ-PWSUYJOCSA-N 1 1 222.332 2.089 20 10 BECDMO C[C@@H]([NH3+])[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000817977078 586860922 /nfs/dbraw/zinc/86/09/22/586860922.db2.gz ANLMUFYFPBJTEM-WOPDTQHZSA-N 1 1 235.375 2.139 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CC[C@H](F)C2)cc1 ZINC000824571911 587277263 /nfs/dbraw/zinc/27/72/63/587277263.db2.gz QVBIXBFWMIMYAI-LBPRGKRZSA-N 1 1 222.307 2.296 20 10 BECDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000824572272 587277269 /nfs/dbraw/zinc/27/72/69/587277269.db2.gz XHJBVFURMIBPSZ-LLVKDONJSA-N 1 1 239.290 2.335 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)C[C@H](O)C2)cc1C ZINC000825316975 587314780 /nfs/dbraw/zinc/31/47/80/587314780.db2.gz ZSRLINQOKOZRFC-YGRLFVJLSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)C[C@@H](C)O)cc1Cl ZINC000825500458 587322058 /nfs/dbraw/zinc/32/20/58/587322058.db2.gz CAHCQYLPMXHOCR-SECBINFHSA-N 1 1 243.734 2.167 20 10 BECDMO C[C@]1(C2CC2)C[N@@H+](Cc2ccccc2O)CCO1 ZINC000826877173 587364712 /nfs/dbraw/zinc/36/47/12/587364712.db2.gz BSQXHQSVYKUDIR-OAHLLOKOSA-N 1 1 247.338 2.393 20 10 BECDMO Cc1cc(C[N@@H+]2CC[C@@H](O)[C@H]2C)ccc1N(C)C ZINC000832225014 587651577 /nfs/dbraw/zinc/65/15/77/587651577.db2.gz IVQAFVCYNHGUJA-IUODEOHRSA-N 1 1 248.370 2.016 20 10 BECDMO CC[N@H+]1CCCC[C@H]1C(=O)Nc1ccc(N)cc1 ZINC000832244840 587652176 /nfs/dbraw/zinc/65/21/76/587652176.db2.gz ZTOFDGMQZCZEMU-ZDUSSCGKSA-N 1 1 247.342 2.082 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+](CCO)C1CC1 ZINC000840909807 587929207 /nfs/dbraw/zinc/92/92/07/587929207.db2.gz HYGUFIVFRDKBIB-UHFFFAOYSA-N 1 1 248.370 2.018 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H]1CO ZINC000840909696 587929583 /nfs/dbraw/zinc/92/95/83/587929583.db2.gz KWLPEQRHNFCODZ-OAHLLOKOSA-N 1 1 248.370 2.018 20 10 BECDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccon1 ZINC000840935149 587930920 /nfs/dbraw/zinc/93/09/20/587930920.db2.gz GWJOGAQIBWKPQH-UHFFFAOYSA-N 1 1 245.326 2.339 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@H](O)C[C@@H]1C ZINC000840942349 587931136 /nfs/dbraw/zinc/93/11/36/587931136.db2.gz ZPUHVCIXAUDNHX-SWLSCSKDSA-N 1 1 248.370 2.016 20 10 BECDMO CCC([NH3+])(CC)CNCc1cccc(C)c1O ZINC000841030356 587936559 /nfs/dbraw/zinc/93/65/59/587936559.db2.gz FQLSAPMAPMFPSR-UHFFFAOYSA-N 1 1 236.359 2.308 20 10 BECDMO CNCC[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000841034150 587937289 /nfs/dbraw/zinc/93/72/89/587937289.db2.gz BINRKSVCHMLSOP-UHFFFAOYSA-N 1 1 249.141 2.008 20 10 BECDMO CC(C)C[C@H](CN)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000841038604 587937874 /nfs/dbraw/zinc/93/78/74/587937874.db2.gz LRLIDVAGPQRLST-CQSZACIVSA-N 1 1 248.370 2.085 20 10 BECDMO CC(C)C[C@@H](C[NH3+])NCc1ccc(N(C)C)cc1 ZINC000841039069 587938481 /nfs/dbraw/zinc/93/84/81/587938481.db2.gz ZFEZPMZYSBYMNA-AWEZNQCLSA-N 1 1 249.402 2.216 20 10 BECDMO COc1ccc(CN[C@H]2CC[NH2+]C[C@H]2C)cc1C ZINC000841063279 587941298 /nfs/dbraw/zinc/94/12/98/587941298.db2.gz HYKRIQVNXSRVFV-OCCSQVGLSA-N 1 1 248.370 2.091 20 10 BECDMO Cc1cc(Cl)cc(CN[C@H](C)[C@H](C)[NH3+])c1O ZINC000841076925 587944300 /nfs/dbraw/zinc/94/43/00/587944300.db2.gz UANHOJHKKOXEIG-DTWKUNHWSA-N 1 1 242.750 2.179 20 10 BECDMO C[C@H](CCO)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841757656 587974128 /nfs/dbraw/zinc/97/41/28/587974128.db2.gz DWJXLMIURNFZKJ-RKDXNWHRSA-N 1 1 243.734 2.467 20 10 BECDMO C[C@H](CCO)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841757649 587974404 /nfs/dbraw/zinc/97/44/04/587974404.db2.gz DWJXLMIURNFZKJ-BDAKNGLRSA-N 1 1 243.734 2.467 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCN[C@@H](C)[C@H]2C)cc1C ZINC000843057496 588077445 /nfs/dbraw/zinc/07/74/45/588077445.db2.gz ILMUHFIUCMHQIZ-QWHCGFSZSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CCN[C@@H](C)[C@H]2C)cc1C ZINC000843057496 588077446 /nfs/dbraw/zinc/07/74/46/588077446.db2.gz ILMUHFIUCMHQIZ-QWHCGFSZSA-N 1 1 248.370 2.191 20 10 BECDMO COc1cccc([C@@H](C)[NH2+]Cc2ccon2)c1O ZINC000846145651 588258608 /nfs/dbraw/zinc/25/86/08/588258608.db2.gz MJPAFJDTHGHPJG-SECBINFHSA-N 1 1 248.282 2.240 20 10 BECDMO CCc1cccc(C[N@H+]2C[C@H](O)[C@H](CC)C2)c1O ZINC000848891466 588417783 /nfs/dbraw/zinc/41/77/83/588417783.db2.gz YPFYFBSFSRJPNR-OCCSQVGLSA-N 1 1 249.354 2.157 20 10 BECDMO Cc1cccc(C[N@H+](C[C@@H](C)O)C2CC2)c1O ZINC000848929090 588421750 /nfs/dbraw/zinc/42/17/50/588421750.db2.gz SSAUGUZOBVMQQE-LLVKDONJSA-N 1 1 235.327 2.046 20 10 BECDMO CC[C@@H](O)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000850373749 588541391 /nfs/dbraw/zinc/54/13/91/588541391.db2.gz OZZGWBPSCCEJCQ-SSDOTTSWSA-N 1 1 247.697 2.045 20 10 BECDMO CC[C@H]([NH2+]C/C=C/CO)c1ccc(F)cc1O ZINC000850509737 588554663 /nfs/dbraw/zinc/55/46/63/588554663.db2.gz RJXLDASIUJHCEM-PCAWENJQSA-N 1 1 239.290 2.121 20 10 BECDMO CC[C@@H](O)C[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000850528514 588557520 /nfs/dbraw/zinc/55/75/20/588557520.db2.gz IOKVCQYTLUBPQE-PWSUYJOCSA-N 1 1 241.306 2.343 20 10 BECDMO CCc1cccc(C[N@@H+](C)CC2(C)COC2)c1O ZINC000862479138 589216997 /nfs/dbraw/zinc/21/69/97/589216997.db2.gz DMVZMOZFQPHQGU-UHFFFAOYSA-N 1 1 249.354 2.423 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@@H]2CC[C@H](C)NC2)cc1C ZINC000863484172 589293430 /nfs/dbraw/zinc/29/34/30/589293430.db2.gz HPZDHJOGURHQET-GXTWGEPZSA-N 1 1 248.370 2.239 20 10 BECDMO C[C@H]([NH2+]CC(C)(C)CO)c1ccc(F)cc1O ZINC000122021334 589549883 /nfs/dbraw/zinc/54/98/83/589549883.db2.gz IOXSBELRRXUDKM-VIFPVBQESA-N 1 1 241.306 2.200 20 10 BECDMO CC[C@H]1COCC[N@H+]1Cc1cccc(C)c1O ZINC000124554391 590050040 /nfs/dbraw/zinc/05/00/40/590050040.db2.gz KTAXFMYLYCOFLV-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cc(C[NH2+]Cc2cccc(C)c2O)no1 ZINC000124737745 590080709 /nfs/dbraw/zinc/08/07/09/590080709.db2.gz DDEFHROGMDJGQM-UHFFFAOYSA-N 1 1 232.283 2.287 20 10 BECDMO CC[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876560736 590215769 /nfs/dbraw/zinc/21/57/69/590215769.db2.gz KSNQLPYOBLBMKW-UHFFFAOYSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1ccc(C[N@H+]2CCOC(C)(C)C2)c(O)c1 ZINC000876612908 590222022 /nfs/dbraw/zinc/22/20/22/590222022.db2.gz AZPSQJWZAXFQJZ-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC[C@H](N(C)C)C1 ZINC000876678048 590229645 /nfs/dbraw/zinc/22/96/45/590229645.db2.gz ALELWFDVRFPPAB-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1CN1CCC[C@H]([NH+](C)C)C1 ZINC000876678048 590229646 /nfs/dbraw/zinc/22/96/46/590229646.db2.gz ALELWFDVRFPPAB-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO COC[C@H]1CC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000876725753 590233606 /nfs/dbraw/zinc/23/36/06/590233606.db2.gz PHQPZVLCWJPQDH-LBPRGKRZSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)CC1(O)CCCC1 ZINC000876747312 590236884 /nfs/dbraw/zinc/23/68/84/590236884.db2.gz AFPDWGBXUAMPCQ-UHFFFAOYSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000877423883 590325213 /nfs/dbraw/zinc/32/52/13/590325213.db2.gz NDEWXRDSRCAQQM-HNNXBMFYSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1ccc(C[N@@H+](CC(C)(C)O)C2CC2)c(O)c1 ZINC000877428329 590325719 /nfs/dbraw/zinc/32/57/19/590325719.db2.gz IIFJVVKIIGXBNI-UHFFFAOYSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@H]2CCO)c(O)c1 ZINC000877435118 590326855 /nfs/dbraw/zinc/32/68/55/590326855.db2.gz OEVJJTDFMAJCLM-ZDUSSCGKSA-N 1 1 235.327 2.047 20 10 BECDMO CCN1CC[N@@H+](Cc2ccc(C)cc2O)[C@H](C)C1 ZINC000877517018 590345407 /nfs/dbraw/zinc/34/54/07/590345407.db2.gz KTABGIIQIZGZQQ-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2ccc(C)cc2O)[C@H](C)C1 ZINC000877517018 590345410 /nfs/dbraw/zinc/34/54/10/590345410.db2.gz KTABGIIQIZGZQQ-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2ccc(C)cc2O)[C@H](C)C1 ZINC000877517018 590345413 /nfs/dbraw/zinc/34/54/13/590345413.db2.gz KTABGIIQIZGZQQ-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[NH2+]CC(C)(F)F)c(O)c1 ZINC000877552378 590355672 /nfs/dbraw/zinc/35/56/72/590355672.db2.gz SCTFFJSHDDRHPI-UHFFFAOYSA-N 1 1 215.243 2.445 20 10 BECDMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1c(C)cccc1O ZINC000877562426 590359719 /nfs/dbraw/zinc/35/97/19/590359719.db2.gz ZVUFAAOPNXCOGQ-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H](CCCO)C2)c(O)c1 ZINC000877576048 590364101 /nfs/dbraw/zinc/36/41/01/590364101.db2.gz DJRCXBAXGTYHBU-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C[C@H](C)O)C1CC1 ZINC000877621841 590375583 /nfs/dbraw/zinc/37/55/83/590375583.db2.gz XOQVMQBITYPZOZ-NSHDSACASA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@H](C)[C@@](C)(CO)C1 ZINC000877640352 590381641 /nfs/dbraw/zinc/38/16/41/590381641.db2.gz LWYXVAKGJVAYEV-SWLSCSKDSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@@](C)(CO)C2)c(O)c1 ZINC000877640705 590383052 /nfs/dbraw/zinc/38/30/52/590383052.db2.gz QVOFAJNOBQLUCT-SWLSCSKDSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](CO)C2)c(O)c1 ZINC000877646504 590383640 /nfs/dbraw/zinc/38/36/40/590383640.db2.gz JFYSBXTVUDKAKH-GXTWGEPZSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@H+](C)CC2(C)COC2)c(O)c1 ZINC000877652899 590384979 /nfs/dbraw/zinc/38/49/79/590384979.db2.gz PJJVMKKUZXTCEL-UHFFFAOYSA-N 1 1 235.327 2.169 20 10 BECDMO CC1([NH2+]Cc2cc(Cl)c(F)cc2O)COC1 ZINC000877690951 590392561 /nfs/dbraw/zinc/39/25/61/590392561.db2.gz HBJZXPZBEGJLGH-UHFFFAOYSA-N 1 1 245.681 2.063 20 10 BECDMO CC[C@]1(O)CCC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000877690628 590393017 /nfs/dbraw/zinc/39/30/17/590393017.db2.gz DGSKPDQGCYJCNL-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO Cn1cccc1C[N@H+]1Cc2cccc(O)c2C1 ZINC000877703558 590397445 /nfs/dbraw/zinc/39/74/45/590397445.db2.gz OJYQRUIADPBBBM-UHFFFAOYSA-N 1 1 228.295 2.247 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@H](O)CC(C)(C)C2)c(O)c1 ZINC000877751680 590416166 /nfs/dbraw/zinc/41/61/66/590416166.db2.gz FXMRSZQCZINUBJ-CYBMUJFWSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cnc(C[NH2+][C@H](C)c2ccccc2O)nc1 ZINC000879649023 590842451 /nfs/dbraw/zinc/84/24/51/590842451.db2.gz HWTQCPWPLLKIAX-LLVKDONJSA-N 1 1 243.310 2.341 20 10 BECDMO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](O)C1 ZINC000127988666 590864558 /nfs/dbraw/zinc/86/45/58/590864558.db2.gz JPVYURLZZLFOOO-SECBINFHSA-N 1 1 241.718 2.002 20 10 BECDMO Cc1ccc(O)c(CN(C)C[C@H]2CCC[N@H+]2C)c1 ZINC000211556271 591195193 /nfs/dbraw/zinc/19/51/93/591195193.db2.gz HXBZYGBABWARIS-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)C[C@H]2CCCN2C)c1 ZINC000211556271 591195195 /nfs/dbraw/zinc/19/51/95/591195195.db2.gz HXBZYGBABWARIS-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)C[C@H]2CCCN2C)c1 ZINC000211556271 591195198 /nfs/dbraw/zinc/19/51/98/591195198.db2.gz HXBZYGBABWARIS-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO CC[C@@H](C)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000132027052 591683368 /nfs/dbraw/zinc/68/33/68/591683368.db2.gz KTMRAJSSWGUCIB-SECBINFHSA-N 1 1 237.299 2.351 20 10 BECDMO CC[C@H]1COCC[N@H+]1Cc1cc(C)ccc1O ZINC000132332094 591701776 /nfs/dbraw/zinc/70/17/76/591701776.db2.gz MOAGNLCHLWNKGE-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO CC1(C)C[N@@H+](Cc2ccccc2O)CCO1 ZINC000132632123 591726302 /nfs/dbraw/zinc/72/63/02/591726302.db2.gz CJNJLHAHLVNGEV-UHFFFAOYSA-N 1 1 221.300 2.003 20 10 BECDMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000134957925 591963361 /nfs/dbraw/zinc/96/33/61/591963361.db2.gz XJQQACHLYWFCSF-NXEZZACHSA-N 1 1 249.310 2.351 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@H]1C[C@@]12CCOC2 ZINC000886065361 592141561 /nfs/dbraw/zinc/14/15/61/592141561.db2.gz SPQOCVPPIHOWJN-UKRRQHHQSA-N 1 1 247.338 2.251 20 10 BECDMO C[C@H]([NH2+]Cc1cnn(C)c1)c1c(O)cccc1F ZINC000886510025 592240147 /nfs/dbraw/zinc/24/01/47/592240147.db2.gz PTFIZHKWEPJREP-VIFPVBQESA-N 1 1 249.289 2.116 20 10 BECDMO CC[C@@](C)(O)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886524967 592245749 /nfs/dbraw/zinc/24/57/49/592245749.db2.gz UTPBSGQNABUZLE-NOZJJQNGSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H](CCO)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886535198 592250182 /nfs/dbraw/zinc/25/01/82/592250182.db2.gz WLNAKJPLQDURAC-UWVGGRQHSA-N 1 1 241.306 2.200 20 10 BECDMO C[C@@H]([NH2+][C@@H](C)CCCO)c1c(O)cccc1F ZINC000886538486 592252928 /nfs/dbraw/zinc/25/29/28/592252928.db2.gz IYOWZMNGKKNRIA-VHSXEESVSA-N 1 1 241.306 2.343 20 10 BECDMO CC[C@H](O)CC[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886540198 592253425 /nfs/dbraw/zinc/25/34/25/592253425.db2.gz ARJCSJAMKHOHEI-UWVGGRQHSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ncc[nH]1 ZINC000138933931 592321393 /nfs/dbraw/zinc/32/13/93/592321393.db2.gz KTDNATXHQMTJGQ-SNVBAGLBSA-N 1 1 243.310 2.195 20 10 BECDMO C[N@H+](CCCCCCO)c1ccc(N)cc1 ZINC000234289566 635550622 /nfs/dbraw/zinc/55/06/22/635550622.db2.gz SZVDFYOUMJBCFF-UHFFFAOYSA-N 1 1 222.332 2.258 20 10 BECDMO C[N@@H+](CCCCCCO)c1ccc(N)cc1 ZINC000234289566 635550624 /nfs/dbraw/zinc/55/06/24/635550624.db2.gz SZVDFYOUMJBCFF-UHFFFAOYSA-N 1 1 222.332 2.258 20 10 BECDMO C[C@H](O)CC[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000093481415 631569670 /nfs/dbraw/zinc/56/96/70/631569670.db2.gz CUEBHKNLJLSEGA-VIFPVBQESA-N 1 1 243.734 2.248 20 10 BECDMO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000934114643 631691265 /nfs/dbraw/zinc/69/12/65/631691265.db2.gz UZCHRRDPHWLWFD-HUUCEWRRSA-N 1 1 248.370 2.362 20 10 BECDMO Oc1c(F)cccc1C[NH2+]CC[C@H]1CCCO1 ZINC000158730450 632483801 /nfs/dbraw/zinc/48/38/01/632483801.db2.gz GJEVXHCDBXZNKC-LLVKDONJSA-N 1 1 239.290 2.190 20 10 BECDMO C[C@H]1CSC[C@@H]1[NH2+]Cc1cccc(F)c1O ZINC000309761896 632667683 /nfs/dbraw/zinc/66/76/83/632667683.db2.gz IVRDSOLDBHICMB-KWQFWETISA-N 1 1 241.331 2.372 20 10 BECDMO Nc1ccc([NH2+]CC[C@@H]2CCOC2)cc1 ZINC000236371914 632927534 /nfs/dbraw/zinc/92/75/34/632927534.db2.gz BLAGEMQISAPSHK-SNVBAGLBSA-N 1 1 206.289 2.107 20 10 BECDMO Cc1ccc(C[NH2+][C@@H](C)C(F)F)c(O)c1 ZINC000895725960 636174277 /nfs/dbraw/zinc/17/42/77/636174277.db2.gz VXRPTDYZKGIOJJ-QMMMGPOBSA-N 1 1 215.243 2.444 20 10 BECDMO COc1ccc(CNC2(C)CC[NH2+]CC2)cc1C ZINC000841064779 636973316 /nfs/dbraw/zinc/97/33/16/636973316.db2.gz JLKWPFHXHDDOTN-UHFFFAOYSA-N 1 1 248.370 2.235 20 10 BECDMO CC[C@@H](CCO)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168793621 640827738 /nfs/dbraw/zinc/82/77/38/640827738.db2.gz HOKBFRDIURLYDV-KOLCDFICSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H]([NH2+]Cc1ccccc1O)C(F)F ZINC000228522412 640878474 /nfs/dbraw/zinc/87/84/74/640878474.db2.gz UMCCXEHQKHUBLX-SSDOTTSWSA-N 1 1 201.216 2.135 20 10 BECDMO CCO[C@@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000155487205 641573655 /nfs/dbraw/zinc/57/36/55/641573655.db2.gz GJNZFOPKZPUQRZ-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO C[C@@H](CCO)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000191144179 641901855 /nfs/dbraw/zinc/90/18/55/641901855.db2.gz LECVYGLFLOWJSK-ZETCQYMHSA-N 1 1 247.697 2.045 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@@H]2C(C)(C)O)c1O ZINC000154413871 642069221 /nfs/dbraw/zinc/06/92/21/642069221.db2.gz RGLXARQBOCWZHG-CYBMUJFWSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@H]2C(C)(C)O)c1O ZINC000154413987 642070079 /nfs/dbraw/zinc/07/00/79/642070079.db2.gz RGLXARQBOCWZHG-ZDUSSCGKSA-N 1 1 249.354 2.436 20 10 BECDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1ccccc1O ZINC000179576923 642730547 /nfs/dbraw/zinc/73/05/47/642730547.db2.gz QUXXBCZVROKWKP-AAEUAGOBSA-N 1 1 235.327 2.128 20 10 BECDMO [NH3+]CC[C@H]1CCCC[N@@H+]1Cc1ccccc1[O-] ZINC000070148363 642977964 /nfs/dbraw/zinc/97/79/64/642977964.db2.gz CMIMUNJHUNZBMC-CYBMUJFWSA-N 1 1 234.343 2.096 20 10 BECDMO [NH3+]CC[C@H]1CCCC[N@H+]1Cc1ccccc1[O-] ZINC000070148363 642977978 /nfs/dbraw/zinc/97/79/78/642977978.db2.gz CMIMUNJHUNZBMC-CYBMUJFWSA-N 1 1 234.343 2.096 20 10 BECDMO C[C@H](C[C@H](C)O)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000252758373 643111125 /nfs/dbraw/zinc/11/11/25/643111125.db2.gz KXTAITJSWQDOKA-KXUCPTDWSA-N 1 1 241.306 2.341 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2)CCO1 ZINC000932339110 643140764 /nfs/dbraw/zinc/14/07/64/643140764.db2.gz NBMBCODLPKCOHZ-CYBMUJFWSA-N 1 1 248.370 2.363 20 10 BECDMO Nc1ccc([NH2+]CC[C@H]2CCOC2)cc1 ZINC000236372295 643657799 /nfs/dbraw/zinc/65/77/99/643657799.db2.gz BLAGEMQISAPSHK-JTQLQIEISA-N 1 1 206.289 2.107 20 10 BECDMO C=Cn1cc(C[N@H+](C)Cc2ccccc2O)cn1 ZINC000193757512 644277794 /nfs/dbraw/zinc/27/77/94/644277794.db2.gz LICNMYZAGGOVBX-UHFFFAOYSA-N 1 1 243.310 2.321 20 10 BECDMO CCCC[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000074172438 644290865 /nfs/dbraw/zinc/29/08/65/644290865.db2.gz GJPKTMDJLGHKBP-UHFFFAOYSA-N 1 1 237.299 2.353 20 10 BECDMO Cc1noc([C@@H](C)[NH2+]Cc2cccc(C)c2O)n1 ZINC000792178247 644793577 /nfs/dbraw/zinc/79/35/77/644793577.db2.gz YUSZXQUXXPAGGC-SECBINFHSA-N 1 1 247.298 2.243 20 10 BECDMO COc1cc(C)cc(C[N@H+]2CC[C@H](F)C2)c1O ZINC000840104039 644865057 /nfs/dbraw/zinc/86/50/57/644865057.db2.gz GGESHDIQOMJESC-NSHDSACASA-N 1 1 239.290 2.253 20 10 BECDMO CC[C@@H](N)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000817981141 644994306 /nfs/dbraw/zinc/99/43/06/644994306.db2.gz ZLPKZHHUUQCRDR-GHMZBOCLSA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1cccc(C)c1O ZINC000824636282 645056827 /nfs/dbraw/zinc/05/68/27/645056827.db2.gz NWJLSJGFHXKKBI-UONOGXRCSA-N 1 1 249.354 2.293 20 10 BECDMO C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000843129614 645265976 /nfs/dbraw/zinc/26/59/76/645265976.db2.gz QKZKCXPZHDCQIY-BDAKNGLRSA-N 1 1 242.750 2.261 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@]2(C)CO)c(O)c1 ZINC000877459761 645797188 /nfs/dbraw/zinc/79/71/88/645797188.db2.gz KLYMLYORDMAADA-AWEZNQCLSA-N 1 1 235.327 2.047 20 10 BECDMO CCOCC[N@@H+](C)Cc1ccc(F)c(F)c1[O-] ZINC000703519476 712078077 /nfs/dbraw/zinc/07/80/77/712078077.db2.gz WGKHRTFIKIKSSE-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO Oc1c(F)cc(F)cc1C[N@@H+]1CC[C@H](CF)C1 ZINC000711504367 712308023 /nfs/dbraw/zinc/30/80/23/712308023.db2.gz ZOEWFAJWTZVNJX-MRVPVSSYSA-N 1 1 245.244 2.462 20 10 BECDMO Oc1c(F)cc(F)cc1C[N@H+]1CC[C@H](CF)C1 ZINC000711504367 712308026 /nfs/dbraw/zinc/30/80/26/712308026.db2.gz ZOEWFAJWTZVNJX-MRVPVSSYSA-N 1 1 245.244 2.462 20 10 BECDMO Oc1c(Br)cccc1C[NH2+]CCF ZINC000379358661 712376114 /nfs/dbraw/zinc/37/61/14/712376114.db2.gz VZVJYVWCIFGWMM-UHFFFAOYSA-N 1 1 248.095 2.214 20 10 BECDMO C[C@@H]([NH2+][C@H](C)C(C)(C)O)c1ccc(F)cc1O ZINC000393968987 711180813 /nfs/dbraw/zinc/18/08/13/711180813.db2.gz ITQPQXDEZFKNEC-RKDXNWHRSA-N 1 1 241.306 2.341 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ncccn2)c1 ZINC000702325056 712047112 /nfs/dbraw/zinc/04/71/12/712047112.db2.gz CCQOPWOHHPCFBD-NSHDSACASA-N 1 1 243.310 2.341 20 10 BECDMO CC[C@@]1(C)COCC[N@H+]1Cc1ccccc1O ZINC000708286165 712185397 /nfs/dbraw/zinc/18/53/97/712185397.db2.gz DUQICNKWFODKOW-AWEZNQCLSA-N 1 1 235.327 2.393 20 10 BECDMO C[C@@H](CF)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708393317 712191720 /nfs/dbraw/zinc/19/17/20/712191720.db2.gz CPLWUCFCZOVMAS-LURJTMIESA-N 1 1 219.206 2.118 20 10 BECDMO C[C@H]1CC[N@H+](Cc2cccc(F)c2O)CCO1 ZINC000720482329 712846994 /nfs/dbraw/zinc/84/69/94/712846994.db2.gz KPALDNHYDYJACI-JTQLQIEISA-N 1 1 239.290 2.142 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2cccc(F)c2O)CCO1 ZINC000720482329 712846995 /nfs/dbraw/zinc/84/69/95/712846995.db2.gz KPALDNHYDYJACI-JTQLQIEISA-N 1 1 239.290 2.142 20 10 BECDMO CSCC[N@@H+](C)Cc1cc(C)ccc1O ZINC000093509617 964161217 /nfs/dbraw/zinc/16/12/17/964161217.db2.gz NJRIDVBBJPEGQP-UHFFFAOYSA-N 1 1 225.357 2.495 20 10 BECDMO C[N@@H+](Cc1ccc(O)cc1O)C1CC(F)(F)C1 ZINC001204271704 966954119 /nfs/dbraw/zinc/95/41/19/966954119.db2.gz CECKWZUFWVIMKL-UHFFFAOYSA-N 1 1 243.253 2.327 20 10 BECDMO C[C@@H]1COCCC[N@@H+]1Cc1cccc(F)c1O ZINC000398898651 1165843710 /nfs/dbraw/zinc/84/37/10/1165843710.db2.gz CIZOGBRJTGBUSW-SNVBAGLBSA-N 1 1 239.290 2.142 20 10 BECDMO C[C@@H]1COCCC[N@H+]1Cc1cccc(F)c1O ZINC000398898651 1165843715 /nfs/dbraw/zinc/84/37/15/1165843715.db2.gz CIZOGBRJTGBUSW-SNVBAGLBSA-N 1 1 239.290 2.142 20 10 BECDMO CCCC[C@H](O)C[N@@H+](C)Cc1ccccc1O ZINC001252093750 968572425 /nfs/dbraw/zinc/57/24/25/968572425.db2.gz JPLKZVOJVDXKJY-ZDUSSCGKSA-N 1 1 237.343 2.375 20 10 BECDMO Nc1ccc(C[N@H+]2CCC3(C2)CCOCC3)cc1 ZINC000306049591 1166190698 /nfs/dbraw/zinc/19/06/98/1166190698.db2.gz PCZXYTPWEIMOBC-UHFFFAOYSA-N 1 1 246.354 2.271 20 10 BECDMO C[C@@H]1C[C@@H]([NH2+]Cc2cccc(F)c2O)[C@@H](C)O1 ZINC000395192547 1166617925 /nfs/dbraw/zinc/61/79/25/1166617925.db2.gz XCRKXCDMBFACRY-KBVBSXBZSA-N 1 1 239.290 2.187 20 10 BECDMO C[C@@H]1C[C@H]([NH2+]Cc2cccc(F)c2O)[C@@H](C)O1 ZINC000395192551 1166707299 /nfs/dbraw/zinc/70/72/99/1166707299.db2.gz XCRKXCDMBFACRY-LNLATYFQSA-N 1 1 239.290 2.187 20 10 BECDMO CC[C@]1([NH2+]Cc2cccc(F)c2O)CCOC1 ZINC000383139620 1167114848 /nfs/dbraw/zinc/11/48/48/1167114848.db2.gz XDJODJMFYVURMN-ZDUSSCGKSA-N 1 1 239.290 2.190 20 10 BECDMO C[N@H+](Cc1ccc(N)cc1)C[C@@H]1CCCC[C@@H]1O ZINC000385577960 1167394527 /nfs/dbraw/zinc/39/45/27/1167394527.db2.gz FDAFYLHNPBLLBK-ZFWWWQNUSA-N 1 1 248.370 2.252 20 10 BECDMO CC[N@H+](CCOC)Cc1c(O)ccc(F)c1F ZINC001233331626 978561604 /nfs/dbraw/zinc/56/16/04/978561604.db2.gz DOGHLPSLPRDREJ-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO CC[N@@H+](CCOC)Cc1c(O)ccc(F)c1F ZINC001233331626 978561616 /nfs/dbraw/zinc/56/16/16/978561616.db2.gz DOGHLPSLPRDREJ-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO CCc1ccc(C[N@H+](CC)C2COC2)c(O)c1 ZINC001236794011 979735578 /nfs/dbraw/zinc/73/55/78/979735578.db2.gz JFBCTRSDOQJHSQ-UHFFFAOYSA-N 1 1 235.327 2.175 20 10 BECDMO CC[N@@H+](Cc1cccc(C)c1O)CC(C)(C)O ZINC000271904201 1168350554 /nfs/dbraw/zinc/35/05/54/1168350554.db2.gz ZYSGJIDOWYKJBF-UHFFFAOYSA-N 1 1 237.343 2.293 20 10 BECDMO CC(=O)C[N@@H+](C)Cc1ccc2c(c1)CCCN2C ZINC001138354239 1169354080 /nfs/dbraw/zinc/35/40/80/1169354080.db2.gz BVVZYTFLEKMLII-UHFFFAOYSA-N 1 1 246.354 2.090 20 10 BECDMO CC(=O)C[N@H+](C)Cc1ccc2c(c1)CCCN2C ZINC001138354239 1169354091 /nfs/dbraw/zinc/35/40/91/1169354091.db2.gz BVVZYTFLEKMLII-UHFFFAOYSA-N 1 1 246.354 2.090 20 10 BECDMO Cn1c(=O)ccc2ccc(C3=C[NH2+]CCC3)cc21 ZINC001243953804 971051511 /nfs/dbraw/zinc/05/15/11/971051511.db2.gz NGZVXMNPPDJZKQ-UHFFFAOYSA-N 1 1 240.306 2.263 20 10 BECDMO CCO[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000706177229 957657982 /nfs/dbraw/zinc/65/79/82/957657982.db2.gz CNLXGHMGXXJUSF-GFCCVEGCSA-N 1 1 239.290 2.142 20 10 BECDMO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](F)C1 ZINC000689882764 960422908 /nfs/dbraw/zinc/42/29/08/960422908.db2.gz CUGWPTLSUMVISS-NSHDSACASA-N 1 1 227.254 2.465 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H](F)C1 ZINC000689882764 960422917 /nfs/dbraw/zinc/42/29/17/960422917.db2.gz CUGWPTLSUMVISS-NSHDSACASA-N 1 1 227.254 2.465 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](C)[C@H]2CO)c1 ZINC001140617163 960459095 /nfs/dbraw/zinc/45/90/95/960459095.db2.gz HWINGZXDDLXFEV-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001140617122 960460267 /nfs/dbraw/zinc/46/02/67/960460267.db2.gz GEUSFWIAQUIPPG-LLVKDONJSA-N 1 1 233.311 2.112 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001140617122 960460283 /nfs/dbraw/zinc/46/02/83/960460283.db2.gz GEUSFWIAQUIPPG-LLVKDONJSA-N 1 1 233.311 2.112 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001140617123 960462929 /nfs/dbraw/zinc/46/29/29/960462929.db2.gz GEUSFWIAQUIPPG-NSHDSACASA-N 1 1 233.311 2.112 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001140617123 960462936 /nfs/dbraw/zinc/46/29/36/960462936.db2.gz GEUSFWIAQUIPPG-NSHDSACASA-N 1 1 233.311 2.112 20 10 BECDMO Cc1ccc(O)c(C[NH+]2CC3(C2)CCCCO3)c1 ZINC001140619821 960467332 /nfs/dbraw/zinc/46/73/32/960467332.db2.gz QDQFSWFMJPRRCZ-UHFFFAOYSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@H]2CO)c(O)c1 ZINC001140948072 960746204 /nfs/dbraw/zinc/74/62/04/960746204.db2.gz RTKPHWCMESFYQO-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@](C)(O)[C@H](C)C2)c(O)c1 ZINC001140948182 960746787 /nfs/dbraw/zinc/74/67/87/960746787.db2.gz WYTLMSJTMFOEMJ-IUODEOHRSA-N 1 1 249.354 2.293 20 10 BECDMO CC[N@@H+](Cc1cc(C)n[nH]1)Cc1ccccc1O ZINC001203081601 960750974 /nfs/dbraw/zinc/75/09/74/960750974.db2.gz CRKLMJXXEQLQME-UHFFFAOYSA-N 1 1 245.326 2.446 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@]3(CCO3)C2)c(O)c1 ZINC001140950791 960755378 /nfs/dbraw/zinc/75/53/78/960755378.db2.gz JASUOLLAJKWHBS-OAHLLOKOSA-N 1 1 247.338 2.456 20 10 BECDMO CC[N@@H+](Cc1ccc(C)cc1O)CC(C)(C)O ZINC001140957721 960764027 /nfs/dbraw/zinc/76/40/27/960764027.db2.gz LHMYJMBODMXYBD-UHFFFAOYSA-N 1 1 237.343 2.293 20 10 BECDMO CC1(C)CCC[N@H+]1Cc1cc(O)ccc1O ZINC001141155945 960889568 /nfs/dbraw/zinc/88/95/68/960889568.db2.gz BLJYLTSDEOQXLZ-UHFFFAOYSA-N 1 1 221.300 2.472 20 10 BECDMO C[C@H]1CCC[N@@H+](Cc2cc(O)ccc2O)C1 ZINC001141156537 960891261 /nfs/dbraw/zinc/89/12/61/960891261.db2.gz ZNMQYKPZEIUHMK-JTQLQIEISA-N 1 1 221.300 2.330 20 10 BECDMO CCCC[N@@H+](C)Cc1cc(O)ccc1O ZINC001141155876 960891310 /nfs/dbraw/zinc/89/13/10/960891310.db2.gz NKDKEMDNMGIRQR-UHFFFAOYSA-N 1 1 209.289 2.330 20 10 BECDMO CC[C@@H]1CCC[N@H+]1Cc1cc(O)ccc1O ZINC001141160229 960895100 /nfs/dbraw/zinc/89/51/00/960895100.db2.gz UNESFYMDTBESRX-LLVKDONJSA-N 1 1 221.300 2.472 20 10 BECDMO Oc1ccc(O)c(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC001141158581 960896642 /nfs/dbraw/zinc/89/66/42/960896642.db2.gz FRBUPMMICVHUKY-JTQLQIEISA-N 1 1 225.263 2.032 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCC[C@H](F)C2)c1 ZINC001141158581 960896645 /nfs/dbraw/zinc/89/66/45/960896645.db2.gz FRBUPMMICVHUKY-JTQLQIEISA-N 1 1 225.263 2.032 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CC3CCC2CC3)c1 ZINC001141159461 960897489 /nfs/dbraw/zinc/89/74/89/960897489.db2.gz GUQNSEOIMFWNGZ-UHFFFAOYSA-N 1 1 233.311 2.472 20 10 BECDMO Cc1cccc(CNc2[nH+]cccc2N)c1O ZINC001160768910 964409889 /nfs/dbraw/zinc/40/98/89/964409889.db2.gz DRDVJVNUGVLTEU-UHFFFAOYSA-N 1 1 229.283 2.290 20 10 BECDMO COc1cccc(C[N@H+]2CCC[C@H](F)C2)c1O ZINC000689902887 965453852 /nfs/dbraw/zinc/45/38/52/965453852.db2.gz GLDDWFWKEXBHQN-NSHDSACASA-N 1 1 239.290 2.335 20 10 BECDMO CCOC1C[NH+](Cc2ccc(CC)cc2O)C1 ZINC001236783916 966534329 /nfs/dbraw/zinc/53/43/29/966534329.db2.gz PPQOYJJSPMBOIL-UHFFFAOYSA-N 1 1 235.327 2.175 20 10 BECDMO CCc1ccc(C[N@@H+](C2CC2)C2COC2)c(O)c1 ZINC001236795537 966537582 /nfs/dbraw/zinc/53/75/82/966537582.db2.gz WDKHYPNSFSSTOB-UHFFFAOYSA-N 1 1 247.338 2.318 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)C[C@@H]1F ZINC001203550392 966682298 /nfs/dbraw/zinc/68/22/98/966682298.db2.gz UMRMBAJKIJZWGO-KOLCDFICSA-N 1 1 209.264 2.182 20 10 BECDMO CCCOC1C[NH+](Cc2ccccc2O)C1 ZINC001203556694 966690907 /nfs/dbraw/zinc/69/09/07/966690907.db2.gz UCGVEHPIAQGHQF-UHFFFAOYSA-N 1 1 221.300 2.003 20 10 BECDMO Oc1ccccc1C[N@H+]1CCCCC12COC2 ZINC001203555722 966692017 /nfs/dbraw/zinc/69/20/17/966692017.db2.gz DWGHOSMBFOZXQB-UHFFFAOYSA-N 1 1 233.311 2.147 20 10 BECDMO CCOc1cccc(C[N@H+]2CC[C@@H]2C)c1O ZINC001203602451 966702704 /nfs/dbraw/zinc/70/27/04/966702704.db2.gz XUTDSRPDLROPPF-JTQLQIEISA-N 1 1 221.300 2.385 20 10 BECDMO C[N@@H+](Cc1ccc(O)c(O)c1)C1CC(F)(F)C1 ZINC001203873566 966804053 /nfs/dbraw/zinc/80/40/53/966804053.db2.gz GANFVJAFYPOTTF-UHFFFAOYSA-N 1 1 243.253 2.327 20 10 BECDMO C[C@@]1(F)CCC[N@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203874837 966805241 /nfs/dbraw/zinc/80/52/41/966805241.db2.gz DDNLZUGAYRNOJF-CYBMUJFWSA-N 1 1 239.290 2.422 20 10 BECDMO C[C@@]1(F)CCC[N@@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203874837 966805244 /nfs/dbraw/zinc/80/52/44/966805244.db2.gz DDNLZUGAYRNOJF-CYBMUJFWSA-N 1 1 239.290 2.422 20 10 BECDMO Oc1ccc(C[NH+]2CC3(CCC3)C2)cc1O ZINC001203875519 966805680 /nfs/dbraw/zinc/80/56/80/966805680.db2.gz OLEAJMWKCFBOMH-UHFFFAOYSA-N 1 1 219.284 2.084 20 10 BECDMO Oc1ccc(C[N@H+]2CCC[C@@H](CF)C2)cc1O ZINC001203880437 966810068 /nfs/dbraw/zinc/81/00/68/966810068.db2.gz AUELHOVMSHCDLV-NSHDSACASA-N 1 1 239.290 2.279 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCCC[C@@H](O)C2)cc1 ZINC001203930221 966825856 /nfs/dbraw/zinc/82/58/56/966825856.db2.gz OQUUWTBPXDZKFK-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO CCN(CC)c1ccc(C[N@H+](C)C2COC2)cc1 ZINC001203938745 966826134 /nfs/dbraw/zinc/82/61/34/966826134.db2.gz DCVHGINKKOHFLG-UHFFFAOYSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(CC)c1ccc(C[N@@H+](C)C2COC2)cc1 ZINC001203938745 966826137 /nfs/dbraw/zinc/82/61/37/966826137.db2.gz DCVHGINKKOHFLG-UHFFFAOYSA-N 1 1 248.370 2.363 20 10 BECDMO CC[C@H](C)[N@@H+](C)Cc1cc(O)c(O)c(OC)c1 ZINC001204346143 966969665 /nfs/dbraw/zinc/96/96/65/966969665.db2.gz FHDPPYIZYAMPRD-VIFPVBQESA-N 1 1 239.315 2.337 20 10 BECDMO Oc1cccc2c1C[N@H+](Cc1nccs1)CC2 ZINC001204548557 967049289 /nfs/dbraw/zinc/04/92/89/967049289.db2.gz PNRQVBHUFUWVGL-UHFFFAOYSA-N 1 1 246.335 2.407 20 10 BECDMO Oc1cccc2c1C[N@@H+](Cc1nccs1)CC2 ZINC001204548557 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CC[N@H+](Cc1ccc(N)cc1)C[C@H]1CCOC1 ZINC000041079469 1171165261 /nfs/dbraw/zinc/16/52/61/1171165261.db2.gz XFHGNDXYZGRYRC-CYBMUJFWSA-N 1 1 234.343 2.127 20 10 BECDMO CN(CCC[NH+]1CCCC1)Cc1ccc(N)cc1 ZINC000049333164 1171690247 /nfs/dbraw/zinc/69/02/47/1171690247.db2.gz VYQAYXQCQLWLJJ-UHFFFAOYSA-N 1 1 247.386 2.187 20 10 BECDMO Cc1cc(C[N@H+]2CC[C@](C)(O)C2)ccc1N(C)C ZINC000292895321 178003905 /nfs/dbraw/zinc/00/39/05/178003905.db2.gz VMMIENNDFZCCJH-HNNXBMFYSA-N 1 1 248.370 2.018 20 10 BECDMO C[N@H+](CCN1CCCCC1)Cc1ccccc1O ZINC000077284317 398255867 /nfs/dbraw/zinc/25/58/67/398255867.db2.gz GAURXRNOIOWFGQ-UHFFFAOYSA-N 1 1 248.370 2.310 20 10 BECDMO C[N@@H+](CCN1CCCCC1)Cc1ccccc1O ZINC000077284317 398255869 /nfs/dbraw/zinc/25/58/69/398255869.db2.gz GAURXRNOIOWFGQ-UHFFFAOYSA-N 1 1 248.370 2.310 20 10 BECDMO CCOc1cccc(C[N@@H+](C)CC)c1O ZINC000132548019 398306633 /nfs/dbraw/zinc/30/66/33/398306633.db2.gz HTXXLWAMEAQSFM-UHFFFAOYSA-N 1 1 209.289 2.243 20 10 BECDMO c1csc(C[NH2+]Cc2ccc3c(c2)CCO3)n1 ZINC000040445352 343403720 /nfs/dbraw/zinc/40/37/20/343403720.db2.gz RFNFCRHODPIJJT-UHFFFAOYSA-N 1 1 246.335 2.368 20 10 BECDMO CN(C)c1ccc(C[N@@H+](CCO)C2CCC2)cc1 ZINC000276133144 187338956 /nfs/dbraw/zinc/33/89/56/187338956.db2.gz ZLTLWNQSLZQFTE-UHFFFAOYSA-N 1 1 248.370 2.099 20 10 BECDMO C[C@H](CCN(C)C)[NH2+][C@@H](C)c1ccccc1O ZINC000049553086 343601722 /nfs/dbraw/zinc/60/17/22/343601722.db2.gz LHAGFDOOSQWRSY-NEPJUHHUSA-N 1 1 236.359 2.383 20 10 BECDMO C[C@H](CCN(C)C)[NH2+][C@H](C)c1ccccc1O ZINC000049553088 343602114 /nfs/dbraw/zinc/60/21/14/343602114.db2.gz LHAGFDOOSQWRSY-VXGBXAGGSA-N 1 1 236.359 2.383 20 10 BECDMO CC1(C)COCC[N@@H+]1Cc1cc(F)ccc1O ZINC000179971913 347006265 /nfs/dbraw/zinc/00/62/65/347006265.db2.gz IFLOLGLFXNAPPA-UHFFFAOYSA-N 1 1 239.290 2.142 20 10 BECDMO CC1(C)COCC[N@H+]1Cc1cc(F)ccc1O ZINC000179971913 347006267 /nfs/dbraw/zinc/00/62/67/347006267.db2.gz IFLOLGLFXNAPPA-UHFFFAOYSA-N 1 1 239.290 2.142 20 10 BECDMO CC(C)CN1CC[NH+](Cc2ccccc2O)CC1 ZINC000112642528 344648924 /nfs/dbraw/zinc/64/89/24/344648924.db2.gz IGUQDPFLEHHWMN-UHFFFAOYSA-N 1 1 248.370 2.166 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)CC[C@H](C)O)cc1C ZINC000093481376 345672826 /nfs/dbraw/zinc/67/28/26/345672826.db2.gz FJAUUEFKXALBDE-LBPRGKRZSA-N 1 1 237.343 2.212 20 10 BECDMO Cc1cccc(C[N@H+](C)CC2(O)CCCC2)c1O ZINC000180314648 179063836 /nfs/dbraw/zinc/06/38/36/179063836.db2.gz BSTPPAYNFUSPQU-UHFFFAOYSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1cccc(C[N@@H+](C)CCCCCO)c1O ZINC000279443819 179066399 /nfs/dbraw/zinc/06/63/99/179066399.db2.gz POSYPTRJZAVUEY-UHFFFAOYSA-N 1 1 237.343 2.295 20 10 BECDMO Cc1cccc(C[N@H+]2CCOC3(CCC3)C2)c1O ZINC000180417204 179079272 /nfs/dbraw/zinc/07/92/72/179079272.db2.gz FLLLQOZXSKHPMX-UHFFFAOYSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1cccc(C[NH2+][C@@H](C)CCN(C)C)c1O ZINC000124755306 179095781 /nfs/dbraw/zinc/09/57/81/179095781.db2.gz BZVMZXUAUPAXSW-LBPRGKRZSA-N 1 1 236.359 2.130 20 10 BECDMO CC[C@@H](O)CC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168825293 346744333 /nfs/dbraw/zinc/74/43/33/346744333.db2.gz PEQKZUCTEPAWPI-MWLCHTKSSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1nccn1CC[N@H+](C)Cc1ccccc1O ZINC000270941661 180252319 /nfs/dbraw/zinc/25/23/19/180252319.db2.gz YPHOKFQDTMRXSX-UHFFFAOYSA-N 1 1 245.326 2.029 20 10 BECDMO Oc1ccc(Br)cc1C[NH+]1CCC1 ZINC000307701913 353004465 /nfs/dbraw/zinc/00/44/65/353004465.db2.gz SUXVTNLZAYYJDH-UHFFFAOYSA-N 1 1 242.116 2.360 20 10 BECDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000271099349 188376289 /nfs/dbraw/zinc/37/62/89/188376289.db2.gz OKCGVEGGJHQNEL-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1cccc(C[N@H+](C(C)C)C2COC2)c1O ZINC000296040252 188394208 /nfs/dbraw/zinc/39/42/08/188394208.db2.gz NVUIUGMONHXLPY-UHFFFAOYSA-N 1 1 235.327 2.310 20 10 BECDMO Oc1ccc(Cl)cc1C[N@H+]1CCCOCC1 ZINC000132725237 358734365 /nfs/dbraw/zinc/73/43/65/358734365.db2.gz ZYWDKYCMKKJFLD-UHFFFAOYSA-N 1 1 241.718 2.268 20 10 BECDMO Oc1ccccc1CN1CCC[N@H+]2CCC[C@@H]2C1 ZINC000134197422 358782874 /nfs/dbraw/zinc/78/28/74/358782874.db2.gz IHBLQHDQQIJWLH-CQSZACIVSA-N 1 1 246.354 2.062 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@]3(CCOC3)C2)c1 ZINC000093820625 360281415 /nfs/dbraw/zinc/28/14/15/360281415.db2.gz KVMJAEPLCHWCBO-OAHLLOKOSA-N 1 1 247.338 2.313 20 10 BECDMO CCC[N@@H+](C)Cc1cc(OC)ccc1O ZINC000132578600 169079899 /nfs/dbraw/zinc/07/98/99/169079899.db2.gz IYDWJSYOYNOEJC-UHFFFAOYSA-N 1 1 209.289 2.243 20 10 BECDMO Oc1c(F)cccc1C[NH2+]C[C@@H]1CCSC1 ZINC000228556635 183255440 /nfs/dbraw/zinc/25/54/40/183255440.db2.gz CGBWOMHSQCNRGS-VIFPVBQESA-N 1 1 241.331 2.374 20 10 BECDMO Oc1cc(F)c(Cl)cc1C[NH2+]C1CC1 ZINC000293783150 183258864 /nfs/dbraw/zinc/25/88/64/183258864.db2.gz BCOXLUOXZAFGMF-UHFFFAOYSA-N 1 1 215.655 2.437 20 10 BECDMO Oc1ccccc1C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000375331648 183301357 /nfs/dbraw/zinc/30/13/57/183301357.db2.gz LKIYXBVMCQEJSX-AWEZNQCLSA-N 1 1 233.311 2.003 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@H]1CF ZINC000293989908 183301985 /nfs/dbraw/zinc/30/19/85/183301985.db2.gz LOSMSUORXMGJJE-NSHDSACASA-N 1 1 209.264 2.326 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2cc(C)ccc2O)CCO1 ZINC000132003273 384211743 /nfs/dbraw/zinc/21/17/43/384211743.db2.gz XQOTUARGAFGTEG-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO C[C@H](CCCO)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000094942439 384318614 /nfs/dbraw/zinc/31/86/14/384318614.db2.gz LUXINIGDVLLSIL-ZJUUUORDSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)CN(C)C ZINC000297388546 384279904 /nfs/dbraw/zinc/27/99/04/384279904.db2.gz RQZXUNOIYIQYNT-WCQYABFASA-N 1 1 248.370 2.167 20 10 BECDMO C[N@@H+](CCOCC1CC1)Cc1ccccc1O ZINC000119526851 384281335 /nfs/dbraw/zinc/28/13/35/384281335.db2.gz CRLHJAUHGZFMNX-UHFFFAOYSA-N 1 1 235.327 2.251 20 10 BECDMO C[N@@H+](Cc1cccc(F)c1O)C[C@H]1CCCO1 ZINC000160213111 384392770 /nfs/dbraw/zinc/39/27/70/384392770.db2.gz ZNOLIBPQXNKUSH-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO C[N@H+](Cc1cccc(F)c1O)C[C@H]1CCCO1 ZINC000160213111 384392776 /nfs/dbraw/zinc/39/27/76/384392776.db2.gz ZNOLIBPQXNKUSH-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO C[N@@H+](Cc1cccc(Cl)c1[O-])[C@H]1CCOC1 ZINC000162818306 384694230 /nfs/dbraw/zinc/69/42/30/384694230.db2.gz OBSHHSHJLVQNNC-JTQLQIEISA-N 1 1 241.718 2.266 20 10 BECDMO C[N@@H+](CCc1ccncc1)Cc1ccccc1O ZINC000084828004 384901952 /nfs/dbraw/zinc/90/19/52/384901952.db2.gz ZECHDVZSZCNNQV-UHFFFAOYSA-N 1 1 242.322 2.462 20 10 BECDMO Cc1n[nH]cc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062747820 385186613 /nfs/dbraw/zinc/18/66/13/385186613.db2.gz VJYNCTUNRFZYIB-SECBINFHSA-N 1 1 249.289 2.414 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@](C)(O)C2)c1 ZINC000129550045 385161586 /nfs/dbraw/zinc/16/15/86/385161586.db2.gz XRPZXIUSMOHKKR-AWEZNQCLSA-N 1 1 235.327 2.047 20 10 BECDMO C[N@@H+](CC[C@@H]1CCCO1)Cc1ccccc1O ZINC000191660271 385312777 /nfs/dbraw/zinc/31/27/77/385312777.db2.gz XOVSICGDKBWJSJ-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO CCC[C@@H](O)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168770680 385384762 /nfs/dbraw/zinc/38/47/62/385384762.db2.gz RFRCBNCEHWTBDU-MWLCHTKSSA-N 1 1 241.306 2.343 20 10 BECDMO COc1cc(O)c(C[N@@H+](C)C2CC2)cc1OC ZINC000179437704 385467015 /nfs/dbraw/zinc/46/70/15/385467015.db2.gz PGEJBKKJZYJMKN-UHFFFAOYSA-N 1 1 237.299 2.004 20 10 BECDMO CCOC[C@@H]1CC[N@@H+](Cc2ccccc2O)C1 ZINC000179583632 385476657 /nfs/dbraw/zinc/47/66/57/385476657.db2.gz YXWVSZRIZQRNFO-GFCCVEGCSA-N 1 1 235.327 2.251 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000179749537 385487601 /nfs/dbraw/zinc/48/76/01/385487601.db2.gz BJPHEPAASSHTQC-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO CCCC[N@@H+](CCO)Cc1cc(F)ccc1O ZINC000179874329 385496576 /nfs/dbraw/zinc/49/65/76/385496576.db2.gz XOCYIOGWUJUURA-UHFFFAOYSA-N 1 1 241.306 2.126 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2ccccc2O)CCCO1 ZINC000281253092 385649846 /nfs/dbraw/zinc/64/98/46/385649846.db2.gz MRIPQEOJAXIBDJ-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@H]1CCCC[C@H]1O ZINC000272587410 385915007 /nfs/dbraw/zinc/91/50/07/385915007.db2.gz HIJKCXIFKZCQPB-UKRRQHHQSA-N 1 1 249.354 2.375 20 10 BECDMO CC[C@H]([NH2+]CC[C@@H](C)O)c1ccc(F)cc1O ZINC000285530969 385938111 /nfs/dbraw/zinc/93/81/11/385938111.db2.gz BQOKFDRPWBPVBG-SKDRFNHKSA-N 1 1 241.306 2.343 20 10 BECDMO CC[C@@H]([NH2+][C@@H](CC)CO)c1ccc(F)cc1O ZINC000285837253 385969920 /nfs/dbraw/zinc/96/99/20/385969920.db2.gz XETGJVAHULYNJV-CMPLNLGQSA-N 1 1 241.306 2.343 20 10 BECDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC2CC2)c1 ZINC000273405878 385997747 /nfs/dbraw/zinc/99/77/47/385997747.db2.gz OJNCODWVFISLLI-SECBINFHSA-N 1 1 249.310 2.239 20 10 BECDMO Cc1cc(C[N@H+]2CCC[C@H](O)C2)ccc1N(C)C ZINC000293587912 386660927 /nfs/dbraw/zinc/66/09/27/386660927.db2.gz UFWXBDZJXANEAC-AWEZNQCLSA-N 1 1 248.370 2.018 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@](C)(O)CC2)c1 ZINC000279648144 386713504 /nfs/dbraw/zinc/71/35/04/386713504.db2.gz KDMFIIWVDKRGOM-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO CC[C@H]1CC[N@H+]1Cc1cc(OC)ccc1O ZINC000292897631 386744527 /nfs/dbraw/zinc/74/45/27/386744527.db2.gz ZOTKTVXSKYQIJV-NSHDSACASA-N 1 1 221.300 2.385 20 10 BECDMO Cc1cc(C[N@@H+](C)[C@@H]2CCOC2)ccc1N(C)C ZINC000293196441 386787581 /nfs/dbraw/zinc/78/75/81/386787581.db2.gz UEBKTIZXCSEIQZ-CQSZACIVSA-N 1 1 248.370 2.282 20 10 BECDMO CCOCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293731663 386868426 /nfs/dbraw/zinc/86/84/26/386868426.db2.gz WJHRITCVLDAMAJ-UHFFFAOYSA-N 1 1 247.697 2.311 20 10 BECDMO CO[C@H]1C[N@@H+](Cc2ccccc2O)CC[C@@H]1C ZINC000188298633 387267176 /nfs/dbraw/zinc/26/71/76/387267176.db2.gz ZCAROQQQPKBSJS-FZMZJTMJSA-N 1 1 235.327 2.249 20 10 BECDMO C[C@H](CCCCO)[NH2+]Cc1cccc(F)c1O ZINC000294951814 388406129 /nfs/dbraw/zinc/40/61/29/388406129.db2.gz DDAMZSSTXIXUAI-SNVBAGLBSA-N 1 1 241.306 2.172 20 10 BECDMO C[C@H](C[NH2+][C@H](C)c1ccccc1O)CN(C)C ZINC000293688671 388390709 /nfs/dbraw/zinc/39/07/09/388390709.db2.gz NQBQNBAREJFAMS-VXGBXAGGSA-N 1 1 236.359 2.241 20 10 BECDMO C[C@@H](CC(C)(C)O)[NH2+]Cc1cccc(F)c1O ZINC000295023981 388407949 /nfs/dbraw/zinc/40/79/49/388407949.db2.gz KXGLAFKOKVNFQA-VIFPVBQESA-N 1 1 241.306 2.170 20 10 BECDMO CC[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000077234943 135059935 /nfs/dbraw/zinc/05/99/35/135059935.db2.gz UYBFGOCJEKAHIO-UHFFFAOYSA-N 1 1 234.343 2.227 20 10 BECDMO CC1=CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000280657418 168100901 /nfs/dbraw/zinc/10/09/01/168100901.db2.gz WYYYSFMXBWGCOA-UHFFFAOYSA-N 1 1 247.294 2.273 20 10 BECDMO CCOC(C)(C)C[NH2+]Cc1cccc(F)c1O ZINC000159231017 170312501 /nfs/dbraw/zinc/31/25/01/170312501.db2.gz SJUUVXBHYHXLLU-UHFFFAOYSA-N 1 1 241.306 2.436 20 10 BECDMO CCOC1C[NH+](Cc2cc(C)c(C)cc2O)C1 ZINC000297433647 170337212 /nfs/dbraw/zinc/33/72/12/170337212.db2.gz NOYKQXHJBGCYRM-UHFFFAOYSA-N 1 1 235.327 2.230 20 10 BECDMO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(N)cc1 ZINC000036797830 171110772 /nfs/dbraw/zinc/11/07/72/171110772.db2.gz PVIAWRHNSGFBCG-SMDDNHRTSA-N 1 1 234.343 2.268 20 10 BECDMO CCn1cc(C[NH2+]Cc2cccc(F)c2O)cn1 ZINC000272240950 172172744 /nfs/dbraw/zinc/17/27/44/172172744.db2.gz AQROHABESWYLRL-UHFFFAOYSA-N 1 1 249.289 2.038 20 10 BECDMO CCn1nccc1C[N@@H+](C)Cc1ccccc1O ZINC000120051111 172264033 /nfs/dbraw/zinc/26/40/33/172264033.db2.gz QWFPRJJKNLZQJU-UHFFFAOYSA-N 1 1 245.326 2.241 20 10 BECDMO COCC[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000293570634 174280055 /nfs/dbraw/zinc/28/00/55/174280055.db2.gz SQQGSNCEVSJASY-UHFFFAOYSA-N 1 1 236.359 2.139 20 10 BECDMO COc1ccc(C[NH2+]CCCN(C)C)cc1C ZINC000035052492 175106615 /nfs/dbraw/zinc/10/66/15/175106615.db2.gz XMYAIKQVCURLCX-UHFFFAOYSA-N 1 1 236.359 2.045 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2CF)c1 ZINC000294086988 175157100 /nfs/dbraw/zinc/15/71/00/175157100.db2.gz RHCMPCZOIDTTGI-NSHDSACASA-N 1 1 239.290 2.335 20 10 BECDMO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)[C@H](C)CO1 ZINC000179938608 176301955 /nfs/dbraw/zinc/30/19/55/176301955.db2.gz SVKCQKLDCKVIQI-NXEZZACHSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@H](C)CO1 ZINC000179938608 176301956 /nfs/dbraw/zinc/30/19/56/176301956.db2.gz SVKCQKLDCKVIQI-NXEZZACHSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)CCS1 ZINC000179569750 176307852 /nfs/dbraw/zinc/30/78/52/176307852.db2.gz JPXDIHHDZMMILU-SNVBAGLBSA-N 1 1 223.341 2.330 20 10 BECDMO C[C@H]1CCOCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000365344008 177178045 /nfs/dbraw/zinc/17/80/45/177178045.db2.gz MVDLFMCOFNOOJY-ZDUSSCGKSA-N 1 1 248.370 2.363 20 10 BECDMO C[C@H]1C[NH+](Cc2cc(F)ccc2O)C[C@H](C)O1 ZINC000183250406 177260147 /nfs/dbraw/zinc/26/01/47/177260147.db2.gz QLBUXWOMDMSOBN-UWVGGRQHSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)C[C@H](C)O1 ZINC000180908123 177260947 /nfs/dbraw/zinc/26/09/47/177260947.db2.gz QLBUXWOMDMSOBN-AOOOYVTPSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)C[C@H](C)O1 ZINC000180908123 177260948 /nfs/dbraw/zinc/26/09/48/177260948.db2.gz QLBUXWOMDMSOBN-AOOOYVTPSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@@H]1C[N@H+](Cc2ccccc2O)C[C@H](C)O1 ZINC000028221875 177265928 /nfs/dbraw/zinc/26/59/28/177265928.db2.gz CTGGINCBVRTYPW-PHIMTYICSA-N 1 1 221.300 2.001 20 10 BECDMO C[C@H]1[C@@H](O)CC[N@H+]1Cc1ccc(Cl)cc1O ZINC001652474678 1173088842 /nfs/dbraw/zinc/08/88/42/1173088842.db2.gz MXVRRXAMDPWOGU-KWQFWETISA-N 1 1 241.718 2.001 20 10 BECDMO CC[C@@H]([NH2+]C[C@@H](O)CC)c1ccc(F)cc1O ZINC000293385434 488014221 /nfs/dbraw/zinc/01/42/21/488014221.db2.gz IOKVCQYTLUBPQE-CMPLNLGQSA-N 1 1 241.306 2.343 20 10 BECDMO COc1cc(Cl)cc(C[N@@H+](C)CCF)c1O ZINC000293792286 488017401 /nfs/dbraw/zinc/01/74/01/488017401.db2.gz ZYYHLNSJSQUXPR-UHFFFAOYSA-N 1 1 247.697 2.456 20 10 BECDMO Cc1cccc(O)c1C[NH2+]C(CF)CF ZINC000877555893 583327693 /nfs/dbraw/zinc/32/76/93/583327693.db2.gz GGZILPDMNSTQFJ-UHFFFAOYSA-N 1 1 215.243 2.098 20 10 BECDMO Cc1cc(C)c(O)c(C[N@H+](C)CC2CN(C)C2)c1 ZINC000853555268 588748487 /nfs/dbraw/zinc/74/84/87/588748487.db2.gz IGTXLLGPLJAQNJ-UHFFFAOYSA-N 1 1 248.370 2.002 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)CC2CN(C)C2)cc1C ZINC000853555851 588748550 /nfs/dbraw/zinc/74/85/50/588748550.db2.gz QPNYQURLOVIFEH-UHFFFAOYSA-N 1 1 248.370 2.002 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)CNC)c1ccc(C)cc1O ZINC000854231350 588781455 /nfs/dbraw/zinc/78/14/55/588781455.db2.gz GHITXXGFHBDPSQ-AAEUAGOBSA-N 1 1 236.359 2.349 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@H](C(C)(C)O)C1 ZINC000877836396 583350448 /nfs/dbraw/zinc/35/04/48/583350448.db2.gz WFDCBOZSWNLGDI-LBPRGKRZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(CN2C[C@@H]3CCC[C@]3([NH3+])C2)c1 ZINC000857226431 588896000 /nfs/dbraw/zinc/89/60/00/588896000.db2.gz NUJFXYGVQPRETI-ZFWWWQNUSA-N 1 1 246.354 2.014 20 10 BECDMO Cc1cccc(CN2C[C@H]3CCC[C@@]3([NH3+])C2)c1O ZINC000857226683 588896406 /nfs/dbraw/zinc/89/64/06/588896406.db2.gz WHTHKVBDQVOSBJ-UKRRQHHQSA-N 1 1 246.354 2.014 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H](CF)C1 ZINC000895572247 583692523 /nfs/dbraw/zinc/69/25/23/583692523.db2.gz FVBYTQKOTAWIJJ-NSHDSACASA-N 1 1 223.291 2.492 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000895847887 583736467 /nfs/dbraw/zinc/73/64/67/583736467.db2.gz XFGQLZLZJZRSCV-HIFRSBDPSA-N 1 1 247.338 2.393 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000895847888 583736936 /nfs/dbraw/zinc/73/69/36/583736936.db2.gz XFGQLZLZJZRSCV-UKRRQHHQSA-N 1 1 247.338 2.393 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCO[C@H](C)CC1 ZINC000896577761 583814506 /nfs/dbraw/zinc/81/45/06/583814506.db2.gz OMPUCGOYVQYPAL-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO C[C@@H]([NH2+]Cc1c(O)cccc1F)[C@H]1CCCO1 ZINC000896636382 583818879 /nfs/dbraw/zinc/81/88/79/583818879.db2.gz CENNIJMYZIHHAW-NOZJJQNGSA-N 1 1 239.290 2.188 20 10 BECDMO C[C@H]([NH2+]Cc1c(O)cccc1F)[C@H]1CCCO1 ZINC000896636384 583819176 /nfs/dbraw/zinc/81/91/76/583819176.db2.gz CENNIJMYZIHHAW-TVQRCGJNSA-N 1 1 239.290 2.188 20 10 BECDMO Cc1nocc1C[NH2+]Cc1c(O)cccc1F ZINC000896638334 583819741 /nfs/dbraw/zinc/81/97/41/583819741.db2.gz OYCIXHRPNJYINO-UHFFFAOYSA-N 1 1 236.246 2.118 20 10 BECDMO CC1(C)C[C@@H]([NH2+]Cc2c(O)cccc2F)CO1 ZINC000896637560 583820061 /nfs/dbraw/zinc/82/00/61/583820061.db2.gz KLMAFXFVPQUBDZ-SECBINFHSA-N 1 1 239.290 2.188 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CC[C@H]2CO)cc1C(C)C ZINC000902629725 584646457 /nfs/dbraw/zinc/64/64/57/584646457.db2.gz ILNXQHATZAEKJE-ZDUSSCGKSA-N 1 1 249.354 2.391 20 10 BECDMO Cc1ncc(C[N@H+](C)Cc2ccccc2O)cn1 ZINC000732202843 584934544 /nfs/dbraw/zinc/93/45/44/584934544.db2.gz GUICXRBYWCHMHO-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]CC2(N)CCC2)c1 ZINC000817964619 584992659 /nfs/dbraw/zinc/99/26/59/584992659.db2.gz FZODSRQWYMLXAI-LLVKDONJSA-N 1 1 234.343 2.233 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H](C)N)c(O)c1 ZINC000817977268 584993300 /nfs/dbraw/zinc/99/33/00/584993300.db2.gz FXHUPOSXPWKFAT-AXFHLTTASA-N 1 1 222.332 2.087 20 10 BECDMO C[C@H]([NH2+][C@H]1CCOC1)c1cc(F)cc(F)c1O ZINC000756766505 585028494 /nfs/dbraw/zinc/02/84/94/585028494.db2.gz AAVAJWASCZAABV-CBAPKCEASA-N 1 1 243.253 2.110 20 10 BECDMO C[C@@H]([NH2+][C@H]1CCOC1)c1cc(F)cc(F)c1O ZINC000756766491 585028513 /nfs/dbraw/zinc/02/85/13/585028513.db2.gz AAVAJWASCZAABV-APPZFPTMSA-N 1 1 243.253 2.110 20 10 BECDMO Oc1ccc(F)cc1C[NH+]1CC(C(F)F)C1 ZINC000839141668 585094286 /nfs/dbraw/zinc/09/42/86/585094286.db2.gz VVCKSMQZYUOENU-UHFFFAOYSA-N 1 1 231.217 2.228 20 10 BECDMO CC(C)[C@@H](O)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886528236 585141649 /nfs/dbraw/zinc/14/16/49/585141649.db2.gz IXPBVEUIODWXJO-CABZTGNLSA-N 1 1 241.306 2.199 20 10 BECDMO COCC(C)(C)C[N@@H+](C)Cc1ccccc1O ZINC000756077280 585314012 /nfs/dbraw/zinc/31/40/12/585314012.db2.gz RYFOIACTEMTRQP-UHFFFAOYSA-N 1 1 237.343 2.497 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)CC2(O)CCC2)c1 ZINC000761220106 585412547 /nfs/dbraw/zinc/41/25/47/585412547.db2.gz UNSHAQWBLDDZEW-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO CCOc1ccc(C[N@@H+](C)CC)c(O)c1 ZINC000768237491 585534266 /nfs/dbraw/zinc/53/42/66/585534266.db2.gz TXZBANFILPJJDY-UHFFFAOYSA-N 1 1 209.289 2.243 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)Cc2cc[nH]n2)c1 ZINC000769383782 585555130 /nfs/dbraw/zinc/55/51/30/585555130.db2.gz JDVUHLLPCNKLCE-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)Cc2cc[nH]n2)c1 ZINC000769383782 585555131 /nfs/dbraw/zinc/55/51/31/585555131.db2.gz JDVUHLLPCNKLCE-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)Cc2cn[nH]c2)cc1 ZINC000771935596 585604932 /nfs/dbraw/zinc/60/49/32/585604932.db2.gz ZEYOQDCJTIZJTO-UHFFFAOYSA-N 1 1 244.342 2.108 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CC[C@@](C)(O)C2)cc1 ZINC000773757110 585642912 /nfs/dbraw/zinc/64/29/12/585642912.db2.gz YPGVXGFTJZYVTJ-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO CCN(C)c1ccc(C[N@@H+]2CCO[C@@H](C)C2)cc1 ZINC000773734954 585642951 /nfs/dbraw/zinc/64/29/51/585642951.db2.gz USFFZFXWROLHFA-ZDUSSCGKSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CCO[C@@H](C)C2)cc1 ZINC000773734954 585642952 /nfs/dbraw/zinc/64/29/52/585642952.db2.gz USFFZFXWROLHFA-ZDUSSCGKSA-N 1 1 248.370 2.363 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@H]([C@@H](C)O)C2)c1O ZINC000780893311 585785773 /nfs/dbraw/zinc/78/57/73/585785773.db2.gz WCXSXCUDTVXVFN-OLZOCXBDSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cc(O)c(C[N@@H+](CCO)C2CCC2)cc1C ZINC000784671219 585865369 /nfs/dbraw/zinc/86/53/69/585865369.db2.gz HZSTUBPDCWMEEA-UHFFFAOYSA-N 1 1 249.354 2.356 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@]2(C)CO)c1 ZINC000789557068 585943915 /nfs/dbraw/zinc/94/39/15/585943915.db2.gz FUQQNKSCIFFMBT-AWEZNQCLSA-N 1 1 235.327 2.047 20 10 BECDMO CC[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(F)cc1O ZINC000796756917 586111668 /nfs/dbraw/zinc/11/16/68/586111668.db2.gz ZFJOWAKEVNCFPC-GFCCVEGCSA-N 1 1 249.289 2.495 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCOCC23CC3)cc1C ZINC000802658609 586309036 /nfs/dbraw/zinc/30/90/36/586309036.db2.gz KCPKWZXLKBBHCY-UHFFFAOYSA-N 1 1 247.338 2.374 20 10 BECDMO Cc1cc(C[N@@H+]2C[C@H](O)C[C@H]2C)ccc1N(C)C ZINC000815079563 586665991 /nfs/dbraw/zinc/66/59/91/586665991.db2.gz SEPYIBASCMARIS-TZMCWYRMSA-N 1 1 248.370 2.016 20 10 BECDMO COC[C@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816530157 586739110 /nfs/dbraw/zinc/73/91/10/586739110.db2.gz WIJVVRYUCGHMHP-ZETCQYMHSA-N 1 1 247.697 2.309 20 10 BECDMO COC[C@H]1CC[N@H+]1Cc1cc(Cl)ccc1O ZINC000816637324 586745725 /nfs/dbraw/zinc/74/57/25/586745725.db2.gz ZUJFWVXTNPZAMH-LLVKDONJSA-N 1 1 241.718 2.266 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@@H](O)CC[C@H]2C)c1O ZINC000817415588 586802408 /nfs/dbraw/zinc/80/24/08/586802408.db2.gz ZIFIEMRWYIHFGJ-YPMHNXCESA-N 1 1 235.327 2.046 20 10 BECDMO CC[C@@H]([NH2+]CCC[NH3+])c1cc(Cl)ccc1[O-] ZINC000817938032 586843933 /nfs/dbraw/zinc/84/39/33/586843933.db2.gz BSAVQIPHPUOTNL-LLVKDONJSA-N 1 1 242.750 2.435 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCNC2)c1 ZINC000817941152 586845510 /nfs/dbraw/zinc/84/55/10/586845510.db2.gz MWEWUJFWTRBAJE-NEPJUHHUSA-N 1 1 234.343 2.103 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCNC2)c1 ZINC000817941154 586845671 /nfs/dbraw/zinc/84/56/71/586845671.db2.gz MWEWUJFWTRBAJE-NWDGAFQWSA-N 1 1 234.343 2.103 20 10 BECDMO CC[NH2+]CCCN[C@H](C)c1ccc(N(C)C)cc1 ZINC000817943614 586846457 /nfs/dbraw/zinc/84/64/57/586846457.db2.gz PRBWIQZDTOCWAM-CYBMUJFWSA-N 1 1 249.402 2.403 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCCN2)c1 ZINC000817948486 586846880 /nfs/dbraw/zinc/84/68/80/586846880.db2.gz AMGQTWSNKKBPOL-OLZOCXBDSA-N 1 1 248.370 2.493 20 10 BECDMO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCCCN1)CC2 ZINC000817949307 586846998 /nfs/dbraw/zinc/84/69/98/586846998.db2.gz IHWKDDHXCYDTGL-CHWSQXEVSA-N 1 1 246.354 2.111 20 10 BECDMO C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cc(Cl)ccc1[O-] ZINC000817953631 586849139 /nfs/dbraw/zinc/84/91/39/586849139.db2.gz RAPAQHKVFGAFQM-DTWKUNHWSA-N 1 1 242.750 2.434 20 10 BECDMO CNCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817953654 586849326 /nfs/dbraw/zinc/84/93/26/586849326.db2.gz ROLYLCWNRFFCEB-NSHDSACASA-N 1 1 248.370 2.141 20 10 BECDMO Cc1[nH]ncc1[C@@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817956229 586850012 /nfs/dbraw/zinc/85/00/12/586850012.db2.gz ULBUDMZSHMTBLF-SNVBAGLBSA-N 1 1 244.342 2.194 20 10 BECDMO CC(C)[C@@H](N)C[NH2+][C@H](C)c1ccccc1O ZINC000817958476 586850742 /nfs/dbraw/zinc/85/07/42/586850742.db2.gz KEYAPYFJXFXOPU-PWSUYJOCSA-N 1 1 222.332 2.026 20 10 BECDMO CC(C)[C@H](N)C[NH2+][C@@H](C)c1ccccc1O ZINC000817958472 586850833 /nfs/dbraw/zinc/85/08/33/586850833.db2.gz KEYAPYFJXFXOPU-CMPLNLGQSA-N 1 1 222.332 2.026 20 10 BECDMO CC(C)[C@H](N)C[NH2+][C@H](C)c1ccccc1O ZINC000817958478 586850888 /nfs/dbraw/zinc/85/08/88/586850888.db2.gz KEYAPYFJXFXOPU-ZYHUDNBSSA-N 1 1 222.332 2.026 20 10 BECDMO CC[C@@H]([NH2+]C[C@H](N)C(C)C)c1ccccc1O ZINC000817960179 586851629 /nfs/dbraw/zinc/85/16/29/586851629.db2.gz XZDCMESMHJHXHC-QWHCGFSZSA-N 1 1 236.359 2.416 20 10 BECDMO C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1cc(Cl)ccc1[O-] ZINC000817961638 586853418 /nfs/dbraw/zinc/85/34/18/586853418.db2.gz BKVSRVGQBZVQES-IUCAKERBSA-N 1 1 242.750 2.291 20 10 BECDMO CC[C@@H](NCC1C[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817964546 586854256 /nfs/dbraw/zinc/85/42/56/586854256.db2.gz CFUVOIRNOFPERE-OAHLLOKOSA-N 1 1 247.386 2.013 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]CC2(N)CCC2)c(O)c1 ZINC000817965247 586854294 /nfs/dbraw/zinc/85/42/94/586854294.db2.gz RVLFBININYKLAZ-LLVKDONJSA-N 1 1 234.343 2.233 20 10 BECDMO C[C@@H](N)C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000817972297 586858851 /nfs/dbraw/zinc/85/88/51/586858851.db2.gz KWUQPRCAKXBPIO-GHMZBOCLSA-N 1 1 248.370 2.269 20 10 BECDMO CC[C@H]([NH2+][C@H](C)[C@H](C)N)c1ccc(C)cc1O ZINC000817977333 586861607 /nfs/dbraw/zinc/86/16/07/586861607.db2.gz HXJLXUBPBDUAIV-LOWVWBTDSA-N 1 1 236.359 2.477 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@@H](C)N)c1 ZINC000817978032 586861914 /nfs/dbraw/zinc/86/19/14/586861914.db2.gz UFMLZPKKCWJXPM-VWYCJHECSA-N 1 1 222.332 2.087 20 10 BECDMO CC[C@@H](N)C[NH2+][C@@H](CC)c1ccccc1O ZINC000817979375 586862158 /nfs/dbraw/zinc/86/21/58/586862158.db2.gz JYHQIRZUUXHMFT-PWSUYJOCSA-N 1 1 222.332 2.170 20 10 BECDMO CC[C@H]([NH2+][C@@H]1CC[C@H]1O)c1ccc(F)cc1O ZINC000818357658 586888972 /nfs/dbraw/zinc/88/89/72/586888972.db2.gz DTSXPLSRWLUBOG-QJPTWQEYSA-N 1 1 239.290 2.095 20 10 BECDMO C[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccccc1O ZINC000818615139 586906905 /nfs/dbraw/zinc/90/69/05/586906905.db2.gz MHOMREMXSHEBKF-CYZMBNFOSA-N 1 1 234.343 2.313 20 10 BECDMO CO[C@H]1CC[C@@H]([N@@H+](C)Cc2ccccc2O)C1 ZINC000821392200 587116031 /nfs/dbraw/zinc/11/60/31/587116031.db2.gz VSNVAZMJIAPUQZ-OLZOCXBDSA-N 1 1 235.327 2.392 20 10 BECDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H]1C1CC1)OCO2 ZINC000824649623 587280585 /nfs/dbraw/zinc/28/05/85/587280585.db2.gz DKVCPUYILOTGND-LLVKDONJSA-N 1 1 247.294 2.105 20 10 BECDMO CC[C@@H]1CN(CC)CC[N@H+]1Cc1ccccc1O ZINC000825006163 587298257 /nfs/dbraw/zinc/29/82/57/587298257.db2.gz YTKRNABPUHRRQS-CQSZACIVSA-N 1 1 248.370 2.308 20 10 BECDMO CC[C@@H]1C[N@H+](CC)CCN1Cc1ccccc1O ZINC000825006163 587298258 /nfs/dbraw/zinc/29/82/58/587298258.db2.gz YTKRNABPUHRRQS-CQSZACIVSA-N 1 1 248.370 2.308 20 10 BECDMO CC[C@@H]1C[N@@H+](CC)CCN1Cc1ccccc1O ZINC000825006163 587298259 /nfs/dbraw/zinc/29/82/59/587298259.db2.gz YTKRNABPUHRRQS-CQSZACIVSA-N 1 1 248.370 2.308 20 10 BECDMO C[C@@]12COC[C@]1(C)C[N@H+](Cc1ccccc1O)C2 ZINC000827017704 587368077 /nfs/dbraw/zinc/36/80/77/587368077.db2.gz IROFIDTZDPQARE-GASCZTMLSA-N 1 1 247.338 2.251 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CC[C@H]3C[C@H]3C2)c1 ZINC000827506067 587384682 /nfs/dbraw/zinc/38/46/82/587384682.db2.gz BWRWJVHPPFGNRX-QWRGUYRKSA-N 1 1 233.311 2.243 20 10 BECDMO COC1(C)C[NH+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840945355 587931294 /nfs/dbraw/zinc/93/12/94/587931294.db2.gz KVCVYQBWKAXCNE-UHFFFAOYSA-N 1 1 248.370 2.282 20 10 BECDMO CCOC1C[NH+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840952715 587931828 /nfs/dbraw/zinc/93/18/28/587931828.db2.gz GUXIJQZBOFTCRW-UHFFFAOYSA-N 1 1 248.370 2.282 20 10 BECDMO CCCC[C@@H](CN)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000841028586 587935910 /nfs/dbraw/zinc/93/59/10/587935910.db2.gz FEMXSBOSTNBXAM-AWEZNQCLSA-N 1 1 248.370 2.229 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@H]2CNCC[C@@H]2C)cc1C ZINC000841059983 587941363 /nfs/dbraw/zinc/94/13/63/587941363.db2.gz ZHWSVZKLAOUWNQ-HZMBPMFUSA-N 1 1 248.370 2.097 20 10 BECDMO CC(C)(C)[C@@H](CN)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000841087131 587945433 /nfs/dbraw/zinc/94/54/33/587945433.db2.gz JGRXPXYEACFMKA-CQSZACIVSA-N 1 1 248.370 2.085 20 10 BECDMO Cc1cccc(C[N@@H+]2CCN[C@@H](C(C)C)C2)c1O ZINC000843104486 588081738 /nfs/dbraw/zinc/08/17/38/588081738.db2.gz IZECDPKBUKCICP-CQSZACIVSA-N 1 1 248.370 2.130 20 10 BECDMO Cc1cccc(C[N@H+]2CCN[C@@H](C(C)C)C2)c1O ZINC000843104486 588081739 /nfs/dbraw/zinc/08/17/39/588081739.db2.gz IZECDPKBUKCICP-CQSZACIVSA-N 1 1 248.370 2.130 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)NC[C@H]2C)cc1C ZINC000843119745 588083588 /nfs/dbraw/zinc/08/35/88/588083588.db2.gz GREFQDCXXWVRJW-QWHCGFSZSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)NC[C@H]2C)cc1C ZINC000843119745 588083590 /nfs/dbraw/zinc/08/35/90/588083590.db2.gz GREFQDCXXWVRJW-QWHCGFSZSA-N 1 1 248.370 2.191 20 10 BECDMO CCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CC[NH2+]C1 ZINC000843358412 588103559 /nfs/dbraw/zinc/10/35/59/588103559.db2.gz NPPGBOBZTURGAI-ZDUSSCGKSA-N 1 1 248.370 2.214 20 10 BECDMO CCC[N@H+](Cc1ccccc1[O-])C[C@H]1CC[NH2+]C1 ZINC000843358412 588103560 /nfs/dbraw/zinc/10/35/60/588103560.db2.gz NPPGBOBZTURGAI-ZDUSSCGKSA-N 1 1 248.370 2.214 20 10 BECDMO CCc1cccc(C[N@@H+](C)C[C@H](O)C2CC2)c1O ZINC000848910987 588419440 /nfs/dbraw/zinc/41/94/40/588419440.db2.gz CJIMOAJMSWOQQW-AWEZNQCLSA-N 1 1 249.354 2.157 20 10 BECDMO CC[C@@H](O)C[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000850528515 588557338 /nfs/dbraw/zinc/55/73/38/588557338.db2.gz IOKVCQYTLUBPQE-ZYHUDNBSSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1ncc(C[N@H+](C)Cc2ccccc2O)o1 ZINC000862228191 589195688 /nfs/dbraw/zinc/19/56/88/589195688.db2.gz MYEONCKVOBYFJE-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO C[N@@H+](CCC[C@H]1CCO1)Cc1ccccc1O ZINC000876616150 590222460 /nfs/dbraw/zinc/22/24/60/590222460.db2.gz TUALWTMKQZEBGH-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1ccc(C[N@@H+](C)Cc2cnccn2)c(O)c1 ZINC000876643795 590225447 /nfs/dbraw/zinc/22/54/47/590225447.db2.gz NBBKVUNTOKTTLU-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC[C@@H](N(C)C)C2)c(O)c1 ZINC000876678131 590229671 /nfs/dbraw/zinc/22/96/71/590229671.db2.gz BXTRHGPQQPTRBU-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN2CCC[C@@H]([NH+](C)C)C2)c(O)c1 ZINC000876678131 590229672 /nfs/dbraw/zinc/22/96/72/590229672.db2.gz BXTRHGPQQPTRBU-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCCO[C@@H](C)C1 ZINC000876685069 590230161 /nfs/dbraw/zinc/23/01/61/590230161.db2.gz XBBXGNSWMLORSP-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)c(O)c1 ZINC000876748796 590236919 /nfs/dbraw/zinc/23/69/19/590236919.db2.gz FRMUARPXZOWQFC-TZMCWYRMSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC[C@H]1C[C@@H](C)O ZINC000876749436 590237270 /nfs/dbraw/zinc/23/72/70/590237270.db2.gz KCHIMTPVCBKKPU-OLZOCXBDSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H]1C[C@H](C)O ZINC000876749439 590237396 /nfs/dbraw/zinc/23/73/96/590237396.db2.gz KCHIMTPVCBKKPU-QWHCGFSZSA-N 1 1 249.354 2.436 20 10 BECDMO CCOCC[N@@H+](C)Cc1c(C)cccc1O ZINC000877172174 590296483 /nfs/dbraw/zinc/29/64/83/590296483.db2.gz LYVSSZXSMUNKMV-UHFFFAOYSA-N 1 1 223.316 2.169 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@H]3COC[C@@H]32)c(O)c1 ZINC000877586185 590367972 /nfs/dbraw/zinc/36/79/72/590367972.db2.gz WGLRDAHYUQCPTD-KGLIPLIRSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](CO)C2)c(O)c1 ZINC000877646507 590384048 /nfs/dbraw/zinc/38/40/48/590384048.db2.gz JFYSBXTVUDKAKH-TZMCWYRMSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[NH+]2CC3(C2)CCCO3)c(O)c1 ZINC000877653821 590385337 /nfs/dbraw/zinc/38/53/37/590385337.db2.gz GPBAYVSXEXCSET-UHFFFAOYSA-N 1 1 233.311 2.065 20 10 BECDMO CCc1noc(C[NH2+][C@H](C)c2ccccc2O)n1 ZINC000879647869 590842348 /nfs/dbraw/zinc/84/23/48/590842348.db2.gz ORRIXTLHKRDMGB-SECBINFHSA-N 1 1 247.298 2.188 20 10 BECDMO Cc1cnc(C[NH2+][C@@H](C)c2ccccc2O)nc1 ZINC000879650570 590843582 /nfs/dbraw/zinc/84/35/82/590843582.db2.gz HWTQCPWPLLKIAX-NSHDSACASA-N 1 1 243.310 2.341 20 10 BECDMO C[C@@H]1CC[C@H](CO)[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000880439517 591042035 /nfs/dbraw/zinc/04/20/35/591042035.db2.gz BKMNWWJBWFGSDJ-IUODEOHRSA-N 1 1 248.370 2.098 20 10 BECDMO CCC[N@H+]1CCC[C@@H]1C(=O)Nc1ccc(N)cc1 ZINC000212585961 591416484 /nfs/dbraw/zinc/41/64/84/591416484.db2.gz DNKIUFOYTQVOSD-CYBMUJFWSA-N 1 1 247.342 2.082 20 10 BECDMO CO[C@@H](C)[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883100023 591539453 /nfs/dbraw/zinc/53/94/53/591539453.db2.gz LPQNEFOQYMLFRJ-YUMQZZPRSA-N 1 1 245.269 2.183 20 10 BECDMO CC[C@H](C)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000132027256 591684528 /nfs/dbraw/zinc/68/45/28/591684528.db2.gz KTMRAJSSWGUCIB-VIFPVBQESA-N 1 1 237.299 2.351 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCOC(C)(C)C2)c1 ZINC000132300926 591699616 /nfs/dbraw/zinc/69/96/16/591699616.db2.gz LNCKOUAGIOQLIY-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@H]1C[C@]12CCOC2 ZINC000886065360 592142095 /nfs/dbraw/zinc/14/20/95/592142095.db2.gz SPQOCVPPIHOWJN-HIFRSBDPSA-N 1 1 247.338 2.251 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@@H]1C[C@@]12CCOC2 ZINC000886065359 592142310 /nfs/dbraw/zinc/14/23/10/592142310.db2.gz SPQOCVPPIHOWJN-DZGCQCFKSA-N 1 1 247.338 2.251 20 10 BECDMO CCOCC[NH2+][C@H](C)c1c(O)cccc1F ZINC000886506478 592239341 /nfs/dbraw/zinc/23/93/41/592239341.db2.gz UWZZTPOBOVYROC-SECBINFHSA-N 1 1 227.279 2.218 20 10 BECDMO CCOCC[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886506479 592239583 /nfs/dbraw/zinc/23/95/83/592239583.db2.gz UWZZTPOBOVYROC-VIFPVBQESA-N 1 1 227.279 2.218 20 10 BECDMO C[C@@H]([NH2+]CC1(O)CCC1)c1c(O)cccc1F ZINC000886526490 592245818 /nfs/dbraw/zinc/24/58/18/592245818.db2.gz NAZIKEBXIINEIL-SECBINFHSA-N 1 1 239.290 2.097 20 10 BECDMO CC[C@@H](CCO)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886531150 592247654 /nfs/dbraw/zinc/24/76/54/592247654.db2.gz XHJLNLSZGFRFKG-UWVGGRQHSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H](CCCO)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886538485 592251964 /nfs/dbraw/zinc/25/19/64/592251964.db2.gz IYOWZMNGKKNRIA-UWVGGRQHSA-N 1 1 241.306 2.343 20 10 BECDMO CC[C@@H](O)CC[NH2+][C@H](C)c1c(O)cccc1F ZINC000886540197 592253284 /nfs/dbraw/zinc/25/32/84/592253284.db2.gz ARJCSJAMKHOHEI-NXEZZACHSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H](O)CCC[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886603392 592271894 /nfs/dbraw/zinc/27/18/94/592271894.db2.gz MXUKHQQVTSMERK-ZJUUUORDSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@H]([NH2+][C@@H]1CO[C@H](C)C1)c1c(O)cccc1F ZINC000886631550 592282471 /nfs/dbraw/zinc/28/24/71/592282471.db2.gz PRBYOTAIPRYNJX-UTLUCORTSA-N 1 1 239.290 2.359 20 10 BECDMO C[C@@H]([NH2+][C@H]1CCC[C@@H]1O)c1c(O)cccc1F ZINC000886646701 592287867 /nfs/dbraw/zinc/28/78/67/592287867.db2.gz QRQSITXPWXQDFK-MIMYLULJSA-N 1 1 239.290 2.095 20 10 BECDMO Nc1ccc([NH2+]C[C@H]2CCCOC2)cc1 ZINC000044981779 631827130 /nfs/dbraw/zinc/82/71/30/631827130.db2.gz BKUATKAZUGWHAQ-SNVBAGLBSA-N 1 1 206.289 2.107 20 10 BECDMO Cc1cc(NCc2ccccc2O)nc(C)[nH+]1 ZINC000163769673 633063971 /nfs/dbraw/zinc/06/39/71/633063971.db2.gz QMCOHNXJQIZPQO-UHFFFAOYSA-N 1 1 229.283 2.411 20 10 BECDMO COc1ccc(CNC[C@@H]2CCC[NH2+]C2)cc1C ZINC000258924087 635225235 /nfs/dbraw/zinc/22/52/35/635225235.db2.gz GLNOOCWZPOYTPC-CQSZACIVSA-N 1 1 248.370 2.093 20 10 BECDMO C[C@H](O)C[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000228090135 640860154 /nfs/dbraw/zinc/86/01/54/640860154.db2.gz KXTAITJSWQDOKA-GUBZILKMSA-N 1 1 241.306 2.341 20 10 BECDMO C[C@@H]([NH3+])[C@H]1CCCCN1Cc1ccccc1O ZINC000063191713 641142731 /nfs/dbraw/zinc/14/27/31/641142731.db2.gz ARWPZRCLDMNYMJ-DGCLKSJQSA-N 1 1 234.343 2.094 20 10 BECDMO C[C@H]([NH3+])[C@H]1CCCCN1Cc1ccccc1O ZINC000063191712 641143509 /nfs/dbraw/zinc/14/35/09/641143509.db2.gz ARWPZRCLDMNYMJ-WCQYABFASA-N 1 1 234.343 2.094 20 10 BECDMO c1nc(C[NH2+]Cc2ccc3c(c2)CCO3)cs1 ZINC000070168360 642421870 /nfs/dbraw/zinc/42/18/70/642421870.db2.gz BRKAKVQAKYNCCR-UHFFFAOYSA-N 1 1 246.335 2.368 20 10 BECDMO C[C@@H]([NH2+]Cc1ncc[nH]1)c1ccc(N(C)C)cc1 ZINC000080581636 642841601 /nfs/dbraw/zinc/84/16/01/642841601.db2.gz ZFPCYBZCIKCWLS-LLVKDONJSA-N 1 1 244.342 2.327 20 10 BECDMO C[N@H+]1CC[C@@H](CSc2nccs2)C1 ZINC000187682057 643091277 /nfs/dbraw/zinc/09/12/77/643091277.db2.gz QSACTAUWLWXVAS-MRVPVSSYSA-N 1 1 214.359 2.187 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2)CCO1 ZINC000932339111 643139808 /nfs/dbraw/zinc/13/98/08/643139808.db2.gz NBMBCODLPKCOHZ-ZDUSSCGKSA-N 1 1 248.370 2.363 20 10 BECDMO COc1cccc(C[N@H+]2C[C@@H](C)[C@@H]2C)c1O ZINC000816647594 643555840 /nfs/dbraw/zinc/55/58/40/643555840.db2.gz VIQPEGIBVJQPLD-ZJUUUORDSA-N 1 1 221.300 2.241 20 10 BECDMO C[C@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)CCO1 ZINC000192596451 644167821 /nfs/dbraw/zinc/16/78/21/644167821.db2.gz NURKTLAVJHCPTM-NSHDSACASA-N 1 1 247.338 2.102 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](OC)C2)cc1 ZINC000773756184 644696066 /nfs/dbraw/zinc/69/60/66/644696066.db2.gz ULQIKNFFWVXKCX-HNNXBMFYSA-N 1 1 248.370 2.363 20 10 BECDMO C[C@@H](O)C[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835047250 645163195 /nfs/dbraw/zinc/16/31/95/645163195.db2.gz DQIYCDNMHYPUFV-CFHLNLSMSA-N 1 1 248.370 2.078 20 10 BECDMO CCCN(Cc1ccccc1O)CC(C)(C)[NH3+] ZINC000843060942 645256647 /nfs/dbraw/zinc/25/66/47/645256647.db2.gz SSJLPXWQFRTSHT-UHFFFAOYSA-N 1 1 236.359 2.342 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c(O)c1 ZINC000877628005 645802504 /nfs/dbraw/zinc/80/25/04/645802504.db2.gz CGLIPPXKCSKBRA-JYAVWHMHSA-N 1 1 249.354 2.149 20 10 BECDMO COCC[N@@H+](CCF)Cc1c(C)cccc1O ZINC000877627154 645803167 /nfs/dbraw/zinc/80/31/67/645803167.db2.gz MXWZXACBMBCEKI-UHFFFAOYSA-N 1 1 241.306 2.119 20 10 BECDMO COC/C(C)=C\C[N@@H+](C)Cc1ccccc1O ZINC000929976819 646381466 /nfs/dbraw/zinc/38/14/66/646381466.db2.gz QIZZTMBJFBDAPP-WQLSENKSSA-N 1 1 235.327 2.417 20 10 BECDMO C[C@@H]([NH2+]Cc1csnn1)c1ccccc1O ZINC000398482894 711710476 /nfs/dbraw/zinc/71/04/76/711710476.db2.gz SKMXGIALJUPHTD-MRVPVSSYSA-N 1 1 235.312 2.095 20 10 BECDMO CO[C@@H](C)CC[NH2+]Cc1cc(F)cc(F)c1O ZINC000708487492 712210956 /nfs/dbraw/zinc/21/09/56/712210956.db2.gz YOXFJWFGUVEWPY-QMMMGPOBSA-N 1 1 245.269 2.185 20 10 BECDMO COC[C@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000393770098 710674043 /nfs/dbraw/zinc/67/40/43/710674043.db2.gz SFDHNHZSAUHFPM-ZETCQYMHSA-N 1 1 247.697 2.309 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@H](C)O ZINC000395646815 711213859 /nfs/dbraw/zinc/21/38/59/711213859.db2.gz DOJDAYIJJRAOID-AUTRQRHGSA-N 1 1 241.306 2.341 20 10 BECDMO Oc1cccc2c1[C@@H]([NH2+]Cc1cocn1)CC2 ZINC000397849111 711393942 /nfs/dbraw/zinc/39/39/42/711393942.db2.gz JDWDZURSSUVGOT-NSHDSACASA-N 1 1 230.267 2.157 20 10 BECDMO CCOc1cccc(C[NH2+]Cc2cocn2)c1O ZINC000397933152 711396487 /nfs/dbraw/zinc/39/64/87/711396487.db2.gz QRHQRFFHYWQQOL-UHFFFAOYSA-N 1 1 248.282 2.069 20 10 BECDMO C[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2[O-])C[C@@H]1C[NH3+] ZINC000397322894 711705371 /nfs/dbraw/zinc/70/53/71/711705371.db2.gz TYSPKHNEKYQMHF-BZPMIXESSA-N 1 1 248.370 2.197 20 10 BECDMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2[O-])C[C@@H]1C[NH3+] ZINC000397322894 711705372 /nfs/dbraw/zinc/70/53/72/711705372.db2.gz TYSPKHNEKYQMHF-BZPMIXESSA-N 1 1 248.370 2.197 20 10 BECDMO CC[NH+]1CCN(Cc2cc(C)c(C)cc2O)CC1 ZINC000125100668 711716506 /nfs/dbraw/zinc/71/65/06/711716506.db2.gz HQFXIMTULOROEV-UHFFFAOYSA-N 1 1 248.370 2.147 20 10 BECDMO CCO[C@H]1CC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000706177231 712141380 /nfs/dbraw/zinc/14/13/80/712141380.db2.gz CNLXGHMGXXJUSF-LBPRGKRZSA-N 1 1 239.290 2.142 20 10 BECDMO COC[C@H](C)C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708486480 712211035 /nfs/dbraw/zinc/21/10/35/712211035.db2.gz RQPZJGOTBZDFAB-MRVPVSSYSA-N 1 1 245.269 2.043 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@@H](COC)C2)c1O ZINC000709309196 712219363 /nfs/dbraw/zinc/21/93/63/712219363.db2.gz SOJZBSZDYDMACZ-GFCCVEGCSA-N 1 1 249.354 2.423 20 10 BECDMO Oc1c(F)cccc1C[NH2+]C[C@@H]1CCC=CO1 ZINC000379958863 712636871 /nfs/dbraw/zinc/63/68/71/712636871.db2.gz ADLOUXBTRPRXIZ-NSHDSACASA-N 1 1 237.274 2.314 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCO[C@H](C)CC2)c1 ZINC000720483492 712846593 /nfs/dbraw/zinc/84/65/93/712846593.db2.gz OLBICXHWGZFZQW-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(C[N@H+]2CCO[C@H](C)CC2)c1O ZINC000720485373 712846771 /nfs/dbraw/zinc/84/67/71/712846771.db2.gz UOLTUMFUISOZIF-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO CC[C@H]1CCC[N@H+]1Cc1cc(O)ccc1O ZINC001141160230 960895382 /nfs/dbraw/zinc/89/53/82/960895382.db2.gz UNESFYMDTBESRX-NSHDSACASA-N 1 1 221.300 2.472 20 10 BECDMO Nc1ccc(C[N@H+]2CCC[C@@H](CF)C2)cc1 ZINC000711499342 962719628 /nfs/dbraw/zinc/71/96/28/962719628.db2.gz RONKHGOAINIMDL-LBPRGKRZSA-N 1 1 222.307 2.450 20 10 BECDMO C[C@@H]1CSCC[N@@H+](Cc2ccc(N)cc2)C1 ZINC000379501770 1166738856 /nfs/dbraw/zinc/73/88/56/1166738856.db2.gz DTGZWCKHHNZSMN-NSHDSACASA-N 1 1 236.384 2.454 20 10 BECDMO CO[C@H](C)[C@H](C)[NH2+]Cc1cccc(F)c1O ZINC000381292069 1167538108 /nfs/dbraw/zinc/53/81/08/1167538108.db2.gz DORYLGMJTANWPI-DTWKUNHWSA-N 1 1 227.279 2.044 20 10 BECDMO CO[C@@H](C)[C@H](C)[NH2+]Cc1cccc(F)c1O ZINC000381292070 1167539990 /nfs/dbraw/zinc/53/99/90/1167539990.db2.gz DORYLGMJTANWPI-IUCAKERBSA-N 1 1 227.279 2.044 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)c1O ZINC001231590896 977642120 /nfs/dbraw/zinc/64/21/20/977642120.db2.gz KRILEZRKMDMBAL-PWSUYJOCSA-N 1 1 223.291 2.490 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@H](C)[C@H]2CO)c1O ZINC001231591224 1167661177 /nfs/dbraw/zinc/66/11/77/1167661177.db2.gz WOQOBXUWQLDYGS-SMDDNHRTSA-N 1 1 249.354 2.293 20 10 BECDMO Oc1ccc(F)c(F)c1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001233332252 978564298 /nfs/dbraw/zinc/56/42/98/978564298.db2.gz FFFCAIGEJOTIKT-OCAPTIKFSA-N 1 1 225.238 2.122 20 10 BECDMO Oc1ccc(F)c(F)c1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001233332252 978564304 /nfs/dbraw/zinc/56/43/04/978564304.db2.gz FFFCAIGEJOTIKT-OCAPTIKFSA-N 1 1 225.238 2.122 20 10 BECDMO C[NH2+][C@@H](C)CC[NH2+]Cc1cc(Cl)ccc1[O-] ZINC001328677827 973258744 /nfs/dbraw/zinc/25/87/44/973258744.db2.gz VOFVDBSBUWCFHF-VIFPVBQESA-N 1 1 242.750 2.133 20 10 BECDMO CC[N@@H+](Cc1ccccc1O)[C@@H]1CCCOC1 ZINC000402685819 970832105 /nfs/dbraw/zinc/83/21/05/970832105.db2.gz KAFYYTFKVKGDKF-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c1O ZINC000690789011 959839587 /nfs/dbraw/zinc/83/95/87/959839587.db2.gz HIOCNSHJCLNYGJ-ZIAGYGMSSA-N 1 1 247.338 2.169 20 10 BECDMO CCN1CCC[N@@H+](Cc2ccc(C)cc2O)CC1 ZINC001140948256 960124621 /nfs/dbraw/zinc/12/46/21/960124621.db2.gz ADCVRBSKLDUTOV-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO CC[N@@H+]1CCCN(Cc2ccc(C)cc2O)CC1 ZINC001140948256 960124629 /nfs/dbraw/zinc/12/46/29/960124629.db2.gz ADCVRBSKLDUTOV-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO CC[N@H+]1CCCN(Cc2ccc(C)cc2O)CC1 ZINC001140948256 960124636 /nfs/dbraw/zinc/12/46/36/960124636.db2.gz ADCVRBSKLDUTOV-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO CN(C)c1ccc(C[N@H+](C)Cc2cnco2)cc1 ZINC001140934092 960718735 /nfs/dbraw/zinc/71/87/35/960718735.db2.gz SQFKXZPPKKRQNU-UHFFFAOYSA-N 1 1 245.326 2.373 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnco2)cc1 ZINC001140934092 960718751 /nfs/dbraw/zinc/71/87/51/960718751.db2.gz SQFKXZPPKKRQNU-UHFFFAOYSA-N 1 1 245.326 2.373 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@](C)(O)[C@@H](C)C2)c(O)c1 ZINC001140948183 960741796 /nfs/dbraw/zinc/74/17/96/960741796.db2.gz WYTLMSJTMFOEMJ-SWLSCSKDSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2CCCC[C@H](O)C2)c(O)c1 ZINC001140947872 960743560 /nfs/dbraw/zinc/74/35/60/960743560.db2.gz JCHYDWDBAIMKJL-ZDUSSCGKSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)c(O)c1 ZINC001140947961 960745184 /nfs/dbraw/zinc/74/51/84/960745184.db2.gz NGVIAQGIUSGIGG-PWSUYJOCSA-N 1 1 223.291 2.490 20 10 BECDMO CCCOC1C[NH+](Cc2ccc(C)cc2O)C1 ZINC001140949787 960748864 /nfs/dbraw/zinc/74/88/64/960748864.db2.gz KWGJFZDZALLSEM-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@H](O)[C@@H](C)C2)c(O)c1 ZINC001140947757 960750421 /nfs/dbraw/zinc/75/04/21/960750421.db2.gz DRHANELDOHTUAY-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO CC(=O)[C@H]1CC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC001140957466 960755264 /nfs/dbraw/zinc/75/52/64/960755264.db2.gz AALXBUWXSCCXOG-LBPRGKRZSA-N 1 1 233.311 2.112 20 10 BECDMO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1ccc(C)cc1O)C2 ZINC001140957744 960755728 /nfs/dbraw/zinc/75/57/28/960755728.db2.gz MIITZYXPNRZNRN-ZFWWWQNUSA-N 1 1 247.338 2.454 20 10 BECDMO CC[N@@H+](Cc1cc(O)ccc1O)C1CC1 ZINC001141156485 960890774 /nfs/dbraw/zinc/89/07/74/960890774.db2.gz YHGFQTMJELDFDR-UHFFFAOYSA-N 1 1 207.273 2.082 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCC[C@@H]2CF)c1 ZINC001141163318 960902665 /nfs/dbraw/zinc/90/26/65/960902665.db2.gz ZNAQQSTWWCBVGZ-SNVBAGLBSA-N 1 1 225.263 2.032 20 10 BECDMO CC1C[NH+](Cc2cc(F)c(F)cc2O)C1 ZINC001142508832 961466151 /nfs/dbraw/zinc/46/61/51/961466151.db2.gz NECLYDLDTLLGEQ-UHFFFAOYSA-N 1 1 213.227 2.122 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)C2CCN(C)CC2)c1 ZINC000131725155 962311170 /nfs/dbraw/zinc/31/11/70/962311170.db2.gz MUTPXVISADNOOW-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO C[C@H]1CC[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001142509092 964347090 /nfs/dbraw/zinc/34/70/90/964347090.db2.gz WMRLRSUQDCAOSG-ZETCQYMHSA-N 1 1 213.227 2.265 20 10 BECDMO C[C@H]1CC[N@H+]1Cc1cc(F)c(F)cc1O ZINC001142509092 964347112 /nfs/dbraw/zinc/34/71/12/964347112.db2.gz WMRLRSUQDCAOSG-ZETCQYMHSA-N 1 1 213.227 2.265 20 10 BECDMO Cn1cccc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001203267308 966589081 /nfs/dbraw/zinc/58/90/81/966589081.db2.gz JKUOJPVKTOCCIZ-UHFFFAOYSA-N 1 1 242.322 2.289 20 10 BECDMO Oc1ccccc1C[N@H+]1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001203549931 966673986 /nfs/dbraw/zinc/67/39/86/966673986.db2.gz DCAQOXXAFYGCFI-SRVKXCTJSA-N 1 1 221.275 2.182 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]2CCO[C@H]2C1 ZINC001203550227 966682116 /nfs/dbraw/zinc/68/21/16/966682116.db2.gz NCXYFBFXTXNNFO-RISCZKNCSA-N 1 1 233.311 2.003 20 10 BECDMO C[C@@]1(O)CCCC[N@@H+](Cc2ccccc2O)C1 ZINC001203550477 966682672 /nfs/dbraw/zinc/68/26/72/966682672.db2.gz VIBMJCFABFCQTR-CQSZACIVSA-N 1 1 235.327 2.129 20 10 BECDMO CN(C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2O)C1 ZINC001203561276 966689674 /nfs/dbraw/zinc/68/96/74/966689674.db2.gz OWEAHDUDSQVLNW-AWEZNQCLSA-N 1 1 246.354 2.061 20 10 BECDMO C[N@H+](C1CC1)[C@H]1CCN(Cc2ccccc2O)C1 ZINC001203561276 966689680 /nfs/dbraw/zinc/68/96/80/966689680.db2.gz OWEAHDUDSQVLNW-AWEZNQCLSA-N 1 1 246.354 2.061 20 10 BECDMO C[N@@H+](C1CC1)[C@H]1CCN(Cc2ccccc2O)C1 ZINC001203561276 966689683 /nfs/dbraw/zinc/68/96/83/966689683.db2.gz OWEAHDUDSQVLNW-AWEZNQCLSA-N 1 1 246.354 2.061 20 10 BECDMO CCCCN1CC[NH+](Cc2ccccc2O)CC1 ZINC001203555806 966692158 /nfs/dbraw/zinc/69/21/58/966692158.db2.gz GKNKPSIOKPPQSA-UHFFFAOYSA-N 1 1 248.370 2.310 20 10 BECDMO C[C@H]1CCC[N@@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203874325 966790631 /nfs/dbraw/zinc/79/06/31/966790631.db2.gz UEDHNWZZMTUKFZ-JTQLQIEISA-N 1 1 221.300 2.330 20 10 BECDMO Oc1ccc(C[N@@H+]2CCCC[C@H](F)C2)cc1O ZINC001203874621 966792779 /nfs/dbraw/zinc/79/27/79/966792779.db2.gz AOJDTMRXGGIXQC-NSHDSACASA-N 1 1 239.290 2.422 20 10 BECDMO Oc1ccc(C[N@H+]2CCCC[C@H](F)C2)cc1O ZINC001203874621 966792787 /nfs/dbraw/zinc/79/27/87/966792787.db2.gz AOJDTMRXGGIXQC-NSHDSACASA-N 1 1 239.290 2.422 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccc(O)c(O)c2)C2(CC2)C1 ZINC001203881642 966808308 /nfs/dbraw/zinc/80/83/08/966808308.db2.gz SBXLCVSTRNGEGD-JTQLQIEISA-N 1 1 233.311 2.472 20 10 BECDMO C[C@H]1CC[C@@H](CO)[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001203930645 966824254 /nfs/dbraw/zinc/82/42/54/966824254.db2.gz BKMNWWJBWFGSDJ-WFASDCNBSA-N 1 1 248.370 2.098 20 10 BECDMO C[C@]1(F)CCC[N@@H+](Cc2ccc(O)cc2O)C1 ZINC001204276795 966949934 /nfs/dbraw/zinc/94/99/34/966949934.db2.gz RNAFAZRGUWSILS-ZDUSSCGKSA-N 1 1 239.290 2.422 20 10 BECDMO C[C@H]1CCC[N@H+]1Cc1ccc(O)cc1O ZINC001204272546 966954687 /nfs/dbraw/zinc/95/46/87/966954687.db2.gz PZLZPLNKAJPHPT-VIFPVBQESA-N 1 1 207.273 2.082 20 10 BECDMO Oc1ccc(C[N@H+]2CCC[C@@H](CF)C2)c(O)c1 ZINC001204278815 966960006 /nfs/dbraw/zinc/96/00/06/966960006.db2.gz KGRDMBBJQCZZIH-JTQLQIEISA-N 1 1 239.290 2.279 20 10 BECDMO CC(=O)C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001204326305 966967354 /nfs/dbraw/zinc/96/73/54/966967354.db2.gz WYZIUZJJLSSAJB-UHFFFAOYSA-N 1 1 246.354 2.308 20 10 BECDMO CC(=O)C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001204326305 966967365 /nfs/dbraw/zinc/96/73/65/966967365.db2.gz WYZIUZJJLSSAJB-UHFFFAOYSA-N 1 1 246.354 2.308 20 10 BECDMO C[N@@H+](Cc1ccc(Cl)cc1O)C1CC(O)C1 ZINC001205340805 967552726 /nfs/dbraw/zinc/55/27/26/967552726.db2.gz LIULXMHVFHDQAV-UHFFFAOYSA-N 1 1 241.718 2.001 20 10 BECDMO Cc1ccc(CN2C[C@@H](C)CC[C@@H]2C[NH3+])c(O)c1 ZINC001205831127 967842253 /nfs/dbraw/zinc/84/22/53/967842253.db2.gz WNLUEEMYHVREBQ-GXTWGEPZSA-N 1 1 248.370 2.260 20 10 BECDMO COc1cc(C)c(C[NH2+]C(CF)CF)c(O)c1 ZINC001205952728 967898888 /nfs/dbraw/zinc/89/88/88/967898888.db2.gz VNPQGOJNPYCAQB-UHFFFAOYSA-N 1 1 245.269 2.106 20 10 BECDMO C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccccc2[O-])C1 ZINC001206541418 968368110 /nfs/dbraw/zinc/36/81/10/968368110.db2.gz HGXLPMSNUWYOLY-OAHLLOKOSA-N 1 1 248.370 2.343 20 10 BECDMO C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccccc2[O-])C1 ZINC001206541418 968368119 /nfs/dbraw/zinc/36/81/19/968368119.db2.gz HGXLPMSNUWYOLY-OAHLLOKOSA-N 1 1 248.370 2.343 20 10 BECDMO C[N@H+](Cc1cccc(F)c1O)[C@H]1CCCOC1 ZINC000401570617 970703029 /nfs/dbraw/zinc/70/30/29/970703029.db2.gz LEFCTFZTDPLEJK-NSHDSACASA-N 1 1 239.290 2.142 20 10 BECDMO C[N@@H+](Cc1cccc(F)c1O)[C@H]1CCCOC1 ZINC000401570617 970703035 /nfs/dbraw/zinc/70/30/35/970703035.db2.gz LEFCTFZTDPLEJK-NSHDSACASA-N 1 1 239.290 2.142 20 10 BECDMO C[N@H+](Cc1cccc(F)c1O)[C@@H]1CCCOC1 ZINC000401570616 970705002 /nfs/dbraw/zinc/70/50/02/970705002.db2.gz LEFCTFZTDPLEJK-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO C[N@@H+](Cc1cccc(F)c1O)[C@@H]1CCCOC1 ZINC000401570616 970705004 /nfs/dbraw/zinc/70/50/04/970705004.db2.gz LEFCTFZTDPLEJK-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO CCCCC[N@@H+](C)Cc1c(O)cc(O)cc1O ZINC001144500305 972848493 /nfs/dbraw/zinc/84/84/93/972848493.db2.gz RJBBOXUXBVBOFL-UHFFFAOYSA-N 1 1 239.315 2.425 20 10 BECDMO C[N@@H+](Cc1c(O)cc(O)cc1O)CC(C)(C)C ZINC001144509420 972858106 /nfs/dbraw/zinc/85/81/06/972858106.db2.gz WDELCTHLXFEPDW-UHFFFAOYSA-N 1 1 239.315 2.281 20 10 BECDMO CC[N@H+](Cc1ccccc1[O-])[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246858910 973167498 /nfs/dbraw/zinc/16/74/98/973167498.db2.gz CYDPZSDPNVKDKK-TZMCWYRMSA-N 1 1 248.370 2.355 20 10 BECDMO CC[N@@H+](Cc1ccccc1[O-])[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246858910 973167509 /nfs/dbraw/zinc/16/75/09/973167509.db2.gz CYDPZSDPNVKDKK-TZMCWYRMSA-N 1 1 248.370 2.355 20 10 BECDMO C[NH2+][C@H](C)CC[NH2+]Cc1cc(Cl)ccc1[O-] ZINC001328677825 973259290 /nfs/dbraw/zinc/25/92/90/973259290.db2.gz VOFVDBSBUWCFHF-SECBINFHSA-N 1 1 242.750 2.133 20 10 BECDMO Nc1ccc(C[N@@H+](CCO)C2CCCC2)cc1 ZINC000044414777 973748398 /nfs/dbraw/zinc/74/83/98/973748398.db2.gz AUFFLWUHDAEIQX-UHFFFAOYSA-N 1 1 234.343 2.006 20 10 BECDMO CNC[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001330117857 974113154 /nfs/dbraw/zinc/11/31/54/974113154.db2.gz AFQDSVCRWJSASV-SDDRHHMPSA-N 1 1 248.370 2.446 20 10 BECDMO Cc1cccc(C[N@@H+]2CC[C@@H](C)[C@](C)(O)C2)c1O ZINC001231591258 977637109 /nfs/dbraw/zinc/63/71/09/977637109.db2.gz XGSHXRDQVNZRHS-IUODEOHRSA-N 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Oc1cccc(F)c1C[N@@H+]1C[C@@H]2C[C@H]1C[C@H]2F ZINC001137837879 990857257 /nfs/dbraw/zinc/85/72/57/990857257.db2.gz YAKUAMNQEZSYOD-HOTUBEGUSA-N 1 1 239.265 2.464 20 10 BECDMO Oc1cccc(F)c1C[N@H+]1C[C@@H]2C[C@H]1C[C@H]2F ZINC001137837879 990857263 /nfs/dbraw/zinc/85/72/63/990857263.db2.gz YAKUAMNQEZSYOD-HOTUBEGUSA-N 1 1 239.265 2.464 20 10 BECDMO CO[C@H](C)[C@H](C)[NH2+]Cc1cc(F)c(F)cc1O ZINC001308690931 991096187 /nfs/dbraw/zinc/09/61/87/991096187.db2.gz ICNWYYGNCQVUDE-JGVFFNPUSA-N 1 1 245.269 2.183 20 10 BECDMO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc(F)ccc1O ZINC001140058171 991509833 /nfs/dbraw/zinc/50/98/33/991509833.db2.gz TVKWNWJISREIJB-LDYMZIIASA-N 1 1 227.254 2.464 20 10 BECDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@@H](CO)C2)c1 ZINC001560666553 991541658 /nfs/dbraw/zinc/54/16/58/991541658.db2.gz HCVWCPVGHIVUHF-GFCCVEGCSA-N 1 1 249.354 2.330 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CC[C@H]3OCC[C@H]32)c1O ZINC001140178992 991548385 /nfs/dbraw/zinc/54/83/85/991548385.db2.gz AYSSXLAQZKYNIZ-ZIAGYGMSSA-N 1 1 247.338 2.372 20 10 BECDMO Cc1ccc(C)c(C[N@@H+]2C[C@H](O)CC[C@H]2C)c1O ZINC001140178603 991548972 /nfs/dbraw/zinc/54/89/72/991548972.db2.gz QIOOGXQLACVVSJ-CHWSQXEVSA-N 1 1 249.354 2.354 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCCC[C@@H]2CO)c1O ZINC001140179201 991549471 /nfs/dbraw/zinc/54/94/71/991549471.db2.gz BSVMJTDEPLVBDB-CYBMUJFWSA-N 1 1 249.354 2.356 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CC[C@@](C)(CO)C2)c1O ZINC001140178833 991549494 /nfs/dbraw/zinc/54/94/94/991549494.db2.gz ZHJZJGFSJQGMET-OAHLLOKOSA-N 1 1 249.354 2.213 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2C[C@@H](C)C[C@H]2CO)c1O ZINC001140178396 991550752 /nfs/dbraw/zinc/55/07/52/991550752.db2.gz KLDVOGCAFRAQSJ-GWCFXTLKSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCC[C@H](CO)C2)c1O ZINC001140179936 991553229 /nfs/dbraw/zinc/55/32/29/991553229.db2.gz KFMOPXBWIGRQPN-ZDUSSCGKSA-N 1 1 249.354 2.213 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@H](C)[C@H](O)C2)c1O ZINC001560811563 991610171 /nfs/dbraw/zinc/61/01/71/991610171.db2.gz PENYBKZLBABDDT-SMDDNHRTSA-N 1 1 249.354 2.157 20 10 BECDMO CNCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001261423620 992296639 /nfs/dbraw/zinc/29/66/39/992296639.db2.gz ANCZGBTVCGCZLO-GHMZBOCLSA-N 1 1 234.343 2.058 20 10 BECDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(N)cc1 ZINC001262487711 992892370 /nfs/dbraw/zinc/89/23/70/992892370.db2.gz BUERBMQKPWXHSQ-LALPHHSUSA-N 1 1 248.370 2.250 20 10 BECDMO CC(C)c1ccc(O)c(C[NH2+][C@H](C)[C@@H](C)N)c1 ZINC001575858984 993116030 /nfs/dbraw/zinc/11/60/30/993116030.db2.gz VVIUTNMMBOPKMO-GHMZBOCLSA-N 1 1 236.359 2.341 20 10 BECDMO CC(C)c1ccc(O)c(CN[C@H](C)[C@@H](C)[NH3+])c1 ZINC001575858984 993116031 /nfs/dbraw/zinc/11/60/31/993116031.db2.gz VVIUTNMMBOPKMO-GHMZBOCLSA-N 1 1 236.359 2.341 20 10 BECDMO Nc1ccc(C[N@H+]2CCOCC23CCCC3)cc1 ZINC000388653756 993734197 /nfs/dbraw/zinc/73/41/97/993734197.db2.gz SPTRPQSDUCDOOE-UHFFFAOYSA-N 1 1 246.354 2.414 20 10 BECDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)[C@H](C)O ZINC001615686620 1170529463 /nfs/dbraw/zinc/52/94/63/1170529463.db2.gz RSROWVGUFAHEBF-NEPJUHHUSA-N 1 1 237.343 2.374 20 10 BECDMO CCOC[C@H](C)[NH2+]Cc1cc(F)c(F)cc1O ZINC001621271803 1170758049 /nfs/dbraw/zinc/75/80/49/1170758049.db2.gz LBOJTHPUFJRZLB-QMMMGPOBSA-N 1 1 245.269 2.185 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](C)[C@@H]2CO)cc1C ZINC000191185955 178195473 /nfs/dbraw/zinc/19/54/73/178195473.db2.gz RKFRQHNDBVGDOP-HZMBPMFUSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCOC[C@H](C)C2)c1 ZINC000370053958 398249491 /nfs/dbraw/zinc/24/94/91/398249491.db2.gz SJSXARGRTSVTGK-GFCCVEGCSA-N 1 1 235.327 2.169 20 10 BECDMO Cn1cccc1C[N@@H+](C)Cc1ccccc1O ZINC000091974676 398304194 /nfs/dbraw/zinc/30/41/94/398304194.db2.gz FZIHONZAOJSJJU-UHFFFAOYSA-N 1 1 230.311 2.363 20 10 BECDMO CC[N@@H+](Cc1cc(OC)ccc1O)C1CC1 ZINC000179684002 346992563 /nfs/dbraw/zinc/99/25/63/346992563.db2.gz GBSNTCOJHSMHSB-UHFFFAOYSA-N 1 1 221.300 2.385 20 10 BECDMO CC[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000070976158 343958119 /nfs/dbraw/zinc/95/81/19/343958119.db2.gz ZITDVRLBVWVRQX-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1cccc(C[N@H+](C)CC(C)(C)CO)c1O ZINC000294664694 179063100 /nfs/dbraw/zinc/06/31/00/179063100.db2.gz ALLAWHLNVJNXHC-UHFFFAOYSA-N 1 1 237.343 2.151 20 10 BECDMO Cc1cccc(C[N@@H+]2CCN(C)CC2(C)C)c1O ZINC000271891880 179076199 /nfs/dbraw/zinc/07/61/99/179076199.db2.gz XFYLNFFEPCCUMB-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1csc(C[NH2+]Cc2ccc(N)cc2)n1 ZINC000049539112 179777096 /nfs/dbraw/zinc/77/70/96/179777096.db2.gz XVLRJJHMQGQFJZ-UHFFFAOYSA-N 1 1 233.340 2.324 20 10 BECDMO CCN1CC[N@@H+](Cc2cc(C)ccc2O)[C@H](C)C1 ZINC000289211781 352176093 /nfs/dbraw/zinc/17/60/93/352176093.db2.gz CAJMUKKPDXAALX-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2cc(C)ccc2O)[C@H](C)C1 ZINC000289211781 352176095 /nfs/dbraw/zinc/17/60/95/352176095.db2.gz CAJMUKKPDXAALX-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2cc(C)ccc2O)[C@H](C)C1 ZINC000289211781 352176098 /nfs/dbraw/zinc/17/60/98/352176098.db2.gz CAJMUKKPDXAALX-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC(C)(C)[C@@H](CO)[NH2+]Cc1cccc(F)c1O ZINC000278538200 188267427 /nfs/dbraw/zinc/26/74/27/188267427.db2.gz WRIHERMXMNYGQD-LLVKDONJSA-N 1 1 241.306 2.028 20 10 BECDMO CC(C)(O)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293649765 188391047 /nfs/dbraw/zinc/39/10/47/188391047.db2.gz OPOXLQLTBRZPQD-UHFFFAOYSA-N 1 1 247.697 2.045 20 10 BECDMO Oc1c(F)cccc1C[NH2+]C[C@H]1CCSC1 ZINC000228556641 183255884 /nfs/dbraw/zinc/25/58/84/183255884.db2.gz CGBWOMHSQCNRGS-SECBINFHSA-N 1 1 241.331 2.374 20 10 BECDMO CCC[N@@H+](CCO)Cc1c(O)cccc1Cl ZINC000128034418 169165659 /nfs/dbraw/zinc/16/56/59/169165659.db2.gz GYPFZDPRTMMOOF-UHFFFAOYSA-N 1 1 243.734 2.250 20 10 BECDMO Oc1ccccc1C[N@H+]1CCN2CCCC[C@@H]2C1 ZINC000156079222 183301419 /nfs/dbraw/zinc/30/14/19/183301419.db2.gz FLKNTPGSRCKZEA-CQSZACIVSA-N 1 1 246.354 2.062 20 10 BECDMO Oc1ccccc1CN1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000156079222 183301420 /nfs/dbraw/zinc/30/14/20/183301420.db2.gz FLKNTPGSRCKZEA-CQSZACIVSA-N 1 1 246.354 2.062 20 10 BECDMO Oc1ccccc1CN1CC[N@H+]2CCCC[C@@H]2C1 ZINC000156079222 183301422 /nfs/dbraw/zinc/30/14/22/183301422.db2.gz FLKNTPGSRCKZEA-CQSZACIVSA-N 1 1 246.354 2.062 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000368623037 183302443 /nfs/dbraw/zinc/30/24/43/183302443.db2.gz HLZCUARDAGHKDJ-GFCCVEGCSA-N 1 1 243.310 2.452 20 10 BECDMO CC[C@H](C[NH2+]Cc1cccc(F)c1O)OC ZINC000290371824 384031239 /nfs/dbraw/zinc/03/12/39/384031239.db2.gz AOTWVIIJNDFIDH-SNVBAGLBSA-N 1 1 227.279 2.046 20 10 BECDMO C[C@H](CCN(C)C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297598550 384307411 /nfs/dbraw/zinc/30/74/11/384307411.db2.gz HXJBMZKTLNPFDQ-DGCLKSJQSA-N 1 1 248.370 2.309 20 10 BECDMO C[N@@H+](Cc1ccccc1O)CC1(O)CCCC1 ZINC000121141921 384400306 /nfs/dbraw/zinc/40/03/06/384400306.db2.gz HBCHKTWJUIPUMF-UHFFFAOYSA-N 1 1 235.327 2.129 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@@H]1CCCCO1 ZINC000096477920 384461806 /nfs/dbraw/zinc/46/18/06/384461806.db2.gz IFDPVIVHQXUIAG-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCC[C@](C)(O)C2)cc1 ZINC000129396312 385147724 /nfs/dbraw/zinc/14/77/24/385147724.db2.gz BOXYSCUZHMRSSR-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCO[C@H](C3CC3)C2)c1 ZINC000368411168 385318288 /nfs/dbraw/zinc/31/82/88/385318288.db2.gz NBJNQJBPVNXGCL-HNNXBMFYSA-N 1 1 247.338 2.311 20 10 BECDMO CC[C@@]1(C)C[N@@H+](Cc2ccccc2O)CCO1 ZINC000191148571 385286108 /nfs/dbraw/zinc/28/61/08/385286108.db2.gz JSBLLSAPXHMZCZ-AWEZNQCLSA-N 1 1 235.327 2.393 20 10 BECDMO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccccc1O ZINC000131487634 385338123 /nfs/dbraw/zinc/33/81/23/385338123.db2.gz PPIWFNPWUHFHMM-AAEUAGOBSA-N 1 1 235.327 2.392 20 10 BECDMO C[C@H]([NH2+]CCCCCO)c1ccc(F)cc1O ZINC000192931060 385376523 /nfs/dbraw/zinc/37/65/23/385376523.db2.gz JHHQSZLPIGSQIZ-JTQLQIEISA-N 1 1 241.306 2.345 20 10 BECDMO CCC[C@@H](O)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168770490 385384718 /nfs/dbraw/zinc/38/47/18/385384718.db2.gz RFRCBNCEHWTBDU-GXSJLCMTSA-N 1 1 241.306 2.343 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000361050127 385526309 /nfs/dbraw/zinc/52/63/09/385526309.db2.gz FUQBVQJKWDANNP-TZMCWYRMSA-N 1 1 247.338 2.251 20 10 BECDMO COC[C@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000271182277 385799390 /nfs/dbraw/zinc/79/93/90/385799390.db2.gz MLTRCDKSKOKGBC-AWEZNQCLSA-N 1 1 248.370 2.221 20 10 BECDMO COC[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000271182278 385799602 /nfs/dbraw/zinc/79/96/02/385799602.db2.gz MLTRCDKSKOKGBC-CQSZACIVSA-N 1 1 248.370 2.221 20 10 BECDMO CC[N@@H+](CCCO)Cc1c(O)cccc1Cl ZINC000271206603 385802338 /nfs/dbraw/zinc/80/23/38/385802338.db2.gz SFGWIWKTFHIBPT-UHFFFAOYSA-N 1 1 243.734 2.250 20 10 BECDMO CC[C@H]([NH2+]CCCCO)c1ccc(F)cc1O ZINC000287586828 386134827 /nfs/dbraw/zinc/13/48/27/386134827.db2.gz RJYQKGIQMFCIST-LBPRGKRZSA-N 1 1 241.306 2.345 20 10 BECDMO C[C@H]([NH2+]Cc1cccc(F)c1O)[C@@H]1CCOC1 ZINC000166136867 386474301 /nfs/dbraw/zinc/47/43/01/386474301.db2.gz GNBPFTMQXLZCFB-GXSJLCMTSA-N 1 1 239.290 2.046 20 10 BECDMO C[C@H](O)CCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000228032336 386531985 /nfs/dbraw/zinc/53/19/85/386531985.db2.gz YDSJVMHEOMGFGL-UWVGGRQHSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@](C)(O)CC2)c1 ZINC000279648147 386713332 /nfs/dbraw/zinc/71/33/32/386713332.db2.gz KDMFIIWVDKRGOM-OAHLLOKOSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1cc(C[N@H+]2CCC[C@@H]2CO)ccc1N(C)C ZINC000292945386 386755238 /nfs/dbraw/zinc/75/52/38/386755238.db2.gz BSLLJKYTBRXKBQ-CQSZACIVSA-N 1 1 248.370 2.018 20 10 BECDMO Oc1ccccc1C[N@H+]1CCOCC12CCC2 ZINC000179577341 134321954 /nfs/dbraw/zinc/32/19/54/134321954.db2.gz UMKUVTQOXDCUGN-UHFFFAOYSA-N 1 1 233.311 2.147 20 10 BECDMO CC(C)OCC[N@@H+](C)Cc1ccccc1O ZINC000109772872 167227250 /nfs/dbraw/zinc/22/72/50/167227250.db2.gz KCUOSYHUKKSIHX-UHFFFAOYSA-N 1 1 223.316 2.249 20 10 BECDMO CC[C@@H](CO)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000295209185 170834320 /nfs/dbraw/zinc/83/43/20/170834320.db2.gz ZUKDENBNNMUVEL-ZDUSSCGKSA-N 1 1 237.343 2.212 20 10 BECDMO CC[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000119586262 171011018 /nfs/dbraw/zinc/01/10/18/171011018.db2.gz FPMZWAKPYHWDDK-SNVBAGLBSA-N 1 1 249.310 2.353 20 10 BECDMO CC[C@@H]1CC[N@H+]1Cc1cc(OC)ccc1O ZINC000292897624 171025733 /nfs/dbraw/zinc/02/57/33/171025733.db2.gz ZOTKTVXSKYQIJV-LLVKDONJSA-N 1 1 221.300 2.385 20 10 BECDMO CC[C@@]1(CO)CCC[N@H+]1Cc1cc(C)ccc1O ZINC000191958119 171213488 /nfs/dbraw/zinc/21/34/88/171213488.db2.gz XJFNUMNMVWSRDV-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO CCc1nnc(C[NH2+]Cc2ccccc2O)s1 ZINC000289684521 172052563 /nfs/dbraw/zinc/05/25/63/172052563.db2.gz CSWSWOOUMIILLQ-UHFFFAOYSA-N 1 1 249.339 2.096 20 10 BECDMO COCCC[N@@H+](C)Cc1cccc(C)c1O ZINC000162817035 174218550 /nfs/dbraw/zinc/21/85/50/174218550.db2.gz PGRZQXAFLUSNDS-UHFFFAOYSA-N 1 1 223.316 2.169 20 10 BECDMO COc1cccc(C[N@@H+](C)C(C)C)c1O ZINC000132486655 175253940 /nfs/dbraw/zinc/25/39/40/175253940.db2.gz BGJUXOYHACNGAN-UHFFFAOYSA-N 1 1 209.289 2.241 20 10 BECDMO COc1cccc(C[N@@H+]2CCC=C(F)C2)c1O ZINC000274525744 175256611 /nfs/dbraw/zinc/25/66/11/175256611.db2.gz ZRKWGJXSBBLWIE-UHFFFAOYSA-N 1 1 237.274 2.460 20 10 BECDMO COc1cccc(C[N@H+]2CCC=C(F)C2)c1O ZINC000274525744 175256613 /nfs/dbraw/zinc/25/66/13/175256613.db2.gz ZRKWGJXSBBLWIE-UHFFFAOYSA-N 1 1 237.274 2.460 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)CCS1 ZINC000180069789 176301095 /nfs/dbraw/zinc/30/10/95/176301095.db2.gz QKYJWCHIZDCMAW-SECBINFHSA-N 1 1 241.331 2.469 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)[C@H](C)CO1 ZINC000132611397 176307788 /nfs/dbraw/zinc/30/77/88/176307788.db2.gz YBIJZSUQEIAVTR-GHMZBOCLSA-N 1 1 221.300 2.001 20 10 BECDMO C[C@@H]1CSCC[N@@H+]1Cc1cccc(F)c1O ZINC000272253591 176350983 /nfs/dbraw/zinc/35/09/83/176350983.db2.gz ITSNBPJFZOSADA-SECBINFHSA-N 1 1 241.331 2.469 20 10 BECDMO C[C@@H]1CSCC[N@H+]1Cc1cccc(F)c1O ZINC000272253591 176350984 /nfs/dbraw/zinc/35/09/84/176350984.db2.gz ITSNBPJFZOSADA-SECBINFHSA-N 1 1 241.331 2.469 20 10 BECDMO C[C@H]1COCC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000376582055 177287855 /nfs/dbraw/zinc/28/78/55/177287855.db2.gz RIKHKNSCLCMDQM-CYBMUJFWSA-N 1 1 248.370 2.221 20 10 BECDMO CC[C@@H]([NH2+][C@@H](C)CNC)c1ccccc1O ZINC000854230873 588780803 /nfs/dbraw/zinc/78/08/03/588780803.db2.gz BAZUTJQVCOQEBQ-CMPLNLGQSA-N 1 1 222.332 2.041 20 10 BECDMO C[N@@H+](CC[C@H]1CCOC1)Cc1ccccc1O ZINC000783535033 582959156 /nfs/dbraw/zinc/95/91/56/582959156.db2.gz JWFSGRHAMBUMGU-LBPRGKRZSA-N 1 1 235.327 2.251 20 10 BECDMO Cc1cccc(O)c1C[NH2+]CC[C@@H](C)N(C)C ZINC000895292107 583637673 /nfs/dbraw/zinc/63/76/73/583637673.db2.gz FAHBWWJZPGFJRE-GFCCVEGCSA-N 1 1 236.359 2.130 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](CF)C1 ZINC000895572488 583691937 /nfs/dbraw/zinc/69/19/37/583691937.db2.gz FCPLLSBZDHHCPZ-JTQLQIEISA-N 1 1 239.290 2.192 20 10 BECDMO C[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2F)[C@H](C)O1 ZINC000896639431 583819737 /nfs/dbraw/zinc/81/97/37/583819737.db2.gz UHDGGOXLLBMPNB-VDDIYKPWSA-N 1 1 239.290 2.187 20 10 BECDMO CCC[C@H](C[NH2+]Cc1c(O)cccc1F)OC ZINC000896639085 583819748 /nfs/dbraw/zinc/81/97/48/583819748.db2.gz UGVZJJIRHLFTRZ-SNVBAGLBSA-N 1 1 241.306 2.436 20 10 BECDMO CC[C@@](C)(C[NH2+]Cc1c(O)cccc1F)OC ZINC000896639809 583820329 /nfs/dbraw/zinc/82/03/29/583820329.db2.gz XWSZTLGHRAHXCZ-ZDUSSCGKSA-N 1 1 241.306 2.436 20 10 BECDMO CO[C@@H](C)[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896641587 583820418 /nfs/dbraw/zinc/82/04/18/583820418.db2.gz NCBNPJQUHBNZPU-IUCAKERBSA-N 1 1 227.279 2.044 20 10 BECDMO C[C@@H]1CSC[C@H]1[NH2+]Cc1c(O)cccc1F ZINC000896640174 583820439 /nfs/dbraw/zinc/82/04/39/583820439.db2.gz ZOWDXZYTCAYDRV-LDYMZIIASA-N 1 1 241.331 2.372 20 10 BECDMO CCO[C@H]1CC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000897061839 583875894 /nfs/dbraw/zinc/87/58/94/583875894.db2.gz NBGWDMZMNKHSBU-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cc(O)c(C[NH2+]C[C@H]2CCCCN2)cc1C ZINC000841033189 584032065 /nfs/dbraw/zinc/03/20/65/584032065.db2.gz OUQKZTPTPRPOHS-CQSZACIVSA-N 1 1 248.370 2.241 20 10 BECDMO C/C=C\C[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000858537757 588963822 /nfs/dbraw/zinc/96/38/22/588963822.db2.gz PRFDRGWQEFITBO-LWTINBJPSA-N 1 1 249.310 2.406 20 10 BECDMO C[C@H]([NH2+][C@H]1COC[C@H]1C)c1c(O)cccc1F ZINC000903393067 584756259 /nfs/dbraw/zinc/75/62/59/584756259.db2.gz FLAJGTCENUTOLJ-YWVKMMECSA-N 1 1 239.290 2.217 20 10 BECDMO Cc1cnn(CC[N@H+](C)Cc2ccccc2O)c1 ZINC000732202651 584934827 /nfs/dbraw/zinc/93/48/27/584934827.db2.gz AOALRYOIGHASMV-UHFFFAOYSA-N 1 1 245.326 2.029 20 10 BECDMO CCN(C)c1ccc(C[N@@H+]2CCOC[C@H]2C)cc1 ZINC000741753418 584948704 /nfs/dbraw/zinc/94/87/04/584948704.db2.gz XROZBFALNUAFFX-CYBMUJFWSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CCOC[C@H]2C)cc1 ZINC000741753418 584948705 /nfs/dbraw/zinc/94/87/05/584948705.db2.gz XROZBFALNUAFFX-CYBMUJFWSA-N 1 1 248.370 2.363 20 10 BECDMO C[NH2+]CCCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000817940471 584991976 /nfs/dbraw/zinc/99/19/76/584991976.db2.gz MZKIFNHTSWTLHA-LBPRGKRZSA-N 1 1 235.375 2.013 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](C)N)c(O)c1 ZINC000817977271 584993061 /nfs/dbraw/zinc/99/30/61/584993061.db2.gz FXHUPOSXPWKFAT-VWYCJHECSA-N 1 1 222.332 2.087 20 10 BECDMO C[C@H]([NH2+]Cc1cccc(F)c1O)c1ccn(C)n1 ZINC000839191442 585097322 /nfs/dbraw/zinc/09/73/22/585097322.db2.gz PPJOULUYKLQMIO-VIFPVBQESA-N 1 1 249.289 2.116 20 10 BECDMO CCOCC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756417233 585319754 /nfs/dbraw/zinc/31/97/54/585319754.db2.gz LSFHBHBZPRLSAV-MRVPVSSYSA-N 1 1 245.269 2.358 20 10 BECDMO COc1cccc(C[N@@H+](C)Cc2ccc[nH]2)c1O ZINC000769544527 585559195 /nfs/dbraw/zinc/55/91/95/585559195.db2.gz XTJFTURBCKUJGD-UHFFFAOYSA-N 1 1 246.310 2.361 20 10 BECDMO COCC[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775648004 585682441 /nfs/dbraw/zinc/68/24/41/585682441.db2.gz LVCPSICABDOMLX-UHFFFAOYSA-N 1 1 243.734 2.432 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)N(C)C[C@@H]2C)c1 ZINC000775985172 585688818 /nfs/dbraw/zinc/68/88/18/585688818.db2.gz KJLNUJKFEFWKSP-STQMWFEESA-N 1 1 248.370 2.225 20 10 BECDMO CC(=O)c1cc(F)cc(C[N@H+]2CC=CCC2)c1O ZINC000778965274 585743091 /nfs/dbraw/zinc/74/30/91/585743091.db2.gz AAVOWTZPBOZDGK-UHFFFAOYSA-N 1 1 249.285 2.496 20 10 BECDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC=CCC2)c1O ZINC000778965274 585743092 /nfs/dbraw/zinc/74/30/92/585743092.db2.gz AAVOWTZPBOZDGK-UHFFFAOYSA-N 1 1 249.285 2.496 20 10 BECDMO CCN1C[C@H](C)[N@@H+](Cc2ccccc2O)C[C@@H]1C ZINC000779017783 585743714 /nfs/dbraw/zinc/74/37/14/585743714.db2.gz BPIOVKMFFPRZPP-STQMWFEESA-N 1 1 248.370 2.307 20 10 BECDMO CC[N@@H+]1C[C@H](C)N(Cc2ccccc2O)C[C@@H]1C ZINC000779017783 585743715 /nfs/dbraw/zinc/74/37/15/585743715.db2.gz BPIOVKMFFPRZPP-STQMWFEESA-N 1 1 248.370 2.307 20 10 BECDMO CC[N@H+]1C[C@H](C)N(Cc2ccccc2O)C[C@@H]1C ZINC000779017783 585743716 /nfs/dbraw/zinc/74/37/16/585743716.db2.gz BPIOVKMFFPRZPP-STQMWFEESA-N 1 1 248.370 2.307 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)[C@@H](C)[C@@H](C)O1 ZINC000783738476 585841531 /nfs/dbraw/zinc/84/15/31/585841531.db2.gz WPPUDUOEXWEWPO-GRYCIOLGSA-N 1 1 235.327 2.390 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CC[C@H]3C[C@H]32)cc1 ZINC000785770606 585880358 /nfs/dbraw/zinc/88/03/58/585880358.db2.gz ZLCRROIRIULFGN-GXTWGEPZSA-N 1 1 216.328 2.347 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@@]2(C)CO)c1O ZINC000789557761 585944207 /nfs/dbraw/zinc/94/42/07/585944207.db2.gz LTLFANYIDVPZAF-AWEZNQCLSA-N 1 1 235.327 2.047 20 10 BECDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](F)C1)CCC2 ZINC000840105692 586447472 /nfs/dbraw/zinc/44/74/72/586447472.db2.gz PYYCBSOCQVDOEF-CYBMUJFWSA-N 1 1 235.302 2.425 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CC[C@H](O)C2(C)C)cc1C ZINC000812779310 586583859 /nfs/dbraw/zinc/58/38/59/586583859.db2.gz LUZNQEQNZDFJRE-AWEZNQCLSA-N 1 1 249.354 2.354 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@H]1C ZINC000816647257 586748576 /nfs/dbraw/zinc/74/85/76/586748576.db2.gz QEBWYIIJBDHMDV-BDAKNGLRSA-N 1 1 209.264 2.372 20 10 BECDMO C[C@@H]1C[N@H+](Cc2cccc(F)c2O)[C@@H]1C ZINC000816646815 586749108 /nfs/dbraw/zinc/74/91/08/586749108.db2.gz JHYPPZRXJGRMRM-RKDXNWHRSA-N 1 1 209.264 2.372 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cccc(F)c2O)[C@@H]1C ZINC000816646815 586749109 /nfs/dbraw/zinc/74/91/09/586749109.db2.gz JHYPPZRXJGRMRM-RKDXNWHRSA-N 1 1 209.264 2.372 20 10 BECDMO COc1cccc(O)c1C[N@H+]1C[C@H](C)[C@H]1C ZINC000816649133 586751340 /nfs/dbraw/zinc/75/13/40/586751340.db2.gz URQBEHJEVSLERC-VHSXEESVSA-N 1 1 221.300 2.241 20 10 BECDMO C[C@H]([NH2+]CCN)c1ccc(N2CCCCC2)cc1 ZINC000817934653 586843359 /nfs/dbraw/zinc/84/33/59/586843359.db2.gz MGYLZWCOCFRQEN-ZDUSSCGKSA-N 1 1 247.386 2.286 20 10 BECDMO C[C@H]([NH2+][C@H]1CCCNC1)c1ccc(N(C)C)cc1 ZINC000817941261 586845120 /nfs/dbraw/zinc/84/51/20/586845120.db2.gz PBIUIBUHVRLDRO-JSGCOSHPSA-N 1 1 247.386 2.155 20 10 BECDMO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCCNC2)c(O)c1 ZINC000817941533 586845680 /nfs/dbraw/zinc/84/56/80/586845680.db2.gz RFIFEOLQFJOTDR-OLZOCXBDSA-N 1 1 248.370 2.412 20 10 BECDMO C[C@H]([NH2+]C[C@H]1CCCCN1)c1ccccc1O ZINC000817950063 586847308 /nfs/dbraw/zinc/84/73/08/586847308.db2.gz RKCIMZYHWXXODO-NWDGAFQWSA-N 1 1 234.343 2.185 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]CCNC2CC2)c(O)c1 ZINC000817953561 586848929 /nfs/dbraw/zinc/84/89/29/586848929.db2.gz OGTJBWKBRVZBND-LLVKDONJSA-N 1 1 234.343 2.103 20 10 BECDMO Nc1ccc(CC[NH2+][C@@H]2CCCCC[C@@H]2N)cc1 ZINC000817958236 586850614 /nfs/dbraw/zinc/85/06/14/586850614.db2.gz UHEDDEZSWOAXNZ-LSDHHAIUSA-N 1 1 247.386 2.061 20 10 BECDMO C[C@H](C[NH3+])C[NH2+][C@H](C)c1cc(Cl)ccc1[O-] ZINC000817961639 586853018 /nfs/dbraw/zinc/85/30/18/586853018.db2.gz BKVSRVGQBZVQES-RKDXNWHRSA-N 1 1 242.750 2.291 20 10 BECDMO CC[C@@H]([NH2+][C@H](C)C[NH3+])c1cccc(Cl)c1[O-] ZINC000817966634 586855231 /nfs/dbraw/zinc/85/52/31/586855231.db2.gz SCTFPGRUKIIBEK-LDYMZIIASA-N 1 1 242.750 2.434 20 10 BECDMO Cc1ccc(O)c([C@H](C)N[C@H]2C[NH2+]CC[C@@H]2C)c1 ZINC000817969318 586856030 /nfs/dbraw/zinc/85/60/30/586856030.db2.gz UOPTUHIOBYOFIV-OBJOEFQTSA-N 1 1 248.370 2.349 20 10 BECDMO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](C)N)cc1 ZINC000817970987 586858093 /nfs/dbraw/zinc/85/80/93/586858093.db2.gz IWTRAHJWUNQALD-RYUDHWBXSA-N 1 1 235.375 2.141 20 10 BECDMO CC[C@@H]([NH2+]C[C@H](C)N)c1ccc(C)cc1O ZINC000817971654 586859149 /nfs/dbraw/zinc/85/91/49/586859149.db2.gz GAQGPGWQOAXZCJ-CMPLNLGQSA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@H]([NH2+]C[C@H](C)N)c1ccc(C)cc1O ZINC000817971656 586859470 /nfs/dbraw/zinc/85/94/70/586859470.db2.gz GAQGPGWQOAXZCJ-JQWIXIFHSA-N 1 1 222.332 2.089 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](C)N)c(O)c1 ZINC000817973601 586860394 /nfs/dbraw/zinc/86/03/94/586860394.db2.gz VMXFJSLVFFWSCV-QWRGUYRKSA-N 1 1 222.332 2.007 20 10 BECDMO C[C@@H]([NH3+])[C@@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000817977077 586860784 /nfs/dbraw/zinc/86/07/84/586860784.db2.gz ANLMUFYFPBJTEM-UTUOFQBUSA-N 1 1 235.375 2.139 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H](C)N)c(O)c1C ZINC000817977466 586861189 /nfs/dbraw/zinc/86/11/89/586861189.db2.gz KTPONUNOFFUSRZ-TUAOUCFPSA-N 1 1 236.359 2.395 20 10 BECDMO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccccc1O ZINC000818615140 586906688 /nfs/dbraw/zinc/90/66/88/586906688.db2.gz MHOMREMXSHEBKF-RAIGVLPGSA-N 1 1 234.343 2.313 20 10 BECDMO CCOc1cccc(C[NH2+]C(CF)CF)c1O ZINC000824555579 587273567 /nfs/dbraw/zinc/27/35/67/587273567.db2.gz VGLNTMSAOISUJH-UHFFFAOYSA-N 1 1 245.269 2.188 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)C[C@H](C)O)cc1Cl ZINC000825500459 587321945 /nfs/dbraw/zinc/32/19/45/587321945.db2.gz CAHCQYLPMXHOCR-VIFPVBQESA-N 1 1 243.734 2.167 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000827507253 587384613 /nfs/dbraw/zinc/38/46/13/587384613.db2.gz VXEWSUHMRGBBKK-GHMZBOCLSA-N 1 1 233.311 2.243 20 10 BECDMO C[N@@H+](CC1=CCSC1)Cc1ccccc1O ZINC000827805340 587403271 /nfs/dbraw/zinc/40/32/71/587403271.db2.gz IVIKQHAAFJPCIE-UHFFFAOYSA-N 1 1 235.352 2.497 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCO[C@H](C)C1 ZINC000840909896 587929587 /nfs/dbraw/zinc/92/95/87/587929587.db2.gz MMDNXKVNNNFIIX-CYBMUJFWSA-N 1 1 248.370 2.282 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCO[C@@H](C)C1 ZINC000840909898 587929781 /nfs/dbraw/zinc/92/97/81/587929781.db2.gz MMDNXKVNNNFIIX-ZDUSSCGKSA-N 1 1 248.370 2.282 20 10 BECDMO COc1ccc(CN[C@H]2CC[NH2+][C@H](C)C2)cc1C ZINC000841061015 587941253 /nfs/dbraw/zinc/94/12/53/587941253.db2.gz DKWWEOKNZYIBQB-OCCSQVGLSA-N 1 1 248.370 2.234 20 10 BECDMO Cc1cc(Cl)cc(CN[C@@H](C)[C@H](C)[NH3+])c1O ZINC000841076926 587943604 /nfs/dbraw/zinc/94/36/04/587943604.db2.gz UANHOJHKKOXEIG-IUCAKERBSA-N 1 1 242.750 2.179 20 10 BECDMO CC[C@H]([NH3+])CNCc1cc(Cl)cc(C)c1O ZINC000841072954 587944473 /nfs/dbraw/zinc/94/44/73/587944473.db2.gz SYEYNKJTBXYRCC-NSHDSACASA-N 1 1 242.750 2.181 20 10 BECDMO Cc1cc(O)c(C[NH+]2C[C@H](C)N[C@@H](C)C2)cc1C ZINC000843048959 588077255 /nfs/dbraw/zinc/07/72/55/588077255.db2.gz BTKDXIWSYIMWFP-STQMWFEESA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCN[C@@H](C)[C@@H]2C)cc1C ZINC000843057497 588077802 /nfs/dbraw/zinc/07/78/02/588077802.db2.gz ILMUHFIUCMHQIZ-STQMWFEESA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CCN[C@@H](C)[C@@H]2C)cc1C ZINC000843057497 588077803 /nfs/dbraw/zinc/07/78/03/588077803.db2.gz ILMUHFIUCMHQIZ-STQMWFEESA-N 1 1 248.370 2.191 20 10 BECDMO CCC[C@H]1CNCC[N@H+]1Cc1cccc(C)c1O ZINC000843057627 588078083 /nfs/dbraw/zinc/07/80/83/588078083.db2.gz FZBILRSQFGABAO-AWEZNQCLSA-N 1 1 248.370 2.275 20 10 BECDMO CCC[C@H]1C[NH2+]CCN1Cc1cccc(C)c1O ZINC000843057627 588078085 /nfs/dbraw/zinc/07/80/85/588078085.db2.gz FZBILRSQFGABAO-AWEZNQCLSA-N 1 1 248.370 2.275 20 10 BECDMO Cc1cccc(C[N@@H+](C)C2(CN)CCC2)c1O ZINC000843125589 588084564 /nfs/dbraw/zinc/08/45/64/588084564.db2.gz XWKFWSYPYZWARO-UHFFFAOYSA-N 1 1 234.343 2.014 20 10 BECDMO Cc1cccc(C[N@H+](C)C2(CN)CCC2)c1O ZINC000843125589 588084566 /nfs/dbraw/zinc/08/45/66/588084566.db2.gz XWKFWSYPYZWARO-UHFFFAOYSA-N 1 1 234.343 2.014 20 10 BECDMO Oc1ccccc1C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC000846113214 588257164 /nfs/dbraw/zinc/25/71/64/588257164.db2.gz WSJFFCNDXJMZHH-AOOOYVTPSA-N 1 1 225.238 2.089 20 10 BECDMO CCc1cccc(C[N@@H+](C)CCCCO)c1O ZINC000848906187 588418679 /nfs/dbraw/zinc/41/86/79/588418679.db2.gz QYPWUXKGIMUBOS-UHFFFAOYSA-N 1 1 237.343 2.159 20 10 BECDMO CCc1cccc(C[N@H+]2CCC[C@]2(C)CO)c1O ZINC000848906047 588418722 /nfs/dbraw/zinc/41/87/22/588418722.db2.gz QBTSSUSLQCPFMS-OAHLLOKOSA-N 1 1 249.354 2.301 20 10 BECDMO CCc1cccc(C[N@H+]2C[C@H](O)C(C)(C)C2)c1O ZINC000848908204 588419305 /nfs/dbraw/zinc/41/93/05/588419305.db2.gz OWIUUTMKLUGQRX-ZDUSSCGKSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@@H](C)[C@@H]2CO)c1O ZINC000848906663 588419498 /nfs/dbraw/zinc/41/94/98/588419498.db2.gz XPZRJKIQQGQSCZ-RISCZKNCSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@H]2COC)c1O ZINC000848914447 588420120 /nfs/dbraw/zinc/42/01/20/588420120.db2.gz NABWLIQPTDLMMG-ZDUSSCGKSA-N 1 1 235.327 2.175 20 10 BECDMO Cc1nnc([C@H](C)[N@@H+](C)Cc2ccccc2O)o1 ZINC000109772748 588592183 /nfs/dbraw/zinc/59/21/83/588592183.db2.gz KEYFUXXBGJLIKE-VIFPVBQESA-N 1 1 247.298 2.277 20 10 BECDMO C[N@@H+](Cc1cccnc1)Cc1ccccc1O ZINC000109771119 588592496 /nfs/dbraw/zinc/59/24/96/588592496.db2.gz OKYNSCPTBWYSTA-UHFFFAOYSA-N 1 1 228.295 2.419 20 10 BECDMO COc1cc(C[N@H+](C)Cc2ccccc2O)on1 ZINC000851840198 588634242 /nfs/dbraw/zinc/63/42/42/588634242.db2.gz BPHWIFDGUNBMNB-UHFFFAOYSA-N 1 1 248.282 2.021 20 10 BECDMO COc1cc(C[N@@H+](C)Cc2ccccc2O)on1 ZINC000851840198 588634243 /nfs/dbraw/zinc/63/42/43/588634243.db2.gz BPHWIFDGUNBMNB-UHFFFAOYSA-N 1 1 248.282 2.021 20 10 BECDMO Cc1cccc(C[NH+]2CC3(C2)CCCO3)c1O ZINC000862484292 589216847 /nfs/dbraw/zinc/21/68/47/589216847.db2.gz JFYJGJNKCADCSC-UHFFFAOYSA-N 1 1 233.311 2.065 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C)NC2)c(O)c1 ZINC000863544940 589298004 /nfs/dbraw/zinc/29/80/04/589298004.db2.gz FMYSYDVWMDTUPA-RWMBFGLXSA-N 1 1 248.370 2.492 20 10 BECDMO Cc1cc(N2Cc3cccc(O)c3C2)nc(C)[nH+]1 ZINC000866119135 589477642 /nfs/dbraw/zinc/47/76/42/589477642.db2.gz MGZCVHRSGNTREC-UHFFFAOYSA-N 1 1 241.294 2.319 20 10 BECDMO Cc1nonc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000872135303 589878138 /nfs/dbraw/zinc/87/81/38/589878138.db2.gz FEQHGCGWNNLOGM-SECBINFHSA-N 1 1 247.298 2.243 20 10 BECDMO Cc1cc(C)c(O)c(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c1 ZINC000872785528 589970514 /nfs/dbraw/zinc/97/05/14/589970514.db2.gz SXHCJDJIDOFFPM-OKILXGFUSA-N 1 1 247.338 2.087 20 10 BECDMO Cc1cccc(C[N@H+]2CCCCC[C@H]([NH3+])C2)c1O ZINC000873214383 589997427 /nfs/dbraw/zinc/99/74/27/589997427.db2.gz DLALQTSHXBTPDL-AWEZNQCLSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1cccc(C[N@@H+]2CCCCC[C@H](N)C2)c1O ZINC000873214383 589997429 /nfs/dbraw/zinc/99/74/29/589997429.db2.gz DLALQTSHXBTPDL-AWEZNQCLSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1cccc(C[N@H+]2CCCCC[C@H](N)C2)c1O ZINC000873214383 589997431 /nfs/dbraw/zinc/99/74/31/589997431.db2.gz DLALQTSHXBTPDL-AWEZNQCLSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1cccc(CN2CCCCC[C@H]([NH3+])C2)c1O ZINC000873214383 589997433 /nfs/dbraw/zinc/99/74/33/589997433.db2.gz DLALQTSHXBTPDL-AWEZNQCLSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1cccc(C[N@H+]2CCOC(C)(C)C2)c1O ZINC000124549667 590049770 /nfs/dbraw/zinc/04/97/70/590049770.db2.gz WGJZIBCLKBHQQI-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2c(C)cccc2O)CCO1 ZINC000876560275 590215756 /nfs/dbraw/zinc/21/57/56/590215756.db2.gz JOFXVWUQSXESLF-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(C[N@H+](C[C@H](C)O)C(C)C)c(O)c1 ZINC000876697504 590231599 /nfs/dbraw/zinc/23/15/99/590231599.db2.gz USFVQBYCMUBLIO-LBPRGKRZSA-N 1 1 237.343 2.292 20 10 BECDMO CCN1CC[N@@H+](Cc2ccc(C)cc2O)C[C@@H]1C ZINC000876714928 590232706 /nfs/dbraw/zinc/23/27/06/590232706.db2.gz GIOZSFZUEJRVBS-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2ccc(C)cc2O)C[C@@H]1C ZINC000876714928 590232708 /nfs/dbraw/zinc/23/27/08/590232708.db2.gz GIOZSFZUEJRVBS-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2ccc(C)cc2O)C[C@@H]1C ZINC000876714928 590232711 /nfs/dbraw/zinc/23/27/11/590232711.db2.gz GIOZSFZUEJRVBS-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@H+]2CCOC3(CCC3)C2)c(O)c1 ZINC000876765470 590239558 /nfs/dbraw/zinc/23/95/58/590239558.db2.gz XNFCKGMKLLRYKX-UHFFFAOYSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)CC1(O)CCC1 ZINC000877346200 590319309 /nfs/dbraw/zinc/31/93/09/590319309.db2.gz PQXQQZUWAOIOKO-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO CC[C@]1(O)CC[N@@H+](Cc2c(C)cccc2O)C1 ZINC000877440716 590328270 /nfs/dbraw/zinc/32/82/70/590328270.db2.gz IYNIIRWMUJMUMA-AWEZNQCLSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1noc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)n1 ZINC000877470969 590335296 /nfs/dbraw/zinc/33/52/96/590335296.db2.gz ONBSTNPTRVGZNU-SECBINFHSA-N 1 1 247.298 2.243 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)CCN1CCCC1 ZINC000877524988 590347123 /nfs/dbraw/zinc/34/71/23/590347123.db2.gz NCBYWXQOBSEHFI-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)CCN1CCCC1 ZINC000877524988 590347127 /nfs/dbraw/zinc/34/71/27/590347127.db2.gz NCBYWXQOBSEHFI-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@@H](C)N(C)[C@@H](C)C2)c(O)c1 ZINC000877552178 590354947 /nfs/dbraw/zinc/35/49/47/590354947.db2.gz LRABGWFNUSZZPZ-BETUJISGSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@H](CO)CC1 ZINC000877555711 590356099 /nfs/dbraw/zinc/35/60/99/590356099.db2.gz ZJFWODNISWZVCA-CYBMUJFWSA-N 1 1 249.354 2.295 20 10 BECDMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1c(C)cccc1O ZINC000877562429 590359955 /nfs/dbraw/zinc/35/99/55/590359955.db2.gz ZVUFAAOPNXCOGQ-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[NH2+][C@@H](C)c2csnn2)c(O)c1 ZINC000877589861 590369171 /nfs/dbraw/zinc/36/91/71/590369171.db2.gz MDMJJIKSNMJZDN-VIFPVBQESA-N 1 1 249.339 2.403 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)CC1=CCCOC1 ZINC000877629343 590377922 /nfs/dbraw/zinc/37/79/22/590377922.db2.gz RCJHIJONWOCCAL-UHFFFAOYSA-N 1 1 247.338 2.479 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c(O)c1 ZINC000877638022 590381809 /nfs/dbraw/zinc/38/18/09/590381809.db2.gz RKVOYVSJWOQJDO-KBPBESRZSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c(O)c1 ZINC000877649643 590383860 /nfs/dbraw/zinc/38/38/60/590383860.db2.gz DEUWKYWKVUMHEO-TXEJJXNPSA-N 1 1 203.285 2.152 20 10 BECDMO CC[C@]1(O)CCC[N@@H+](Cc2c(C)cccc2O)C1 ZINC000877691759 590393332 /nfs/dbraw/zinc/39/33/32/590393332.db2.gz VOXDXRSNMLWGON-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO Oc1cccc2c1C[N@@H+](CC1=CCCOC1)C2 ZINC000877702962 590396820 /nfs/dbraw/zinc/39/68/20/590396820.db2.gz MHYXRLFTAMLMGI-UHFFFAOYSA-N 1 1 231.295 2.055 20 10 BECDMO CCc1noc(C[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000879653353 590843247 /nfs/dbraw/zinc/84/32/47/590843247.db2.gz ORRIXTLHKRDMGB-VIFPVBQESA-N 1 1 247.298 2.188 20 10 BECDMO C[C@H]([NH2+]CCn1ccnc1)c1c(O)cccc1F ZINC000886489834 592235529 /nfs/dbraw/zinc/23/55/29/592235529.db2.gz SETATTKWJBVXHC-JTQLQIEISA-N 1 1 249.289 2.079 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@@H](C)O ZINC000886620471 592278126 /nfs/dbraw/zinc/27/81/26/592278126.db2.gz KQLZAJHKDCQOMW-NGZCFLSTSA-N 1 1 241.306 2.341 20 10 BECDMO C[C@@H]1C[C@H]([NH3+])CCN1Cc1ccc(N(C)C)cc1 ZINC000084946388 631455341 /nfs/dbraw/zinc/45/53/41/631455341.db2.gz WRCSVYMFXRWOAI-TZMCWYRMSA-N 1 1 247.386 2.064 20 10 BECDMO C[C@H]([NH2+]Cc1cocn1)c1ccccc1O ZINC000309834258 632672486 /nfs/dbraw/zinc/67/24/86/632672486.db2.gz ZQAWHTIUENWKFJ-VIFPVBQESA-N 1 1 218.256 2.231 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1C ZINC000862441101 636627555 /nfs/dbraw/zinc/62/75/55/636627555.db2.gz OKGLTLZJOYIXKY-TXEJJXNPSA-N 1 1 217.312 2.461 20 10 BECDMO C[C@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccccc1O ZINC000044534646 640401635 /nfs/dbraw/zinc/40/16/35/640401635.db2.gz GBFBEJFNKLDXOT-STQMWFEESA-N 1 1 248.370 2.385 20 10 BECDMO COCCC[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000164215054 640454926 /nfs/dbraw/zinc/45/49/26/640454926.db2.gz NWFUHVFEQWXJCG-UHFFFAOYSA-N 1 1 237.343 2.477 20 10 BECDMO Cc1cc(C[NH2+]Cc2cc(F)ccc2O)no1 ZINC000226586460 640778346 /nfs/dbraw/zinc/77/83/46/640778346.db2.gz DSXGDOATWICNLD-UHFFFAOYSA-N 1 1 236.246 2.118 20 10 BECDMO Cc1ccc(O)c(CN2CCCC[C@@H]2[C@H](C)[NH3+])c1 ZINC000226933333 640803284 /nfs/dbraw/zinc/80/32/84/640803284.db2.gz BIAHQWNJYKKWRI-GXTWGEPZSA-N 1 1 248.370 2.402 20 10 BECDMO COC[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062744760 641086734 /nfs/dbraw/zinc/08/67/34/641086734.db2.gz SVXXSQMIDZHEQF-DTWKUNHWSA-N 1 1 227.279 2.217 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCCC[C@@H]2CO)cc1 ZINC000039225793 641216977 /nfs/dbraw/zinc/21/69/77/641216977.db2.gz BDKIGUZKDNCELL-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CCCN(C)CC2)cc1C ZINC000915795047 641859228 /nfs/dbraw/zinc/85/92/28/641859228.db2.gz MLUULAJTXYNJAW-UHFFFAOYSA-N 1 1 248.370 2.147 20 10 BECDMO Cc1cc(O)c(CN2CCC[N@@H+](C)CC2)cc1C ZINC000915795047 641859231 /nfs/dbraw/zinc/85/92/31/641859231.db2.gz MLUULAJTXYNJAW-UHFFFAOYSA-N 1 1 248.370 2.147 20 10 BECDMO Cc1cc(O)c(CN2CCC[N@H+](C)CC2)cc1C ZINC000915795047 641859235 /nfs/dbraw/zinc/85/92/35/641859235.db2.gz MLUULAJTXYNJAW-UHFFFAOYSA-N 1 1 248.370 2.147 20 10 BECDMO C[N@H+](CC[C@@H]1CCCO1)c1ccc(N)cc1 ZINC000083527395 643585491 /nfs/dbraw/zinc/58/54/91/643585491.db2.gz JWCPMCPZXSRQEZ-ZDUSSCGKSA-N 1 1 220.316 2.274 20 10 BECDMO C[N@@H+](CC[C@@H]1CCCO1)c1ccc(N)cc1 ZINC000083527395 643585499 /nfs/dbraw/zinc/58/54/99/643585499.db2.gz JWCPMCPZXSRQEZ-ZDUSSCGKSA-N 1 1 220.316 2.274 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CCCOCC2)cc1 ZINC000773758014 644695856 /nfs/dbraw/zinc/69/58/56/644695856.db2.gz VVYBCVHIVVXJOA-UHFFFAOYSA-N 1 1 248.370 2.365 20 10 BECDMO CC[C@H](N)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000817980058 644992708 /nfs/dbraw/zinc/99/27/08/644992708.db2.gz QXSABOSCHGXBHM-RYUDHWBXSA-N 1 1 236.359 2.397 20 10 BECDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cc[nH]n1 ZINC000115629140 645669054 /nfs/dbraw/zinc/66/90/54/645669054.db2.gz XGFVTKMMGHWPDH-UHFFFAOYSA-N 1 1 244.342 2.074 20 10 BECDMO COC1CC(C[N@H+](C)c2ccc(N)cc2)C1 ZINC000703296909 712071108 /nfs/dbraw/zinc/07/11/08/712071108.db2.gz BWSUMFMHLUIMGC-UHFFFAOYSA-N 1 1 220.316 2.130 20 10 BECDMO COC1CC(C[N@@H+](C)c2ccc(N)cc2)C1 ZINC000703296909 712071110 /nfs/dbraw/zinc/07/11/10/712071110.db2.gz BWSUMFMHLUIMGC-UHFFFAOYSA-N 1 1 220.316 2.130 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2ccccc2O)CCO1 ZINC000720481242 712846567 /nfs/dbraw/zinc/84/65/67/712846567.db2.gz GTJFJLMHEOFBHX-LLVKDONJSA-N 1 1 221.300 2.003 20 10 BECDMO CO[C@@H](C)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000381466294 710640969 /nfs/dbraw/zinc/64/09/69/710640969.db2.gz MQQRUTGSGXOKOV-ZETCQYMHSA-N 1 1 247.697 2.309 20 10 BECDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2O)C[C@@H]1C[NH3+] ZINC000397322897 711380242 /nfs/dbraw/zinc/38/02/42/711380242.db2.gz TYSPKHNEKYQMHF-DYEKYZERSA-N 1 1 248.370 2.197 20 10 BECDMO C[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2[O-])C[C@@H]1C[NH3+] ZINC000397322897 711380246 /nfs/dbraw/zinc/38/02/46/711380246.db2.gz TYSPKHNEKYQMHF-DYEKYZERSA-N 1 1 248.370 2.197 20 10 BECDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2[O-])C[C@@H]1C[NH3+] ZINC000397322897 711380249 /nfs/dbraw/zinc/38/02/49/711380249.db2.gz TYSPKHNEKYQMHF-DYEKYZERSA-N 1 1 248.370 2.197 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c1O ZINC000724814393 711616534 /nfs/dbraw/zinc/61/65/34/711616534.db2.gz ONNJJAOVYQQHCC-OCCSQVGLSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1cccc(CN(C)CCC[NH+](C)C)c1O ZINC000160240563 711806090 /nfs/dbraw/zinc/80/60/90/711806090.db2.gz PCWRTJJOJLGQQJ-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO Cc1cccc(C[N@@H+](C)CCCN(C)C)c1O ZINC000160240563 711806091 /nfs/dbraw/zinc/80/60/91/711806091.db2.gz PCWRTJJOJLGQQJ-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO Cc1cccc(C[N@H+](C)CCCN(C)C)c1O ZINC000160240563 711806092 /nfs/dbraw/zinc/80/60/92/711806092.db2.gz PCWRTJJOJLGQQJ-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO CCO[C@H]1CC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000701662445 712026645 /nfs/dbraw/zinc/02/66/45/712026645.db2.gz PLPTYOHPVYNQAP-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ncccn2)c1 ZINC000702325055 712047042 /nfs/dbraw/zinc/04/70/42/712047042.db2.gz CCQOPWOHHPCFBD-LLVKDONJSA-N 1 1 243.310 2.341 20 10 BECDMO C[C@@H]([NH2+]CCOCCF)c1ccc(F)cc1O ZINC000702654702 712058497 /nfs/dbraw/zinc/05/84/97/712058497.db2.gz QINSLYPVZXAJGJ-SECBINFHSA-N 1 1 245.269 2.168 20 10 BECDMO COC(C)(C)C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708487656 712211315 /nfs/dbraw/zinc/21/13/15/712211315.db2.gz ZWRQBVSLIWMCMR-UHFFFAOYSA-N 1 1 245.269 2.185 20 10 BECDMO OCCCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000390819169 712427808 /nfs/dbraw/zinc/42/78/08/712427808.db2.gz SMLDUBKQFUUCTG-UHFFFAOYSA-N 1 1 247.697 2.047 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2ccccc2O)CCO1 ZINC000720481243 712846613 /nfs/dbraw/zinc/84/66/13/712846613.db2.gz GTJFJLMHEOFBHX-NSHDSACASA-N 1 1 221.300 2.003 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2cc(F)ccc2O)CCO1 ZINC000720485463 712846997 /nfs/dbraw/zinc/84/69/97/712846997.db2.gz VGOQUWHJKYKXCY-JTQLQIEISA-N 1 1 239.290 2.142 20 10 BECDMO CC1(C)CCC[N@H+]1Cc1ccc(O)cc1O ZINC001204272772 966951222 /nfs/dbraw/zinc/95/12/22/966951222.db2.gz RMXFWRLYMJYNAG-UHFFFAOYSA-N 1 1 221.300 2.472 20 10 BECDMO Oc1c(F)cccc1C[NH2+]CC[C@H]1CCOC1 ZINC000230393043 1166379594 /nfs/dbraw/zinc/37/95/94/1166379594.db2.gz ASBZEILAYWHIMR-JTQLQIEISA-N 1 1 239.290 2.048 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@@H](O)[C@H](C)C2)c1O ZINC001231590729 1167661151 /nfs/dbraw/zinc/66/11/51/1167661151.db2.gz GAYGXLIORJGJMP-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cc(C)c(C[N@H+]2CCC[C@](C)(O)C2)c(O)c1 ZINC001231847390 1167665495 /nfs/dbraw/zinc/66/54/95/1167665495.db2.gz YGXRUGXLAOWHMM-HNNXBMFYSA-N 1 1 249.354 2.356 20 10 BECDMO CCc1ccc(C[N@@H+](C)CC2COC2)c(O)c1 ZINC001236794831 979741428 /nfs/dbraw/zinc/74/14/28/979741428.db2.gz PPWLXYJHMJEQEI-UHFFFAOYSA-N 1 1 235.327 2.033 20 10 BECDMO C[C@@H]1CCC[N@H+](Cc2ccccc2[O-])[C@@H]1CC[NH3+] ZINC000404434786 971161015 /nfs/dbraw/zinc/16/10/15/971161015.db2.gz QRCJAHREEWVPJT-TZMCWYRMSA-N 1 1 248.370 2.342 20 10 BECDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])[C@@H]1CC[NH3+] ZINC000404434786 971161025 /nfs/dbraw/zinc/16/10/25/971161025.db2.gz QRCJAHREEWVPJT-TZMCWYRMSA-N 1 1 248.370 2.342 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)Cc2ccncn2)c1 ZINC001140624219 959223980 /nfs/dbraw/zinc/22/39/80/959223980.db2.gz LOFVUCGCQCKXIX-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H](F)C1 ZINC000689844749 959307571 /nfs/dbraw/zinc/30/75/71/959307571.db2.gz AQVZJMREDCYPRR-SNVBAGLBSA-N 1 1 213.227 2.075 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](F)C1 ZINC000689844749 959307583 /nfs/dbraw/zinc/30/75/83/959307583.db2.gz AQVZJMREDCYPRR-SNVBAGLBSA-N 1 1 213.227 2.075 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H]2OCC[C@@H]2C1 ZINC000724813892 959686063 /nfs/dbraw/zinc/68/60/63/959686063.db2.gz HWKSNURYTFCKSR-TZMCWYRMSA-N 1 1 233.311 2.003 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1O ZINC000690789008 959839423 /nfs/dbraw/zinc/83/94/23/959839423.db2.gz HIOCNSHJCLNYGJ-KGLIPLIRSA-N 1 1 247.338 2.169 20 10 BECDMO CO[C@@]1(C)C[C@H]1[NH2+][C@H](C)c1ccc(F)cc1O ZINC000694362716 959840967 /nfs/dbraw/zinc/84/09/67/959840967.db2.gz OBQDGJLKHQSWQA-WQHBLYJGSA-N 1 1 239.290 2.359 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2C[C@H]3CC[C@@H]2C3)c1 ZINC001141161452 960415933 /nfs/dbraw/zinc/41/59/33/960415933.db2.gz ROPDMLCVPKJXJE-GXSJLCMTSA-N 1 1 219.284 2.082 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@](C)(O)[C@@H](C)C2)c1 ZINC001140619368 960459601 /nfs/dbraw/zinc/45/96/01/960459601.db2.gz BVTRCICTEVFFHX-SWLSCSKDSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H]3CCO[C@H]3C2)c1 ZINC001140619532 960460127 /nfs/dbraw/zinc/46/01/27/960460127.db2.gz GSAXZWYOZSTRIZ-DOMZBBRYSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@]3(CCCO3)C2)c1 ZINC001140619691 960462846 /nfs/dbraw/zinc/46/28/46/960462846.db2.gz KTKVOQHTHRHVAI-HNNXBMFYSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@]23CCOC3)c1 ZINC001140623149 960465425 /nfs/dbraw/zinc/46/54/25/960465425.db2.gz HDBSEXGIUWIUQT-AWEZNQCLSA-N 1 1 233.311 2.065 20 10 BECDMO CCCOC1C[NH+](Cc2cc(C)ccc2O)C1 ZINC001140620917 960466637 /nfs/dbraw/zinc/46/66/37/960466637.db2.gz HAKFGWGJGRGAMU-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1c(O)ccc(C[N@@H+]2C[C@@H](F)C[C@H]2C)c1O ZINC001140742493 960546633 /nfs/dbraw/zinc/54/66/33/960546633.db2.gz PNCWOCLOQHXNEI-KCJUWKMLSA-N 1 1 239.290 2.339 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CO)c(O)c1 ZINC001140948074 960739778 /nfs/dbraw/zinc/73/97/78/960739778.db2.gz RTKPHWCMESFYQO-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)c(O)c1 ZINC001140947843 960740599 /nfs/dbraw/zinc/74/05/99/960740599.db2.gz HWGKWWKANHMQNY-RWMBFGLXSA-N 1 1 235.302 2.490 20 10 BECDMO CCC[N@@H+](C)Cc1c(O)cc(OC)cc1OC ZINC001141031731 960824159 /nfs/dbraw/zinc/82/41/59/960824159.db2.gz JABHSAHDKZNROI-UHFFFAOYSA-N 1 1 239.315 2.251 20 10 BECDMO COc1cc(O)c(C[N@H+]2CC[C@@H]2C)c(OC)c1 ZINC001141032238 960825775 /nfs/dbraw/zinc/82/57/75/960825775.db2.gz WVBIGOJIKYHNNC-VIFPVBQESA-N 1 1 237.299 2.004 20 10 BECDMO Cc1ncoc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001141053738 960844918 /nfs/dbraw/zinc/84/49/18/960844918.db2.gz OBFPHHGYAPKBEL-UHFFFAOYSA-N 1 1 244.294 2.247 20 10 BECDMO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cc(O)ccc1O ZINC001141156076 960892491 /nfs/dbraw/zinc/89/24/91/960892491.db2.gz DTPQJVNMAWUJSD-SCZZXKLOSA-N 1 1 225.263 2.030 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCCC[C@@H](F)C2)c1 ZINC001141156795 960894914 /nfs/dbraw/zinc/89/49/14/960894914.db2.gz VGVMCJGWKMSFNT-LLVKDONJSA-N 1 1 239.290 2.422 20 10 BECDMO CC[N@H+](C)Cc1cc(F)c(F)cc1O ZINC001142502403 961455928 /nfs/dbraw/zinc/45/59/28/961455928.db2.gz OJRBYDVOHKIAAJ-UHFFFAOYSA-N 1 1 201.216 2.122 20 10 BECDMO CC[N@@H+](C)Cc1cc(F)c(F)cc1O ZINC001142502403 961455943 /nfs/dbraw/zinc/45/59/43/961455943.db2.gz OJRBYDVOHKIAAJ-UHFFFAOYSA-N 1 1 201.216 2.122 20 10 BECDMO Nc1ccc(C[N@H+]2CCC[C@H](CF)C2)cc1 ZINC000711499341 962720725 /nfs/dbraw/zinc/72/07/25/962720725.db2.gz RONKHGOAINIMDL-GFCCVEGCSA-N 1 1 222.307 2.450 20 10 BECDMO C[C@H]1C[C@@H]([N@H+]2CCc3cccc(O)c3C2)CCO1 ZINC001168137189 963835888 /nfs/dbraw/zinc/83/58/88/963835888.db2.gz NLRXHBYLRYISJI-AAEUAGOBSA-N 1 1 247.338 2.318 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2[C@@H](C)CC[C@H]2CN)c1O ZINC001205069043 965425593 /nfs/dbraw/zinc/42/55/93/965425593.db2.gz SJHMFGSGMTWWHX-STQMWFEESA-N 1 1 248.370 2.321 20 10 BECDMO CNc1ccccc1NCCn1cc[nH+]c1C ZINC001163928365 965641734 /nfs/dbraw/zinc/64/17/34/965641734.db2.gz INKFWFRAILVBAE-UHFFFAOYSA-N 1 1 230.315 2.345 20 10 BECDMO C[C@H]([NH2+][C@@H]1COC[C@@H]1C)c1ccc(F)cc1O ZINC000699802976 966093750 /nfs/dbraw/zinc/09/37/50/966093750.db2.gz DEAMBFGWPBLOEM-HOTUBEGUSA-N 1 1 239.290 2.217 20 10 BECDMO CCc1ccc(C[N@H+]2C[C@@H](O)CC[C@H]2C)c(O)c1 ZINC001236784058 966532344 /nfs/dbraw/zinc/53/23/44/966532344.db2.gz RROHMQHVZIQSFL-RISCZKNCSA-N 1 1 249.354 2.300 20 10 BECDMO CCc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)c(O)c1 ZINC001236783664 966534394 /nfs/dbraw/zinc/53/43/94/966534394.db2.gz OBMULTFVWYFNNR-NSHDSACASA-N 1 1 247.338 2.366 20 10 BECDMO CCc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C2)c(O)c1 ZINC001236783664 966534400 /nfs/dbraw/zinc/53/44/00/966534400.db2.gz OBMULTFVWYFNNR-NSHDSACASA-N 1 1 247.338 2.366 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCOC[C@@H]1C1CC1 ZINC001237492955 966665563 /nfs/dbraw/zinc/66/55/63/966665563.db2.gz UVAPHBGRKZJPQL-CQSZACIVSA-N 1 1 247.338 2.311 20 10 BECDMO COc1ccc(C[N@H+]2CCC3(CC3)C2)c(O)c1 ZINC001203622087 966710939 /nfs/dbraw/zinc/71/09/39/966710939.db2.gz ODWDSQRFCPGIMG-UHFFFAOYSA-N 1 1 233.311 2.387 20 10 BECDMO C[N@H+](Cc1ccncc1)Cc1ccc(O)c(O)c1 ZINC001203875350 966805643 /nfs/dbraw/zinc/80/56/43/966805643.db2.gz MDDDTNDGGQKILD-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO C[N@@H+](Cc1ccncc1)Cc1ccc(O)c(O)c1 ZINC001203875350 966805645 /nfs/dbraw/zinc/80/56/45/966805645.db2.gz MDDDTNDGGQKILD-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO C[N@H+](Cc1ccc(O)c(O)c1)CC1CCC1 ZINC001203882710 966808902 /nfs/dbraw/zinc/80/89/02/966808902.db2.gz SCQPMHRGOVQGBM-UHFFFAOYSA-N 1 1 221.300 2.330 20 10 BECDMO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001203929975 966825604 /nfs/dbraw/zinc/82/56/04/966825604.db2.gz MIWDHVALHRGRNX-LBPRGKRZSA-N 1 1 246.354 2.306 20 10 BECDMO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001203929975 966825611 /nfs/dbraw/zinc/82/56/11/966825611.db2.gz MIWDHVALHRGRNX-LBPRGKRZSA-N 1 1 246.354 2.306 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]2CCCO[C@H]2C1 ZINC001203550308 966935667 /nfs/dbraw/zinc/93/56/67/966935667.db2.gz QYHZQQAPEMZRHM-WFASDCNBSA-N 1 1 247.338 2.393 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]2CCCO[C@@H]2C1 ZINC001203550307 966936597 /nfs/dbraw/zinc/93/65/97/966936597.db2.gz QYHZQQAPEMZRHM-SWLSCSKDSA-N 1 1 247.338 2.393 20 10 BECDMO CC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(O)cc1O ZINC001204281873 966961165 /nfs/dbraw/zinc/96/11/65/966961165.db2.gz YNGOJXAHOXFGRI-CYBMUJFWSA-N 1 1 249.310 2.041 20 10 BECDMO Oc1ccc(C[N@H+]2CCC[C@@H]3C[C@@H]32)c(O)c1 ZINC001204277373 966961278 /nfs/dbraw/zinc/96/12/78/966961278.db2.gz BPGINAODCMONHF-SKDRFNHKSA-N 1 1 219.284 2.082 20 10 BECDMO CC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(O)cc1O ZINC001204281874 966961461 /nfs/dbraw/zinc/96/14/61/966961461.db2.gz YNGOJXAHOXFGRI-ZDUSSCGKSA-N 1 1 249.310 2.041 20 10 BECDMO COc1cc(C[N@H+]2CCC3(CC3)C2)cc(O)c1O ZINC001204347875 966976879 /nfs/dbraw/zinc/97/68/79/966976879.db2.gz ZNZZMWSZBFRSNY-UHFFFAOYSA-N 1 1 249.310 2.092 20 10 BECDMO O=C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1O ZINC001203556991 966977522 /nfs/dbraw/zinc/97/75/22/966977522.db2.gz XYGIDFBQMXVLAV-BETUJISGSA-N 1 1 245.322 2.478 20 10 BECDMO CC[N@@H+](Cc1cncn1C)Cc1ccccc1O ZINC001204386418 966988080 /nfs/dbraw/zinc/98/80/80/966988080.db2.gz BJSSWRAPIHPVPO-UHFFFAOYSA-N 1 1 245.326 2.148 20 10 BECDMO Cc1nc[nH]c1C[N@H+](C)Cc1ccccc1O ZINC001204592211 967093005 /nfs/dbraw/zinc/09/30/05/967093005.db2.gz LJMQADZJTXEOSI-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(C[N@H+]2[C@@H](C)CC[C@H]2C[NH3+])c(O)c1 ZINC001205076838 967324675 /nfs/dbraw/zinc/32/46/75/967324675.db2.gz XEADFQLARNAMMN-AAEUAGOBSA-N 1 1 234.343 2.012 20 10 BECDMO Cn1ccc2ccc(CC[NH+]3CCOCC3)cc21 ZINC001250275457 967605074 /nfs/dbraw/zinc/60/50/74/967605074.db2.gz KUROALPSQUZNNV-UHFFFAOYSA-N 1 1 244.338 2.053 20 10 BECDMO COc1ccc(O)c(C[N@@H+](C)CCSC)c1 ZINC000180320368 968492925 /nfs/dbraw/zinc/49/29/25/968492925.db2.gz JBWUIXFBPJBCEO-UHFFFAOYSA-N 1 1 241.356 2.196 20 10 BECDMO C[N@@H+](Cc1ccccc1O)Cc1ccc[nH]c1=O ZINC001207008843 968544606 /nfs/dbraw/zinc/54/46/06/968544606.db2.gz MZLDSJONOCGZQK-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO CCCC[C@H](O)C[N@H+]1CCc2cccc(O)c2C1 ZINC001252093936 968572634 /nfs/dbraw/zinc/57/26/34/968572634.db2.gz KQRDYWZJIOHDAY-ZDUSSCGKSA-N 1 1 249.354 2.301 20 10 BECDMO C[N@@H+](Cc1cc[nH]c(=O)c1)Cc1ccccc1O ZINC001207123675 968644075 /nfs/dbraw/zinc/64/40/75/968644075.db2.gz WTTXHXFBPVOPLA-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@H](C)[C@H](O)C2)c1 ZINC001207662775 968855513 /nfs/dbraw/zinc/85/55/13/968855513.db2.gz WBYDIJWAYXEGBS-XHDPSFHLSA-N 1 1 249.354 2.328 20 10 BECDMO CC1(C)CCC[N@H+]1Cc1c(O)cc(O)cc1O ZINC001144500347 972848870 /nfs/dbraw/zinc/84/88/70/972848870.db2.gz SGRPGWXIQWCTIL-UHFFFAOYSA-N 1 1 237.299 2.178 20 10 BECDMO CC[C@H](C)[N@@H+](C)Cc1c(O)cc(O)cc1O ZINC001144503763 972850002 /nfs/dbraw/zinc/85/00/02/972850002.db2.gz CEMPRJDYEDLODR-QMMMGPOBSA-N 1 1 225.288 2.034 20 10 BECDMO CC[N@H+](Cc1ccccc1[O-])[C@H]1CC[NH2+][C@H](C)C1 ZINC001246858907 973168548 /nfs/dbraw/zinc/16/85/48/973168548.db2.gz CYDPZSDPNVKDKK-OCCSQVGLSA-N 1 1 248.370 2.355 20 10 BECDMO CC[N@@H+](Cc1ccccc1[O-])[C@H]1CC[NH2+][C@H](C)C1 ZINC001246858907 973168567 /nfs/dbraw/zinc/16/85/67/973168567.db2.gz CYDPZSDPNVKDKK-OCCSQVGLSA-N 1 1 248.370 2.355 20 10 BECDMO CCOc1ccc(N2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC001276926820 973309320 /nfs/dbraw/zinc/30/93/20/973309320.db2.gz YMNNRXWBTKTMBC-OKILXGFUSA-N 1 1 246.354 2.368 20 10 BECDMO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CC1(N)CC1 ZINC001336262349 977604320 /nfs/dbraw/zinc/60/43/20/977604320.db2.gz MXXNIZBZODCUTK-WDEREUQCSA-N 1 1 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343403767 /nfs/dbraw/zinc/40/37/67/343403767.db2.gz KHNAKKHXFOHUAW-UHFFFAOYSA-N 1 1 247.367 2.499 20 10 BECDMO C[C@@H](CCN(C)C)[NH2+][C@@H](C)c1ccccc1O ZINC000049553085 343601943 /nfs/dbraw/zinc/60/19/43/343601943.db2.gz LHAGFDOOSQWRSY-RYUDHWBXSA-N 1 1 236.359 2.383 20 10 BECDMO C[C@@H](CC[NH+](C)C)NCc1ccc2c(c1)CCO2 ZINC000049554399 343602777 /nfs/dbraw/zinc/60/27/77/343602777.db2.gz KJDKOLRGKLNUIC-LBPRGKRZSA-N 1 1 248.370 2.051 20 10 BECDMO C[C@@H](CCN(C)C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000049554399 343602778 /nfs/dbraw/zinc/60/27/78/343602778.db2.gz KJDKOLRGKLNUIC-LBPRGKRZSA-N 1 1 248.370 2.051 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)C[C@H]2CCOC2)c1 ZINC000093840260 537969037 /nfs/dbraw/zinc/96/90/37/537969037.db2.gz PHBBMDNMPYWIJZ-GFCCVEGCSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1cccc(C[N@H+]2CCCO[C@@H](C)C2)c1O ZINC000124588211 179074971 /nfs/dbraw/zinc/07/49/71/179074971.db2.gz FNXNDUXGZPQTQR-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(C[N@@H+]2CC[C@H](CO)C[C@@H]2C)c1O ZINC000290210665 179081402 /nfs/dbraw/zinc/08/14/02/179081402.db2.gz QNGDUYCXYVCNGS-STQMWFEESA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1O ZINC000124498311 179085139 /nfs/dbraw/zinc/08/51/39/179085139.db2.gz PDZJBDWWBXJBHC-TXEJJXNPSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H](O)C(C)(C)C2)c1O ZINC000276064270 179082455 /nfs/dbraw/zinc/08/24/55/179082455.db2.gz VLYRWSOOUGILOB-ZDUSSCGKSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)c1O ZINC000124542969 179083197 /nfs/dbraw/zinc/08/31/97/179083197.db2.gz JQKWHPGELPGXIK-NWDGAFQWSA-N 1 1 235.327 2.310 20 10 BECDMO CCN1CC[N@@H+](Cc2cccc(C)c2O)[C@H](C)C1 ZINC000289560474 352189939 /nfs/dbraw/zinc/18/99/39/352189939.db2.gz IYVPFPHSCZOUIJ-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2cccc(C)c2O)[C@H](C)C1 ZINC000289560474 352189941 /nfs/dbraw/zinc/18/99/41/352189941.db2.gz IYVPFPHSCZOUIJ-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2cccc(C)c2O)[C@H](C)C1 ZINC000289560474 352189945 /nfs/dbraw/zinc/18/99/45/352189945.db2.gz IYVPFPHSCZOUIJ-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Oc1c(F)cccc1C[N@@H+]1CCC[C@H]1CF ZINC000293824661 188390883 /nfs/dbraw/zinc/39/08/83/188390883.db2.gz AHITWMHFNKNKBJ-JTQLQIEISA-N 1 1 227.254 2.465 20 10 BECDMO Oc1c(F)cccc1C[N@H+]1CCC[C@H]1CF ZINC000293824661 188390885 /nfs/dbraw/zinc/39/08/85/188390885.db2.gz AHITWMHFNKNKBJ-JTQLQIEISA-N 1 1 227.254 2.465 20 10 BECDMO CC[N@@H+](CCOC)Cc1ccc(N(C)C)cc1 ZINC000053401846 363244372 /nfs/dbraw/zinc/24/43/72/363244372.db2.gz MSCBXRFYSILIFG-UHFFFAOYSA-N 1 1 236.359 2.221 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCCO[C@@H](C)C2)c1 ZINC000134145487 358781699 /nfs/dbraw/zinc/78/16/99/358781699.db2.gz INRRTTGCCKHUSE-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO CC1(C)C[N@@H+](Cc2ccccc2O)CCCO1 ZINC000359997997 366915296 /nfs/dbraw/zinc/91/52/96/366915296.db2.gz KTNZFMVGSVEFTO-UHFFFAOYSA-N 1 1 235.327 2.393 20 10 BECDMO CCOCC[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000092885106 170389120 /nfs/dbraw/zinc/38/91/20/170389120.db2.gz KHPJVGDKGMVJTG-UHFFFAOYSA-N 1 1 237.343 2.477 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000368623038 183301307 /nfs/dbraw/zinc/30/13/07/183301307.db2.gz HLZCUARDAGHKDJ-LBPRGKRZSA-N 1 1 243.310 2.452 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@]12CCOC2 ZINC000375308565 183301966 /nfs/dbraw/zinc/30/19/66/183301966.db2.gz JBFPSKYYGONZQN-CQSZACIVSA-N 1 1 233.311 2.147 20 10 BECDMO Cc1cc(C[N@@H+](C)Cc2ccccc2O)no1 ZINC000111235915 383842594 /nfs/dbraw/zinc/84/25/94/383842594.db2.gz SKOCUXMPMGJWPJ-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1cc(C[N@H+](C)Cc2ccccc2O)no1 ZINC000111235915 383842603 /nfs/dbraw/zinc/84/26/03/383842603.db2.gz SKOCUXMPMGJWPJ-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO CC(=O)c1cc(F)cc(C[N@H+](C)C2CC2)c1O ZINC000037322940 383972114 /nfs/dbraw/zinc/97/21/14/383972114.db2.gz LXKMMJPOQCXZJI-UHFFFAOYSA-N 1 1 237.274 2.328 20 10 BECDMO CC(C)[C@@H](CO)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000092392687 384176334 /nfs/dbraw/zinc/17/63/34/384176334.db2.gz AKZBLBWXLIFNLC-JOYOIKCWSA-N 1 1 241.306 2.199 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)c1 ZINC000093418537 384206568 /nfs/dbraw/zinc/20/65/68/384206568.db2.gz FSAMJJLJURAKTH-RYUDHWBXSA-N 1 1 235.327 2.310 20 10 BECDMO C[C@@H]1OCC[N@@H+](Cc2ccc(N(C)C)cc2)[C@H]1C ZINC000093417621 384234672 /nfs/dbraw/zinc/23/46/72/384234672.db2.gz ODIYBPQUZMKDTA-STQMWFEESA-N 1 1 248.370 2.362 20 10 BECDMO C[C@@H](CCO)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000097439698 384520840 /nfs/dbraw/zinc/52/08/40/384520840.db2.gz ANJCELGHYRNSGT-UWVGGRQHSA-N 1 1 241.306 2.200 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]CCCN(C)C)c(O)c1 ZINC000020091837 384574388 /nfs/dbraw/zinc/57/43/88/384574388.db2.gz OXTLMHXJQZFOEY-GFCCVEGCSA-N 1 1 236.359 2.303 20 10 BECDMO CO[C@H](C)[C@@H](C)[NH2+]Cc1cccc(F)c1O ZINC000290790960 384766349 /nfs/dbraw/zinc/76/63/49/384766349.db2.gz DORYLGMJTANWPI-RKDXNWHRSA-N 1 1 227.279 2.044 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c1 ZINC000126785847 384831622 /nfs/dbraw/zinc/83/16/22/384831622.db2.gz AELVAOLNJQGTMW-PBWFPOADSA-N 1 1 247.338 2.188 20 10 BECDMO C[C@@H]([NH2+]C[C@H](C)N(C)C)c1ccc(F)cc1O ZINC000062747899 385186342 /nfs/dbraw/zinc/18/63/42/385186342.db2.gz OPAHZPAKNZIYIE-VHSXEESVSA-N 1 1 240.322 2.132 20 10 BECDMO C[C@H]([NH2+]C[C@H](C)N(C)C)c1ccc(F)cc1O ZINC000062747897 385186493 /nfs/dbraw/zinc/18/64/93/385186493.db2.gz OPAHZPAKNZIYIE-UWVGGRQHSA-N 1 1 240.322 2.132 20 10 BECDMO CO[C@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000191205570 385293663 /nfs/dbraw/zinc/29/36/63/385293663.db2.gz KNLXFFVCVJGPRN-BDAKNGLRSA-N 1 1 227.279 2.217 20 10 BECDMO COc1cc(O)c(C[N@@H+](C)C(C)C)cc1OC ZINC000183468935 385762998 /nfs/dbraw/zinc/76/29/98/385762998.db2.gz VANLVOAZCNJKRP-UHFFFAOYSA-N 1 1 239.315 2.250 20 10 BECDMO CC[N@@H+](CCCO)Cc1cc(C)c(C)cc1O ZINC000271213228 385806529 /nfs/dbraw/zinc/80/65/29/385806529.db2.gz VQARAMWCAHTZQG-UHFFFAOYSA-N 1 1 237.343 2.213 20 10 BECDMO C[N@@H+](Cc1ccccc1O)[C@@H](CO)C(C)(C)C ZINC000271246474 385810681 /nfs/dbraw/zinc/81/06/81/385810681.db2.gz CPQDUQZBXPTSBQ-ZDUSSCGKSA-N 1 1 237.343 2.231 20 10 BECDMO CC[C@@H](C)[N@H+](C)CCNCc1ccccc1O ZINC000217390293 385883221 /nfs/dbraw/zinc/88/32/21/385883221.db2.gz WRSZXYPVJDZHBH-GFCCVEGCSA-N 1 1 236.359 2.212 20 10 BECDMO CC[C@@H](C)[N@@H+](C)CCNCc1ccccc1O ZINC000217390293 385883223 /nfs/dbraw/zinc/88/32/23/385883223.db2.gz WRSZXYPVJDZHBH-GFCCVEGCSA-N 1 1 236.359 2.212 20 10 BECDMO Cc1c[nH]nc1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000289927051 386373117 /nfs/dbraw/zinc/37/31/17/386373117.db2.gz OVJOQXAJLYUCAU-UHFFFAOYSA-N 1 1 244.342 2.074 20 10 BECDMO CC[N@@H+](CCOC)Cc1cc(C)c(C)cc1O ZINC000299290728 386438059 /nfs/dbraw/zinc/43/80/59/386438059.db2.gz SZYLWLGMZMMKKP-UHFFFAOYSA-N 1 1 237.343 2.477 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2cccc(C)c2O)CCO1 ZINC000124525332 386635465 /nfs/dbraw/zinc/63/54/65/386635465.db2.gz SPDQYOSRJADPSJ-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cc(C[N@@H+](C)C2(CO)CC2)ccc1N(C)C ZINC000293453543 386658424 /nfs/dbraw/zinc/65/84/24/386658424.db2.gz CRUKRCOYWCYUOW-UHFFFAOYSA-N 1 1 248.370 2.018 20 10 BECDMO COC[C@@H]1CC[N@H+]1Cc1cc(C)c(C)cc1O ZINC000293629406 386853323 /nfs/dbraw/zinc/85/33/23/386853323.db2.gz LHMJSQFXERGEQP-ZDUSSCGKSA-N 1 1 235.327 2.230 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@](O)(C3CC3)C2)c1 ZINC000373328980 387357622 /nfs/dbraw/zinc/35/76/22/387357622.db2.gz SWBPLNNSFFBFEF-HNNXBMFYSA-N 1 1 247.338 2.047 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC23CCOCC3)c1 ZINC000375730320 387575844 /nfs/dbraw/zinc/57/58/44/387575844.db2.gz IYRDXQYEMZPJEY-UHFFFAOYSA-N 1 1 247.338 2.456 20 10 BECDMO CC(C)[C@H](O)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168775216 387801297 /nfs/dbraw/zinc/80/12/97/387801297.db2.gz CJIZHXASSOJQQW-TVQRCGJNSA-N 1 1 241.306 2.199 20 10 BECDMO CCC(=O)CC[N@@H+](C)Cc1ccccc1O ZINC000190295083 168201169 /nfs/dbraw/zinc/20/11/69/168201169.db2.gz LHOCTCRQXDOITK-UHFFFAOYSA-N 1 1 221.300 2.193 20 10 BECDMO CCOCC[N@@H+](CC)Cc1cc(F)ccc1O ZINC000179997879 170396292 /nfs/dbraw/zinc/39/62/92/170396292.db2.gz NZIWQTRWUSGPJA-UHFFFAOYSA-N 1 1 241.306 2.390 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2cc(C)c(C)cc2O)C[C@H]1O ZINC000271244474 171088255 /nfs/dbraw/zinc/08/82/55/171088255.db2.gz BUTKZVBYTHHKCH-IUODEOHRSA-N 1 1 249.354 2.212 20 10 BECDMO COCCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062745100 174248956 /nfs/dbraw/zinc/24/89/56/174248956.db2.gz PFYOVVULVPRIMS-VIFPVBQESA-N 1 1 227.279 2.218 20 10 BECDMO COCC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000298713344 174299006 /nfs/dbraw/zinc/29/90/06/174299006.db2.gz LGPJWXLNRZRVKF-UHFFFAOYSA-N 1 1 248.370 2.363 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@@H]1C ZINC000174963573 176173498 /nfs/dbraw/zinc/17/34/98/176173498.db2.gz NEUDUOIUDCEPGY-NXEZZACHSA-N 1 1 249.310 2.351 20 10 BECDMO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)CCC1=O ZINC000283296981 177262990 /nfs/dbraw/zinc/26/29/90/177262990.db2.gz XDRMXOZUTPPWCZ-LBPRGKRZSA-N 1 1 246.354 2.164 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CCC1=O ZINC000283296981 177262993 /nfs/dbraw/zinc/26/29/93/177262993.db2.gz XDRMXOZUTPPWCZ-LBPRGKRZSA-N 1 1 246.354 2.164 20 10 BECDMO C[C@H]1OCC[N@@H+](Cc2ccc(N(C)C)cc2)[C@@H]1C ZINC000093417622 177399815 /nfs/dbraw/zinc/39/98/15/177399815.db2.gz ODIYBPQUZMKDTA-CHWSQXEVSA-N 1 1 248.370 2.362 20 10 BECDMO C[C@@H]1[C@H](O)CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000294928149 488025573 /nfs/dbraw/zinc/02/55/73/488025573.db2.gz GAVHQGVIORQNRM-IUODEOHRSA-N 1 1 248.370 2.098 20 10 BECDMO C[N@@H+](CCO)Cc1ccc(N2CCCCC2)cc1 ZINC000267157737 536392340 /nfs/dbraw/zinc/39/23/40/536392340.db2.gz PDYDAEOSHBKTKR-UHFFFAOYSA-N 1 1 248.370 2.101 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)CNC)c1ccccc1O ZINC000854230874 588781085 /nfs/dbraw/zinc/78/10/85/588781085.db2.gz BAZUTJQVCOQEBQ-JQWIXIFHSA-N 1 1 222.332 2.041 20 10 BECDMO CNC[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000854232444 588781546 /nfs/dbraw/zinc/78/15/46/588781546.db2.gz PVGQMFBFBNCZRD-PWSUYJOCSA-N 1 1 236.359 2.268 20 10 BECDMO Cc1ccc(C[N@H+](C)Cc2ccccc2O)nn1 ZINC000840911092 583116202 /nfs/dbraw/zinc/11/62/02/583116202.db2.gz OTWPJEOQRAQQSA-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Cc1cccc(C[N@@H+]2CC[C@@H](C)[C@H](CO)C2)c1O ZINC000857060525 588884500 /nfs/dbraw/zinc/88/45/00/588884500.db2.gz ASTGYYBLIJAXSN-RISCZKNCSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](CO)[C@H]2C)c1 ZINC000840979787 583214523 /nfs/dbraw/zinc/21/45/23/583214523.db2.gz URXWDUIMWHCAOK-OLZOCXBDSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](CO)[C@H]2C)c1 ZINC000840979779 583214817 /nfs/dbraw/zinc/21/48/17/583214817.db2.gz URXWDUIMWHCAOK-CHWSQXEVSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)[C@H]1CCCOC1 ZINC000877515778 583321744 /nfs/dbraw/zinc/32/17/44/583321744.db2.gz OXKLHKDKPWUWLN-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(CN2C[C@@H]3CCC[C@]3([NH3+])C2)c1O ZINC000857226684 588896278 /nfs/dbraw/zinc/89/62/78/588896278.db2.gz WHTHKVBDQVOSBJ-ZFWWWQNUSA-N 1 1 246.354 2.014 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c1 ZINC000895779423 583726545 /nfs/dbraw/zinc/72/65/45/583726545.db2.gz OLIZOSOWHUVTIQ-BETUJISGSA-N 1 1 249.379 2.495 20 10 BECDMO C[C@@H]([NH2+]Cc1c(O)cccc1F)[C@@H]1CCOC1 ZINC000896637313 583819124 /nfs/dbraw/zinc/81/91/24/583819124.db2.gz JDTRDOMNELOHAQ-NXEZZACHSA-N 1 1 239.290 2.046 20 10 BECDMO CC[C@H]1C[C@H]([NH2+]Cc2c(O)cccc2F)CO1 ZINC000896638040 583820017 /nfs/dbraw/zinc/82/00/17/583820017.db2.gz NRGSUMBCHXADSZ-UWVGGRQHSA-N 1 1 239.290 2.188 20 10 BECDMO CO[C@H](C)[C@@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896641589 583820262 /nfs/dbraw/zinc/82/02/62/583820262.db2.gz NCBNPJQUHBNZPU-RKDXNWHRSA-N 1 1 227.279 2.044 20 10 BECDMO CC(C)OC[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896639550 583820422 /nfs/dbraw/zinc/82/04/22/583820422.db2.gz WDKHEYUENWTWMA-JTQLQIEISA-N 1 1 241.306 2.434 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@@H]2CNCC[C@H]2C)cc1C ZINC000841059985 584126153 /nfs/dbraw/zinc/12/61/53/584126153.db2.gz ZHWSVZKLAOUWNQ-QMTHXVAHSA-N 1 1 248.370 2.097 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](C)N)c(O)c1 ZINC000817977269 584993012 /nfs/dbraw/zinc/99/30/12/584993012.db2.gz FXHUPOSXPWKFAT-DCAQKATOSA-N 1 1 222.332 2.087 20 10 BECDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)C1CC1 ZINC000838859550 585075704 /nfs/dbraw/zinc/07/57/04/585075704.db2.gz LGYFXMALWDPYCG-OAHLLOKOSA-N 1 1 249.354 2.375 20 10 BECDMO C[C@H]([NH2+]CC1(C)COC1)c1c(O)cccc1F ZINC000886526577 585141686 /nfs/dbraw/zinc/14/16/86/585141686.db2.gz NWDSINJSJMAXKE-VIFPVBQESA-N 1 1 239.290 2.218 20 10 BECDMO CC(C)[C@H](O)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886528237 585141852 /nfs/dbraw/zinc/14/18/52/585141852.db2.gz IXPBVEUIODWXJO-JOYOIKCWSA-N 1 1 241.306 2.199 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCC[C@]2(C)CO)cc1 ZINC000789556580 585166471 /nfs/dbraw/zinc/16/64/71/585166471.db2.gz CWNCZVKSKAFLKL-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO COCC1([NH2+][C@@H](C)c2ccc(F)cc2O)CC1 ZINC000756851267 585324298 /nfs/dbraw/zinc/32/42/98/585324298.db2.gz RESXLKJZDCTUJX-VIFPVBQESA-N 1 1 239.290 2.361 20 10 BECDMO CCC[N@@H+](C)Cc1c(O)cccc1OC ZINC000768244354 585534749 /nfs/dbraw/zinc/53/47/49/585534749.db2.gz ISLGEYIFUSIXPQ-UHFFFAOYSA-N 1 1 209.289 2.243 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2C[C@H](O)C[C@@H]2C)cc1 ZINC000773815929 585644361 /nfs/dbraw/zinc/64/43/61/585644361.db2.gz KEAOCGUKYMLDJG-SWLSCSKDSA-N 1 1 248.370 2.098 20 10 BECDMO C[C@@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccccc1O ZINC000777824412 585720722 /nfs/dbraw/zinc/72/07/22/585720722.db2.gz FBQVPOFHWAVVHU-OCCSQVGLSA-N 1 1 248.370 2.164 20 10 BECDMO COc1cc(C)cc(C[N@@H+]2CC=CCC2)c1O ZINC000778576459 585737392 /nfs/dbraw/zinc/73/73/92/585737392.db2.gz HAJPMVSAXCDKSC-UHFFFAOYSA-N 1 1 233.311 2.471 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2CCO)c1 ZINC000779202655 585747225 /nfs/dbraw/zinc/74/72/25/585747225.db2.gz RWCRBQZNWFSODB-CYBMUJFWSA-N 1 1 235.327 2.047 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2CCO)cc1 ZINC000779202653 585747279 /nfs/dbraw/zinc/74/72/79/585747279.db2.gz RSCZILYRFRWFAD-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO CC[C@@]1(O)CC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000779219015 585747502 /nfs/dbraw/zinc/74/75/02/585747502.db2.gz KQFDLCXXEITWFC-OAHLLOKOSA-N 1 1 249.354 2.356 20 10 BECDMO CC[C@]1(O)CC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000779215549 585747508 /nfs/dbraw/zinc/74/75/08/585747508.db2.gz BMKXHOUUADVIJV-AWEZNQCLSA-N 1 1 235.327 2.047 20 10 BECDMO C[C@@H]1C[C@H](O)C[N@H+]1Cc1cc(Cl)ccc1O ZINC000788268502 585920104 /nfs/dbraw/zinc/92/01/04/585920104.db2.gz DVSFCMQEYSFKQB-KCJUWKMLSA-N 1 1 241.718 2.001 20 10 BECDMO CC[C@H]([NH2+][C@@H]1CCOC1)c1ccc(F)cc1O ZINC000796842330 586114693 /nfs/dbraw/zinc/11/46/93/586114693.db2.gz YTDVZGTUOQQYBX-PWSUYJOCSA-N 1 1 239.290 2.361 20 10 BECDMO CN(C)c1ccc(C[N@@H+]2CCOCC23CC3)cc1 ZINC000801979469 586284312 /nfs/dbraw/zinc/28/43/12/586284312.db2.gz BNRYOMKOWNEZQD-UHFFFAOYSA-N 1 1 246.354 2.117 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCOCC23CC3)cc1 ZINC000801979469 586284314 /nfs/dbraw/zinc/28/43/14/586284314.db2.gz BNRYOMKOWNEZQD-UHFFFAOYSA-N 1 1 246.354 2.117 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H](OC(F)F)C1 ZINC000802658520 586308811 /nfs/dbraw/zinc/30/88/11/586308811.db2.gz HLACYQCTCJZUOZ-JTQLQIEISA-N 1 1 243.253 2.206 20 10 BECDMO Cc1cc(C[N@@H+]2C[C@H](O)C[C@@H]2C)ccc1N(C)C ZINC000815079560 586665934 /nfs/dbraw/zinc/66/59/34/586665934.db2.gz SEPYIBASCMARIS-GXTWGEPZSA-N 1 1 248.370 2.016 20 10 BECDMO COC[C@@H]1CC[N@H+]1Cc1cc(Cl)ccc1O ZINC000816637325 586746341 /nfs/dbraw/zinc/74/63/41/586746341.db2.gz ZUJFWVXTNPZAMH-NSHDSACASA-N 1 1 241.718 2.266 20 10 BECDMO C[C@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@H]1C ZINC000816647259 586749181 /nfs/dbraw/zinc/74/91/81/586749181.db2.gz QEBWYIIJBDHMDV-IUCAKERBSA-N 1 1 209.264 2.372 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@H](O)CC[C@H]2C)c1O ZINC000817415586 586802717 /nfs/dbraw/zinc/80/27/17/586802717.db2.gz ZIFIEMRWYIHFGJ-DGCLKSJQSA-N 1 1 235.327 2.046 20 10 BECDMO C[C@@H]([NH2+][C@H]1CCCNC1)c1ccc(N(C)C)cc1 ZINC000817941369 586844928 /nfs/dbraw/zinc/84/49/28/586844928.db2.gz PBIUIBUHVRLDRO-OCCSQVGLSA-N 1 1 247.386 2.155 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@H]2CCCNC2)c(O)c1C ZINC000817942489 586844992 /nfs/dbraw/zinc/84/49/92/586844992.db2.gz ZRSXTPQPXWEVEH-STQMWFEESA-N 1 1 248.370 2.412 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCNC2)c(O)c1 ZINC000817942428 586845346 /nfs/dbraw/zinc/84/53/46/586845346.db2.gz YMAGPWCEAFAIKJ-VXGBXAGGSA-N 1 1 234.343 2.103 20 10 BECDMO Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CCCCN1)CC2 ZINC000817949308 586846988 /nfs/dbraw/zinc/84/69/88/586846988.db2.gz IHWKDDHXCYDTGL-OLZOCXBDSA-N 1 1 246.354 2.111 20 10 BECDMO CC[C@@H](NCC[NH2+]C1CC1)c1ccc(C)cc1O ZINC000817953989 586849163 /nfs/dbraw/zinc/84/91/63/586849163.db2.gz UNTYZYBUHLIJJS-CQSZACIVSA-N 1 1 248.370 2.493 20 10 BECDMO CC[C@H]([NH2+]C[C@@H](N)C(C)C)c1ccccc1O ZINC000817960177 586851455 /nfs/dbraw/zinc/85/14/55/586851455.db2.gz XZDCMESMHJHXHC-OLZOCXBDSA-N 1 1 236.359 2.416 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]CC(C)(C)N)c(O)c1C ZINC000817961114 586851686 /nfs/dbraw/zinc/85/16/86/586851686.db2.gz XIJLDPTTZCEAPJ-NSHDSACASA-N 1 1 236.359 2.397 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@@H](N)C2CC2)c(O)c1C ZINC000817964925 586853861 /nfs/dbraw/zinc/85/38/61/586853861.db2.gz JHKADVUGKOQZEE-SMDDNHRTSA-N 1 1 248.370 2.397 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](N)C2CC2)c(O)c1 ZINC000817964702 586854276 /nfs/dbraw/zinc/85/42/76/586854276.db2.gz FHLZMHILBLIREO-WCQYABFASA-N 1 1 248.370 2.397 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@@H](N)C2CC2)c(O)c1 ZINC000817964713 586854288 /nfs/dbraw/zinc/85/42/88/586854288.db2.gz FPJHGHIJOPHFNX-GXFFZTMASA-N 1 1 234.343 2.089 20 10 BECDMO CC[C@@H]([NH2+]C[C@H](N)C1CC1)c1ccc(C)cc1O ZINC000817965683 586854975 /nfs/dbraw/zinc/85/49/75/586854975.db2.gz TUIOACTZTMHENG-UONOGXRCSA-N 1 1 248.370 2.479 20 10 BECDMO CCN[C@H](C)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000817971269 586857777 /nfs/dbraw/zinc/85/77/77/586857777.db2.gz BNOLPXQEKSURDH-NEPJUHHUSA-N 1 1 236.359 2.349 20 10 BECDMO CC[C@@H](NC[C@H](C)[NH3+])c1ccc(N(C)C)cc1 ZINC000817970869 586858100 /nfs/dbraw/zinc/85/81/00/586858100.db2.gz GLFUMVTYXRAJNB-SMDDNHRTSA-N 1 1 235.375 2.141 20 10 BECDMO CC[C@@H]([NH2+]C[C@H](C)N)c1ccc(N(C)C)cc1 ZINC000817970869 586858103 /nfs/dbraw/zinc/85/81/03/586858103.db2.gz GLFUMVTYXRAJNB-SMDDNHRTSA-N 1 1 235.375 2.141 20 10 BECDMO C[C@H]([NH3+])[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000817977075 586859908 /nfs/dbraw/zinc/85/99/08/586859908.db2.gz ANLMUFYFPBJTEM-SRVKXCTJSA-N 1 1 235.375 2.139 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)[C@H](C)N)c1ccccc1O ZINC000817978076 586861315 /nfs/dbraw/zinc/86/13/15/586861315.db2.gz VJHRNLROELEVHC-NHCYSSNCSA-N 1 1 222.332 2.169 20 10 BECDMO CC[C@H]([NH2+][C@H](C)[C@@H](C)N)c1ccc(C)cc1O ZINC000817977335 586861501 /nfs/dbraw/zinc/86/15/01/586861501.db2.gz HXJLXUBPBDUAIV-WZRBSPASSA-N 1 1 236.359 2.477 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)[C@@H](C)N)c1ccc(C)cc1O ZINC000817977334 586861754 /nfs/dbraw/zinc/86/17/54/586861754.db2.gz HXJLXUBPBDUAIV-MDZLAQPJSA-N 1 1 236.359 2.477 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@H](C)N)c1 ZINC000817978031 586862067 /nfs/dbraw/zinc/86/20/67/586862067.db2.gz UFMLZPKKCWJXPM-MXWKQRLJSA-N 1 1 222.332 2.087 20 10 BECDMO CC[C@@H]([NH2+][C@@H]1CC[C@H]1O)c1ccc(F)cc1O ZINC000818357657 586889224 /nfs/dbraw/zinc/88/92/24/586889224.db2.gz DTSXPLSRWLUBOG-IJLUTSLNSA-N 1 1 239.290 2.095 20 10 BECDMO Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2N)c1O ZINC000818431460 586890240 /nfs/dbraw/zinc/89/02/40/586890240.db2.gz NIOQTDWODGFWPO-CHWSQXEVSA-N 1 1 234.343 2.060 20 10 BECDMO CC[C@H]1CN(CC)CC[N@H+]1Cc1ccccc1O ZINC000825006162 587298284 /nfs/dbraw/zinc/29/82/84/587298284.db2.gz YTKRNABPUHRRQS-AWEZNQCLSA-N 1 1 248.370 2.308 20 10 BECDMO CC[C@H]1C[N@H+](CC)CCN1Cc1ccccc1O ZINC000825006162 587298285 /nfs/dbraw/zinc/29/82/85/587298285.db2.gz YTKRNABPUHRRQS-AWEZNQCLSA-N 1 1 248.370 2.308 20 10 BECDMO CC[C@H]1C[N@@H+](CC)CCN1Cc1ccccc1O ZINC000825006162 587298286 /nfs/dbraw/zinc/29/82/86/587298286.db2.gz YTKRNABPUHRRQS-AWEZNQCLSA-N 1 1 248.370 2.308 20 10 BECDMO CC1(C)C[C@@H](O)CC[N@@H+](Cc2ccccc2O)C1 ZINC000825091320 587303619 /nfs/dbraw/zinc/30/36/19/587303619.db2.gz YCOGKQZSVDWXJD-ZDUSSCGKSA-N 1 1 249.354 2.375 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](CCCO)C2)c1 ZINC000825338845 587316113 /nfs/dbraw/zinc/31/61/13/587316113.db2.gz VLPZQNQZQIRTNE-CYBMUJFWSA-N 1 1 249.354 2.295 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@H]3COC[C@@]3(C)C2)c1 ZINC000827285246 587375118 /nfs/dbraw/zinc/37/51/18/587375118.db2.gz YZAQCAOSWVFUNR-DZGCQCFKSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@H]3COC[C@@]3(C)C2)c1O ZINC000827282431 587375341 /nfs/dbraw/zinc/37/53/41/587375341.db2.gz MJHFVTPGBCOGSZ-DZGCQCFKSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@@H](CO)[C@H]2C)c1O ZINC000840977810 587933090 /nfs/dbraw/zinc/93/30/90/587933090.db2.gz KBBHAFVJGTXXJZ-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO [NH3+]CCC[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000841006417 587934883 /nfs/dbraw/zinc/93/48/83/587934883.db2.gz KHIWYSWNLSVIJB-UHFFFAOYSA-N 1 1 248.370 2.486 20 10 BECDMO [NH3+]CCC[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000841006417 587934886 /nfs/dbraw/zinc/93/48/86/587934886.db2.gz KHIWYSWNLSVIJB-UHFFFAOYSA-N 1 1 248.370 2.486 20 10 BECDMO CC(C)C[C@@H](CN)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000841038603 587938021 /nfs/dbraw/zinc/93/80/21/587938021.db2.gz LRLIDVAGPQRLST-AWEZNQCLSA-N 1 1 248.370 2.085 20 10 BECDMO Cc1cc(N(C)C)ccc1CNCC1([NH3+])CCC1 ZINC000841048021 587938828 /nfs/dbraw/zinc/93/88/28/587938828.db2.gz FUKYFMRZXBXALX-UHFFFAOYSA-N 1 1 247.386 2.032 20 10 BECDMO C[C@H](C[NH3+])[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000841060160 587941808 /nfs/dbraw/zinc/94/18/08/587941808.db2.gz RNNALCYEQYJBHA-ZCFIWIBFSA-N 1 1 249.141 2.136 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@@H]2CCCCNC2)cc1C ZINC000841089549 587946016 /nfs/dbraw/zinc/94/60/16/587946016.db2.gz IFBOIEOKIBVPKQ-CQSZACIVSA-N 1 1 248.370 2.241 20 10 BECDMO C[C@@H]([NH2+]CCCCO)c1ccc(Cl)cc1O ZINC000841751908 587973472 /nfs/dbraw/zinc/97/34/72/587973472.db2.gz LIYHURUGIXJLFT-SECBINFHSA-N 1 1 243.734 2.469 20 10 BECDMO C[C@H]([NH2+]CCCCO)c1ccc(Cl)cc1O ZINC000841751910 587973839 /nfs/dbraw/zinc/97/38/39/587973839.db2.gz LIYHURUGIXJLFT-VIFPVBQESA-N 1 1 243.734 2.469 20 10 BECDMO Cc1cccc(CN2CCCC[C@H]2[C@@H](C)[NH3+])c1O ZINC000843046412 588075678 /nfs/dbraw/zinc/07/56/78/588075678.db2.gz VCHGGXVCFPVAGI-OCCSQVGLSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cccc(C[N@H+]2CCCC[C@H]2[C@@H](C)N)c1O ZINC000843046412 588075680 /nfs/dbraw/zinc/07/56/80/588075680.db2.gz VCHGGXVCFPVAGI-OCCSQVGLSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cccc(C[N@@H+]2CCCC[C@H]2[C@@H](C)N)c1O ZINC000843046412 588075682 /nfs/dbraw/zinc/07/56/82/588075682.db2.gz VCHGGXVCFPVAGI-OCCSQVGLSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)NC[C@H]2C)cc1C ZINC000843119743 588083709 /nfs/dbraw/zinc/08/37/09/588083709.db2.gz GREFQDCXXWVRJW-CHWSQXEVSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)NC[C@H]2C)cc1C ZINC000843119743 588083711 /nfs/dbraw/zinc/08/37/11/588083711.db2.gz GREFQDCXXWVRJW-CHWSQXEVSA-N 1 1 248.370 2.191 20 10 BECDMO Oc1ccccc1C[N@H+]1CCOC[C@@H]1C1CCC1 ZINC000843428835 588108539 /nfs/dbraw/zinc/10/85/39/588108539.db2.gz NQYDNAKTJLPDSX-CQSZACIVSA-N 1 1 247.338 2.393 20 10 BECDMO C[C@@H](CCO)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000846111453 588257252 /nfs/dbraw/zinc/25/72/52/588257252.db2.gz PGEIAPCJCQUFMI-VIFPVBQESA-N 1 1 243.734 2.248 20 10 BECDMO COc1cccc([C@@H](C)[NH2+]Cc2cocn2)c1O ZINC000846163142 588258897 /nfs/dbraw/zinc/25/88/97/588258897.db2.gz OFPSRPYKZRBIHI-SECBINFHSA-N 1 1 248.282 2.240 20 10 BECDMO CCc1cccc(C[N@H+]2CCC[C@@H](CO)C2)c1O ZINC000848876719 588416391 /nfs/dbraw/zinc/41/63/91/588416391.db2.gz KMESCJGJKNPLMD-GFCCVEGCSA-N 1 1 249.354 2.159 20 10 BECDMO CCc1cccc(C[N@H+](C)Cc2cc[nH]n2)c1O ZINC000848886082 588416999 /nfs/dbraw/zinc/41/69/99/588416999.db2.gz XWUDVMGGAJLMGH-UHFFFAOYSA-N 1 1 245.326 2.310 20 10 BECDMO CCc1cccc(C[N@@H+](C)Cc2cc[nH]n2)c1O ZINC000848886082 588417000 /nfs/dbraw/zinc/41/70/00/588417000.db2.gz XWUDVMGGAJLMGH-UHFFFAOYSA-N 1 1 245.326 2.310 20 10 BECDMO CCc1cccc(C[N@H+]2CCOCC23CC3)c1O ZINC000848909637 588419291 /nfs/dbraw/zinc/41/92/91/588419291.db2.gz YPFSDVFRBNNOHN-UHFFFAOYSA-N 1 1 247.338 2.319 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@@H](C)[C@H]2CO)c1O ZINC000848906658 588419566 /nfs/dbraw/zinc/41/95/66/588419566.db2.gz XPZRJKIQQGQSCZ-BXUZGUMPSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@@H+]2C[C@H](O)C[C@H](C)C2)c1O ZINC000848915750 588419795 /nfs/dbraw/zinc/41/97/95/588419795.db2.gz ZSNSYWOAXJGOBA-SMDDNHRTSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@H+](C)[C@H](CC)CO)c1O ZINC000848914663 588420090 /nfs/dbraw/zinc/42/00/90/588420090.db2.gz QQQHWNSZAOEDIN-CYBMUJFWSA-N 1 1 237.343 2.157 20 10 BECDMO CC[C@H]([NH2+][C@H]1C[C@H](O)C1)c1ccc(F)cc1O ZINC000850578412 588561854 /nfs/dbraw/zinc/56/18/54/588561854.db2.gz JTRXPYBSRGOPAF-NHCYSSNCSA-N 1 1 239.290 2.095 20 10 BECDMO C[C@H](O)[C@H]1CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000852558136 588690447 /nfs/dbraw/zinc/69/04/47/588690447.db2.gz HAGRFWFFCZMAJC-SWLSCSKDSA-N 1 1 248.370 2.098 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1O ZINC000862443775 589213768 /nfs/dbraw/zinc/21/37/68/589213768.db2.gz TZYAHHYCDRNPON-TXEJJXNPSA-N 1 1 203.285 2.152 20 10 BECDMO CCc1cccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1O ZINC000862443802 589214008 /nfs/dbraw/zinc/21/40/08/589214008.db2.gz UPCZAYKSAFLWFM-BETUJISGSA-N 1 1 217.312 2.406 20 10 BECDMO Cc1cc(O)c(C[NH+]2CC3(C2)CCCO3)cc1C ZINC000862484696 589217027 /nfs/dbraw/zinc/21/70/27/589217027.db2.gz ZGEMTHMNYLHFEP-UHFFFAOYSA-N 1 1 247.338 2.374 20 10 BECDMO Cc1ccc(O)c(C[NH+]2CC3(C2)CCCO3)c1 ZINC000862484639 589217107 /nfs/dbraw/zinc/21/71/07/589217107.db2.gz XLFMCRXBFKWEJA-UHFFFAOYSA-N 1 1 233.311 2.065 20 10 BECDMO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)NC1)c1ccccc1O ZINC000863545549 589297871 /nfs/dbraw/zinc/29/78/71/589297871.db2.gz UZJWVTAPQAGZCU-IJLUTSLNSA-N 1 1 234.343 2.183 20 10 BECDMO Cc1nonc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000872137321 589879504 /nfs/dbraw/zinc/87/95/04/589879504.db2.gz SAHDVFDBDWIUSJ-VIFPVBQESA-N 1 1 247.298 2.243 20 10 BECDMO CCCC[N@@H+](CCO)Cc1ccc(C)cc1O ZINC000876528673 590208941 /nfs/dbraw/zinc/20/89/41/590208941.db2.gz VMNJBPIYCOEUOM-UHFFFAOYSA-N 1 1 237.343 2.295 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)Cc1cnn(C)c1 ZINC000876547949 590213964 /nfs/dbraw/zinc/21/39/64/590213964.db2.gz NXZSBOURYPOQIH-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO Cc1ccc(C[N@H+](C)Cc2cnn(C)c2)c(O)c1 ZINC000876547880 590214093 /nfs/dbraw/zinc/21/40/93/590214093.db2.gz LRRKMSPEIFUZFI-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2ccc(C)cc2O)CCO1 ZINC000876561322 590215905 /nfs/dbraw/zinc/21/59/05/590215905.db2.gz QYGZBQYSCCMNHY-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(C[NH+]2CCN(C(C)C)CC2)c(O)c1 ZINC000876564292 590216426 /nfs/dbraw/zinc/21/64/26/590216426.db2.gz JHWGAPVYGCEBMM-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@H](CCO)C2)c(O)c1 ZINC000876693412 590231246 /nfs/dbraw/zinc/23/12/46/590231246.db2.gz DIZUHJCQVOFJFJ-CYBMUJFWSA-N 1 1 249.354 2.295 20 10 BECDMO CCN1CC[N@@H+](Cc2ccc(C)cc2O)C[C@H]1C ZINC000876714927 590232808 /nfs/dbraw/zinc/23/28/08/590232808.db2.gz GIOZSFZUEJRVBS-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2ccc(C)cc2O)C[C@H]1C ZINC000876714927 590232809 /nfs/dbraw/zinc/23/28/09/590232809.db2.gz GIOZSFZUEJRVBS-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2ccc(C)cc2O)C[C@H]1C ZINC000876714927 590232810 /nfs/dbraw/zinc/23/28/10/590232810.db2.gz GIOZSFZUEJRVBS-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@@H+](CCCO)C2CC2)c(O)c1 ZINC000876731303 590234592 /nfs/dbraw/zinc/23/45/92/590234592.db2.gz HSBJIILLWVFCNU-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[N@@H+]2CCO[C@H](C)[C@H]2C)c(O)c1 ZINC000876739312 590235232 /nfs/dbraw/zinc/23/52/32/590235232.db2.gz OAHLZAXCTZBZJW-VXGBXAGGSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1cc(C[NH2+]Cc2ccc(C)cc2O)no1 ZINC000876970870 590263139 /nfs/dbraw/zinc/26/31/39/590263139.db2.gz DYRMCAOBNCCJHD-UHFFFAOYSA-N 1 1 232.283 2.287 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H](C)N(C)C[C@H]2C)c(O)c1 ZINC000877407063 590324284 /nfs/dbraw/zinc/32/42/84/590324284.db2.gz MEYWLNFEZYYSJQ-QWHCGFSZSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H](O)C(C)(C)C2)c(O)c1 ZINC000877461857 590332878 /nfs/dbraw/zinc/33/28/78/590332878.db2.gz KZMMBYQSMCZFSA-AWEZNQCLSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@](C)(O)CC1 ZINC000877489190 590339279 /nfs/dbraw/zinc/33/92/79/590339279.db2.gz LETTVPJLGLICSI-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1ccc(C[N@H+](C)CCN2CCCC2)c(O)c1 ZINC000877524989 590346770 /nfs/dbraw/zinc/34/67/70/590346770.db2.gz NDHDCRBITWCFCU-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO Cc1ccc(C[N@@H+](C)CCN2CCCC2)c(O)c1 ZINC000877524989 590346772 /nfs/dbraw/zinc/34/67/72/590346772.db2.gz NDHDCRBITWCFCU-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@H](O)C2(C)C)c(O)c1 ZINC000877542237 590351950 /nfs/dbraw/zinc/35/19/50/590351950.db2.gz QLZXDBXBRBIPDP-CYBMUJFWSA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@H](CO)C[C@H](C)C1 ZINC000877595158 590370129 /nfs/dbraw/zinc/37/01/29/590370129.db2.gz UAKHETPPBSMPIP-WCQYABFASA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@H+](C)C[C@@H]2CCCN2C)c(O)c1 ZINC000877595837 590370386 /nfs/dbraw/zinc/37/03/86/590370386.db2.gz CZQZNEZHFUHMPU-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN(C)C[C@@H]2CCC[N@@H+]2C)c(O)c1 ZINC000877595837 590370388 /nfs/dbraw/zinc/37/03/88/590370388.db2.gz CZQZNEZHFUHMPU-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN(C)C[C@@H]2CCC[N@H+]2C)c(O)c1 ZINC000877595837 590370390 /nfs/dbraw/zinc/37/03/90/590370390.db2.gz CZQZNEZHFUHMPU-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC000877615637 590375054 /nfs/dbraw/zinc/37/50/54/590375054.db2.gz USXWOEPPZQRXJE-PHIMTYICSA-N 1 1 239.265 2.398 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CC[C@@H](C)[C@@H](CO)C1 ZINC000877646881 590384469 /nfs/dbraw/zinc/38/44/69/590384469.db2.gz MNWQTTKHZAANSZ-DGCLKSJQSA-N 1 1 249.354 2.151 20 10 BECDMO CC[C@@]1(O)CCC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000877692000 590392433 /nfs/dbraw/zinc/39/24/33/590392433.db2.gz ZUNWCPZPZYKJGY-OAHLLOKOSA-N 1 1 249.354 2.438 20 10 BECDMO CCc1nocc1C[N@H+]1Cc2cccc(O)c2C1 ZINC000877702809 590395590 /nfs/dbraw/zinc/39/55/90/590395590.db2.gz IJLQVSRPWNIZGN-UHFFFAOYSA-N 1 1 244.294 2.458 20 10 BECDMO Cn1ccc(C[N@H+]2Cc3cccc(O)c3C2)c1 ZINC000877703170 590396437 /nfs/dbraw/zinc/39/64/37/590396437.db2.gz UOKOABUXRYKLJJ-UHFFFAOYSA-N 1 1 228.295 2.247 20 10 BECDMO C[C@@H]1C[C@@H]1C[N@H+]1Cc2cccc(O)c2C1 ZINC000877703072 590396834 /nfs/dbraw/zinc/39/68/34/590396834.db2.gz PZBDWVGPBQULBN-MWLCHTKSSA-N 1 1 203.285 2.364 20 10 BECDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000877797342 590424786 /nfs/dbraw/zinc/42/47/86/590424786.db2.gz UFYGXRWXGHHTEO-CYBMUJFWSA-N 1 1 249.354 2.375 20 10 BECDMO CCc1nnc(C[NH2+][C@@H](C)c2ccccc2O)o1 ZINC000879653354 590843683 /nfs/dbraw/zinc/84/36/83/590843683.db2.gz OTIALOJRAQSUQR-VIFPVBQESA-N 1 1 247.298 2.188 20 10 BECDMO C[C@@H]([NH2+]Cc1ccn(C)n1)c1ccc(F)cc1O ZINC000213211800 591455638 /nfs/dbraw/zinc/45/56/38/591455638.db2.gz TVCOLWBDCYFOQW-SECBINFHSA-N 1 1 249.289 2.116 20 10 BECDMO C[C@H]([NH2+]Cc1ccn(C)n1)c1ccc(F)cc1O ZINC000213211739 591455797 /nfs/dbraw/zinc/45/57/97/591455797.db2.gz TVCOLWBDCYFOQW-VIFPVBQESA-N 1 1 249.289 2.116 20 10 BECDMO COCCCC[N@H+](C)c1ccc(N)cc1 ZINC000130940679 591537409 /nfs/dbraw/zinc/53/74/09/591537409.db2.gz QXAZWLYZHVRBES-UHFFFAOYSA-N 1 1 208.305 2.132 20 10 BECDMO COCCCC[N@@H+](C)c1ccc(N)cc1 ZINC000130940679 591537411 /nfs/dbraw/zinc/53/74/11/591537411.db2.gz QXAZWLYZHVRBES-UHFFFAOYSA-N 1 1 208.305 2.132 20 10 BECDMO Oc1cccc(Cl)c1C[N@H+]1CCCOCC1 ZINC000132726989 591733967 /nfs/dbraw/zinc/73/39/67/591733967.db2.gz ITYIODGGYJHOQW-UHFFFAOYSA-N 1 1 241.718 2.268 20 10 BECDMO C[C@H]1C[C@H](C)[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000134957909 591962994 /nfs/dbraw/zinc/96/29/94/591962994.db2.gz XJQQACHLYWFCSF-UWVGGRQHSA-N 1 1 249.310 2.351 20 10 BECDMO C[C@@H]([NH2+]CCn1ccnc1)c1c(O)cccc1F ZINC000886489835 592235831 /nfs/dbraw/zinc/23/58/31/592235831.db2.gz SETATTKWJBVXHC-SNVBAGLBSA-N 1 1 249.289 2.079 20 10 BECDMO C[C@H]([NH2+][C@@H]1CCCOC1)c1c(O)cccc1F ZINC000886525160 592245409 /nfs/dbraw/zinc/24/54/09/592245409.db2.gz YRITXULCOBEVQB-VHSXEESVSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@H]([NH2+]CC1(O)CCC1)c1c(O)cccc1F ZINC000886526491 592245727 /nfs/dbraw/zinc/24/57/27/592245727.db2.gz NAZIKEBXIINEIL-VIFPVBQESA-N 1 1 239.290 2.097 20 10 BECDMO C[C@@H]([NH2+]CC(C)(C)CO)c1c(O)cccc1F ZINC000886553196 592259310 /nfs/dbraw/zinc/25/93/10/592259310.db2.gz FZKPGXKMMQOAPD-SECBINFHSA-N 1 1 241.306 2.200 20 10 BECDMO C[C@@H]([NH2+][C@@H](C)C[C@H](C)O)c1c(O)cccc1F ZINC000886588617 592271304 /nfs/dbraw/zinc/27/13/04/592271304.db2.gz WBJYBMBFIHNQKN-LPEHRKFASA-N 1 1 241.306 2.341 20 10 BECDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ncc[nH]1 ZINC000138933843 592321568 /nfs/dbraw/zinc/32/15/68/592321568.db2.gz KTDNATXHQMTJGQ-JTQLQIEISA-N 1 1 243.310 2.195 20 10 BECDMO CO[C@@H]1CC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000300045467 592501720 /nfs/dbraw/zinc/50/17/20/592501720.db2.gz LHARBENHAACHOE-SECBINFHSA-N 1 1 241.718 2.266 20 10 BECDMO CC(C)[N@H+](C)CCNCc1ccc2c(c1)CCO2 ZINC000054111415 635393569 /nfs/dbraw/zinc/39/35/69/635393569.db2.gz KAGSTNRSSPPMDP-UHFFFAOYSA-N 1 1 248.370 2.051 20 10 BECDMO CC(C)[N@@H+](C)CCNCc1ccc2c(c1)CCO2 ZINC000054111415 635393576 /nfs/dbraw/zinc/39/35/76/635393576.db2.gz KAGSTNRSSPPMDP-UHFFFAOYSA-N 1 1 248.370 2.051 20 10 BECDMO OC[C@H]1CCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000092470848 631555879 /nfs/dbraw/zinc/55/58/79/631555879.db2.gz LRQLQFALFDCLBE-LLVKDONJSA-N 1 1 241.718 2.002 20 10 BECDMO CCN1CC[N@@H+](Cc2cccc(C)c2O)C[C@H]1C ZINC000252729268 635714279 /nfs/dbraw/zinc/71/42/79/635714279.db2.gz FYDCKMANKTWSBY-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2cccc(C)c2O)C[C@H]1C ZINC000252729268 635714284 /nfs/dbraw/zinc/71/42/84/635714284.db2.gz FYDCKMANKTWSBY-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2cccc(C)c2O)C[C@H]1C ZINC000252729268 635714288 /nfs/dbraw/zinc/71/42/88/635714288.db2.gz FYDCKMANKTWSBY-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Oc1c(F)cccc1C[NH2+]C1CC=CC1 ZINC000163178329 636135264 /nfs/dbraw/zinc/13/52/64/636135264.db2.gz XDRHHHLWYGDXQT-UHFFFAOYSA-N 1 1 207.248 2.340 20 10 BECDMO CCOc1cccc(C[N@@H+](C)C2CC2)c1O ZINC000179304722 636784904 /nfs/dbraw/zinc/78/49/04/636784904.db2.gz CUASACAUZGUMAM-UHFFFAOYSA-N 1 1 221.300 2.385 20 10 BECDMO C[C@@H]([NH2+]Cc1ccon1)c1cc(F)ccc1O ZINC000148705198 636831379 /nfs/dbraw/zinc/83/13/79/636831379.db2.gz NIZBRNKURLGCQY-MRVPVSSYSA-N 1 1 236.246 2.370 20 10 BECDMO Oc1cccc(Cl)c1C[NH2+]Cc1ccno1 ZINC000230973091 641122051 /nfs/dbraw/zinc/12/20/51/641122051.db2.gz RFJBFWZCCDDJBB-UHFFFAOYSA-N 1 1 238.674 2.323 20 10 BECDMO C[C@H]([NH3+])[C@@H]1CCCCN1Cc1ccccc1O ZINC000063191710 641142192 /nfs/dbraw/zinc/14/21/92/641142192.db2.gz ARWPZRCLDMNYMJ-AAEUAGOBSA-N 1 1 234.343 2.094 20 10 BECDMO CC(C)(CO)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000190992391 641896051 /nfs/dbraw/zinc/89/60/51/641896051.db2.gz PORZZHZODNCCBE-UHFFFAOYSA-N 1 1 247.697 2.045 20 10 BECDMO CC(C)(O)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000190991687 641896220 /nfs/dbraw/zinc/89/62/20/641896220.db2.gz SVGHWSDUCYEJNC-UHFFFAOYSA-N 1 1 247.697 2.045 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2C(C)(C)O)c1 ZINC000154479441 642107942 /nfs/dbraw/zinc/10/79/42/642107942.db2.gz HFZYKSYZZMQDDS-CQSZACIVSA-N 1 1 249.354 2.436 20 10 BECDMO C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1ccccc1O ZINC000179576954 642730597 /nfs/dbraw/zinc/73/05/97/642730597.db2.gz QUXXBCZVROKWKP-DGCLKSJQSA-N 1 1 235.327 2.128 20 10 BECDMO CCC[N@@H+](CCOC)Cc1ccccc1O ZINC000195156254 644362328 /nfs/dbraw/zinc/36/23/28/644362328.db2.gz HGSVDAQGSRQIIS-UHFFFAOYSA-N 1 1 223.316 2.251 20 10 BECDMO C[C@@H](O)CC[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000093481416 644692320 /nfs/dbraw/zinc/69/23/20/644692320.db2.gz CUEBHKNLJLSEGA-SECBINFHSA-N 1 1 243.734 2.248 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CC[C@H](O)[C@@H](C)C2)cc1C ZINC000249839898 644742030 /nfs/dbraw/zinc/74/20/30/644742030.db2.gz FWELMNFXNUXWTQ-JSGCOSHPSA-N 1 1 249.354 2.212 20 10 BECDMO COC[C@@H]1CC[N@H+]1Cc1cc(C)cc(C)c1O ZINC000840083736 644857466 /nfs/dbraw/zinc/85/74/66/644857466.db2.gz QWBNBYPEOOHSNO-ZDUSSCGKSA-N 1 1 235.327 2.230 20 10 BECDMO CC[C@H](N)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000817980056 644992147 /nfs/dbraw/zinc/99/21/47/644992147.db2.gz QXSABOSCHGXBHM-NEPJUHHUSA-N 1 1 236.359 2.397 20 10 BECDMO C[C@@H](O)C[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835047254 645163172 /nfs/dbraw/zinc/16/31/72/645163172.db2.gz DQIYCDNMHYPUFV-URWSZGRFSA-N 1 1 248.370 2.078 20 10 BECDMO C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000843129617 645266687 /nfs/dbraw/zinc/26/66/87/645266687.db2.gz QKZKCXPZHDCQIY-RKDXNWHRSA-N 1 1 242.750 2.261 20 10 BECDMO C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000843129616 645267540 /nfs/dbraw/zinc/26/75/40/645267540.db2.gz QKZKCXPZHDCQIY-IUCAKERBSA-N 1 1 242.750 2.261 20 10 BECDMO COc1cccc(C[NH2+]CC(C)(F)F)c1O ZINC000382051921 710769886 /nfs/dbraw/zinc/76/98/86/710769886.db2.gz MZBCPAFYSJUJPT-UHFFFAOYSA-N 1 1 231.242 2.146 20 10 BECDMO C[C@H]1COCCC[N@H+]1Cc1cc(F)ccc1O ZINC000398907368 710910711 /nfs/dbraw/zinc/91/07/11/710910711.db2.gz GMVIYHYGCVJTRI-JTQLQIEISA-N 1 1 239.290 2.142 20 10 BECDMO C[C@H]([NH2+]Cc1csnn1)c1ccccc1O ZINC000398482895 711411256 /nfs/dbraw/zinc/41/12/56/711411256.db2.gz SKMXGIALJUPHTD-QMMMGPOBSA-N 1 1 235.312 2.095 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@](C)(O)C1 ZINC000840918196 711709552 /nfs/dbraw/zinc/70/95/52/711709552.db2.gz DWRFISHDHRSWID-OAHLLOKOSA-N 1 1 248.370 2.018 20 10 BECDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)Nc1ccc(N)cc1 ZINC000706291399 712144025 /nfs/dbraw/zinc/14/40/25/712144025.db2.gz UZTHFLRSXYSUDT-PHIMTYICSA-N 1 1 247.342 2.080 20 10 BECDMO [NH3+][C@H]1CCCCCN(Cc2ccccc2O)C1 ZINC000709011926 712206275 /nfs/dbraw/zinc/20/62/75/712206275.db2.gz URLMCSLJENMPEG-ZDUSSCGKSA-N 1 1 234.343 2.096 20 10 BECDMO COCC[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708487404 712211286 /nfs/dbraw/zinc/21/12/86/712211286.db2.gz WCOFRQKESYNXNX-QMMMGPOBSA-N 1 1 245.269 2.185 20 10 BECDMO Cc1cc(C[NH2+][C@H](C)c2ccc(F)cc2O)[nH]n1 ZINC000716465145 712562995 /nfs/dbraw/zinc/56/29/95/712562995.db2.gz VRJLNWLUUUGMHJ-SECBINFHSA-N 1 1 249.289 2.414 20 10 BECDMO Oc1c(F)cccc1C[NH2+]CCCOC(F)F ZINC000398281717 1167048862 /nfs/dbraw/zinc/04/88/62/1167048862.db2.gz PVJVIFRGLLMWOR-UHFFFAOYSA-N 1 1 249.232 2.250 20 10 BECDMO CC(C)(CF)[NH2+]Cc1cccc(F)c1O ZINC000308830564 1167204514 /nfs/dbraw/zinc/20/45/14/1167204514.db2.gz AJGOVXZIAJJCKN-UHFFFAOYSA-N 1 1 215.243 2.369 20 10 BECDMO CO[C@H]1CC[N@@H+](Cc2ccc(N)cc2)[C@@H](C)C1 ZINC000310035760 1167342207 /nfs/dbraw/zinc/34/22/07/1167342207.db2.gz KTYUTTRYVXYUMF-FZMZJTMJSA-N 1 1 234.343 2.268 20 10 BECDMO CC[N@@H+](CCCCCO)Cc1ccccc1O ZINC001236045500 979335248 /nfs/dbraw/zinc/33/52/48/979335248.db2.gz VFTKBWUTYAWKSR-UHFFFAOYSA-N 1 1 237.343 2.377 20 10 BECDMO Cc1cc(F)cc(C[N@@H+]2CC[C@H](F)C2)c1O ZINC001238064873 980132738 /nfs/dbraw/zinc/13/27/38/980132738.db2.gz RFBHOQGBCVHESU-JTQLQIEISA-N 1 1 227.254 2.384 20 10 BECDMO Cc1cc(F)cc(C[N@H+]2CC[C@H](F)C2)c1O ZINC001238064873 980132744 /nfs/dbraw/zinc/13/27/44/980132744.db2.gz RFBHOQGBCVHESU-JTQLQIEISA-N 1 1 227.254 2.384 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c(O)c1 ZINC000877605160 1168927277 /nfs/dbraw/zinc/92/72/77/1168927277.db2.gz OCDDOKXXQFIQBP-HIFRSBDPSA-N 1 1 247.338 2.311 20 10 BECDMO C[C@H]1CCC[N@H+](Cc2ccccc2[O-])[C@@H]1CC[NH3+] ZINC000404434783 971163607 /nfs/dbraw/zinc/16/36/07/971163607.db2.gz QRCJAHREEWVPJT-GXTWGEPZSA-N 1 1 248.370 2.342 20 10 BECDMO C[C@H]1CCC[N@@H+](Cc2ccccc2[O-])[C@@H]1CC[NH3+] ZINC000404434783 971163614 /nfs/dbraw/zinc/16/36/14/971163614.db2.gz QRCJAHREEWVPJT-GXTWGEPZSA-N 1 1 248.370 2.342 20 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BECDMO Cc1c(O)ccc(C[N@H+]2CCC[C@@H]2CF)c1O ZINC001140750954 960552638 /nfs/dbraw/zinc/55/26/38/960552638.db2.gz DPLALDWKYARUQH-LLVKDONJSA-N 1 1 239.290 2.340 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@](C)(O)[C@@H](C)C2)c(O)c1 ZINC001140948184 960740498 /nfs/dbraw/zinc/74/04/98/960740498.db2.gz WYTLMSJTMFOEMJ-WFASDCNBSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@H]3[C@H](CF)[C@H]3C2)c(O)c1 ZINC001140958220 960754424 /nfs/dbraw/zinc/75/44/24/960754424.db2.gz USFCOHPFZZPORT-XYYAHUGASA-N 1 1 235.302 2.348 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@]23CCOC3)c(O)c1 ZINC001140954231 960754947 /nfs/dbraw/zinc/75/49/47/960754947.db2.gz NQEADFSMEDEKMY-AWEZNQCLSA-N 1 1 233.311 2.065 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H]3OC[C@@H](C)[C@H]3C2)c(O)c1 ZINC001140958120 960757298 /nfs/dbraw/zinc/75/72/98/960757298.db2.gz QZHMBIAZYLBARZ-UXIGCNINSA-N 1 1 247.338 2.167 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@@H](O)C[C@@H]2C)c(O)c1 ZINC001140950987 960757372 /nfs/dbraw/zinc/75/73/72/960757372.db2.gz RWZPTAAQGVIMHV-WCQYABFASA-N 1 1 235.327 2.046 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)c(O)c1 ZINC001140954763 960763354 /nfs/dbraw/zinc/76/33/54/960763354.db2.gz YIKFXUUZCIBWEN-CHWSQXEVSA-N 1 1 233.311 2.064 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCC3(CC3)C2)c1 ZINC001141156716 960889847 /nfs/dbraw/zinc/88/98/47/960889847.db2.gz RTHHLEDTHMGQBK-UHFFFAOYSA-N 1 1 219.284 2.084 20 10 BECDMO CC[N@@H+](Cc1cc(O)ccc1O)C(C)C ZINC001141155629 960890207 /nfs/dbraw/zinc/89/02/07/960890207.db2.gz BYFUELIZZPEKLF-UHFFFAOYSA-N 1 1 209.289 2.328 20 10 BECDMO C[C@@H]1CCC[N@@H+](Cc2cc(O)ccc2O)C1 ZINC001141156538 960892231 /nfs/dbraw/zinc/89/22/31/960892231.db2.gz ZNMQYKPZEIUHMK-SNVBAGLBSA-N 1 1 221.300 2.330 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCC[C@H](CF)C2)c1 ZINC001141159955 960896976 /nfs/dbraw/zinc/89/69/76/960896976.db2.gz NCRFFVGWCFFXHA-SNVBAGLBSA-N 1 1 239.290 2.279 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCC[C@@H]3C[C@@H]32)c1 ZINC001141162522 960907460 /nfs/dbraw/zinc/90/74/60/960907460.db2.gz VPEUSIPCHJZQSR-SKDRFNHKSA-N 1 1 219.284 2.082 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2ccc(N)cc2)CCCO1 ZINC000302288127 962201305 /nfs/dbraw/zinc/20/13/05/962201305.db2.gz CTSLUIGZZJNHTI-CQSZACIVSA-N 1 1 234.343 2.270 20 10 BECDMO CCc1ccc(C[N@H+]2CC[C@]23CCOC3)c(O)c1 ZINC001236786693 966534639 /nfs/dbraw/zinc/53/46/39/966534639.db2.gz DQYSYEDPZHPROI-OAHLLOKOSA-N 1 1 247.338 2.319 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@H](CO)CC[C@@H]1C ZINC001237485401 966664385 /nfs/dbraw/zinc/66/43/85/966664385.db2.gz OYJDIYOHJONIMU-QWHCGFSZSA-N 1 1 249.354 2.293 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2ccccc2O)CC[C@@]1(C)O ZINC001203550364 966679182 /nfs/dbraw/zinc/67/91/82/966679182.db2.gz TWQILBFSKIMRGC-SWLSCSKDSA-N 1 1 249.354 2.375 20 10 BECDMO C[C@@]1(CO)CCC[N@@H+](Cc2ccccc2O)CC1 ZINC001203550554 966679781 /nfs/dbraw/zinc/67/97/81/966679781.db2.gz ZCHPWNKVNIDMDO-OAHLLOKOSA-N 1 1 249.354 2.377 20 10 BECDMO CCCCOC1C[NH+](Cc2ccccc2O)C1 ZINC001203555893 966688934 /nfs/dbraw/zinc/68/89/34/966688934.db2.gz JLHBLFOTOATFKO-UHFFFAOYSA-N 1 1 235.327 2.393 20 10 BECDMO Oc1ccccc1C[N@H+]1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001203558617 966689049 /nfs/dbraw/zinc/68/90/49/966689049.db2.gz PTLHIAFWOBWYAI-CNDDSTCGSA-N 1 1 221.275 2.040 20 10 BECDMO COc1cccc(C[N@H+]2C[C@@H](F)C[C@H]2C)c1O ZINC001203586137 966699979 /nfs/dbraw/zinc/69/99/79/966699979.db2.gz ZJSBSANMCFKDTF-KOLCDFICSA-N 1 1 239.290 2.333 20 10 BECDMO COc1ccc(C[N@H+]2CCC[C@@H]3C[C@@H]32)c(O)c1 ZINC001203634753 966715976 /nfs/dbraw/zinc/71/59/76/966715976.db2.gz UDIPMOJVYGVEBW-MFKMUULPSA-N 1 1 233.311 2.385 20 10 BECDMO C[N@H+](Cc1cc(Cl)ccc1O)CC1COC1 ZINC001203664297 966731418 /nfs/dbraw/zinc/73/14/18/966731418.db2.gz WVHGUFXTLFOTCW-UHFFFAOYSA-N 1 1 241.718 2.124 20 10 BECDMO C[C@@H]1CCC[N@@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203874326 966792611 /nfs/dbraw/zinc/79/26/11/966792611.db2.gz UEDHNWZZMTUKFZ-SNVBAGLBSA-N 1 1 221.300 2.330 20 10 BECDMO C[N@H+](Cc1cccnc1)Cc1ccc(O)c(O)c1 ZINC001203874137 966794677 /nfs/dbraw/zinc/79/46/77/966794677.db2.gz PQMKJUSOLWHKKQ-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO C[N@@H+](Cc1cccnc1)Cc1ccc(O)c(O)c1 ZINC001203874137 966794694 /nfs/dbraw/zinc/79/46/94/966794694.db2.gz PQMKJUSOLWHKKQ-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO CC[N@@H+](Cc1ccc(O)c(O)c1)C(C)C ZINC001203873349 966801331 /nfs/dbraw/zinc/80/13/31/966801331.db2.gz DSZUYWPWMCHXDY-UHFFFAOYSA-N 1 1 209.289 2.328 20 10 BECDMO C[N@H+](Cc1ccc(O)c(O)c1)Cc1ccccn1 ZINC001203874469 966805520 /nfs/dbraw/zinc/80/55/20/966805520.db2.gz ZCEAVVNLYUMTOD-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO C[N@@H+](Cc1ccc(O)c(O)c1)Cc1ccccn1 ZINC001203874469 966805525 /nfs/dbraw/zinc/80/55/25/966805525.db2.gz ZCEAVVNLYUMTOD-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO C[C@]1(F)CCC[N@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203874838 966807239 /nfs/dbraw/zinc/80/72/39/966807239.db2.gz DDNLZUGAYRNOJF-ZDUSSCGKSA-N 1 1 239.290 2.422 20 10 BECDMO C[C@]1(F)CCC[N@@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203874838 966807243 /nfs/dbraw/zinc/80/72/43/966807243.db2.gz DDNLZUGAYRNOJF-ZDUSSCGKSA-N 1 1 239.290 2.422 20 10 BECDMO CC[C@@H]1CC[N@@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203883636 966808828 /nfs/dbraw/zinc/80/88/28/966808828.db2.gz KYLCLJCBISAUIL-SNVBAGLBSA-N 1 1 221.300 2.330 20 10 BECDMO Oc1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)cc1O ZINC001203880362 966808938 /nfs/dbraw/zinc/80/89/38/966808938.db2.gz PJESWLKCHLIBMD-DCAQKATOSA-N 1 1 237.274 2.030 20 10 BECDMO Oc1ccc(C[N@@H+]2CCC[C@@H]2CF)cc1O ZINC001203884814 966810041 /nfs/dbraw/zinc/81/00/41/966810041.db2.gz ZNTGWCGPYJKSNI-SNVBAGLBSA-N 1 1 225.263 2.032 20 10 BECDMO Oc1ccc(C[N@H+]2CCC[C@@H]2CF)cc1O ZINC001203884814 966810043 /nfs/dbraw/zinc/81/00/43/966810043.db2.gz ZNTGWCGPYJKSNI-SNVBAGLBSA-N 1 1 225.263 2.032 20 10 BECDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001203937116 966823655 /nfs/dbraw/zinc/82/36/55/966823655.db2.gz LMASNPUZODFNIR-OAHLLOKOSA-N 1 1 248.370 2.363 20 10 BECDMO Oc1ccc(C[N@H+]2CCC[C@H](F)CC2)c(O)c1 ZINC001204276069 966950064 /nfs/dbraw/zinc/95/00/64/966950064.db2.gz FLUSNKBOGOQRRK-NSHDSACASA-N 1 1 239.290 2.422 20 10 BECDMO C[N@@H+](Cc1ccncc1)Cc1ccc(O)cc1O ZINC001204276934 966957318 /nfs/dbraw/zinc/95/73/18/966957318.db2.gz UFQQKXBBPDGDNI-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO Oc1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c(O)c1 ZINC001204279945 966957696 /nfs/dbraw/zinc/95/76/96/966957696.db2.gz FWZLVXVMQVRDSP-NHCYSSNCSA-N 1 1 237.274 2.030 20 10 BECDMO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(O)cc1O ZINC001204276793 966959452 /nfs/dbraw/zinc/95/94/52/966959452.db2.gz RLQLBNXIKVTMOR-SCZZXKLOSA-N 1 1 225.263 2.030 20 10 BECDMO Oc1ccc(C[N@@H+](CC2CC2)C2CC2)c(O)c1 ZINC001204277387 966960892 /nfs/dbraw/zinc/96/08/92/966960892.db2.gz CEMIGLHVYBDRPN-UHFFFAOYSA-N 1 1 233.311 2.472 20 10 BECDMO COc1cc(C[N@H+]2C[C@H]3CC[C@@H]2C3)cc(O)c1O ZINC001204346747 966975707 /nfs/dbraw/zinc/97/57/07/966975707.db2.gz YFBDFDRVPPQTTK-GXSJLCMTSA-N 1 1 249.310 2.091 20 10 BECDMO C[N@@H+](Cc1cnoc1)Cc1ccccc1O ZINC001205724736 967804332 /nfs/dbraw/zinc/80/43/32/967804332.db2.gz 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CC(C)c1ccc(O)c(C[N@@H+](C)[C@@H](C)CO)c1 ZINC001462197382 986305378 /nfs/dbraw/zinc/30/53/78/986305378.db2.gz HWRZVBTURQOGAM-NSHDSACASA-N 1 1 237.343 2.328 20 10 BECDMO CO[C@@H](C)CC[NH2+]Cc1cc(F)c(F)cc1O ZINC001462250480 986324451 /nfs/dbraw/zinc/32/44/51/986324451.db2.gz ODYIBSARVNNRKI-QMMMGPOBSA-N 1 1 245.269 2.185 20 10 BECDMO C[C@]1(CN)CCCC[N@H+](Cc2ccc(N)cc2)C1 ZINC001206563885 986382999 /nfs/dbraw/zinc/38/29/99/986382999.db2.gz JQUUMSHNCSIULD-OAHLLOKOSA-N 1 1 247.386 2.220 20 10 BECDMO C[C@]1(CN)CCCC[N@@H+](Cc2ccc(N)cc2)C1 ZINC001206563885 986383010 /nfs/dbraw/zinc/38/30/10/986383010.db2.gz JQUUMSHNCSIULD-OAHLLOKOSA-N 1 1 247.386 2.220 20 10 BECDMO CC(C)[C@@H]1C[C@@H](NCc2ccc(N)cc2)CC[NH2+]1 ZINC001246174578 987544274 /nfs/dbraw/zinc/54/42/74/987544274.db2.gz WDNNADSUNCWRDQ-GJZGRUSLSA-N 1 1 247.386 2.135 20 10 BECDMO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H](C)N ZINC001325756037 989252725 /nfs/dbraw/zinc/25/27/25/989252725.db2.gz OVWUGCGWUAWSGH-MXWKQRLJSA-N 1 1 234.343 2.186 20 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C[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(F)c1O ZINC001138122521 990883949 /nfs/dbraw/zinc/88/39/49/990883949.db2.gz KTAXPYWZMJNXAH-SCZZXKLOSA-N 1 1 227.254 2.464 20 10 BECDMO Oc1c(F)cccc1C[N@@H+]1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001138129433 990886006 /nfs/dbraw/zinc/88/60/06/990886006.db2.gz CHAQRWBLVKXAJC-RTCCRHLQSA-N 1 1 239.265 2.179 20 10 BECDMO Oc1c(F)cccc1C[N@H+]1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001138129433 990886007 /nfs/dbraw/zinc/88/60/07/990886007.db2.gz CHAQRWBLVKXAJC-RTCCRHLQSA-N 1 1 239.265 2.179 20 10 BECDMO CC(C)c1ccc(O)c(C[N@H+](C)C[C@H](C)O)c1 ZINC001308679918 991095969 /nfs/dbraw/zinc/09/59/69/991095969.db2.gz HSFYMUZSTQDLEJ-NSHDSACASA-N 1 1 237.343 2.328 20 10 BECDMO CC[N@@H+](Cc1ccc(Cl)cc1O)[C@H](C)CO ZINC001308795608 991134456 /nfs/dbraw/zinc/13/44/56/991134456.db2.gz NRSRLEQOKFVVCA-SECBINFHSA-N 1 1 243.734 2.248 20 10 BECDMO CC[N@@H+](Cc1cccnn1)Cc1ccccc1O ZINC001139972279 991444802 /nfs/dbraw/zinc/44/48/02/991444802.db2.gz PHUUWRSIWFXKPS-UHFFFAOYSA-N 1 1 243.310 2.204 20 10 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ZINC000857061261 588884669 /nfs/dbraw/zinc/88/46/69/588884669.db2.gz NBBNZIYXJOKPNV-TZMCWYRMSA-N 1 1 249.354 2.151 20 10 BECDMO CC[C@]1(O)CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000877691295 583342770 /nfs/dbraw/zinc/34/27/70/583342770.db2.gz MACGCPIZLRDXRJ-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO COc1cc(C)cc(C[NH2+]CC(C)(F)F)c1O ZINC000894859337 583533633 /nfs/dbraw/zinc/53/36/33/583533633.db2.gz GWZRYIUBRJNIQW-UHFFFAOYSA-N 1 1 245.269 2.454 20 10 BECDMO Cc1cccc(O)c1C[NH2+]CC[C@H](C)N(C)C ZINC000895292109 583637612 /nfs/dbraw/zinc/63/76/12/583637612.db2.gz FAHBWWJZPGFJRE-LBPRGKRZSA-N 1 1 236.359 2.130 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)[C@@H]2CCCC[C@H]2O)c1 ZINC000895436409 583674716 /nfs/dbraw/zinc/67/47/16/583674716.db2.gz DNPHSCXUGGFMAB-UKRRQHHQSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ncoc1C[N@@H+]1Cc2cccc(O)c2C1 ZINC000895450329 583675851 /nfs/dbraw/zinc/67/58/51/583675851.db2.gz WQYRJWARVIJRQY-UHFFFAOYSA-N 1 1 230.267 2.204 20 10 BECDMO Cc1ncoc1C[N@H+]1Cc2cccc(O)c2C1 ZINC000895450329 583675852 /nfs/dbraw/zinc/67/58/52/583675852.db2.gz WQYRJWARVIJRQY-UHFFFAOYSA-N 1 1 230.267 2.204 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@H](CF)C1 ZINC000895572246 583692233 /nfs/dbraw/zinc/69/22/33/583692233.db2.gz FVBYTQKOTAWIJJ-LLVKDONJSA-N 1 1 223.291 2.492 20 10 BECDMO CC(C)OC1C[NH+](Cc2ccccc2O)C1 ZINC000895952846 583751550 /nfs/dbraw/zinc/75/15/50/583751550.db2.gz QLIQIACKVNKEMX-UHFFFAOYSA-N 1 1 221.300 2.001 20 10 BECDMO C[C@H]([NH2+]Cc1c(O)cccc1F)[C@@H]1CCOC1 ZINC000896637326 583818938 /nfs/dbraw/zinc/81/89/38/583818938.db2.gz JDTRDOMNELOHAQ-VHSXEESVSA-N 1 1 239.290 2.046 20 10 BECDMO COCC[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896636187 583819047 /nfs/dbraw/zinc/81/90/47/583819047.db2.gz AAJRNMDVSOVONB-VIFPVBQESA-N 1 1 227.279 2.046 20 10 BECDMO C[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2F)[C@@H](C)O1 ZINC000896639426 583819722 /nfs/dbraw/zinc/81/97/22/583819722.db2.gz UHDGGOXLLBMPNB-LNLATYFQSA-N 1 1 239.290 2.187 20 10 BECDMO Oc1cccc(F)c1C[NH2+]C[C@H]1CCC=CO1 ZINC000896637572 583819729 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/nfs/dbraw/zinc/87/63/47/583876347.db2.gz HNHJAINRCUSTIG-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO CN(C)CCC[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000734843292 584968937 /nfs/dbraw/zinc/96/89/37/584968937.db2.gz ITFZMXJWQSQKQS-UHFFFAOYSA-N 1 1 249.402 2.136 20 10 BECDMO CN(C)CCC[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000734843292 584968938 /nfs/dbraw/zinc/96/89/38/584968938.db2.gz ITFZMXJWQSQKQS-UHFFFAOYSA-N 1 1 249.402 2.136 20 10 BECDMO CC[C@@H]([NH2+]C[C@H](N)C1CC1)c1ccccc1O ZINC000817966004 584993400 /nfs/dbraw/zinc/99/34/00/584993400.db2.gz YTLRAGTYFVQYQW-QWHCGFSZSA-N 1 1 234.343 2.170 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](C)N)c(O)c1 ZINC000817977270 584993456 /nfs/dbraw/zinc/99/34/56/584993456.db2.gz FXHUPOSXPWKFAT-MXWKQRLJSA-N 1 1 222.332 2.087 20 10 BECDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)C1CC1 ZINC000838859549 585075620 /nfs/dbraw/zinc/07/56/20/585075620.db2.gz LGYFXMALWDPYCG-HNNXBMFYSA-N 1 1 249.354 2.375 20 10 BECDMO Cc1cc(O)c(C[NH2+]Cc2cocn2)cc1C ZINC000742369669 585125175 /nfs/dbraw/zinc/12/51/75/585125175.db2.gz CMQABIMOYDWMOQ-UHFFFAOYSA-N 1 1 232.283 2.287 20 10 BECDMO C[C@@H]1C[C@@H]1C[N@@H+](C)Cc1ccccc1O ZINC000754100744 585278264 /nfs/dbraw/zinc/27/82/64/585278264.db2.gz FDWJXRBBWXFAOZ-ZYHUDNBSSA-N 1 1 205.301 2.480 20 10 BECDMO CO[C@H]1CC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000754736789 585290083 /nfs/dbraw/zinc/29/00/83/585290083.db2.gz MATODUQTKXJBBU-ZDUSSCGKSA-N 1 1 235.327 2.230 20 10 BECDMO Cc1cc(C)c(O)c(C[N@@H+]2CCOC[C@@H](C)C2)c1 ZINC000754748997 585290431 /nfs/dbraw/zinc/29/04/31/585290431.db2.gz UVNSCNLYPCEZCB-LBPRGKRZSA-N 1 1 249.354 2.477 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](C)C1 ZINC000769102581 585549078 /nfs/dbraw/zinc/54/90/78/585549078.db2.gz OMFCTVRKEOYUQW-SNVBAGLBSA-N 1 1 221.300 2.243 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CCC[C@H]1C ZINC000769389225 585555433 /nfs/dbraw/zinc/55/54/33/585555433.db2.gz MCQNZZYBRWWKJE-SNVBAGLBSA-N 1 1 221.300 2.385 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)Cc2cn[nH]c2)cc1C ZINC000769427642 585556241 /nfs/dbraw/zinc/55/62/41/585556241.db2.gz YTVVKGSYSPNBKC-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO CCN(C)c1ccc(C[N@@H+](C)C2CC(O)C2)cc1 ZINC000773844930 585644804 /nfs/dbraw/zinc/64/48/04/585644804.db2.gz IWVOBJINRJNQKB-UHFFFAOYSA-N 1 1 248.370 2.098 20 10 BECDMO CC[C@H]([NH2+]Cc1nonc1C)c1ccccc1O ZINC000775411658 585677662 /nfs/dbraw/zinc/67/76/62/585677662.db2.gz GNKXYTMKMZNCCR-NSHDSACASA-N 1 1 247.298 2.325 20 10 BECDMO Cc1cccc(C[N@@H+](C)Cc2cn[nH]c2)c1O ZINC000775700253 585683298 /nfs/dbraw/zinc/68/32/98/585683298.db2.gz LHBQRETXMSUOOI-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccccc1O ZINC000785988377 585884674 /nfs/dbraw/zinc/88/46/74/585884674.db2.gz MPBMLPUDKQYWMZ-DYEKYZERSA-N 1 1 249.354 2.374 20 10 BECDMO COc1cccc(O)c1C[N@@H+]1[C@H](C)C[C@@H]1C ZINC000793220032 586014543 /nfs/dbraw/zinc/01/45/43/586014543.db2.gz JIQCLNFZMGQXBJ-AOOOYVTPSA-N 1 1 221.300 2.384 20 10 BECDMO CO[C@H](C)C[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000795750562 586091658 /nfs/dbraw/zinc/09/16/58/586091658.db2.gz LILZXQUPCHYHBT-GFCCVEGCSA-N 1 1 237.343 2.476 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)C[C@@H](O)C2CC2)cc1C ZINC000809750921 586516948 /nfs/dbraw/zinc/51/69/48/586516948.db2.gz BTRJYDDGRZHFIL-OAHLLOKOSA-N 1 1 249.354 2.212 20 10 BECDMO C[C@H]([NH2+]CCO)c1cccc(C(F)(F)F)c1O ZINC000815555083 586687851 /nfs/dbraw/zinc/68/78/51/586687851.db2.gz PEOLGZMEODOZBF-ZETCQYMHSA-N 1 1 249.232 2.054 20 10 BECDMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cc(F)ccc1O ZINC000816647258 586749308 /nfs/dbraw/zinc/74/93/08/586749308.db2.gz QEBWYIIJBDHMDV-DTWKUNHWSA-N 1 1 209.264 2.372 20 10 BECDMO OCC[C@@H]1CCC[N@@H+](Cc2ccccc2O)CC1 ZINC000817418969 586803778 /nfs/dbraw/zinc/80/37/78/586803778.db2.gz MSBNOZJDGGJSAP-CYBMUJFWSA-N 1 1 249.354 2.377 20 10 BECDMO Cc1cccc(CN2CCC3(CC[NH2+]3)CC2)c1O ZINC000817865933 586831404 /nfs/dbraw/zinc/83/14/04/586831404.db2.gz PQNJBTWMAGBEFB-UHFFFAOYSA-N 1 1 246.354 2.029 20 10 BECDMO CC[C@@H](N[C@H]1CCC[NH2+]C1)c1ccc(C)cc1O ZINC000817941979 586845082 /nfs/dbraw/zinc/84/50/82/586845082.db2.gz VHJKYVLQGTUYHE-GXTWGEPZSA-N 1 1 248.370 2.493 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCNC2)c(O)c1C ZINC000817942488 586845607 /nfs/dbraw/zinc/84/56/07/586845607.db2.gz ZRSXTPQPXWEVEH-QWHCGFSZSA-N 1 1 248.370 2.412 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCCN2)c1 ZINC000817948484 586846742 /nfs/dbraw/zinc/84/67/42/586846742.db2.gz AMGQTWSNKKBPOL-CHWSQXEVSA-N 1 1 248.370 2.493 20 10 BECDMO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CCCCN1)CC2 ZINC000817949310 586847081 /nfs/dbraw/zinc/84/70/81/586847081.db2.gz IHWKDDHXCYDTGL-STQMWFEESA-N 1 1 246.354 2.111 20 10 BECDMO CC[C@@H](NC1C[NH2+]C1)c1cccc(Cl)c1O ZINC000817955805 586849955 /nfs/dbraw/zinc/84/99/55/586849955.db2.gz IEVDLTYLIXMNKK-LLVKDONJSA-N 1 1 240.734 2.058 20 10 BECDMO CC(C)[C@@H](N)C[NH2+][C@@H](C)c1ccccc1O ZINC000817958474 586850878 /nfs/dbraw/zinc/85/08/78/586850878.db2.gz KEYAPYFJXFXOPU-JQWIXIFHSA-N 1 1 222.332 2.026 20 10 BECDMO CC(C)[C@H]([NH3+])CN[C@H](C)c1cc(F)ccc1O ZINC000817958439 586850894 /nfs/dbraw/zinc/85/08/94/586850894.db2.gz JTJTYJJDPHKKOB-BXKDBHETSA-N 1 1 240.322 2.165 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]C[C@@H](N)C2CC2)c(O)c1 ZINC000817964715 586854111 /nfs/dbraw/zinc/85/41/11/586854111.db2.gz FPJHGHIJOPHFNX-ZWNOBZJWSA-N 1 1 234.343 2.089 20 10 BECDMO C[C@H](N[C@@H]1C[NH2+]CC[C@H]1C)c1ccccc1O ZINC000817967844 586856564 /nfs/dbraw/zinc/85/65/64/586856564.db2.gz MLBAJMPNWKQSPA-NTZNESFSSA-N 1 1 234.343 2.041 20 10 BECDMO CC[C@@H]([NH2+]C[C@@H](C)N)c1ccc(C)cc1O ZINC000817971660 586859322 /nfs/dbraw/zinc/85/93/22/586859322.db2.gz GAQGPGWQOAXZCJ-ZYHUDNBSSA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@H]([NH2+][C@H](C)[C@@H](C)N)c1ccccc1O ZINC000817978075 586861821 /nfs/dbraw/zinc/86/18/21/586861821.db2.gz VJHRNLROELEVHC-FOGDFJRCSA-N 1 1 222.332 2.169 20 10 BECDMO CN(C)c1ccc(C[NH+]2CC3(CC3)C2)cc1F ZINC000824533734 587274156 /nfs/dbraw/zinc/27/41/56/587274156.db2.gz LSTQNBZAEGYJQM-UHFFFAOYSA-N 1 1 234.318 2.488 20 10 BECDMO CCOc1ccc(C[N@H+]2CC[C@H](F)C2)c(O)c1 ZINC000824571044 587276934 /nfs/dbraw/zinc/27/69/34/587276934.db2.gz HRUPRCQMNZSBRZ-NSHDSACASA-N 1 1 239.290 2.335 20 10 BECDMO COc1cccc(C[N@H+]2CC[C@H]2C2CC2)c1O ZINC000824649700 587280544 /nfs/dbraw/zinc/28/05/44/587280544.db2.gz FKHXKIYEYQSIOA-LBPRGKRZSA-N 1 1 233.311 2.385 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)CCCO)cc1Cl ZINC000825774295 587338335 /nfs/dbraw/zinc/33/83/35/587338335.db2.gz VXGGNIHFOHXUML-UHFFFAOYSA-N 1 1 243.734 2.168 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000827506791 587384913 /nfs/dbraw/zinc/38/49/13/587384913.db2.gz MFPGQEDMSDVEPM-ZYHUDNBSSA-N 1 1 203.285 2.234 20 10 BECDMO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)CCO ZINC000835025948 587779081 /nfs/dbraw/zinc/77/90/81/587779081.db2.gz OSRPNBICDYETJQ-WAYWQWQTSA-N 1 1 248.370 2.080 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCCOCC1 ZINC000840911113 587929628 /nfs/dbraw/zinc/92/96/28/587929628.db2.gz PHAZUNWBDILPLB-UHFFFAOYSA-N 1 1 248.370 2.283 20 10 BECDMO Cc1cc(N(C)C)ccc1C[NH2+]CCCN(C)C ZINC000840928309 587930250 /nfs/dbraw/zinc/93/02/50/587930250.db2.gz OSNWHPCHZMMCAG-UHFFFAOYSA-N 1 1 249.402 2.102 20 10 BECDMO Cc1cc(N(C)C)ccc1CNCCC[NH+](C)C ZINC000840928309 587930251 /nfs/dbraw/zinc/93/02/51/587930251.db2.gz OSNWHPCHZMMCAG-UHFFFAOYSA-N 1 1 249.402 2.102 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@H](CO)[C@H]2C)c1O ZINC000840977813 587933441 /nfs/dbraw/zinc/93/34/41/587933441.db2.gz KBBHAFVJGTXXJZ-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO CCC([NH3+])(CC)CNCc1cc(F)ccc1O ZINC000841029888 587935945 /nfs/dbraw/zinc/93/59/45/587935945.db2.gz CJGPCKMPHXHJCN-UHFFFAOYSA-N 1 1 240.322 2.138 20 10 BECDMO COc1ccc(CN[C@@H]2CC[NH2+]C[C@H]2C)cc1C ZINC000841063280 587941176 /nfs/dbraw/zinc/94/11/76/587941176.db2.gz HYKRIQVNXSRVFV-TZMCWYRMSA-N 1 1 248.370 2.091 20 10 BECDMO Cc1cc(Cl)cc(CN[C@H](C)[C@@H](C)[NH3+])c1O ZINC000841076927 587944217 /nfs/dbraw/zinc/94/42/17/587944217.db2.gz UANHOJHKKOXEIG-RKDXNWHRSA-N 1 1 242.750 2.179 20 10 BECDMO CN(C)c1ccc(CN[C@H](C[NH3+])C(C)(C)C)cc1 ZINC000841087690 587945787 /nfs/dbraw/zinc/94/57/87/587945787.db2.gz QLYRNSFNBWNULT-CQSZACIVSA-N 1 1 249.402 2.216 20 10 BECDMO C[NH2+]CCCN(C)Cc1ccc(N(C)C)cc1C ZINC000841104823 587946449 /nfs/dbraw/zinc/94/64/49/587946449.db2.gz UDQVVQBFAIRMRO-UHFFFAOYSA-N 1 1 249.402 2.102 20 10 BECDMO C[N@@H+](CC[C@H]1CCC[NH2+]C1)Cc1ccccc1O ZINC000842472291 588029165 /nfs/dbraw/zinc/02/91/65/588029165.db2.gz WAYINEZROPFBSE-CYBMUJFWSA-N 1 1 248.370 2.214 20 10 BECDMO C[NH2+]C1CCN(Cc2cc(C)c(C)cc2O)CC1 ZINC000843049168 588077211 /nfs/dbraw/zinc/07/72/11/588077211.db2.gz HLBWIHQWIDDKAD-UHFFFAOYSA-N 1 1 248.370 2.193 20 10 BECDMO Oc1ccccc1C[N@H+]1CCOC[C@H]1C1CCC1 ZINC000843428834 588108505 /nfs/dbraw/zinc/10/85/05/588108505.db2.gz NQYDNAKTJLPDSX-AWEZNQCLSA-N 1 1 247.338 2.393 20 10 BECDMO COc1ccc(N(C)CC[N@@H+](C)CC2CC2)cc1 ZINC000844401834 588190264 /nfs/dbraw/zinc/19/02/64/588190264.db2.gz SCWLLRQVYLFTBU-UHFFFAOYSA-N 1 1 248.370 2.473 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](F)C1 ZINC000846120212 588258064 /nfs/dbraw/zinc/25/80/64/588258064.db2.gz MUKWABFEZYOXEI-JTQLQIEISA-N 1 1 239.290 2.335 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H](F)C1 ZINC000846120214 588258143 /nfs/dbraw/zinc/25/81/43/588258143.db2.gz MUKWABFEZYOXEI-SNVBAGLBSA-N 1 1 239.290 2.335 20 10 BECDMO COc1cccc([C@H](C)[NH2+]Cc2cocn2)c1O ZINC000846163144 588259096 /nfs/dbraw/zinc/25/90/96/588259096.db2.gz OFPSRPYKZRBIHI-VIFPVBQESA-N 1 1 248.282 2.240 20 10 BECDMO CCc1cccc(C[N@H+]2CCC[C@@](C)(O)C2)c1O ZINC000848888167 588416006 /nfs/dbraw/zinc/41/60/06/588416006.db2.gz NSHMXUUIOZUMAJ-OAHLLOKOSA-N 1 1 249.354 2.301 20 10 BECDMO CCc1cccc(C[N@@H+](CCO)C2CCC2)c1O ZINC000848905810 588418702 /nfs/dbraw/zinc/41/87/02/588418702.db2.gz OQMWTLGJMMIMKM-UHFFFAOYSA-N 1 1 249.354 2.301 20 10 BECDMO CC[C@@H]([NH2+][C@H]1C[C@H](O)C1)c1ccc(F)cc1O ZINC000850578411 588561551 /nfs/dbraw/zinc/56/15/51/588561551.db2.gz JTRXPYBSRGOPAF-CKYFFXLPSA-N 1 1 239.290 2.095 20 10 BECDMO CC[C@H](C)[N@@H+](CCO)Cc1cccc(C)c1O ZINC000862387291 589207284 /nfs/dbraw/zinc/20/72/84/589207284.db2.gz JLQFEVZIVINAPQ-LBPRGKRZSA-N 1 1 237.343 2.293 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@H]2CC[C@H](C)NC2)cc1C ZINC000863484173 589293482 /nfs/dbraw/zinc/29/34/82/589293482.db2.gz HPZDHJOGURHQET-JSGCOSHPSA-N 1 1 248.370 2.239 20 10 BECDMO C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)CN1 ZINC000863548026 589298244 /nfs/dbraw/zinc/29/82/44/589298244.db2.gz UEZQIWYCOUIPHR-RAIGVLPGSA-N 1 1 246.354 2.110 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@@H]3COC[C@@H]3C2)cc1C ZINC000872266618 589902733 /nfs/dbraw/zinc/90/27/33/589902733.db2.gz JFFUYZVYTWMSNO-OKILXGFUSA-N 1 1 247.338 2.087 20 10 BECDMO Cc1cccc(C[N@H+]2CCCCC[C@@H]([NH3+])C2)c1O ZINC000873214384 589997336 /nfs/dbraw/zinc/99/73/36/589997336.db2.gz DLALQTSHXBTPDL-CQSZACIVSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1cccc(C[N@@H+]2CCCCC[C@@H](N)C2)c1O ZINC000873214384 589997337 /nfs/dbraw/zinc/99/73/37/589997337.db2.gz DLALQTSHXBTPDL-CQSZACIVSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1cccc(C[N@H+]2CCCCC[C@@H](N)C2)c1O ZINC000873214384 589997339 /nfs/dbraw/zinc/99/73/39/589997339.db2.gz DLALQTSHXBTPDL-CQSZACIVSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1cccc(CN2CCCCC[C@@H]([NH3+])C2)c1O ZINC000873214384 589997340 /nfs/dbraw/zinc/99/73/40/589997340.db2.gz DLALQTSHXBTPDL-CQSZACIVSA-N 1 1 248.370 2.404 20 10 BECDMO CCC[NH+]1CCN(Cc2c(C)cccc2O)CC1 ZINC000876522841 590207833 /nfs/dbraw/zinc/20/78/33/590207833.db2.gz DQNZMFOXMSIKCV-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO CC[C@H]1COCC[N@H+]1Cc1ccc(C)cc1O ZINC000876617952 590222600 /nfs/dbraw/zinc/22/26/00/590222600.db2.gz XVGIUJDJNOBDOW-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(O)c1C[NH2+]C[C@H]1CCCN(C)C1 ZINC000877027755 590271566 /nfs/dbraw/zinc/27/15/66/590271566.db2.gz RSIHPUUSGCSDED-CYBMUJFWSA-N 1 1 248.370 2.132 20 10 BECDMO Cc1ccc(C[N@@H+]2CC=CCC2)c(O)c1 ZINC000877168618 590295673 /nfs/dbraw/zinc/29/56/73/590295673.db2.gz XFNMVIGQLRZTBC-UHFFFAOYSA-N 1 1 203.285 2.463 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@H]2C(C)(C)O)c(O)c1 ZINC000877322239 590316584 /nfs/dbraw/zinc/31/65/84/590316584.db2.gz ABVCCRAZLRWDKH-AWEZNQCLSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ccc(C[N@H+]2CCN(C)[C@H](C)[C@H]2C)c(O)c1 ZINC000877409686 590323718 /nfs/dbraw/zinc/32/37/18/590323718.db2.gz XZEXVQYYXKPBCQ-CHWSQXEVSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H](C)N(C)C[C@@H]2C)c(O)c1 ZINC000877407064 590323936 /nfs/dbraw/zinc/32/39/36/590323936.db2.gz MEYWLNFEZYYSJQ-STQMWFEESA-N 1 1 248.370 2.225 20 10 BECDMO Cc1noc([C@@H](C)[NH2+]Cc2c(C)cccc2O)n1 ZINC000877470615 590334611 /nfs/dbraw/zinc/33/46/11/590334611.db2.gz KYHGRLUEDHCPCQ-SECBINFHSA-N 1 1 247.298 2.243 20 10 BECDMO Cc1cccc(O)c1CN(C)CCC[NH+](C)C ZINC000877522236 590346782 /nfs/dbraw/zinc/34/67/82/590346782.db2.gz MCSFSIOJFAJOHO-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)CCCN(C)C ZINC000877522236 590346784 /nfs/dbraw/zinc/34/67/84/590346784.db2.gz MCSFSIOJFAJOHO-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)CCCN(C)C ZINC000877522236 590346787 /nfs/dbraw/zinc/34/67/87/590346787.db2.gz MCSFSIOJFAJOHO-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO Cc1cccc(O)c1C[NH2+]CC(C)(F)F ZINC000877552912 590355186 /nfs/dbraw/zinc/35/51/86/590355186.db2.gz XZMMUEXIJPMMME-UHFFFAOYSA-N 1 1 215.243 2.445 20 10 BECDMO Cc1ccc(C[N@H+](C(C)C)C2COC2)c(O)c1 ZINC000877558093 590358366 /nfs/dbraw/zinc/35/83/66/590358366.db2.gz WHQJVLHXQNHYKD-UHFFFAOYSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@H](F)C1 ZINC000877558352 590359306 /nfs/dbraw/zinc/35/93/06/590359306.db2.gz FKMGAVZSPXZKDQ-JTQLQIEISA-N 1 1 209.264 2.244 20 10 BECDMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(C)cc1O ZINC000877561391 590360111 /nfs/dbraw/zinc/36/01/11/590360111.db2.gz LWMYCIMVRNTZAJ-ZIAGYGMSSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](CO)C2)c(O)c1 ZINC000877594864 590370066 /nfs/dbraw/zinc/37/00/66/590370066.db2.gz LGXCDSDYFDKNNN-OLZOCXBDSA-N 1 1 249.354 2.151 20 10 BECDMO CC[C@@]1(O)CCC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000877690629 590392589 /nfs/dbraw/zinc/39/25/89/590392589.db2.gz DGSKPDQGCYJCNL-OAHLLOKOSA-N 1 1 249.354 2.438 20 10 BECDMO C[C@@H]1C[C@H]1C[N@H+]1Cc2cccc(O)c2C1 ZINC000877703071 590396121 /nfs/dbraw/zinc/39/61/21/590396121.db2.gz PZBDWVGPBQULBN-KOLCDFICSA-N 1 1 203.285 2.364 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@@H](O)CC(C)(C)C2)c1O ZINC000877752106 590416120 /nfs/dbraw/zinc/41/61/20/590416120.db2.gz MYCCHBUQMCWGMN-ZDUSSCGKSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccccc2O)o1 ZINC000879649154 590842055 /nfs/dbraw/zinc/84/20/55/590842055.db2.gz MXRQGGXYAKRXST-BDAKNGLRSA-N 1 1 247.298 2.495 20 10 BECDMO C[C@@H]([NH2+]C[C@@H](C)CCO)c1c(O)cccc1F ZINC000886535199 592250215 /nfs/dbraw/zinc/25/02/15/592250215.db2.gz WLNAKJPLQDURAC-VHSXEESVSA-N 1 1 241.306 2.200 20 10 BECDMO CO[C@H](C)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886596265 592270451 /nfs/dbraw/zinc/27/04/51/592270451.db2.gz AHIJPAZLOCUQLD-RKDXNWHRSA-N 1 1 227.279 2.217 20 10 BECDMO C[C@@H](O)CCC[NH2+][C@H](C)c1c(O)cccc1F ZINC000886603389 592272299 /nfs/dbraw/zinc/27/22/99/592272299.db2.gz MXUKHQQVTSMERK-NXEZZACHSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@H]([NH2+]CCOCCF)c1c(O)cccc1F ZINC000886640078 592285533 /nfs/dbraw/zinc/28/55/33/592285533.db2.gz QVNNDVBFWXWHEL-VIFPVBQESA-N 1 1 245.269 2.168 20 10 BECDMO CO[C@H]1C[C@H]([NH2+][C@H](C)c2c(O)cccc2F)C1 ZINC000886645073 592287275 /nfs/dbraw/zinc/28/72/75/592287275.db2.gz QUYOUFGJONXASJ-OPRDCNLKSA-N 1 1 239.290 2.359 20 10 BECDMO Cc1cccc(C[N@@H+](C)CCn2cccn2)c1O ZINC000180222175 633883800 /nfs/dbraw/zinc/88/38/00/633883800.db2.gz ZGGJJUXJWOWENA-UHFFFAOYSA-N 1 1 245.326 2.029 20 10 BECDMO CC[C@H](CO)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000309950025 633970595 /nfs/dbraw/zinc/97/05/95/633970595.db2.gz FRRFBPCRXANFIT-SSDOTTSWSA-N 1 1 247.697 2.045 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](O)C2(C)C)cc1 ZINC000258744125 635194210 /nfs/dbraw/zinc/19/42/10/635194210.db2.gz JQBVFRZQXZFQDR-CQSZACIVSA-N 1 1 248.370 2.098 20 10 BECDMO Cc1cc(C)c(O)c(C[N@@H+](C)C[C@@H]2CCOC2)c1 ZINC000164459596 640484295 /nfs/dbraw/zinc/48/42/95/640484295.db2.gz BKCHHGZEOFDOMO-ZDUSSCGKSA-N 1 1 249.354 2.477 20 10 BECDMO C[C@@H]([NH3+])[C@@H]1CCCCN1Cc1ccccc1O ZINC000063191711 641143293 /nfs/dbraw/zinc/14/32/93/641143293.db2.gz ARWPZRCLDMNYMJ-YPMHNXCESA-N 1 1 234.343 2.094 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCCC[C@H]2CO)cc1 ZINC000039225794 641217510 /nfs/dbraw/zinc/21/75/10/641217510.db2.gz BDKIGUZKDNCELL-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO CC(C)[N@@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000075666383 641767439 /nfs/dbraw/zinc/76/74/39/641767439.db2.gz ZMTHFZDLNYSCES-UHFFFAOYSA-N 1 1 249.310 2.494 20 10 BECDMO CCOCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000190784059 641885639 /nfs/dbraw/zinc/88/56/39/641885639.db2.gz WVGJGVITPCXFKY-UHFFFAOYSA-N 1 1 247.697 2.311 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2C(C)(C)O)c1 ZINC000154479542 642108109 /nfs/dbraw/zinc/10/81/09/642108109.db2.gz HFZYKSYZZMQDDS-AWEZNQCLSA-N 1 1 249.354 2.436 20 10 BECDMO COCCC[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000154911348 642303393 /nfs/dbraw/zinc/30/33/93/642303393.db2.gz VBJTWGYOWBPFSB-UHFFFAOYSA-N 1 1 236.359 2.221 20 10 BECDMO C[C@H]1C[N@@H+](Cc2cc3c(cc2O)OCO3)C[C@H]1C ZINC000097987278 642652059 /nfs/dbraw/zinc/65/20/59/642652059.db2.gz GZJISGMQQYWBDG-AOOOYVTPSA-N 1 1 249.310 2.209 20 10 BECDMO Cc1cccc(C[N@H+](C[C@@H](C)O)C(C)C)c1O ZINC000305775777 642692614 /nfs/dbraw/zinc/69/26/14/642692614.db2.gz NXYZBYAXEPZSBC-GFCCVEGCSA-N 1 1 237.343 2.292 20 10 BECDMO C[C@@H]1OCC[N@@H+](Cc2ccccc2O)[C@H]1C ZINC000179575430 642725367 /nfs/dbraw/zinc/72/53/67/642725367.db2.gz GFRAFCAIAAKLRZ-QWRGUYRKSA-N 1 1 221.300 2.001 20 10 BECDMO Cc1ccc(O)c(C[NH2+]C[C@@H]2CCCN(C)C2)c1 ZINC000071408612 643143584 /nfs/dbraw/zinc/14/35/84/643143584.db2.gz YIJOMLOWDUSWBK-ZDUSSCGKSA-N 1 1 248.370 2.132 20 10 BECDMO C[C@@H]1C[C@@H]([NH3+])CCN1Cc1ccc(N(C)C)cc1 ZINC000084946392 643676967 /nfs/dbraw/zinc/67/69/67/643676967.db2.gz WRCSVYMFXRWOAI-OCCSQVGLSA-N 1 1 247.386 2.064 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)C2CC2)cc1 ZINC000193988653 644292842 /nfs/dbraw/zinc/29/28/42/644292842.db2.gz YPRHHJLRZZVWPK-UHFFFAOYSA-N 1 1 204.317 2.347 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCOC(C)(C)C2)cc1 ZINC000091917240 644641996 /nfs/dbraw/zinc/64/19/96/644641996.db2.gz IDPWGURLXALGNF-UHFFFAOYSA-N 1 1 248.370 2.363 20 10 BECDMO COc1cc(C[N@H+]2CC[C@H](F)C2)c(O)cc1C ZINC000840105033 644866262 /nfs/dbraw/zinc/86/62/62/644866262.db2.gz WPKCUOWQOLVRJA-NSHDSACASA-N 1 1 239.290 2.253 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCCNC2)c1 ZINC000817984665 644994361 /nfs/dbraw/zinc/99/43/61/644994361.db2.gz XDMQPFYHTKTWQT-STQMWFEESA-N 1 1 248.370 2.493 20 10 BECDMO CC[C@H](N)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000817981142 644994842 /nfs/dbraw/zinc/99/48/42/644994842.db2.gz ZLPKZHHUUQCRDR-MNOVXSKESA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@H](N)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000817981039 644995379 /nfs/dbraw/zinc/99/53/79/644995379.db2.gz ZAHOOMAJRYIPJI-QWRGUYRKSA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@H]([NH3+])CN[C@@H](C)c1cc(C)ccc1O ZINC000817981039 644995380 /nfs/dbraw/zinc/99/53/80/644995380.db2.gz ZAHOOMAJRYIPJI-QWRGUYRKSA-N 1 1 222.332 2.089 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@@H]2CCCC[C@H]2N)cc1C ZINC000818431355 644996246 /nfs/dbraw/zinc/99/62/46/644996246.db2.gz JSFVDAPZQOVYSJ-ZIAGYGMSSA-N 1 1 248.370 2.369 20 10 BECDMO Cc1nc(C)c(C[N@H+](C)Cc2ccccc2O)[nH]1 ZINC000929974743 646381363 /nfs/dbraw/zinc/38/13/63/646381363.db2.gz ADTAIMANTZPUIA-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO C[N@@H+](Cc1cc2c(cc1O)OCO2)C(C)(C)C ZINC000382210032 711602485 /nfs/dbraw/zinc/60/24/85/711602485.db2.gz CRKWNRFRBVGMFL-UHFFFAOYSA-N 1 1 237.299 2.351 20 10 BECDMO CO[C@@H](C)C[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000708415629 712193506 /nfs/dbraw/zinc/19/35/06/712193506.db2.gz ZZPLZNXAXXDTGU-QMMMGPOBSA-N 1 1 245.269 2.137 20 10 BECDMO CO[C@@H](C)C[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000708415629 712193512 /nfs/dbraw/zinc/19/35/12/712193512.db2.gz ZZPLZNXAXXDTGU-QMMMGPOBSA-N 1 1 245.269 2.137 20 10 BECDMO CC[C@H]([NH2+]CCOC)c1ccc(F)cc1O ZINC000381551189 710653696 /nfs/dbraw/zinc/65/36/96/710653696.db2.gz MULQNOVGSJGLPH-NSHDSACASA-N 1 1 227.279 2.218 20 10 BECDMO CC[N@H+](Cc1cc(F)ccc1O)C[C@@H](C)OC ZINC000383341989 710980358 /nfs/dbraw/zinc/98/03/58/710980358.db2.gz RTJVQXPEWIAZEV-SNVBAGLBSA-N 1 1 241.306 2.388 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@@H](C)O ZINC000395646819 711213559 /nfs/dbraw/zinc/21/35/59/711213559.db2.gz DOJDAYIJJRAOID-SBMIAAHKSA-N 1 1 241.306 2.341 20 10 BECDMO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)[C@H](C)O ZINC000395646818 711214214 /nfs/dbraw/zinc/21/42/14/711214214.db2.gz DOJDAYIJJRAOID-PTRXPTGYSA-N 1 1 241.306 2.341 20 10 BECDMO Cc1cccc(C[N@@H+]2CCCOC[C@@H]2C)c1O ZINC000398959996 711417558 /nfs/dbraw/zinc/41/75/58/711417558.db2.gz YFFNNMCBPFVHIC-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@](C)(O)C1 ZINC000840918190 711709542 /nfs/dbraw/zinc/70/95/42/711709542.db2.gz DWRFISHDHRSWID-HNNXBMFYSA-N 1 1 248.370 2.018 20 10 BECDMO Cc1cccc(C[N@H+](C)CCN2CCCC2)c1O ZINC000160231581 711806098 /nfs/dbraw/zinc/80/60/98/711806098.db2.gz ASQXGKBQAISPJJ-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO Cc1cccc(C[N@@H+](C)CCN2CCCC2)c1O ZINC000160231581 711806099 /nfs/dbraw/zinc/80/60/99/711806099.db2.gz ASQXGKBQAISPJJ-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO Cc1cccc(C[N@@H+]2CCN(C)C(C)(C)C2)c1O ZINC000160237987 711806192 /nfs/dbraw/zinc/80/61/92/711806192.db2.gz YGPBBMODEKKMQG-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@@H]3COC[C@@H]32)c1O ZINC000700638362 712003823 /nfs/dbraw/zinc/00/38/23/712003823.db2.gz COOCAWAOUFCIHH-KGLIPLIRSA-N 1 1 247.338 2.311 20 10 BECDMO C[C@H]([NH2+]Cc1ncccn1)c1ccccc1O ZINC000705437948 712131448 /nfs/dbraw/zinc/13/14/48/712131448.db2.gz CHSQOIGNZPIPKK-JTQLQIEISA-N 1 1 229.283 2.033 20 10 BECDMO CO[C@H]1C[C@H]([NH2+][C@H](C)c2ccc(F)cc2O)C1 ZINC000706533188 712149327 /nfs/dbraw/zinc/14/93/27/712149327.db2.gz FTAUZNQHTQEXGB-FBIMIBRVSA-N 1 1 239.290 2.359 20 10 BECDMO C[C@H]1[N@@H+](Cc2ccccc2O)CCOC1(C)C ZINC000707691213 712175943 /nfs/dbraw/zinc/17/59/43/712175943.db2.gz PFRDICVPVFRBER-LLVKDONJSA-N 1 1 235.327 2.392 20 10 BECDMO C[C@H]1C[C@H]1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708387033 712191998 /nfs/dbraw/zinc/19/19/98/712191998.db2.gz AALRLFISOXNCJR-YUMQZZPRSA-N 1 1 227.254 2.416 20 10 BECDMO CO[C@H](C)CC[NH2+]Cc1cc(F)cc(F)c1O ZINC000708487491 712211125 /nfs/dbraw/zinc/21/11/25/712211125.db2.gz YOXFJWFGUVEWPY-MRVPVSSYSA-N 1 1 245.269 2.185 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H](CF)C2)c1O ZINC000711492872 712307311 /nfs/dbraw/zinc/30/73/11/712307311.db2.gz UYYWTAVOTGHYMR-LLVKDONJSA-N 1 1 223.291 2.492 20 10 BECDMO Cc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)[nH]n1 ZINC000716465150 712562941 /nfs/dbraw/zinc/56/29/41/712562941.db2.gz VRJLNWLUUUGMHJ-VIFPVBQESA-N 1 1 249.289 2.414 20 10 BECDMO Oc1cc(F)c(F)cc1C[NH+]1CCCC1 ZINC001142501827 961455093 /nfs/dbraw/zinc/45/50/93/961455093.db2.gz BNHPTTNPDWNEGI-UHFFFAOYSA-N 1 1 213.227 2.266 20 10 BECDMO Cc1nocc1C[NH2+]Cc1cccc(F)c1O ZINC000398041766 1166700053 /nfs/dbraw/zinc/70/00/53/1166700053.db2.gz YQOMAIVUCBMTQX-UHFFFAOYSA-N 1 1 236.246 2.118 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CO)c1O ZINC001231591223 1167661130 /nfs/dbraw/zinc/66/11/30/1167661130.db2.gz WOQOBXUWQLDYGS-RISCZKNCSA-N 1 1 249.354 2.293 20 10 BECDMO CC[N@@H+](Cc1cc(O)c(O)cc1O)C(C)C ZINC001233482330 978612998 /nfs/dbraw/zinc/61/29/98/978612998.db2.gz JRYNEDKBTDEGOB-UHFFFAOYSA-N 1 1 225.288 2.034 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](CF)C2)c1 ZINC000711489847 1168408873 /nfs/dbraw/zinc/40/88/73/1168408873.db2.gz LMPVVMAWNBYWAM-LLVKDONJSA-N 1 1 223.291 2.492 20 10 BECDMO CSCC[N@@H+](C)Cc1cccc(C)c1O ZINC000180320194 1168441809 /nfs/dbraw/zinc/44/18/09/1168441809.db2.gz DDXIULQMXPZTOO-UHFFFAOYSA-N 1 1 225.357 2.495 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2ccccc2O)[C@@H](C)CO1 ZINC000403885660 971085608 /nfs/dbraw/zinc/08/56/08/971085608.db2.gz PBXOIKSCIMPETB-WCQYABFASA-N 1 1 235.327 2.392 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](O)CC2)c(O)c1 ZINC001140948099 960125082 /nfs/dbraw/zinc/12/50/82/960125082.db2.gz SPSAMHXSCNGCAZ-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@@](C)(O)C2)c1 ZINC001140617134 960461265 /nfs/dbraw/zinc/46/12/65/960461265.db2.gz GVHWDSBAQCHXAW-OAHLLOKOSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](O)[C@@H](C)C2)c1 ZINC001140617673 960462314 /nfs/dbraw/zinc/46/23/14/960462314.db2.gz WBYOVIMOCMVWPW-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3=O)c1 ZINC001140623632 960464348 /nfs/dbraw/zinc/46/43/48/960464348.db2.gz ZHHSMFATMHOJCE-TXEJJXNPSA-N 1 1 245.322 2.112 20 10 BECDMO CC[N@@H+](Cc1ccc(O)c(C)c1O)C1CC1 ZINC001140741830 960541712 /nfs/dbraw/zinc/54/17/12/960541712.db2.gz DGGOFKJDCWNFOR-UHFFFAOYSA-N 1 1 221.300 2.391 20 10 BECDMO Cc1c(O)ccc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)c1O ZINC001140742016 960546134 /nfs/dbraw/zinc/54/61/34/960546134.db2.gz HGDBOBXCIAURDW-KCJUWKMLSA-N 1 1 239.290 2.196 20 10 BECDMO Cc1c(O)ccc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1O ZINC001140748437 960552361 /nfs/dbraw/zinc/55/23/61/960552361.db2.gz GJBFBAXVNLUNDP-TXEJJXNPSA-N 1 1 247.338 2.494 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@H](O)[C@@H](C)C2)c(O)c1 ZINC001140947756 960743867 /nfs/dbraw/zinc/74/38/67/960743867.db2.gz DRHANELDOHTUAY-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO COC[C@@H]1CCC[N@H+]1Cc1ccc(C)cc1O ZINC001140948151 960743939 /nfs/dbraw/zinc/74/39/39/960743939.db2.gz VTWAVPJLZISRNU-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@H](O)[C@H](C)C2)c(O)c1 ZINC001140947759 960746482 /nfs/dbraw/zinc/74/64/82/960746482.db2.gz DRHANELDOHTUAY-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO CC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC001140957465 960752517 /nfs/dbraw/zinc/75/25/17/960752517.db2.gz AALXBUWXSCCXOG-GFCCVEGCSA-N 1 1 233.311 2.112 20 10 BECDMO Cc1ccc(C[N@@H+]2CC[C@H](O)C[C@@H]2C)c(O)c1 ZINC001140950985 960758733 /nfs/dbraw/zinc/75/87/33/960758733.db2.gz RWZPTAAQGVIMHV-AAEUAGOBSA-N 1 1 235.327 2.046 20 10 BECDMO C[C@@H]1CCC[N@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141138913 960884220 /nfs/dbraw/zinc/88/42/20/960884220.db2.gz DAVCDPCOTBNSGC-GFCCVEGCSA-N 1 1 246.354 2.500 20 10 BECDMO CC[N@@H+](Cc1ccc2c(c1)OCCN2C)C1CC1 ZINC001141141258 960887018 /nfs/dbraw/zinc/88/70/18/960887018.db2.gz WFZCWOVSHULAAS-UHFFFAOYSA-N 1 1 246.354 2.500 20 10 BECDMO C[C@H]([NH2+][C@@H]1CO[C@H](C)C1)c1ccc(F)cc1O ZINC000402008476 961700107 /nfs/dbraw/zinc/70/01/07/961700107.db2.gz AUKZRDAUUUERJI-YWVKMMECSA-N 1 1 239.290 2.359 20 10 BECDMO CCN(Cc1ccccc1O)c1ccc(N)c[nH+]1 ZINC001154889646 962884060 /nfs/dbraw/zinc/88/40/60/962884060.db2.gz BRYZQDMYOJYHDA-UHFFFAOYSA-N 1 1 243.310 2.396 20 10 BECDMO C[C@@H]1C[C@@H]([N@H+]2CCc3cccc(O)c3C2)CCO1 ZINC001168137208 963835622 /nfs/dbraw/zinc/83/56/22/963835622.db2.gz NLRXHBYLRYISJI-YPMHNXCESA-N 1 1 247.338 2.318 20 10 BECDMO Cc1cccc(C[NH2+]CC[C@H](C)N(C)C)c1O ZINC000697919497 964678779 /nfs/dbraw/zinc/67/87/79/964678779.db2.gz HDSOGQFULPVVRL-LBPRGKRZSA-N 1 1 236.359 2.130 20 10 BECDMO CC[N@@H+](Cc1ccccc1O)C1CCN(C)CC1 ZINC001203555859 966676529 /nfs/dbraw/zinc/67/65/29/966676529.db2.gz HSBLIAWXZOVTEZ-UHFFFAOYSA-N 1 1 248.370 2.308 20 10 BECDMO CC1(C)C[N@@H+](Cc2ccccc2O)[C@](C)(CO)C1 ZINC001203550156 966679483 /nfs/dbraw/zinc/67/94/83/966679483.db2.gz KHZWXRYAYIQBDT-HNNXBMFYSA-N 1 1 249.354 2.375 20 10 BECDMO C[C@]1(CO)CCC[N@@H+](Cc2ccccc2O)CC1 ZINC001203550553 966681217 /nfs/dbraw/zinc/68/12/17/966681217.db2.gz ZCHPWNKVNIDMDO-HNNXBMFYSA-N 1 1 249.354 2.377 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2ccccc2O)CC[C@]1(C)O ZINC001203550365 966681962 /nfs/dbraw/zinc/68/19/62/966681962.db2.gz TWQILBFSKIMRGC-WFASDCNBSA-N 1 1 249.354 2.375 20 10 BECDMO Oc1ccccc1C[NH+]1CC(N2CCCCC2)C1 ZINC001203558340 966687902 /nfs/dbraw/zinc/68/79/02/966687902.db2.gz GLMDRRUCLYBMHC-UHFFFAOYSA-N 1 1 246.354 2.062 20 10 BECDMO COc1cccc(C[N@H+]2C[C@H](F)C[C@H]2C)c1O ZINC001203586138 966701425 /nfs/dbraw/zinc/70/14/25/966701425.db2.gz ZJSBSANMCFKDTF-MWLCHTKSSA-N 1 1 239.290 2.333 20 10 BECDMO C[C@H]1CCCC[N@H+]1Cc1ccc(O)c(O)c1 ZINC001203873564 966801590 /nfs/dbraw/zinc/80/15/90/966801590.db2.gz GALBAXDXZQRURP-JTQLQIEISA-N 1 1 221.300 2.472 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H]2CCCO[C@H]2C1 ZINC001203550305 966935908 /nfs/dbraw/zinc/93/59/08/966935908.db2.gz QYHZQQAPEMZRHM-DOMZBBRYSA-N 1 1 247.338 2.393 20 10 BECDMO C[N@@H+](Cc1ccc(O)cc1O)C(C)(C)C ZINC001204275492 966951789 /nfs/dbraw/zinc/95/17/89/966951789.db2.gz SUDPYDXNLNHVKC-UHFFFAOYSA-N 1 1 209.289 2.328 20 10 BECDMO C[C@@]1(CF)CC[N@@H+](Cc2ccc(O)cc2O)C1 ZINC001204276364 966960110 /nfs/dbraw/zinc/96/01/10/966960110.db2.gz KWQXLOXXYQMLQL-ZDUSSCGKSA-N 1 1 239.290 2.279 20 10 BECDMO COc1cc(C[N@H+]2CCC[C@H]3C[C@H]32)cc(O)c1O ZINC001204349083 966977262 /nfs/dbraw/zinc/97/72/62/966977262.db2.gz OJUVYWGRLZVEGK-WDEREUQCSA-N 1 1 249.310 2.091 20 10 BECDMO Cc1ncc(-c2[nH+]ccc3c2ccn3C)cn1 ZINC001205820373 967836677 /nfs/dbraw/zinc/83/66/77/967836677.db2.gz 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CSCC[N@H+](C)Cc1cccc(F)c1O ZINC001138129603 990887435 /nfs/dbraw/zinc/88/74/35/990887435.db2.gz MGRMSNJLGGGCMN-UHFFFAOYSA-N 1 1 229.320 2.326 20 10 BECDMO CSCC[N@@H+](C)Cc1cccc(F)c1O ZINC001138129603 990887437 /nfs/dbraw/zinc/88/74/37/990887437.db2.gz MGRMSNJLGGGCMN-UHFFFAOYSA-N 1 1 229.320 2.326 20 10 BECDMO Cc1c(C[N@H+]2CC[C@@H](O)C2)c2ccccc2n1C ZINC001138252557 990903807 /nfs/dbraw/zinc/90/38/07/990903807.db2.gz LIUMEJDTBVIBSJ-GFCCVEGCSA-N 1 1 244.338 2.053 20 10 BECDMO CC(C)c1ccc(O)c(C[NH+]2CCOCC2)c1 ZINC001308560522 991042609 /nfs/dbraw/zinc/04/26/09/991042609.db2.gz RXUYPIIYFPIYRS-UHFFFAOYSA-N 1 1 235.327 2.348 20 10 BECDMO C[C@H](O)CCC[NH2+]Cc1ccc(Cl)cc1O ZINC001308722243 991109810 /nfs/dbraw/zinc/10/98/10/991109810.db2.gz GUANDJONCDCQNT-VIFPVBQESA-N 1 1 243.734 2.296 20 10 BECDMO CC[N@H+](Cc1ccc(N)cc1)C[C@@H]1CCCO1 ZINC000035361341 991124059 /nfs/dbraw/zinc/12/40/59/991124059.db2.gz SUFHKVXZQDYHCQ-AWEZNQCLSA-N 1 1 234.343 2.270 20 10 BECDMO C[N@H+](Cc1ccno1)Cc1cc(F)ccc1O ZINC001140060183 991507753 /nfs/dbraw/zinc/50/77/53/991507753.db2.gz OGYKTLHKQUDZOR-UHFFFAOYSA-N 1 1 236.246 2.151 20 10 BECDMO C[N@@H+](Cc1ccno1)Cc1cc(F)ccc1O ZINC001140060183 991507762 /nfs/dbraw/zinc/50/77/62/991507762.db2.gz OGYKTLHKQUDZOR-UHFFFAOYSA-N 1 1 236.246 2.151 20 10 BECDMO C[N@H+](Cc1ccc(N)cc1)C[C@H]1CCCCO1 ZINC000036231131 991545585 /nfs/dbraw/zinc/54/55/85/991545585.db2.gz ZLUDKOHGCWNPHC-CQSZACIVSA-N 1 1 234.343 2.270 20 10 BECDMO OCC[N@@H+](Cc1ccc(Cl)cc1O)C1CC1 ZINC001560678919 991549353 /nfs/dbraw/zinc/54/93/53/991549353.db2.gz WIAFIQDNSVRHTI-UHFFFAOYSA-N 1 1 241.718 2.002 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCN(C)[C@H](C)C2)c1O ZINC001140181430 991549920 /nfs/dbraw/zinc/54/99/20/991549920.db2.gz BCJRPQTVLPRRBK-CYBMUJFWSA-N 1 1 248.370 2.145 20 10 BECDMO COCC[N@@H+](C)Cc1c(C)ccc(C)c1O ZINC001140181681 991550612 /nfs/dbraw/zinc/55/06/12/991550612.db2.gz ZDMZDTKPJNBKIA-UHFFFAOYSA-N 1 1 223.316 2.087 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCO[C@@H](C)C2)c1O ZINC001140178214 991552331 /nfs/dbraw/zinc/55/23/31/991552331.db2.gz CTFSOAGDNZJMLZ-LBPRGKRZSA-N 1 1 235.327 2.230 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCOC3(CC3)C2)c1O ZINC001140185003 991556392 /nfs/dbraw/zinc/55/63/92/991556392.db2.gz NXHLNPYHMSYNRJ-UHFFFAOYSA-N 1 1 247.338 2.374 20 10 BECDMO CC[N@@H+](Cc1ccc(Cl)cc1O)C1COC1 ZINC001140464708 991644340 /nfs/dbraw/zinc/64/43/40/991644340.db2.gz AGSBOCGTMPNMRV-UHFFFAOYSA-N 1 1 241.718 2.266 20 10 BECDMO CCO[C@@H]1CC[N@@H+](Cc2ccccc2O)C1 ZINC000701660934 993897055 /nfs/dbraw/zinc/89/70/55/993897055.db2.gz FCJNFOIWZXOSLC-GFCCVEGCSA-N 1 1 221.300 2.003 20 10 BECDMO C[C@@H]([NH2+][C@@H](C)CCN(C)C)c1ccccc1O ZINC000049553087 343601993 /nfs/dbraw/zinc/60/19/93/343601993.db2.gz LHAGFDOOSQWRSY-NWDGAFQWSA-N 1 1 236.359 2.383 20 10 BECDMO C[C@@H](CCN(C)C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000049551678 343602046 /nfs/dbraw/zinc/60/20/46/343602046.db2.gz VWQKUXMEXFTSCH-ZDUSSCGKSA-N 1 1 249.402 2.182 20 10 BECDMO CC[N@@H+](Cc1cc2c(cc1O)OCO2)C(C)C ZINC000096851201 344382907 /nfs/dbraw/zinc/38/29/07/344382907.db2.gz WVFRNVZVCLANQU-UHFFFAOYSA-N 1 1 237.299 2.351 20 10 BECDMO Cc1cccc(C[N@@H+](C2CC2)C2COC2)c1O ZINC000296136177 179071499 /nfs/dbraw/zinc/07/14/99/179071499.db2.gz UVGLAVMFUVZWNN-UHFFFAOYSA-N 1 1 233.311 2.064 20 10 BECDMO Cc1cccc(C[N@@H+](CCO)C2CCCC2)c1O ZINC000271716291 179072572 /nfs/dbraw/zinc/07/25/72/179072572.db2.gz CDYODHCQFFFLTR-UHFFFAOYSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)c1O ZINC000124542724 179084739 /nfs/dbraw/zinc/08/47/39/179084739.db2.gz JQKWHPGELPGXIK-RYUDHWBXSA-N 1 1 235.327 2.310 20 10 BECDMO CC[C@@H](O)CC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168825095 346744631 /nfs/dbraw/zinc/74/46/31/346744631.db2.gz PEQKZUCTEPAWPI-GXSJLCMTSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCOCC23CCC3)c1 ZINC000093510561 360254154 /nfs/dbraw/zinc/25/41/54/360254154.db2.gz PPDMEECOWLINOF-UHFFFAOYSA-N 1 1 247.338 2.456 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H]1CF ZINC000293961242 183275447 /nfs/dbraw/zinc/27/54/47/183275447.db2.gz JNDQOEBQRCQMTC-LLVKDONJSA-N 1 1 227.254 2.465 20 10 BECDMO CCC[N@@H+](CCO)Cc1cc(C)c(C)cc1O ZINC000271053138 169165443 /nfs/dbraw/zinc/16/54/43/169165443.db2.gz XNFOSBSLTDOWFY-UHFFFAOYSA-N 1 1 237.343 2.213 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H]2OCC[C@H]2C1 ZINC000369682909 183302283 /nfs/dbraw/zinc/30/22/83/183302283.db2.gz HWKSNURYTFCKSR-GXTWGEPZSA-N 1 1 233.311 2.003 20 10 BECDMO Oc1ccccc1C[N@@H+]1CC[C@H](O)C12CCCC2 ZINC000293903222 183302400 /nfs/dbraw/zinc/30/24/00/183302400.db2.gz LFOUEJKYCYWWQC-AWEZNQCLSA-N 1 1 247.338 2.272 20 10 BECDMO CCCN1CC[NH+](Cc2cc(C)ccc2O)CC1 ZINC000131690155 169202445 /nfs/dbraw/zinc/20/24/45/169202445.db2.gz ZZXORYVVLICWBZ-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]CCCN(C)C)c1 ZINC000035628699 383865107 /nfs/dbraw/zinc/86/51/07/383865107.db2.gz CXOGHPNKHUESQS-GFCCVEGCSA-N 1 1 236.359 2.303 20 10 BECDMO C[N@@H+](Cc1ccc(CO)o1)Cc1ccccc1O ZINC000091974438 384157404 /nfs/dbraw/zinc/15/74/04/384157404.db2.gz ALDMOZOSAPJELJ-UHFFFAOYSA-N 1 1 247.294 2.110 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000091772766 384145152 /nfs/dbraw/zinc/14/51/52/384145152.db2.gz CYOJZOAEVMYOAA-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(O)c(CN2CC[NH+](C(C)C)CC2)c1 ZINC000132260946 384223620 /nfs/dbraw/zinc/22/36/20/384223620.db2.gz URTZZRBDZNJTFH-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cnc(C[N@@H+](C)Cc2ccccc2O)o1 ZINC000072629589 384228304 /nfs/dbraw/zinc/22/83/04/384228304.db2.gz VKGADXWMCIKCHI-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1cnc(C[N@H+](C)Cc2ccccc2O)o1 ZINC000072629589 384228311 /nfs/dbraw/zinc/22/83/11/384228311.db2.gz VKGADXWMCIKCHI-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO COC[C@@H](C)[N@@H+](C)Cc1cc(C)ccc1O ZINC000132677664 384244397 /nfs/dbraw/zinc/24/43/97/384244397.db2.gz WBBKCUTZQASWGM-LLVKDONJSA-N 1 1 223.316 2.167 20 10 BECDMO C[C@@H](CCN(C)C)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297598546 384307000 /nfs/dbraw/zinc/30/70/00/384307000.db2.gz HXJBMZKTLNPFDQ-AAEUAGOBSA-N 1 1 248.370 2.309 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@H]1CCCCO1 ZINC000096477922 384461417 /nfs/dbraw/zinc/46/14/17/384461417.db2.gz IFDPVIVHQXUIAG-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO C[N@@H+](CCC1CC1)Cc1cc2c(cc1O)OCO2 ZINC000162874083 384700223 /nfs/dbraw/zinc/70/02/23/384700223.db2.gz YFPKLLMXVRYLFI-UHFFFAOYSA-N 1 1 249.310 2.353 20 10 BECDMO C[N@@H+](Cc1c(O)cccc1Cl)CC(C)(C)O ZINC000126399060 384795817 /nfs/dbraw/zinc/79/58/17/384795817.db2.gz AMMQYJBVXXWWHF-UHFFFAOYSA-N 1 1 243.734 2.248 20 10 BECDMO C[C@@H](O)CC[N@@H+](C)Cc1c(O)cccc1Cl ZINC000127679977 384933321 /nfs/dbraw/zinc/93/33/21/384933321.db2.gz GQMWWPVUMVKLCO-SECBINFHSA-N 1 1 243.734 2.248 20 10 BECDMO COC[C@@H](C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062748389 385187790 /nfs/dbraw/zinc/18/77/90/385187790.db2.gz MTGLSTATKQTIDV-VHSXEESVSA-N 1 1 241.306 2.464 20 10 BECDMO CO[C@H](C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000191205607 385292963 /nfs/dbraw/zinc/29/29/63/385292963.db2.gz KNLXFFVCVJGPRN-RKDXNWHRSA-N 1 1 227.279 2.217 20 10 BECDMO CCC[C@H]1C[N@@H+](Cc2ccccc2O)CCO1 ZINC000179577258 385476158 /nfs/dbraw/zinc/47/61/58/385476158.db2.gz DRSIGUHCTOYEFJ-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO CCCC[N@@H+](CCCO)Cc1ccccc1O ZINC000282428785 385761115 /nfs/dbraw/zinc/76/11/15/385761115.db2.gz JXBTYWGAIJFMPJ-UHFFFAOYSA-N 1 1 237.343 2.377 20 10 BECDMO C[N@@H+](Cc1ccccc1O)[C@H](CO)C(C)(C)C ZINC000271246473 385811090 /nfs/dbraw/zinc/81/10/90/385811090.db2.gz CPQDUQZBXPTSBQ-CYBMUJFWSA-N 1 1 237.343 2.231 20 10 BECDMO CS[C@@H]1CC[N@H+](Cc2cccc(F)c2O)C1 ZINC000295021322 385944521 /nfs/dbraw/zinc/94/45/21/385944521.db2.gz KQVMUAZLULNSGR-SNVBAGLBSA-N 1 1 241.331 2.469 20 10 BECDMO CS[C@@H]1CC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000295021322 385944527 /nfs/dbraw/zinc/94/45/27/385944527.db2.gz KQVMUAZLULNSGR-SNVBAGLBSA-N 1 1 241.331 2.469 20 10 BECDMO CS[C@@H]1CC[N@@H+](Cc2ccccc2O)C1 ZINC000295026993 385946447 /nfs/dbraw/zinc/94/64/47/385946447.db2.gz LFFFRZZJXSUDKD-LLVKDONJSA-N 1 1 223.341 2.330 20 10 BECDMO C[C@@H](CO)[N@H+](Cc1ccccc1O)CC1CCC1 ZINC000289389214 386294885 /nfs/dbraw/zinc/29/48/85/386294885.db2.gz NIQDWKIRTPAYJQ-LBPRGKRZSA-N 1 1 249.354 2.375 20 10 BECDMO C[C@H]([NH2+]Cc1cccc(F)c1O)c1cn[nH]c1 ZINC000226618320 386345030 /nfs/dbraw/zinc/34/50/30/386345030.db2.gz PNGIIZSTMDTICN-QMMMGPOBSA-N 1 1 235.262 2.105 20 10 BECDMO COC[C@@H]1CC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000265857859 386378663 /nfs/dbraw/zinc/37/86/63/386378663.db2.gz WOZQYZKZQDMUSO-CYBMUJFWSA-N 1 1 249.354 2.477 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](O)CC2)c1 ZINC000293991662 386672751 /nfs/dbraw/zinc/67/27/51/386672751.db2.gz LQGXGXBAZYKARE-ZDUSSCGKSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1c(C[N@@H+](C)Cc2ccccc2O)cnn1C ZINC000268874190 386710167 /nfs/dbraw/zinc/71/01/67/386710167.db2.gz AMDHJKFOJMYBSA-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO [O-]c1c(F)cccc1C[N@H+]1CCC[C@@H]1CF ZINC000293824676 386884519 /nfs/dbraw/zinc/88/45/19/386884519.db2.gz AHITWMHFNKNKBJ-SNVBAGLBSA-N 1 1 227.254 2.465 20 10 BECDMO Oc1c(F)cccc1C[N@H+]1CCC[C@@H]1CF ZINC000293824676 386884529 /nfs/dbraw/zinc/88/45/29/386884529.db2.gz AHITWMHFNKNKBJ-SNVBAGLBSA-N 1 1 227.254 2.465 20 10 BECDMO CC(C)[C@@H](O)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168775313 387802276 /nfs/dbraw/zinc/80/22/76/387802276.db2.gz CJIZHXASSOJQQW-ZANVPECISA-N 1 1 241.306 2.199 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@]23CCOC3)c1 ZINC000367047429 136112288 /nfs/dbraw/zinc/11/22/88/136112288.db2.gz JCEPALIPSQCXHV-HNNXBMFYSA-N 1 1 247.338 2.456 20 10 BECDMO C[N@H+](Cc1cc(F)ccc1O)CC1CC1 ZINC000179947574 397854521 /nfs/dbraw/zinc/85/45/21/397854521.db2.gz JICXSYQYBUCUDD-UHFFFAOYSA-N 1 1 209.264 2.373 20 10 BECDMO CC1(C)[C@@H]2C[N@H+](Cc3ccccc3O)C[C@@H]21 ZINC000179579960 168013323 /nfs/dbraw/zinc/01/33/23/168013323.db2.gz VDCQKUVQQPFZIV-TXEJJXNPSA-N 1 1 217.312 2.480 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)CCCCCO)c1 ZINC000279433666 411448479 /nfs/dbraw/zinc/44/84/79/411448479.db2.gz OHIIWXNSOJGCRI-UHFFFAOYSA-N 1 1 237.343 2.295 20 10 BECDMO CCOC1CC([N@@H+](C)Cc2ccccc2O)C1 ZINC000278585810 170328606 /nfs/dbraw/zinc/32/86/06/170328606.db2.gz KPUZMRUEHRNWGC-UHFFFAOYSA-N 1 1 235.327 2.392 20 10 BECDMO CC[C@@H]1CC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000291816022 171024482 /nfs/dbraw/zinc/02/44/82/171024482.db2.gz DMLVVBDUAKMFLE-SNVBAGLBSA-N 1 1 235.283 2.105 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CCO1 ZINC000125493349 171089190 /nfs/dbraw/zinc/08/91/90/171089190.db2.gz DQMGZQBRMOSHNH-OAHLLOKOSA-N 1 1 248.370 2.363 20 10 BECDMO CC[C@@]1(CO)CCC[N@H+]1Cc1ccccc1O ZINC000191012510 171213544 /nfs/dbraw/zinc/21/35/44/171213544.db2.gz NINWNWMXCCTENU-AWEZNQCLSA-N 1 1 235.327 2.129 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2CF)c1 ZINC000294086978 175158156 /nfs/dbraw/zinc/15/81/56/175158156.db2.gz RHCMPCZOIDTTGI-LLVKDONJSA-N 1 1 239.290 2.335 20 10 BECDMO COc1cccc(C[N@@H+](C)CC2CC2)c1O ZINC000122930959 175256017 /nfs/dbraw/zinc/25/60/17/175256017.db2.gz RWVXJZDFSWZHOF-UHFFFAOYSA-N 1 1 221.300 2.243 20 10 BECDMO COc1cccc(C[N@H+]2CC[C@H](C)C2)c1O ZINC000132668325 175259802 /nfs/dbraw/zinc/25/98/02/175259802.db2.gz ORBCCTSDSUJLLU-JTQLQIEISA-N 1 1 221.300 2.243 20 10 BECDMO C[C@H]1CC[C@@H](C[N@@H+](C)Cc2ccccc2O)O1 ZINC000190861001 177189348 /nfs/dbraw/zinc/18/93/48/177189348.db2.gz RYTOPCITNQFVAQ-AAEUAGOBSA-N 1 1 235.327 2.392 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccccc2O)CC(C)(C)O1 ZINC000133105197 177266232 /nfs/dbraw/zinc/26/62/32/177266232.db2.gz IUAPEYFTTYJGDB-NSHDSACASA-N 1 1 235.327 2.392 20 10 BECDMO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccccc1O ZINC000132611576 177266370 /nfs/dbraw/zinc/26/63/70/177266370.db2.gz YBIJZSUQEIAVTR-MNOVXSKESA-N 1 1 221.300 2.001 20 10 BECDMO C[C@H]1COCC[C@H]1[NH2+]Cc1cccc(F)c1O ZINC000277660898 177297106 /nfs/dbraw/zinc/29/71/06/177297106.db2.gz ZTMKLWWHDFOHHY-JOYOIKCWSA-N 1 1 239.290 2.046 20 10 BECDMO COc1ccc(C[N@@H+](C)C(C)C)c(O)c1OC ZINC000891450290 582689281 /nfs/dbraw/zinc/68/92/81/582689281.db2.gz GFLHHKNUQULSOE-UHFFFAOYSA-N 1 1 239.315 2.250 20 10 BECDMO Cc1cc(C)c(O)c(C[N@H+]2CCC3(COC3)C2)c1 ZINC000853594287 588749737 /nfs/dbraw/zinc/74/97/37/588749737.db2.gz CWWIGODJEZHSSU-UHFFFAOYSA-N 1 1 247.338 2.231 20 10 BECDMO CC[C@H]1CCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000112465872 588799246 /nfs/dbraw/zinc/79/92/46/588799246.db2.gz IQRRNOGBMLZJNI-NSHDSACASA-N 1 1 249.310 2.495 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCN(C)[C@H](C)[C@@H]2C)c1 ZINC000775985516 583108318 /nfs/dbraw/zinc/10/83/18/583108318.db2.gz MBVSYYONAHWEBO-OLZOCXBDSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1cccc(C[N@H+]2CCCCC[C@@H]2CO)c1O ZINC000895151372 583606791 /nfs/dbraw/zinc/60/67/91/583606791.db2.gz TXGLNSOJSKEJRA-CQSZACIVSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1ccc(C[N@@H+](C)CCCF)c(O)c1 ZINC000895895836 583743542 /nfs/dbraw/zinc/74/35/42/583743542.db2.gz FFQMOTINTONFEJ-UHFFFAOYSA-N 1 1 211.280 2.492 20 10 BECDMO Cc1ccc(C[N@H+]2CCO[C@@H](C)CC2)c(O)c1 ZINC000896579057 583814496 /nfs/dbraw/zinc/81/44/96/583814496.db2.gz MQBHDLFPCPZEKF-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO C[C@H]1C[C@H]1C[NH2+]Cc1c(O)cccc1F ZINC000896637274 583819415 /nfs/dbraw/zinc/81/94/15/583819415.db2.gz LKUSFWSRNAPHOI-IUCAKERBSA-N 1 1 209.264 2.277 20 10 BECDMO C[C@@H]1C[C@@H]1C[NH2+]Cc1c(O)cccc1F ZINC000896637276 583819486 /nfs/dbraw/zinc/81/94/86/583819486.db2.gz LKUSFWSRNAPHOI-RKDXNWHRSA-N 1 1 209.264 2.277 20 10 BECDMO CC1(C)COC[C@H]1[NH2+]Cc1c(O)cccc1F ZINC000896639580 583820243 /nfs/dbraw/zinc/82/02/43/583820243.db2.gz WRYPVPVDSRWHQI-GFCCVEGCSA-N 1 1 239.290 2.046 20 10 BECDMO Oc1cccc(F)c1C[NH2+]CCC[C@@H]1CCO1 ZINC000896639603 583820384 /nfs/dbraw/zinc/82/03/84/583820384.db2.gz XASPYCWSKXCHJM-SNVBAGLBSA-N 1 1 239.290 2.190 20 10 BECDMO Oc1cccc(F)c1C[NH2+]CCC[C@H]1CCO1 ZINC000896639602 583820415 /nfs/dbraw/zinc/82/04/15/583820415.db2.gz XASPYCWSKXCHJM-JTQLQIEISA-N 1 1 239.290 2.190 20 10 BECDMO Oc1ccccc1C[N@H+]1CCn2cccc2C1 ZINC000896759768 583831374 /nfs/dbraw/zinc/83/13/74/583831374.db2.gz FIVDOKBMKZOGMN-UHFFFAOYSA-N 1 1 228.295 2.210 20 10 BECDMO COc1ccc(CN[C@@H]2CCC[NH2+]CC2)cc1C ZINC000841056773 584125676 /nfs/dbraw/zinc/12/56/76/584125676.db2.gz DUHQLJBONAXFEA-CQSZACIVSA-N 1 1 248.370 2.235 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@H]2CNCC[C@H]2C)cc1C ZINC000841059986 584126111 /nfs/dbraw/zinc/12/61/11/584126111.db2.gz ZHWSVZKLAOUWNQ-YGRLFVJLSA-N 1 1 248.370 2.097 20 10 BECDMO C/C=C\C[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O ZINC000858537759 588963602 /nfs/dbraw/zinc/96/36/02/588963602.db2.gz PRFDRGWQEFITBO-UMCURTJPSA-N 1 1 249.310 2.406 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]CC2(N)CC2)c(O)c1C ZINC000902405607 584573615 /nfs/dbraw/zinc/57/36/15/584573615.db2.gz JHPZSTYJJQFVFH-NSHDSACASA-N 1 1 234.343 2.151 20 10 BECDMO Cc1cc(C)c([C@@H](C)[NH2+]CC2(N)CC2)c(O)c1 ZINC000902406139 584573972 /nfs/dbraw/zinc/57/39/72/584573972.db2.gz LWPJYFCOFFTMGZ-LLVKDONJSA-N 1 1 234.343 2.151 20 10 BECDMO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(N)CC2)cc1 ZINC000902416294 584590454 /nfs/dbraw/zinc/59/04/54/584590454.db2.gz MNZICTSKDJXAQV-GFCCVEGCSA-N 1 1 247.386 2.285 20 10 BECDMO C[C@@H]([NH2+]Cc1cn(C)cn1)c1ccc(F)cc1O ZINC000903352566 584755680 /nfs/dbraw/zinc/75/56/80/584755680.db2.gz VKEMRGOGMZWERF-SECBINFHSA-N 1 1 249.289 2.116 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)C[C@H]1CCOC1 ZINC000876788589 584886798 /nfs/dbraw/zinc/88/67/98/584886798.db2.gz FSUIVZMJKPJARP-GFCCVEGCSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@@](C)(CO)C2)c1 ZINC000827700665 584900682 /nfs/dbraw/zinc/90/06/82/584900682.db2.gz WOAMURYYSCYKAY-SWLSCSKDSA-N 1 1 249.354 2.151 20 10 BECDMO CC[C@@H](N)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000817980068 584994532 /nfs/dbraw/zinc/99/45/32/584994532.db2.gz RACLEPHSZDDBHW-YPMHNXCESA-N 1 1 236.359 2.479 20 10 BECDMO C[C@@H]([NH2+][C@@H]1CCOC1)c1cc(F)cc(F)c1O ZINC000756766530 585028499 /nfs/dbraw/zinc/02/84/99/585028499.db2.gz AAVAJWASCZAABV-VXNVDRBHSA-N 1 1 243.253 2.110 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H](O)C2)cc1 ZINC000741753402 585117472 /nfs/dbraw/zinc/11/74/72/585117472.db2.gz XLTMHHQVHNRTIM-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO C[C@@H]([NH2+]CC1(C)COC1)c1c(O)cccc1F ZINC000886526576 585141732 /nfs/dbraw/zinc/14/17/32/585141732.db2.gz NWDSINJSJMAXKE-SECBINFHSA-N 1 1 239.290 2.218 20 10 BECDMO CC(C)[C@@H](O)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886528238 585141784 /nfs/dbraw/zinc/14/17/84/585141784.db2.gz IXPBVEUIODWXJO-SKDRFNHKSA-N 1 1 241.306 2.199 20 10 BECDMO CO[C@H]1CC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000751946531 585239392 /nfs/dbraw/zinc/23/93/92/585239392.db2.gz VXJNIUZYFVFPOR-AWEZNQCLSA-N 1 1 247.338 2.102 20 10 BECDMO CC[N@@H+](CCOC)Cc1cc(C)cc(C)c1O ZINC000754724222 585289977 /nfs/dbraw/zinc/28/99/77/585289977.db2.gz ZWXDBEFKBSULEL-UHFFFAOYSA-N 1 1 237.343 2.477 20 10 BECDMO CC1=CC[N@@H+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000755767628 585306499 /nfs/dbraw/zinc/30/64/99/585306499.db2.gz JUUYKMRVEYFGRX-UHFFFAOYSA-N 1 1 247.294 2.273 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CC[C@H](C)C1 ZINC000769102580 585549173 /nfs/dbraw/zinc/54/91/73/585549173.db2.gz OMFCTVRKEOYUQW-JTQLQIEISA-N 1 1 221.300 2.243 20 10 BECDMO Cc1cc(O)c(C[N@@H+](CCCO)C2CC2)cc1C ZINC000769404648 585555686 /nfs/dbraw/zinc/55/56/86/585555686.db2.gz MZPFSAMNUCOCAN-UHFFFAOYSA-N 1 1 249.354 2.356 20 10 BECDMO COc1cccc(O)c1C[N@@H+](C)C1CCC1 ZINC000769443340 585556666 /nfs/dbraw/zinc/55/66/66/585556666.db2.gz XFTHARSTBDXUHN-UHFFFAOYSA-N 1 1 221.300 2.385 20 10 BECDMO CC[C@@H]([NH2+]Cc1nonc1C)c1ccccc1O ZINC000775411657 585677635 /nfs/dbraw/zinc/67/76/35/585677635.db2.gz GNKXYTMKMZNCCR-LLVKDONJSA-N 1 1 247.298 2.325 20 10 BECDMO CC(C)[C@@H]1CC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000775763256 585684052 /nfs/dbraw/zinc/68/40/52/585684052.db2.gz FKBLJHNMDDUWNT-NSHDSACASA-N 1 1 249.310 2.351 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@@H](C)N(C)C[C@@H]2C)c1O ZINC000775987352 585688703 /nfs/dbraw/zinc/68/87/03/585688703.db2.gz VLONYJHUMXWEMV-OLZOCXBDSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@@H](C)N(C)C[C@H]2C)c1O ZINC000775987347 585688727 /nfs/dbraw/zinc/68/87/27/585688727.db2.gz VLONYJHUMXWEMV-CHWSQXEVSA-N 1 1 248.370 2.225 20 10 BECDMO C[C@@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccccc1O ZINC000777824413 585720666 /nfs/dbraw/zinc/72/06/66/585720666.db2.gz FBQVPOFHWAVVHU-TZMCWYRMSA-N 1 1 248.370 2.164 20 10 BECDMO CC(C)[N@H+](Cc1cc(F)ccc1O)C[C@@H](C)O ZINC000779013662 585744029 /nfs/dbraw/zinc/74/40/29/585744029.db2.gz HQWFAAILIXCDAZ-SNVBAGLBSA-N 1 1 241.306 2.123 20 10 BECDMO COc1cccc(O)c1C[N@@H+]1CC=CCC1 ZINC000779159499 585746449 /nfs/dbraw/zinc/74/64/49/585746449.db2.gz KZGQABIFHWRGBR-UHFFFAOYSA-N 1 1 219.284 2.163 20 10 BECDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccccc1O ZINC000785988379 585884652 /nfs/dbraw/zinc/88/46/52/585884652.db2.gz MPBMLPUDKQYWMZ-YRGRVCCFSA-N 1 1 249.354 2.374 20 10 BECDMO COc1cccc(C[N@@H+]2[C@H](C)C[C@@H]2C)c1O ZINC000793220812 586014507 /nfs/dbraw/zinc/01/45/07/586014507.db2.gz QREUSXHJPRCEPB-AOOOYVTPSA-N 1 1 221.300 2.384 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCOCC23CC3)c1 ZINC000802658588 586308476 /nfs/dbraw/zinc/30/84/76/586308476.db2.gz ISDZHMRIQXWVPE-UHFFFAOYSA-N 1 1 233.311 2.065 20 10 BECDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2cccc(C)c2O)C1 ZINC000809693125 586513386 /nfs/dbraw/zinc/51/33/86/586513386.db2.gz OJUPGHOOIAYGGC-BETUJISGSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)C[C@H](O)C2CC2)cc1C ZINC000809750920 586517417 /nfs/dbraw/zinc/51/74/17/586517417.db2.gz BTRJYDDGRZHFIL-HNNXBMFYSA-N 1 1 249.354 2.212 20 10 BECDMO CC[N@@H+](Cc1cc(C)c(C)cc1O)[C@H](C)CO ZINC000814169620 586615152 /nfs/dbraw/zinc/61/51/52/586615152.db2.gz KOADDICHNSSYTN-GFCCVEGCSA-N 1 1 237.343 2.212 20 10 BECDMO Cc1cc(C[N@@H+]2C[C@@H](O)C[C@@H]2C)ccc1N(C)C ZINC000815079561 586666212 /nfs/dbraw/zinc/66/62/12/586666212.db2.gz SEPYIBASCMARIS-JSGCOSHPSA-N 1 1 248.370 2.016 20 10 BECDMO C[C@@H]([NH2+]CCO)c1cccc(C(F)(F)F)c1O ZINC000815555082 586687754 /nfs/dbraw/zinc/68/77/54/586687754.db2.gz PEOLGZMEODOZBF-SSDOTTSWSA-N 1 1 249.232 2.054 20 10 BECDMO COC[C@@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816530156 586739175 /nfs/dbraw/zinc/73/91/75/586739175.db2.gz WIJVVRYUCGHMHP-SSDOTTSWSA-N 1 1 247.697 2.309 20 10 BECDMO COc1cccc(O)c1C[N@H+]1C[C@H](C)[C@@H]1C ZINC000816649132 586751575 /nfs/dbraw/zinc/75/15/75/586751575.db2.gz URQBEHJEVSLERC-UWVGGRQHSA-N 1 1 221.300 2.241 20 10 BECDMO CC[C@H]1CN(C)CC[N@H+]1Cc1cc(C)ccc1O ZINC000816660378 586753543 /nfs/dbraw/zinc/75/35/43/586753543.db2.gz BHPHNKSMRIIOKQ-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO CC[C@H]([NH2+]CC[NH3+])c1cccc(Cl)c1[O-] ZINC000817934979 586843393 /nfs/dbraw/zinc/84/33/93/586843393.db2.gz DHSZVEGASVLCBF-JTQLQIEISA-N 1 1 228.723 2.045 20 10 BECDMO CCN(C)c1ccc([C@@H](C)NCCC[NH2+]C)cc1 ZINC000817941730 586845635 /nfs/dbraw/zinc/84/56/35/586845635.db2.gz VYRFXOPLKUZVOJ-CYBMUJFWSA-N 1 1 249.402 2.403 20 10 BECDMO CCNCC[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000817951193 586847554 /nfs/dbraw/zinc/84/75/54/586847554.db2.gz AZTJFUHQAZDUND-ZDUSSCGKSA-N 1 1 236.359 2.351 20 10 BECDMO CCNCC[NH2+][C@H](CC)c1ccccc1O ZINC000817952186 586847781 /nfs/dbraw/zinc/84/77/81/586847781.db2.gz ONESFSPXZDBUJA-GFCCVEGCSA-N 1 1 222.332 2.042 20 10 BECDMO Cc1cc(C)c([C@@H](C)[NH2+]CCNC2CC2)c(O)c1 ZINC000817954454 586850106 /nfs/dbraw/zinc/85/01/06/586850106.db2.gz YADJBZWIKGCVIW-GFCCVEGCSA-N 1 1 248.370 2.412 20 10 BECDMO CC[C@H]([NH2+]C[C@H](N)C(C)C)c1ccccc1O ZINC000817960180 586851678 /nfs/dbraw/zinc/85/16/78/586851678.db2.gz XZDCMESMHJHXHC-STQMWFEESA-N 1 1 236.359 2.416 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)N)c(O)c1C ZINC000817961113 586851841 /nfs/dbraw/zinc/85/18/41/586851841.db2.gz XIJLDPTTZCEAPJ-LLVKDONJSA-N 1 1 236.359 2.397 20 10 BECDMO CC[C@H]([NH2+]CC(C)(C)N)c1ccc(C)cc1O ZINC000817961255 586852698 /nfs/dbraw/zinc/85/26/98/586852698.db2.gz ZSEIDNWMGYOXAT-LBPRGKRZSA-N 1 1 236.359 2.479 20 10 BECDMO C[C@H](N[C@H](C[NH3+])C1CC1)c1ccc(N(C)C)cc1 ZINC000817961214 586852807 /nfs/dbraw/zinc/85/28/07/586852807.db2.gz VJZWNQZEVJKHQJ-XHDPSFHLSA-N 1 1 247.386 2.141 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]CC2(N)CCC2)c(O)c1 ZINC000817965248 586853857 /nfs/dbraw/zinc/85/38/57/586853857.db2.gz RVLFBININYKLAZ-NSHDSACASA-N 1 1 234.343 2.233 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@H](N)C2CC2)c(O)c1 ZINC000817964712 586853883 /nfs/dbraw/zinc/85/38/83/586853883.db2.gz FPJHGHIJOPHFNX-GWCFXTLKSA-N 1 1 234.343 2.089 20 10 BECDMO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)CN)cc1 ZINC000817966542 586854793 /nfs/dbraw/zinc/85/47/93/586854793.db2.gz PVDSDIKIKZAJEH-NEPJUHHUSA-N 1 1 235.375 2.141 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](N)C2CC2)c1 ZINC000817966046 586854876 /nfs/dbraw/zinc/85/48/76/586854876.db2.gz ZOGRYDIHZWKDCA-MFKMUULPSA-N 1 1 234.343 2.089 20 10 BECDMO Cc1ccc(O)c([C@@H](C)NC[C@H]([NH3+])C2CC2)c1 ZINC000817966046 586854878 /nfs/dbraw/zinc/85/48/78/586854878.db2.gz ZOGRYDIHZWKDCA-MFKMUULPSA-N 1 1 234.343 2.089 20 10 BECDMO CC[C@@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(C)cc1O ZINC000817965686 586855452 /nfs/dbraw/zinc/85/54/52/586855452.db2.gz TUIOACTZTMHENG-ZIAGYGMSSA-N 1 1 248.370 2.479 20 10 BECDMO CC[C@@H]([NH2+]C[C@@H](N)C1CC1)c1ccccc1O ZINC000817966002 586855690 /nfs/dbraw/zinc/85/56/90/586855690.db2.gz YTLRAGTYFVQYQW-CHWSQXEVSA-N 1 1 234.343 2.170 20 10 BECDMO CC[C@H](N)C[NH2+][C@@H](CC)c1ccccc1O ZINC000817979374 586861578 /nfs/dbraw/zinc/86/15/78/586861578.db2.gz JYHQIRZUUXHMFT-JQWIXIFHSA-N 1 1 222.332 2.170 20 10 BECDMO CO[C@@H](C[N@@H+](C)Cc1ccccc1O)C1CC1 ZINC000822739760 587183603 /nfs/dbraw/zinc/18/36/03/587183603.db2.gz IABNVJANSKLPAO-AWEZNQCLSA-N 1 1 235.327 2.249 20 10 BECDMO CO[C@H](C[N@@H+](C)Cc1ccccc1O)C1CC1 ZINC000822739762 587183782 /nfs/dbraw/zinc/18/37/82/587183782.db2.gz IABNVJANSKLPAO-CQSZACIVSA-N 1 1 235.327 2.249 20 10 BECDMO COCC[N@@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000824547780 587275446 /nfs/dbraw/zinc/27/54/46/587275446.db2.gz BVPHSWPMPUMRTO-UHFFFAOYSA-N 1 1 243.734 2.432 20 10 BECDMO CCOc1ccc(C[N@H+]2CC[C@@H](F)C2)c(O)c1 ZINC000824571042 587276916 /nfs/dbraw/zinc/27/69/16/587276916.db2.gz HRUPRCQMNZSBRZ-LLVKDONJSA-N 1 1 239.290 2.335 20 10 BECDMO Cc1ncc(C[N@@H+](C)Cc2ccccc2O)n1C ZINC000824593175 587278547 /nfs/dbraw/zinc/27/85/47/587278547.db2.gz LXVLATOADXUFJL-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO Cc1cccc(C[N@@H+](C)CC2=CCCOC2)c1O ZINC000827190250 587372223 /nfs/dbraw/zinc/37/22/23/587372223.db2.gz SVTUULOREHKWAO-UHFFFAOYSA-N 1 1 247.338 2.479 20 10 BECDMO C[N@@H+](Cc1c(O)cccc1Cl)C1(CO)CC1 ZINC000827904175 587409499 /nfs/dbraw/zinc/40/94/99/587409499.db2.gz VNUMDOMNEHNBQV-UHFFFAOYSA-N 1 1 241.718 2.002 20 10 BECDMO C[C@H](CO)[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835053907 587779556 /nfs/dbraw/zinc/77/95/56/587779556.db2.gz QDZJIGZYAQCPCM-CFHLNLSMSA-N 1 1 248.370 2.078 20 10 BECDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840916623 587929301 /nfs/dbraw/zinc/92/93/01/587929301.db2.gz CFYMBCSBFCCNCA-OAHLLOKOSA-N 1 1 248.370 2.282 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCOC[C@@H]1C ZINC000840911371 587929382 /nfs/dbraw/zinc/92/93/82/587929382.db2.gz XXHWXEBADMJVTH-ZDUSSCGKSA-N 1 1 248.370 2.282 20 10 BECDMO CO[C@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840916620 587929660 /nfs/dbraw/zinc/92/96/60/587929660.db2.gz CFYMBCSBFCCNCA-HNNXBMFYSA-N 1 1 248.370 2.282 20 10 BECDMO Cc1cc(O)c(C[NH2+]C[C@@H](N)C(C)C)cc1C ZINC000841030769 587936501 /nfs/dbraw/zinc/93/65/01/587936501.db2.gz VAHDLRWSNVAGCV-CYBMUJFWSA-N 1 1 236.359 2.082 20 10 BECDMO Cc1cc(O)c(CNC[C@@H]([NH3+])C(C)C)cc1C ZINC000841030769 587936502 /nfs/dbraw/zinc/93/65/02/587936502.db2.gz VAHDLRWSNVAGCV-CYBMUJFWSA-N 1 1 236.359 2.082 20 10 BECDMO COC(=O)C(C)(C)CC[NH2+]c1ccc(N)cc1 ZINC000841040082 587938304 /nfs/dbraw/zinc/93/83/04/587938304.db2.gz HYKDJASGJYBZDN-UHFFFAOYSA-N 1 1 236.315 2.270 20 10 BECDMO Cc1cccc(CNCC2([NH3+])CCCCC2)c1O ZINC000841039569 587938575 /nfs/dbraw/zinc/93/85/75/587938575.db2.gz UQBUZCFUMZTTAM-UHFFFAOYSA-N 1 1 248.370 2.452 20 10 BECDMO C[C@@H](CCC[NH3+])[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000841080126 587944916 /nfs/dbraw/zinc/94/49/16/587944916.db2.gz NVHNDKULJVFBRH-VIFPVBQESA-N 1 1 242.750 2.263 20 10 BECDMO CN(C)c1ccc(CN[C@@H](C[NH3+])C(C)(C)C)cc1 ZINC000841087689 587945463 /nfs/dbraw/zinc/94/54/63/587945463.db2.gz QLYRNSFNBWNULT-AWEZNQCLSA-N 1 1 249.402 2.216 20 10 BECDMO CC(C)(C)[C@H](CN)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000841087129 587945672 /nfs/dbraw/zinc/94/56/72/587945672.db2.gz JGRXPXYEACFMKA-AWEZNQCLSA-N 1 1 248.370 2.085 20 10 BECDMO C[C@@H](O)CC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841751950 587973593 /nfs/dbraw/zinc/97/35/93/587973593.db2.gz OZVOBYDZXXNQCA-RKDXNWHRSA-N 1 1 243.734 2.467 20 10 BECDMO CCC[C@H]1CNCC[N@@H+]1Cc1cc(C)ccc1O ZINC000843058625 588078065 /nfs/dbraw/zinc/07/80/65/588078065.db2.gz XNKWEYLEUGMLJE-AWEZNQCLSA-N 1 1 248.370 2.275 20 10 BECDMO CCC[C@H]1CNCC[N@H+]1Cc1cc(C)ccc1O ZINC000843058625 588078067 /nfs/dbraw/zinc/07/80/67/588078067.db2.gz XNKWEYLEUGMLJE-AWEZNQCLSA-N 1 1 248.370 2.275 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCN[C@H](C)[C@@H]2C)cc1C ZINC000843057495 588078147 /nfs/dbraw/zinc/07/81/47/588078147.db2.gz ILMUHFIUCMHQIZ-OLZOCXBDSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CCN[C@H](C)[C@@H]2C)cc1C ZINC000843057495 588078149 /nfs/dbraw/zinc/07/81/49/588078149.db2.gz ILMUHFIUCMHQIZ-OLZOCXBDSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@H]3CCC[C@@H](C2)N3)c1 ZINC000843105050 588081557 /nfs/dbraw/zinc/08/15/57/588081557.db2.gz PAKDFPRZHJDUNF-OKILXGFUSA-N 1 1 246.354 2.027 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@H]3CCC[C@@H](C2)N3)c1 ZINC000843105050 588081558 /nfs/dbraw/zinc/08/15/58/588081558.db2.gz PAKDFPRZHJDUNF-OKILXGFUSA-N 1 1 246.354 2.027 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)CCO)cc1C ZINC000846111882 588257380 /nfs/dbraw/zinc/25/73/80/588257380.db2.gz RUWOKMQGQSPNHA-GFCCVEGCSA-N 1 1 237.343 2.212 20 10 BECDMO CCc1cccc(C[N@@H+](C)Cc2cn[nH]c2)c1O ZINC000848886813 588416981 /nfs/dbraw/zinc/41/69/81/588416981.db2.gz IQRWTDMQJAWUBF-UHFFFAOYSA-N 1 1 245.326 2.310 20 10 BECDMO CCc1cccc(C[N@H+]2CCC[C@H](O)CC2)c1O ZINC000848914936 588419916 /nfs/dbraw/zinc/41/99/16/588419916.db2.gz VNSWKXMDIQQVEV-AWEZNQCLSA-N 1 1 249.354 2.301 20 10 BECDMO CCc1cccc(C[N@H+]2CCC[C@@H](O)CC2)c1O ZINC000848914937 588420322 /nfs/dbraw/zinc/42/03/22/588420322.db2.gz VNSWKXMDIQQVEV-CQSZACIVSA-N 1 1 249.354 2.301 20 10 BECDMO CCc1cccc(C[N@H+]2C[C@@H](O)CC[C@@H]2C)c1O ZINC000848918244 588420631 /nfs/dbraw/zinc/42/06/31/588420631.db2.gz UAWQATLZPAFAIP-FZMZJTMJSA-N 1 1 249.354 2.300 20 10 BECDMO CCc1cccc(C[N@H+]2C[C@@H](O)CC[C@H]2C)c1O ZINC000848918245 588420983 /nfs/dbraw/zinc/42/09/83/588420983.db2.gz UAWQATLZPAFAIP-RISCZKNCSA-N 1 1 249.354 2.300 20 10 BECDMO CC[C@@H](C)[N@@H+](CCO)Cc1cccc(C)c1O ZINC000862387290 589207630 /nfs/dbraw/zinc/20/76/30/589207630.db2.gz JLQFEVZIVINAPQ-GFCCVEGCSA-N 1 1 237.343 2.293 20 10 BECDMO CCc1cccc(C[NH+]2CC3(C2)CCCO3)c1O ZINC000862484390 589217098 /nfs/dbraw/zinc/21/70/98/589217098.db2.gz MVOYKJCWAZOAKJ-UHFFFAOYSA-N 1 1 247.338 2.319 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H](C)NC2)c1 ZINC000863545808 589297682 /nfs/dbraw/zinc/29/76/82/589297682.db2.gz HRRNOLHBWZJTGP-FRRDWIJNSA-N 1 1 248.370 2.492 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C)NC2)c(O)c1 ZINC000863544936 589297724 /nfs/dbraw/zinc/29/77/24/589297724.db2.gz FMYSYDVWMDTUPA-AGIUHOORSA-N 1 1 248.370 2.492 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H](C)NC2)c1 ZINC000863545810 589298027 /nfs/dbraw/zinc/29/80/27/589298027.db2.gz HRRNOLHBWZJTGP-RWMBFGLXSA-N 1 1 248.370 2.492 20 10 BECDMO Cc1nonc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000872137319 589879060 /nfs/dbraw/zinc/87/90/60/589879060.db2.gz SAHDVFDBDWIUSJ-SECBINFHSA-N 1 1 247.298 2.243 20 10 BECDMO Cc1cccc(CN2CC[NH+](C(C)C)CC2)c1O ZINC000124527242 590046911 /nfs/dbraw/zinc/04/69/11/590046911.db2.gz CFPWWTRAZRKFLM-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO COC[C@@H]1CC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000124599543 590060995 /nfs/dbraw/zinc/06/09/95/590060995.db2.gz YMCCWEDACKYHOA-GFCCVEGCSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1ccc(C[N@@H+](CCO)C2CCCC2)c(O)c1 ZINC000876522858 590207739 /nfs/dbraw/zinc/20/77/39/590207739.db2.gz FCGOQVXLCYIVOA-UHFFFAOYSA-N 1 1 249.354 2.438 20 10 BECDMO CCCC[N@@H+](CCO)Cc1c(C)cccc1O ZINC000876528267 590209292 /nfs/dbraw/zinc/20/92/92/590209292.db2.gz NKWUTOPVQOTSEI-UHFFFAOYSA-N 1 1 237.343 2.295 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)c(O)c1 ZINC000876598047 590220491 /nfs/dbraw/zinc/22/04/91/590220491.db2.gz TXCARNIGCULFQG-NWDGAFQWSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@H](CCO)C2)c(O)c1 ZINC000876693413 590231055 /nfs/dbraw/zinc/23/10/55/590231055.db2.gz DIZUHJCQVOFJFJ-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO Cc1ccc(C[N@H+](C[C@@H](C)O)C(C)C)c(O)c1 ZINC000876697503 590231870 /nfs/dbraw/zinc/23/18/70/590231870.db2.gz USFVQBYCMUBLIO-GFCCVEGCSA-N 1 1 237.343 2.292 20 10 BECDMO Cc1ccc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)c(O)c1 ZINC000876739309 590234758 /nfs/dbraw/zinc/23/47/58/590234758.db2.gz OAHLZAXCTZBZJW-NEPJUHHUSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@H]2C(C)(C)O)c(O)c1 ZINC000877322240 590315999 /nfs/dbraw/zinc/31/59/99/590315999.db2.gz ABVCCRAZLRWDKH-CQSZACIVSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ccc(C[N@H+]2CCO[C@H](C3CC3)C2)c(O)c1 ZINC000877423950 590325614 /nfs/dbraw/zinc/32/56/14/590325614.db2.gz NSEMHCQOJRBEQH-HNNXBMFYSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@H]2CCO)c(O)c1 ZINC000877435117 590326636 /nfs/dbraw/zinc/32/66/36/590326636.db2.gz OEVJJTDFMAJCLM-CYBMUJFWSA-N 1 1 235.327 2.047 20 10 BECDMO CC[C@@]1(O)CC[N@@H+](Cc2c(C)cccc2O)C1 ZINC000877440717 590327727 /nfs/dbraw/zinc/32/77/27/590327727.db2.gz IYNIIRWMUJMUMA-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[N@H+]2CCC23CCOCC3)c(O)c1 ZINC000877479814 590336818 /nfs/dbraw/zinc/33/68/18/590336818.db2.gz YEHZYUFUOYSTBD-UHFFFAOYSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1ccc(C[N@H+](C)CC(C)(C)CO)c(O)c1 ZINC000877560914 590359473 /nfs/dbraw/zinc/35/94/73/590359473.db2.gz DOHIGYGXPPDHJQ-UHFFFAOYSA-N 1 1 237.343 2.151 20 10 BECDMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1c(C)cccc1O ZINC000877562427 590359873 /nfs/dbraw/zinc/35/98/73/590359873.db2.gz ZVUFAAOPNXCOGQ-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000877585676 590368247 /nfs/dbraw/zinc/36/82/47/590368247.db2.gz MGQMCVUVLLWKFL-OCCSQVGLSA-N 1 1 247.338 2.311 20 10 BECDMO Oc1cc(F)c(Cl)cc1C[NH2+]C1CSC1 ZINC000877634273 590379277 /nfs/dbraw/zinc/37/92/77/590379277.db2.gz GRSAXKGRQCBTTN-UHFFFAOYSA-N 1 1 247.722 2.390 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC000877649594 590383803 /nfs/dbraw/zinc/38/38/03/590383803.db2.gz BPDUZYCDTZTTHT-PHIMTYICSA-N 1 1 203.285 2.152 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CC[C@@H](C)[C@H](CO)C1 ZINC000877646883 590383817 /nfs/dbraw/zinc/38/38/17/590383817.db2.gz MNWQTTKHZAANSZ-YPMHNXCESA-N 1 1 249.354 2.151 20 10 BECDMO Oc1cccc2c1C[N@@H+](C[C@@H]1CCCOC1)C2 ZINC000877703027 590396667 /nfs/dbraw/zinc/39/66/67/590396667.db2.gz OVEZEPZZKFEVRP-NSHDSACASA-N 1 1 233.311 2.134 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@@H](O)CC(C)(C)C2)c(O)c1 ZINC000877751681 590415890 /nfs/dbraw/zinc/41/58/90/590415890.db2.gz FXMRSZQCZINUBJ-ZDUSSCGKSA-N 1 1 249.354 2.293 20 10 BECDMO CO[C@H]1C[C@@H](C[N@@H+](C)Cc2ccccc2O)C1 ZINC000878243048 590527898 /nfs/dbraw/zinc/52/78/98/590527898.db2.gz YSZWCHMSWHTZLT-BJHJDKERSA-N 1 1 235.327 2.249 20 10 BECDMO Cc1ccc(O)c(CN(C)C[C@@H]2CCC[N@H+]2C)c1 ZINC000211556185 591194888 /nfs/dbraw/zinc/19/48/88/591194888.db2.gz HXBZYGBABWARIS-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)C[C@@H]2CCCN2C)c1 ZINC000211556185 591194891 /nfs/dbraw/zinc/19/48/91/591194891.db2.gz HXBZYGBABWARIS-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)C[C@@H]2CCCN2C)c1 ZINC000211556185 591194892 /nfs/dbraw/zinc/19/48/92/591194892.db2.gz HXBZYGBABWARIS-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO COCC[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000132703433 591731271 /nfs/dbraw/zinc/73/12/71/591731271.db2.gz ZMHLYOQDFJQIDJ-UHFFFAOYSA-N 1 1 229.707 2.124 20 10 BECDMO COC[C@H](C)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886512684 592240346 /nfs/dbraw/zinc/24/03/46/592240346.db2.gz LATLAVKGPWWYCC-NXEZZACHSA-N 1 1 241.306 2.464 20 10 BECDMO C[C@@H]([NH2+]C[C@@H]1CCOC1)c1c(O)cccc1F ZINC000886510895 592240647 /nfs/dbraw/zinc/24/06/47/592240647.db2.gz CBFAWXPHDJLODM-ZJUUUORDSA-N 1 1 239.290 2.218 20 10 BECDMO CC[C@@H](CCO)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886531152 592248025 /nfs/dbraw/zinc/24/80/25/592248025.db2.gz XHJLNLSZGFRFKG-ZJUUUORDSA-N 1 1 241.306 2.343 20 10 BECDMO COCC1([NH2+][C@H](C)c2c(O)cccc2F)CC1 ZINC000886577113 592266627 /nfs/dbraw/zinc/26/66/27/592266627.db2.gz XHISYZXZGXXXGW-SECBINFHSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@@H]([NH2+][C@@H](C)CN(C)C)c1c(O)cccc1F ZINC000886609350 592274105 /nfs/dbraw/zinc/27/41/05/592274105.db2.gz RAMSLZLOBRGBSV-VHSXEESVSA-N 1 1 240.322 2.132 20 10 BECDMO C[C@@H]([NH2+][C@@H]1CO[C@H](C)C1)c1c(O)cccc1F ZINC000886631547 592283344 /nfs/dbraw/zinc/28/33/44/592283344.db2.gz PRBYOTAIPRYNJX-BBBLOLIVSA-N 1 1 239.290 2.359 20 10 BECDMO C[C@@H]([NH2+]CCOCCF)c1c(O)cccc1F ZINC000886640077 592285980 /nfs/dbraw/zinc/28/59/80/592285980.db2.gz QVNNDVBFWXWHEL-SECBINFHSA-N 1 1 245.269 2.168 20 10 BECDMO C[C@@H]1CSC[C@@H]1[NH2+]Cc1cccc(F)c1O ZINC000309761892 632667709 /nfs/dbraw/zinc/66/77/09/632667709.db2.gz IVRDSOLDBHICMB-KCJUWKMLSA-N 1 1 241.331 2.372 20 10 BECDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000179304706 632689870 /nfs/dbraw/zinc/68/98/70/632689870.db2.gz XJESTMOXHROIIZ-UHFFFAOYSA-N 1 1 246.354 2.117 20 10 BECDMO CCn1cc(C[N@@H+](C)Cc2ccccc2O)cn1 ZINC000091956592 632708221 /nfs/dbraw/zinc/70/82/21/632708221.db2.gz IHFWCKZWXLRYFQ-UHFFFAOYSA-N 1 1 245.326 2.241 20 10 BECDMO Cc1cc(C)c(O)c(C[N@@H+]2CCOC[C@H]2C)c1 ZINC000163979570 633068227 /nfs/dbraw/zinc/06/82/27/633068227.db2.gz BNTAYWWAJXXNHW-GFCCVEGCSA-N 1 1 235.327 2.230 20 10 BECDMO C[C@@H]([NH2+]CC1(O)CCC1)c1ccc(F)cc1O ZINC000168762490 633147899 /nfs/dbraw/zinc/14/78/99/633147899.db2.gz WJPASLGUQGDNBC-SECBINFHSA-N 1 1 239.290 2.097 20 10 BECDMO CO[C@@H](C)C[N@@H+](C)Cc1cc(C)ccc1O ZINC000304662763 635947784 /nfs/dbraw/zinc/94/77/84/635947784.db2.gz WIUSUOJOKBFOJU-NSHDSACASA-N 1 1 223.316 2.167 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](CO)CC2)c1 ZINC000294209162 633755888 /nfs/dbraw/zinc/75/58/88/633755888.db2.gz YEKMUQPJCBLYBR-CYBMUJFWSA-N 1 1 249.354 2.295 20 10 BECDMO C[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(N(C)C)cc1 ZINC000041015289 636950795 /nfs/dbraw/zinc/95/07/95/636950795.db2.gz YCPYOZKBKYWEKG-NSHDSACASA-N 1 1 244.342 2.327 20 10 BECDMO C[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(N(C)C)cc1 ZINC000041015292 636951094 /nfs/dbraw/zinc/95/10/94/636951094.db2.gz YCPYOZKBKYWEKG-LLVKDONJSA-N 1 1 244.342 2.327 20 10 BECDMO CC(C)[N@H+]1CCC[C@@H]1C(=O)Nc1ccc(N)cc1 ZINC000911659851 639693301 /nfs/dbraw/zinc/69/33/01/639693301.db2.gz FUOWLYWRGZXKIC-CYBMUJFWSA-N 1 1 247.342 2.080 20 10 BECDMO C[C@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccccc1O ZINC000044534650 640402322 /nfs/dbraw/zinc/40/23/22/640402322.db2.gz GBFBEJFNKLDXOT-QWHCGFSZSA-N 1 1 248.370 2.385 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](C)[C@H]2CN)c1 ZINC000227191394 640817519 /nfs/dbraw/zinc/81/75/19/640817519.db2.gz QGVBZLYWLAAQBM-GXTWGEPZSA-N 1 1 248.370 2.260 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](C)[C@H]2CN)c1 ZINC000227191389 640817975 /nfs/dbraw/zinc/81/79/75/640817975.db2.gz QGVBZLYWLAAQBM-TZMCWYRMSA-N 1 1 248.370 2.260 20 10 BECDMO C[C@H]([NH2+]Cc1ccon1)c1ccccc1O ZINC000088052787 641281033 /nfs/dbraw/zinc/28/10/33/641281033.db2.gz OITIHMFTXIAZRQ-VIFPVBQESA-N 1 1 218.256 2.231 20 10 BECDMO CCO[C@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000155487317 641574276 /nfs/dbraw/zinc/57/42/76/641574276.db2.gz GJNZFOPKZPUQRZ-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1cc(C[NH2+]Cc2ccc(N(C)C)cc2)no1 ZINC000044296605 641595183 /nfs/dbraw/zinc/59/51/83/641595183.db2.gz KUPKYPQXHTYXMO-UHFFFAOYSA-N 1 1 245.326 2.339 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)C[C@@H]2CCOC2)cc1 ZINC000047706996 641658333 /nfs/dbraw/zinc/65/83/33/641658333.db2.gz UEXGCSIJYHSHFJ-AWEZNQCLSA-N 1 1 248.370 2.221 20 10 BECDMO COCC[N@@H+](C)Cc1cc2c(cc1O)CCCC2 ZINC000159948948 641706359 /nfs/dbraw/zinc/70/63/59/641706359.db2.gz KIZYPLFGPSPOSY-UHFFFAOYSA-N 1 1 249.354 2.349 20 10 BECDMO CC[C@H]1COCC[N@@H+]1Cc1cc(F)ccc1O ZINC000179943132 642759158 /nfs/dbraw/zinc/75/91/58/642759158.db2.gz XHNYSYRYKVMZRD-LBPRGKRZSA-N 1 1 239.290 2.142 20 10 BECDMO CC[C@H]1COCC[N@H+]1Cc1cc(F)ccc1O ZINC000179943132 642759170 /nfs/dbraw/zinc/75/91/70/642759170.db2.gz XHNYSYRYKVMZRD-LBPRGKRZSA-N 1 1 239.290 2.142 20 10 BECDMO C[C@@]1(O)CC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000180190274 642777584 /nfs/dbraw/zinc/77/75/84/642777584.db2.gz LHNIXFYWJOWYMD-GFCCVEGCSA-N 1 1 241.718 2.002 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](C)[C@@H]2CN)c1 ZINC000070175264 642987188 /nfs/dbraw/zinc/98/71/88/642987188.db2.gz QGVBZLYWLAAQBM-OCCSQVGLSA-N 1 1 248.370 2.260 20 10 BECDMO CC(C)[C@H]1CN(C)CC[N@H+]1Cc1ccccc1O ZINC000184739467 643232388 /nfs/dbraw/zinc/23/23/88/643232388.db2.gz HKHJQFUQIQNHHQ-CQSZACIVSA-N 1 1 248.370 2.164 20 10 BECDMO C[N@@H+](CC(=O)Nc1ccc(N)cc1)CC(C)(C)C ZINC000045064457 643551164 /nfs/dbraw/zinc/55/11/64/643551164.db2.gz UOKCWQJFOLDAPE-UHFFFAOYSA-N 1 1 249.358 2.185 20 10 BECDMO Oc1ccc(Cl)cc1C[NH2+]Cc1ccon1 ZINC000086452735 644138371 /nfs/dbraw/zinc/13/83/71/644138371.db2.gz NFZDNPVOCQKBED-UHFFFAOYSA-N 1 1 238.674 2.323 20 10 BECDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000192597133 644167517 /nfs/dbraw/zinc/16/75/17/644167517.db2.gz BPIPLCXUXVQTQK-LBPRGKRZSA-N 1 1 235.327 2.230 20 10 BECDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@H](F)C1 ZINC000840104597 644866272 /nfs/dbraw/zinc/86/62/72/644866272.db2.gz UTWYYUWNAOFEAZ-LLVKDONJSA-N 1 1 246.285 2.484 20 10 BECDMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc(C)ccc1O ZINC000824636614 645056438 /nfs/dbraw/zinc/05/64/38/645056438.db2.gz RWMSNHSHTJOTLC-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1c([O-])cccc1Cl ZINC000843129116 645266701 /nfs/dbraw/zinc/26/67/01/645266701.db2.gz MKEAGPQHWACYIY-IUCAKERBSA-N 1 1 242.750 2.261 20 10 BECDMO CC[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000708398542 712192690 /nfs/dbraw/zinc/19/26/90/712192690.db2.gz GSGURWZMYNATGR-UHFFFAOYSA-N 1 1 201.216 2.122 20 10 BECDMO CC[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000708398542 712192691 /nfs/dbraw/zinc/19/26/91/712192691.db2.gz GSGURWZMYNATGR-UHFFFAOYSA-N 1 1 201.216 2.122 20 10 BECDMO C[C@@H]1COCCC[N@H+]1Cc1cc(F)ccc1O ZINC000398907369 710911048 /nfs/dbraw/zinc/91/10/48/710911048.db2.gz GMVIYHYGCVJTRI-SNVBAGLBSA-N 1 1 239.290 2.142 20 10 BECDMO Cc1ccc(O)c(C[NH2+][C@@H](C)C(F)F)c1 ZINC000389964850 711100660 /nfs/dbraw/zinc/10/06/60/711100660.db2.gz LAXBANSIJSYMSJ-QMMMGPOBSA-N 1 1 215.243 2.444 20 10 BECDMO Cc1nnc(C[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000391774477 711140665 /nfs/dbraw/zinc/14/06/65/711140665.db2.gz AYPXUKDDNWGYHP-QMMMGPOBSA-N 1 1 249.339 2.403 20 10 BECDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2cocn2)c1 ZINC000397950836 711397849 /nfs/dbraw/zinc/39/78/49/711397849.db2.gz ZMPQGAZGFFHTBV-VIFPVBQESA-N 1 1 248.282 2.240 20 10 BECDMO C[C@H]1COCCC[N@H+]1Cc1ccccc1O ZINC000398870607 711416313 /nfs/dbraw/zinc/41/63/13/711416313.db2.gz PHBVPSWCFLKYAK-NSHDSACASA-N 1 1 221.300 2.003 20 10 BECDMO C[C@@H]1C[C@H]([N@@H+](C)Cc2ccccc2O)CCO1 ZINC000721437581 711476313 /nfs/dbraw/zinc/47/63/13/711476313.db2.gz NLAHGSRKXRGUAH-DGCLKSJQSA-N 1 1 235.327 2.392 20 10 BECDMO COCC[N@@H+](C)Cc1c(O)ccc2ccncc21 ZINC000921048631 711882211 /nfs/dbraw/zinc/88/22/11/711882211.db2.gz PPKDPDDASIWPQU-UHFFFAOYSA-N 1 1 246.310 2.019 20 10 BECDMO c1cc(C[NH2+]Cc2ccc3c(c2)CCCO3)n[nH]1 ZINC000921703792 711936037 /nfs/dbraw/zinc/93/60/37/711936037.db2.gz ALFAAWZJYWYQJP-UHFFFAOYSA-N 1 1 243.310 2.025 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000700640560 712001303 /nfs/dbraw/zinc/00/13/03/712001303.db2.gz OJGTULFRMMYFCY-OLZOCXBDSA-N 1 1 233.311 2.003 20 10 BECDMO C[C@@H]1[N@@H+](Cc2ccccc2O)CCOC1(C)C ZINC000707691214 712176280 /nfs/dbraw/zinc/17/62/80/712176280.db2.gz PFRDICVPVFRBER-NSHDSACASA-N 1 1 235.327 2.392 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H](CF)C1 ZINC000711497349 712306954 /nfs/dbraw/zinc/30/69/54/712306954.db2.gz LWRUYKCSBNRBDB-SNVBAGLBSA-N 1 1 209.264 2.184 20 10 BECDMO CC[N@@H+](Cc1ccccc1O)[C@@H]1CCOC1 ZINC000390622219 712421858 /nfs/dbraw/zinc/42/18/58/712421858.db2.gz GCMLDAILGDROJP-GFCCVEGCSA-N 1 1 221.300 2.003 20 10 BECDMO Oc1ccccc1CN[C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000036996577 712528893 /nfs/dbraw/zinc/52/88/93/712528893.db2.gz AWHVUWOKNHGRFW-UONOGXRCSA-N 1 1 246.354 2.109 20 10 BECDMO Oc1ccccc1CN[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000036996577 712528894 /nfs/dbraw/zinc/52/88/94/712528894.db2.gz AWHVUWOKNHGRFW-UONOGXRCSA-N 1 1 246.354 2.109 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)CCCF)c1 ZINC000716630362 712568209 /nfs/dbraw/zinc/56/82/09/712568209.db2.gz RTSSHNPCLLYYBM-UHFFFAOYSA-N 1 1 211.280 2.492 20 10 BECDMO C[N@H+](Cc1cc(O)ccc1O)CC1CCC1 ZINC001141159484 960895360 /nfs/dbraw/zinc/89/53/60/960895360.db2.gz HIYVSDFNWIWMQU-UHFFFAOYSA-N 1 1 221.300 2.330 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC[C@@H](F)C1 ZINC000689887734 963880897 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/nfs/dbraw/zinc/72/51/17/979725117.db2.gz XGTNCSDJEMTGRN-LBPRGKRZSA-N 1 1 223.291 2.498 20 10 BECDMO Oc1cccc(OC(F)(F)F)c1C[NH+]1CCC1 ZINC001237120219 979820586 /nfs/dbraw/zinc/82/05/86/979820586.db2.gz OHZIKNBKAUIRRN-UHFFFAOYSA-N 1 1 247.216 2.497 20 10 BECDMO C[NH+](C)Cc1cc(F)c(Cl)cc1O ZINC001237940134 980114506 /nfs/dbraw/zinc/11/45/06/980114506.db2.gz BRDPTPOEUCSXRJ-UHFFFAOYSA-N 1 1 203.644 2.246 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](CO)CC[C@H]2C)c1 ZINC000305740646 970787578 /nfs/dbraw/zinc/78/75/78/970787578.db2.gz CYOORYOUXQCRMA-CHWSQXEVSA-N 1 1 249.354 2.293 20 10 BECDMO C[N@@H+](CCCn1cccn1)Cc1ccccc1O ZINC001208079884 1169502168 /nfs/dbraw/zinc/50/21/68/1169502168.db2.gz YBZODGHVAPYIIT-UHFFFAOYSA-N 1 1 245.326 2.111 20 10 BECDMO C[N@@H+](Cc1ccccc1O)[C@H]1COC(C)(C)C1 ZINC000396497433 956886161 /nfs/dbraw/zinc/88/61/61/956886161.db2.gz HJTZRQBSXQVGBR-GFCCVEGCSA-N 1 1 235.327 2.392 20 10 BECDMO CC[N@@H+](CCCOC)Cc1ccccc1O ZINC001209053807 957306783 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960462132 /nfs/dbraw/zinc/46/21/32/960462132.db2.gz YBKXZAIVSRCHDS-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@](C)(O)[C@H](C)C2)c1 ZINC001140619364 960462368 /nfs/dbraw/zinc/46/23/68/960462368.db2.gz BVTRCICTEVFFHX-DOMZBBRYSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](C)[C@@H]2CO)c1 ZINC001140617161 960462498 /nfs/dbraw/zinc/46/24/98/960462498.db2.gz HWINGZXDDLXFEV-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](O)C[C@@H]2C)c1 ZINC001140623378 960464448 /nfs/dbraw/zinc/46/44/48/960464448.db2.gz OZPODOWNJDZUNX-WCQYABFASA-N 1 1 235.327 2.046 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@H](O)C2)c1 ZINC001140619787 960464835 /nfs/dbraw/zinc/46/48/35/960464835.db2.gz ORXWHOWPXIONHM-ZDUSSCGKSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@]23CCOC3)c1 ZINC001140623150 960464910 /nfs/dbraw/zinc/46/49/10/960464910.db2.gz HDBSEXGIUWIUQT-CQSZACIVSA-N 1 1 233.311 2.065 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](O)C[C@H]2C)c1 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985404744 /nfs/dbraw/zinc/40/47/44/985404744.db2.gz PUZWQXPQYYPFPI-UHFFFAOYSA-N 1 1 235.327 2.177 20 10 BECDMO CCc1cccc(C[N@H+]2CCOC[C@@H]2C)c1O ZINC000692110398 985406082 /nfs/dbraw/zinc/40/60/82/985406082.db2.gz UNHINXUNXRYXSE-NSHDSACASA-N 1 1 235.327 2.175 20 10 BECDMO CCc1cccc(C[N@@H+](C)C[C@H]2CCOC2)c1O ZINC000692116625 985407599 /nfs/dbraw/zinc/40/75/99/985407599.db2.gz UVNHFWMSJDAYIS-GFCCVEGCSA-N 1 1 249.354 2.423 20 10 BECDMO CCc1cccc(C[N@@H+](C)C[C@H](C)OC)c1O ZINC000692108855 985409027 /nfs/dbraw/zinc/40/90/27/985409027.db2.gz LHKAVFDDTOJNHJ-NSHDSACASA-N 1 1 237.343 2.421 20 10 BECDMO Cn1ccc2c1ccnc2C1=C[NH2+]CCC1 ZINC001243947572 985623573 /nfs/dbraw/zinc/62/35/73/985623573.db2.gz LUFQYELMDYIIRY-UHFFFAOYSA-N 1 1 213.284 2.298 20 10 BECDMO C[C@@]12CSC[C@@H]1C[N@@H+](Cc1ccc(N)cc1)C2 ZINC001579475757 985991959 /nfs/dbraw/zinc/99/19/59/985991959.db2.gz QHGYPVNJNKNVPP-GXTWGEPZSA-N 1 1 248.395 2.454 20 10 BECDMO Oc1cccc(F)c1C[N@@H+]1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001137838479 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/nfs/dbraw/zinc/22/77/07/991227707.db2.gz KXLYULUIVGIYIB-UHFFFAOYSA-N 1 1 234.274 2.160 20 10 BECDMO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](CO)[C@H]2C)c1O ZINC001140178246 991553062 /nfs/dbraw/zinc/55/30/62/991553062.db2.gz FFWFLXQFQGQURN-OLZOCXBDSA-N 1 1 249.354 2.212 20 10 BECDMO C[C@]1(O)CC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140462273 991644350 /nfs/dbraw/zinc/64/43/50/991644350.db2.gz CYLCKCWBHVXVIA-LBPRGKRZSA-N 1 1 241.718 2.002 20 10 BECDMO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H](O)C1 ZINC001140460989 991644748 /nfs/dbraw/zinc/64/47/48/991644748.db2.gz AJPAJJOHOFKPMM-NSHDSACASA-N 1 1 241.718 2.002 20 10 BECDMO CC(C)(C[NH3+])C[NH2+]Cc1cc(Cl)ccc1[O-] ZINC001575314865 993011769 /nfs/dbraw/zinc/01/17/69/993011769.db2.gz AIQHMWMJYKQDKI-UHFFFAOYSA-N 1 1 242.750 2.120 20 10 BECDMO CC[N@H+]1C[C@@H](C)N(Cc2ccc(N)cc2)C[C@@H]1C ZINC001336116487 994955258 /nfs/dbraw/zinc/95/52/58/994955258.db2.gz FFZNMKDNLIXNQP-QWHCGFSZSA-N 1 1 247.386 2.183 20 10 BECDMO CCN1C[C@@H](C)[N@H+](Cc2ccc(N)cc2)C[C@@H]1C ZINC001336116487 994955269 /nfs/dbraw/zinc/95/52/69/994955269.db2.gz FFZNMKDNLIXNQP-QWHCGFSZSA-N 1 1 247.386 2.183 20 10 BECDMO CCN1C[C@@H](C)[N@@H+](Cc2ccc(N)cc2)C[C@@H]1C ZINC001336116487 994955280 /nfs/dbraw/zinc/95/52/80/994955280.db2.gz FFZNMKDNLIXNQP-QWHCGFSZSA-N 1 1 247.386 2.183 20 10 BECDMO CC[N@H+]1C[C@@H](C)N(Cc2ccc(N)cc2)C[C@H]1C ZINC001336116470 994955464 /nfs/dbraw/zinc/95/54/64/994955464.db2.gz FFZNMKDNLIXNQP-CHWSQXEVSA-N 1 1 247.386 2.183 20 10 BECDMO CCN1C[C@@H](C)[N@H+](Cc2ccc(N)cc2)C[C@H]1C ZINC001336116470 994955482 /nfs/dbraw/zinc/95/54/82/994955482.db2.gz FFZNMKDNLIXNQP-CHWSQXEVSA-N 1 1 247.386 2.183 20 10 BECDMO CCN1C[C@@H](C)[N@@H+](Cc2ccc(N)cc2)C[C@H]1C ZINC001336116470 994955493 /nfs/dbraw/zinc/95/54/93/994955493.db2.gz FFZNMKDNLIXNQP-CHWSQXEVSA-N 1 1 247.386 2.183 20 10 BECDMO Nc1ccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)cc1 ZINC000041079486 1171166946 /nfs/dbraw/zinc/16/69/46/1171166946.db2.gz AQMVJAZMUFMUCN-ZDUSSCGKSA-N 1 1 246.354 2.270 20 10 BECDMO C[C@H](CCN(C)C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000049551680 343602058 /nfs/dbraw/zinc/60/20/58/343602058.db2.gz VWQKUXMEXFTSCH-CYBMUJFWSA-N 1 1 249.402 2.182 20 10 BECDMO Cc1cccc(C[N@@H+](CC(C)(C)O)C2CC2)c1O ZINC000189941015 179071362 /nfs/dbraw/zinc/07/13/62/179071362.db2.gz NJWZOAUGLCBWFU-UHFFFAOYSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cccc(C[N@@H+](CCO)C2CCC2)c1O ZINC000276013105 179072316 /nfs/dbraw/zinc/07/23/16/179072316.db2.gz OSBYZSOCKZZROX-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@H]2C[C@@H](C)O)c1O ZINC000180308427 179077199 /nfs/dbraw/zinc/07/71/99/179077199.db2.gz ILMDUHATONBAQA-OCCSQVGLSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cccc(C[NH2+][C@H](C)CCN(C)C)c1O ZINC000124755550 179100242 /nfs/dbraw/zinc/10/02/42/179100242.db2.gz BZVMZXUAUPAXSW-GFCCVEGCSA-N 1 1 236.359 2.130 20 10 BECDMO CC[N@H+](Cc1ccccc1O)C[C@@H](C)OC ZINC000291150549 364770302 /nfs/dbraw/zinc/77/03/02/364770302.db2.gz ZJPZNXWOYXAKMF-LLVKDONJSA-N 1 1 223.316 2.249 20 10 BECDMO CCC[N@H+](CC)CCNCc1ccccc1O ZINC000223227691 169123591 /nfs/dbraw/zinc/12/35/91/169123591.db2.gz BUZNSBCBNXEGCV-UHFFFAOYSA-N 1 1 236.359 2.214 20 10 BECDMO CCC[N@@H+](CC)CCNCc1ccccc1O ZINC000223227691 169123592 /nfs/dbraw/zinc/12/35/92/169123592.db2.gz BUZNSBCBNXEGCV-UHFFFAOYSA-N 1 1 236.359 2.214 20 10 BECDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCF ZINC000294674878 183258795 /nfs/dbraw/zinc/25/87/95/183258795.db2.gz MJBMPUSGQSQFIH-UHFFFAOYSA-N 1 1 221.634 2.244 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000375303690 183301552 /nfs/dbraw/zinc/30/15/52/183301552.db2.gz PLJHAPRPQJLJTA-OAHLLOKOSA-N 1 1 247.338 2.395 20 10 BECDMO Oc1ccccc1C[N@H+]1CCO[C@H]2CCC[C@H]21 ZINC000228143693 183301570 /nfs/dbraw/zinc/30/15/70/183301570.db2.gz RUDZBBYUMQICIX-OCCSQVGLSA-N 1 1 233.311 2.146 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000245605519 183301641 /nfs/dbraw/zinc/30/16/41/183301641.db2.gz MEDLBVSQORUUKF-DZGCQCFKSA-N 1 1 247.338 2.393 20 10 BECDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCOC1)C1CC1 ZINC000179556750 183302583 /nfs/dbraw/zinc/30/25/83/183302583.db2.gz ZYGFIGITLLNMLF-LBPRGKRZSA-N 1 1 247.338 2.393 20 10 BECDMO Oc1ccccc1C[N@H+]1CCOCC2(CCC2)C1 ZINC000363916059 183302699 /nfs/dbraw/zinc/30/26/99/183302699.db2.gz DGWWPEMJRFEZHH-UHFFFAOYSA-N 1 1 247.338 2.395 20 10 BECDMO CN(CCC[NH+]1CCCC1)Cc1ccccc1O ZINC000119947788 384319012 /nfs/dbraw/zinc/31/90/12/384319012.db2.gz MGWAJCPKNXDTTN-UHFFFAOYSA-N 1 1 248.370 2.310 20 10 BECDMO C[C@H](CCCO)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000094942441 384319585 /nfs/dbraw/zinc/31/95/85/384319585.db2.gz LUXINIGDVLLSIL-NXEZZACHSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)CN(C)C ZINC000297388549 384279569 /nfs/dbraw/zinc/27/95/69/384279569.db2.gz RQZXUNOIYIQYNT-YPMHNXCESA-N 1 1 248.370 2.167 20 10 BECDMO C[C@H](CCO)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000097439701 384520078 /nfs/dbraw/zinc/52/00/78/384520078.db2.gz ANJCELGHYRNSGT-NXEZZACHSA-N 1 1 241.306 2.200 20 10 BECDMO COC[C@@H](C)[N@@H+](C)Cc1cccc(C)c1O ZINC000162814493 384693164 /nfs/dbraw/zinc/69/31/64/384693164.db2.gz HOCZHUMEKZUMFY-LLVKDONJSA-N 1 1 223.316 2.167 20 10 BECDMO COC[C@H](C)[N@@H+](C)Cc1cccc(C)c1O ZINC000162814381 384693847 /nfs/dbraw/zinc/69/38/47/384693847.db2.gz HOCZHUMEKZUMFY-NSHDSACASA-N 1 1 223.316 2.167 20 10 BECDMO CC[C@](C)(O)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000087011630 385063295 /nfs/dbraw/zinc/06/32/95/385063295.db2.gz AXTWEHYLPVKTKP-RNCFNFMXSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@H]([NH2+]C[C@H]1CCCO1)c1ccc(F)cc1O ZINC000062744940 385183924 /nfs/dbraw/zinc/18/39/24/385183924.db2.gz CTJSTKHOGADAFO-GXSJLCMTSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@H]([NH2+]C1CCOCC1)c1ccc(F)cc1O ZINC000062745948 385186520 /nfs/dbraw/zinc/18/65/20/385186520.db2.gz HSEDBNQDCUIDNB-VIFPVBQESA-N 1 1 239.290 2.361 20 10 BECDMO CCN(C)CC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062748477 385187366 /nfs/dbraw/zinc/18/73/66/385187366.db2.gz LDCFJWHGECCVMI-JTQLQIEISA-N 1 1 240.322 2.134 20 10 BECDMO C[C@@H]([NH2+]C1CCOCC1)c1ccc(F)cc1O ZINC000062745949 385187698 /nfs/dbraw/zinc/18/76/98/385187698.db2.gz HSEDBNQDCUIDNB-SECBINFHSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@@H]([NH2+]C[C@@H]1CCOC1)c1ccc(F)cc1O ZINC000062747673 385188155 /nfs/dbraw/zinc/18/81/55/385188155.db2.gz URZNJPFJDJVXTC-ZJUUUORDSA-N 1 1 239.290 2.218 20 10 BECDMO CO[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000191205556 385293287 /nfs/dbraw/zinc/29/32/87/385293287.db2.gz KNLXFFVCVJGPRN-IUCAKERBSA-N 1 1 227.279 2.217 20 10 BECDMO C[C@@H](CN(C)C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168708501 385382512 /nfs/dbraw/zinc/38/25/12/385382512.db2.gz HWYMVHLKPPMZAN-UWVGGRQHSA-N 1 1 240.322 2.132 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](CN(C)C)C2)c1 ZINC000179637284 385480394 /nfs/dbraw/zinc/48/03/94/385480394.db2.gz MJYKZOGGHFCPGE-CYBMUJFWSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](CN(C)C)C2)c1 ZINC000179637284 385480396 /nfs/dbraw/zinc/48/03/96/385480396.db2.gz MJYKZOGGHFCPGE-CYBMUJFWSA-N 1 1 248.370 2.084 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000361050126 385527160 /nfs/dbraw/zinc/52/71/60/385527160.db2.gz FUQBVQJKWDANNP-OCCSQVGLSA-N 1 1 247.338 2.251 20 10 BECDMO C[N@H+](Cc1cccc(F)c1O)[C@H]1CCSC1 ZINC000272301710 385892778 /nfs/dbraw/zinc/89/27/78/385892778.db2.gz PUOZWUWXJOSTQY-JTQLQIEISA-N 1 1 241.331 2.469 20 10 BECDMO C[N@@H+](Cc1cccc(F)c1O)[C@H]1CCSC1 ZINC000272301710 385892779 /nfs/dbraw/zinc/89/27/79/385892779.db2.gz PUOZWUWXJOSTQY-JTQLQIEISA-N 1 1 241.331 2.469 20 10 BECDMO CS[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000294957409 385929120 /nfs/dbraw/zinc/92/91/20/385929120.db2.gz DMZPUIDEPHGIKE-LLVKDONJSA-N 1 1 241.331 2.469 20 10 BECDMO CC[C@H]([NH2+]CC(C)(C)O)c1ccc(F)cc1O ZINC000286057738 385991739 /nfs/dbraw/zinc/99/17/39/385991739.db2.gz LGNBCDHEQNHGTM-NSHDSACASA-N 1 1 241.306 2.343 20 10 BECDMO CO[C@@H](C)C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000272781261 385933209 /nfs/dbraw/zinc/93/32/09/385933209.db2.gz HQLZUYCTZZEIHM-LBPRGKRZSA-N 1 1 236.359 2.219 20 10 BECDMO CC[C@H](CO)[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000285837265 385970293 /nfs/dbraw/zinc/97/02/93/385970293.db2.gz XETGJVAHULYNJV-ZYHUDNBSSA-N 1 1 241.306 2.343 20 10 BECDMO C[N@@H+](CCCCO)Cc1c(O)cccc1Cl ZINC000276648159 386360508 /nfs/dbraw/zinc/36/05/08/386360508.db2.gz LXCUBLFTQHXRSX-UHFFFAOYSA-N 1 1 243.734 2.250 20 10 BECDMO C[C@@H]([NH2+]Cc1cccc(F)c1O)[C@@H]1CCOC1 ZINC000166137010 386474144 /nfs/dbraw/zinc/47/41/44/386474144.db2.gz GNBPFTMQXLZCFB-MWLCHTKSSA-N 1 1 239.290 2.046 20 10 BECDMO CC[C@H]1CC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000291816020 386587128 /nfs/dbraw/zinc/58/71/28/386587128.db2.gz DMLVVBDUAKMFLE-JTQLQIEISA-N 1 1 235.283 2.105 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2cccc(C)c2O)CCO1 ZINC000124525158 386634193 /nfs/dbraw/zinc/63/41/93/386634193.db2.gz SPDQYOSRJADPSJ-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)OC[C@H]2C)c1 ZINC000245921527 386611548 /nfs/dbraw/zinc/61/15/48/386611548.db2.gz NWFYHKVFZGLUBI-NEPJUHHUSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1cc(C[N@H+]2CCC[C@H]2CO)ccc1N(C)C ZINC000292945383 386755700 /nfs/dbraw/zinc/75/57/00/386755700.db2.gz BSLLJKYTBRXKBQ-AWEZNQCLSA-N 1 1 248.370 2.018 20 10 BECDMO CO[C@H]1C[N@@H+](Cc2ccccc2O)CC[C@H]1C ZINC000188298613 387268581 /nfs/dbraw/zinc/26/85/81/387268581.db2.gz ZCAROQQQPKBSJS-RISCZKNCSA-N 1 1 235.327 2.249 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@H]3OCC[C@H]3C2)c1 ZINC000373896625 387403828 /nfs/dbraw/zinc/40/38/28/387403828.db2.gz GZLHDVCLYGEUPI-SWLSCSKDSA-N 1 1 247.338 2.311 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@H]1C ZINC000246894409 388655339 /nfs/dbraw/zinc/65/53/39/388655339.db2.gz NEUDUOIUDCEPGY-ZJUUUORDSA-N 1 1 249.310 2.351 20 10 BECDMO CC(C)N1CCC[N@@H+](Cc2ccccc2O)CC1 ZINC000272296096 397977939 /nfs/dbraw/zinc/97/79/39/397977939.db2.gz OXJKLESPWADGFE-UHFFFAOYSA-N 1 1 248.370 2.308 20 10 BECDMO CC(C)[N@@H+]1CCCN(Cc2ccccc2O)CC1 ZINC000272296096 397977945 /nfs/dbraw/zinc/97/79/45/397977945.db2.gz OXJKLESPWADGFE-UHFFFAOYSA-N 1 1 248.370 2.308 20 10 BECDMO CC(C)[N@H+]1CCCN(Cc2ccccc2O)CC1 ZINC000272296096 397977949 /nfs/dbraw/zinc/97/79/49/397977949.db2.gz OXJKLESPWADGFE-UHFFFAOYSA-N 1 1 248.370 2.308 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000179939661 410911817 /nfs/dbraw/zinc/91/18/17/410911817.db2.gz ZQQVWCXVDOEWOG-GFCCVEGCSA-N 1 1 239.290 2.142 20 10 BECDMO CO[C@H]1CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000179939677 410912056 /nfs/dbraw/zinc/91/20/56/410912056.db2.gz ZQQVWCXVDOEWOG-LBPRGKRZSA-N 1 1 239.290 2.142 20 10 BECDMO CC[C@@]1(CO)CCC[N@H+]1Cc1cccc(C)c1O ZINC000191957462 171212921 /nfs/dbraw/zinc/21/29/21/171212921.db2.gz OEXYPPBFGPSKTP-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO COCC(C)(C)[N@@H+](C)Cc1cc(F)ccc1O ZINC000292857527 174077435 /nfs/dbraw/zinc/07/74/35/174077435.db2.gz UWYPQCCVBKYNGM-UHFFFAOYSA-N 1 1 241.306 2.388 20 10 BECDMO CO[C@@H](C)CC[NH2+]Cc1cccc(F)c1O ZINC000272531036 174690523 /nfs/dbraw/zinc/69/05/23/174690523.db2.gz ZOHIHDOQTGKCDV-VIFPVBQESA-N 1 1 227.279 2.046 20 10 BECDMO COc1cccc(C[N@H+]2C[C@H](C)[C@H](C)C2)c1O ZINC000211649879 175260750 /nfs/dbraw/zinc/26/07/50/175260750.db2.gz BXXKHHJMXVABSY-PHIMTYICSA-N 1 1 235.327 2.489 20 10 BECDMO C[C@@H]1COCC[C@@H]1[NH2+]Cc1cccc(F)c1O ZINC000277660901 176341796 /nfs/dbraw/zinc/34/17/96/176341796.db2.gz ZTMKLWWHDFOHHY-SKDRFNHKSA-N 1 1 239.290 2.046 20 10 BECDMO C[C@H]([NH2+]C[C@@H]1CCOC1)c1ccc(F)cc1O ZINC000062747672 176862665 /nfs/dbraw/zinc/86/26/65/176862665.db2.gz URZNJPFJDJVXTC-UWVGGRQHSA-N 1 1 239.290 2.218 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@H]1C ZINC000246894378 177163593 /nfs/dbraw/zinc/16/35/93/177163593.db2.gz NEUDUOIUDCEPGY-UWVGGRQHSA-N 1 1 249.310 2.351 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CCCO1 ZINC000179393466 177263404 /nfs/dbraw/zinc/26/34/04/177263404.db2.gz UWZMHIHWIXPRDL-ZDUSSCGKSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(CC)[C@H]1CC[N@H+](Cc2ccccc2O)C1 ZINC000134055188 488164818 /nfs/dbraw/zinc/16/48/18/488164818.db2.gz XNOHNWVIDMAMHI-AWEZNQCLSA-N 1 1 248.370 2.308 20 10 BECDMO CCN(CC)[C@H]1CC[N@@H+](Cc2ccccc2O)C1 ZINC000134055188 488164826 /nfs/dbraw/zinc/16/48/26/488164826.db2.gz XNOHNWVIDMAMHI-AWEZNQCLSA-N 1 1 248.370 2.308 20 10 BECDMO Cc1cc(O)c(C[N@H+](C[C@H](C)O)C2CC2)cc1C ZINC000848929109 582815497 /nfs/dbraw/zinc/81/54/97/582815497.db2.gz STFUGQZFGKJPBM-LBPRGKRZSA-N 1 1 249.354 2.354 20 10 BECDMO Cc1cccc(C[N@@H+]2CC[C@@H](C)[C@@H](CO)C2)c1O ZINC000857060523 588884719 /nfs/dbraw/zinc/88/47/19/588884719.db2.gz ASTGYYBLIJAXSN-BXUZGUMPSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(C[N@H+](C)[C@@H]2CCCC[C@H]2O)c1O ZINC000895437192 583674753 /nfs/dbraw/zinc/67/47/53/583674753.db2.gz IJZCVYYACNGGAB-ZIAGYGMSSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ccc(C[NH+]2CC(OC(C)C)C2)c(O)c1 ZINC000895956832 583752435 /nfs/dbraw/zinc/75/24/35/583752435.db2.gz VXEVLAQOJFATMV-UHFFFAOYSA-N 1 1 235.327 2.310 20 10 BECDMO C[C@@H]1CC[C@H]1[NH2+]Cc1c(O)cccc1F ZINC000896636887 583818953 /nfs/dbraw/zinc/81/89/53/583818953.db2.gz IJFZJJPOCSBGNZ-LDYMZIIASA-N 1 1 209.264 2.419 20 10 BECDMO C[C@@H]1COCC[C@@H]1[NH2+]Cc1c(O)cccc1F ZINC000896636376 583819326 /nfs/dbraw/zinc/81/93/26/583819326.db2.gz CCCVCQUKEHKJFA-SKDRFNHKSA-N 1 1 239.290 2.046 20 10 BECDMO Oc1cccc(F)c1C[NH2+]C[C@@H]1CCCOC1 ZINC000896637951 583819668 /nfs/dbraw/zinc/81/96/68/583819668.db2.gz SLAUPMWKPYCONS-JTQLQIEISA-N 1 1 239.290 2.048 20 10 BECDMO C[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2F)[C@H](C)O1 ZINC000896639429 583819937 /nfs/dbraw/zinc/81/99/37/583819937.db2.gz UHDGGOXLLBMPNB-PTRXPTGYSA-N 1 1 239.290 2.187 20 10 BECDMO CC[C@H]1C[C@@H]([NH2+]Cc2c(O)cccc2F)CO1 ZINC000896638042 583820052 /nfs/dbraw/zinc/82/00/52/583820052.db2.gz NRGSUMBCHXADSZ-ZJUUUORDSA-N 1 1 239.290 2.188 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)Cc2cc[nH]n2)cc1C ZINC000732671117 584939782 /nfs/dbraw/zinc/93/97/82/584939782.db2.gz SYLUOHFMDLEOLF-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)Cc2cc[nH]n2)cc1C ZINC000732671117 584939783 /nfs/dbraw/zinc/93/97/83/584939783.db2.gz SYLUOHFMDLEOLF-UHFFFAOYSA-N 1 1 245.326 2.364 20 10 BECDMO CC[C@@H](N)C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000817980066 584994607 /nfs/dbraw/zinc/99/46/07/584994607.db2.gz RACLEPHSZDDBHW-DGCLKSJQSA-N 1 1 236.359 2.479 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@@H]3C[C@H]2CS3)c1 ZINC000839191225 585097257 /nfs/dbraw/zinc/09/72/57/585097257.db2.gz GXNFXLSYRRNQRB-RYUDHWBXSA-N 1 1 235.352 2.390 20 10 BECDMO CO[C@@H]1CC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000751939182 585239484 /nfs/dbraw/zinc/23/94/84/585239484.db2.gz JIIAXCDXNFSBPD-CYBMUJFWSA-N 1 1 235.327 2.230 20 10 BECDMO CCOCC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756417234 585319854 /nfs/dbraw/zinc/31/98/54/585319854.db2.gz LSFHBHBZPRLSAV-QMMMGPOBSA-N 1 1 245.269 2.358 20 10 BECDMO C[N@@H+](Cc1c(O)cccc1Cl)C1CC(O)C1 ZINC000761223427 585412365 /nfs/dbraw/zinc/41/23/65/585412365.db2.gz QYBNFPDXRPMHLT-UHFFFAOYSA-N 1 1 241.718 2.001 20 10 BECDMO Cc1cc(C[N@H+](C)Cc2ccccc2O)nn1C ZINC000767901783 585527810 /nfs/dbraw/zinc/52/78/10/585527810.db2.gz XVHWPYGNLOOXNJ-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO Cc1cc(C[N@@H+](C)Cc2ccccc2O)nn1C ZINC000767901783 585527811 /nfs/dbraw/zinc/52/78/11/585527811.db2.gz XVHWPYGNLOOXNJ-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO COc1cccc(O)c1C[N@@H+](C)CC(C)C ZINC000768242966 585534890 /nfs/dbraw/zinc/53/48/90/585534890.db2.gz FEZDFBMXMXCTDU-UHFFFAOYSA-N 1 1 223.316 2.489 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)Cc2cn[nH]c2)c1 ZINC000769425616 585556155 /nfs/dbraw/zinc/55/61/55/585556155.db2.gz QYZLJBPSZGSEKH-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO C[C@@]1(O)CC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000769543271 585559437 /nfs/dbraw/zinc/55/94/37/585559437.db2.gz LSWCSAROSCOBNV-GFCCVEGCSA-N 1 1 241.718 2.002 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2C[C@@H](O)C[C@H]2C)cc1 ZINC000773815918 585644309 /nfs/dbraw/zinc/64/43/09/585644309.db2.gz KEAOCGUKYMLDJG-DOMZBBRYSA-N 1 1 248.370 2.098 20 10 BECDMO COc1cccc(C[N@@H+]2CC=CCC2)c1O ZINC000779159601 585746165 /nfs/dbraw/zinc/74/61/65/585746165.db2.gz NAJUXQCPFSGKQD-UHFFFAOYSA-N 1 1 219.284 2.163 20 10 BECDMO CC[C@@]1(O)CC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000779215550 585747434 /nfs/dbraw/zinc/74/74/34/585747434.db2.gz BMKXHOUUADVIJV-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCC[C@]2(C)CO)cc1C ZINC000789558001 585944002 /nfs/dbraw/zinc/94/40/02/585944002.db2.gz SBJUZERTFLIRJZ-OAHLLOKOSA-N 1 1 249.354 2.356 20 10 BECDMO Cc1cccc(C[N@H+]2CCOCC23CC3)c1O ZINC000802658477 586309219 /nfs/dbraw/zinc/30/92/19/586309219.db2.gz DMMDGPUYKWOMCF-UHFFFAOYSA-N 1 1 233.311 2.065 20 10 BECDMO Oc1c(C[N@@H+]2CC[C@H](O)C2)ccc2ccccc21 ZINC000816488125 586735649 /nfs/dbraw/zinc/73/56/49/586735649.db2.gz JGDFURKKSFCBOG-ZDUSSCGKSA-N 1 1 243.306 2.112 20 10 BECDMO CC[N@@H+](Cc1cc(Cl)ccc1O)[C@@H](C)CO ZINC000816654252 586753455 /nfs/dbraw/zinc/75/34/55/586753455.db2.gz ZLFLAFDXPJGGFD-VIFPVBQESA-N 1 1 243.734 2.248 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCNC2)c(O)c1C ZINC000817942486 586845046 /nfs/dbraw/zinc/84/50/46/586845046.db2.gz ZRSXTPQPXWEVEH-CHWSQXEVSA-N 1 1 248.370 2.412 20 10 BECDMO CC[C@@H](N[C@@H]1CCC[NH2+]C1)c1ccccc1O ZINC000817940140 586845056 /nfs/dbraw/zinc/84/50/56/586845056.db2.gz FXQXHEDRUIEBHX-DGCLKSJQSA-N 1 1 234.343 2.185 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCCNC2)c(O)c1 ZINC000817941535 586845338 /nfs/dbraw/zinc/84/53/38/586845338.db2.gz RFIFEOLQFJOTDR-QWHCGFSZSA-N 1 1 248.370 2.412 20 10 BECDMO CC[C@H](N[C@@H]1CCC[NH2+]C1)c1ccccc1O ZINC000817940142 586845376 /nfs/dbraw/zinc/84/53/76/586845376.db2.gz FXQXHEDRUIEBHX-YPMHNXCESA-N 1 1 234.343 2.185 20 10 BECDMO CC[C@@H](N[C@@H]1CCC[NH2+]C1)c1ccc(C)cc1O ZINC000817941984 586845654 /nfs/dbraw/zinc/84/56/54/586845654.db2.gz VHJKYVLQGTUYHE-TZMCWYRMSA-N 1 1 248.370 2.493 20 10 BECDMO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCCCN1)CC2 ZINC000817949309 586846964 /nfs/dbraw/zinc/84/69/64/586846964.db2.gz IHWKDDHXCYDTGL-QWHCGFSZSA-N 1 1 246.354 2.111 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]CCNC2CC2)c1 ZINC000817952383 586848287 /nfs/dbraw/zinc/84/82/87/586848287.db2.gz FKGJHFHABRACBR-NSHDSACASA-N 1 1 234.343 2.103 20 10 BECDMO C[C@H]([NH3+])CC[NH2+][C@@H](C)c1cc(Cl)ccc1[O-] ZINC000817953632 586848621 /nfs/dbraw/zinc/84/86/21/586848621.db2.gz RAPAQHKVFGAFQM-IUCAKERBSA-N 1 1 242.750 2.434 20 10 BECDMO C[C@@H]([NH2+]CCNC1CC1)c1ccc(N(C)C)cc1 ZINC000817954577 586850234 /nfs/dbraw/zinc/85/02/34/586850234.db2.gz ZEURHTDRJYYVHX-GFCCVEGCSA-N 1 1 247.386 2.155 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](N)C(C)C)c1 ZINC000817958502 586850337 /nfs/dbraw/zinc/85/03/37/586850337.db2.gz KIAIGISKBRTAMW-YPMHNXCESA-N 1 1 236.359 2.335 20 10 BECDMO Cc1ccc(O)c([C@@H](C)NC[C@H]([NH3+])C(C)C)c1 ZINC000817958502 586850338 /nfs/dbraw/zinc/85/03/38/586850338.db2.gz KIAIGISKBRTAMW-YPMHNXCESA-N 1 1 236.359 2.335 20 10 BECDMO CC(C)[C@@H]([NH3+])CN[C@H](C)c1cc(F)ccc1O ZINC000817958445 586850541 /nfs/dbraw/zinc/85/05/41/586850541.db2.gz JTJTYJJDPHKKOB-SKDRFNHKSA-N 1 1 240.322 2.165 20 10 BECDMO CC[C@H]([NH2+]C[C@H](N)C1CC1)c1ccc(C)cc1O ZINC000817965678 586854982 /nfs/dbraw/zinc/85/49/82/586854982.db2.gz TUIOACTZTMHENG-KBPBESRZSA-N 1 1 248.370 2.479 20 10 BECDMO Cc1ccc([C@H](C)N[C@H]2C[NH2+]CC[C@@H]2C)c(O)c1 ZINC000817969332 586856442 /nfs/dbraw/zinc/85/64/42/586856442.db2.gz USFUTYMVDQJJMB-OBJOEFQTSA-N 1 1 248.370 2.349 20 10 BECDMO CC[C@H](N[C@@H](C)C[NH3+])c1ccc(N(C)C)cc1 ZINC000817970562 586857289 /nfs/dbraw/zinc/85/72/89/586857289.db2.gz ZZEMRYNDGZXZNT-FZMZJTMJSA-N 1 1 235.375 2.141 20 10 BECDMO C[C@@H](N)C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817972298 586859811 /nfs/dbraw/zinc/85/98/11/586859811.db2.gz KWUQPRCAKXBPIO-MNOVXSKESA-N 1 1 248.370 2.269 20 10 BECDMO CC[C@H]([NH2+][C@H](C)[C@H](C)N)c1ccccc1O ZINC000817978078 586861260 /nfs/dbraw/zinc/86/12/60/586861260.db2.gz VJHRNLROELEVHC-UMNHJUIQSA-N 1 1 222.332 2.169 20 10 BECDMO CC[C@@H](CO)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000824533252 587273899 /nfs/dbraw/zinc/27/38/99/587273899.db2.gz CIRJZPJDAROHFN-NSHDSACASA-N 1 1 243.734 2.248 20 10 BECDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](F)C2)c1 ZINC000824572273 587277142 /nfs/dbraw/zinc/27/71/42/587277142.db2.gz XHJBVFURMIBPSZ-NSHDSACASA-N 1 1 239.290 2.335 20 10 BECDMO CN(C)c1ccc(C[N@@H+]2CC[C@H](F)C2)cc1F ZINC000824572205 587277245 /nfs/dbraw/zinc/27/72/45/587277245.db2.gz UQHHFMOHLOVWLU-NSHDSACASA-N 1 1 240.297 2.436 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CC[C@H](F)C2)cc1F ZINC000824572205 587277246 /nfs/dbraw/zinc/27/72/46/587277246.db2.gz UQHHFMOHLOVWLU-NSHDSACASA-N 1 1 240.297 2.436 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@H](CCCO)C2)c1O ZINC000825338762 587315798 /nfs/dbraw/zinc/31/57/98/587315798.db2.gz UMFXKPCAUQERRD-CYBMUJFWSA-N 1 1 249.354 2.295 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000827507255 587384422 /nfs/dbraw/zinc/38/44/22/587384422.db2.gz VXEWSUHMRGBBKK-QWRGUYRKSA-N 1 1 233.311 2.243 20 10 BECDMO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)CCO ZINC000835025947 587779157 /nfs/dbraw/zinc/77/91/57/587779157.db2.gz OSRPNBICDYETJQ-AATRIKPKSA-N 1 1 248.370 2.080 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H](O)C[C@@H]1C ZINC000840942350 587931285 /nfs/dbraw/zinc/93/12/85/587931285.db2.gz ZPUHVCIXAUDNHX-WFASDCNBSA-N 1 1 248.370 2.016 20 10 BECDMO CCCC[C@H](C[NH3+])NCc1ccc(N(C)C)cc1 ZINC000841030227 587936294 /nfs/dbraw/zinc/93/62/94/587936294.db2.gz VBPCQRGWKNJZBK-CQSZACIVSA-N 1 1 249.402 2.360 20 10 BECDMO [NH3+]C1(CNCc2ccccc2O)CCCCC1 ZINC000841039365 587938489 /nfs/dbraw/zinc/93/84/89/587938489.db2.gz MDSJZHHDWGNRDL-UHFFFAOYSA-N 1 1 234.343 2.143 20 10 BECDMO Cc1cc([O-])c(C[NH2+]C[C@H](C)C[NH3+])c(Cl)c1 ZINC000841050186 587940021 /nfs/dbraw/zinc/94/00/21/587940021.db2.gz ZEILKEIKCCEUBS-SECBINFHSA-N 1 1 242.750 2.038 20 10 BECDMO Cc1cc([O-])c(C[NH2+]C[C@@H](C)C[NH3+])c(Cl)c1 ZINC000841050187 587940030 /nfs/dbraw/zinc/94/00/30/587940030.db2.gz ZEILKEIKCCEUBS-VIFPVBQESA-N 1 1 242.750 2.038 20 10 BECDMO C[C@@H]([NH2+][C@H]1C[C@@](C)(O)C1)c1ccc(F)cc1O ZINC000841757880 587974365 /nfs/dbraw/zinc/97/43/65/587974365.db2.gz BWBJEKLQUGIBIV-JQEORGNBSA-N 1 1 239.290 2.095 20 10 BECDMO C[N@@H+](CC[C@@H]1CCC[NH2+]C1)Cc1ccccc1O ZINC000842472294 588028805 /nfs/dbraw/zinc/02/88/05/588028805.db2.gz WAYINEZROPFBSE-ZDUSSCGKSA-N 1 1 248.370 2.214 20 10 BECDMO CCC[N@H+](Cc1ccccc1[O-])C1CC[NH2+]CC1 ZINC000843044092 588075963 /nfs/dbraw/zinc/07/59/63/588075963.db2.gz CSGTWGLMMTZYAS-UHFFFAOYSA-N 1 1 248.370 2.356 20 10 BECDMO CCC[N@@H+](Cc1ccccc1[O-])C1CC[NH2+]CC1 ZINC000843044092 588075965 /nfs/dbraw/zinc/07/59/65/588075965.db2.gz CSGTWGLMMTZYAS-UHFFFAOYSA-N 1 1 248.370 2.356 20 10 BECDMO Cc1cc(O)c(C[NH+]2C[C@@H](C)N[C@H](C)C2)cc1C ZINC000843048958 588076722 /nfs/dbraw/zinc/07/67/22/588076722.db2.gz BTKDXIWSYIMWFP-CHWSQXEVSA-N 1 1 248.370 2.191 20 10 BECDMO CCC[C@@H]1CNCC[N@H+]1Cc1cccc(C)c1O ZINC000843057628 588078182 /nfs/dbraw/zinc/07/81/82/588078182.db2.gz FZBILRSQFGABAO-CQSZACIVSA-N 1 1 248.370 2.275 20 10 BECDMO CCC[C@@H]1C[NH2+]CCN1Cc1cccc(C)c1O ZINC000843057628 588078184 /nfs/dbraw/zinc/07/81/84/588078184.db2.gz FZBILRSQFGABAO-CQSZACIVSA-N 1 1 248.370 2.275 20 10 BECDMO CN(C)c1ccc(C[NH2+]Cc2ccno2)cc1F ZINC000843402573 588106497 /nfs/dbraw/zinc/10/64/97/588106497.db2.gz KJGRKJZVTNJHFT-UHFFFAOYSA-N 1 1 249.289 2.170 20 10 BECDMO CCc1cccc(C[N@@H+](C)CC[C@@H](C)O)c1O ZINC000848886864 588417350 /nfs/dbraw/zinc/41/73/50/588417350.db2.gz JPVSGDJGHBXDSY-LLVKDONJSA-N 1 1 237.343 2.157 20 10 BECDMO CCc1cccc(C[N@H+]2C[C@@H](O)C(C)(C)C2)c1O ZINC000848908202 588419103 /nfs/dbraw/zinc/41/91/03/588419103.db2.gz OWIUUTMKLUGQRX-CYBMUJFWSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@@H+](C)C[C@@H](O)C2CC2)c1O ZINC000848910989 588419508 /nfs/dbraw/zinc/41/95/08/588419508.db2.gz CJIMOAJMSWOQQW-CQSZACIVSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@@H](O)C2(C)C)c1O ZINC000848913270 588420393 /nfs/dbraw/zinc/42/03/93/588420393.db2.gz SPMAKDBMHGHKDI-CYBMUJFWSA-N 1 1 249.354 2.300 20 10 BECDMO CC1C[NH+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC000862351358 589202332 /nfs/dbraw/zinc/20/23/32/589202332.db2.gz NWGOAUVYFQMERX-UHFFFAOYSA-N 1 1 240.297 2.483 20 10 BECDMO Oc1ccc(Cl)cc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC000862439931 589212879 /nfs/dbraw/zinc/21/28/79/589212879.db2.gz BZIPXEAFFQDUPH-DTORHVGOSA-N 1 1 223.703 2.497 20 10 BECDMO CCOCCC[N@@H+](C)Cc1ccccc1O ZINC000119530539 589302245 /nfs/dbraw/zinc/30/22/45/589302245.db2.gz XDIHLLOTGGNGBV-UHFFFAOYSA-N 1 1 223.316 2.251 20 10 BECDMO C[C@H]1OCC[C@@H]1C[N@H+](C)c1ccc(N)cc1 ZINC000866667917 589509959 /nfs/dbraw/zinc/50/99/59/589509959.db2.gz BPSWTJWFBVRCKX-GHMZBOCLSA-N 1 1 220.316 2.130 20 10 BECDMO C[C@H]1OCC[C@@H]1C[N@@H+](C)c1ccc(N)cc1 ZINC000866667917 589509960 /nfs/dbraw/zinc/50/99/60/589509960.db2.gz BPSWTJWFBVRCKX-GHMZBOCLSA-N 1 1 220.316 2.130 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000876609382 590221861 /nfs/dbraw/zinc/22/18/61/590221861.db2.gz LYSXNLNVXBDIAQ-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H](N(C)C)C1 ZINC000876678046 590229702 /nfs/dbraw/zinc/22/97/02/590229702.db2.gz ALELWFDVRFPPAB-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1CN1CCC[C@@H]([NH+](C)C)C1 ZINC000876678046 590229703 /nfs/dbraw/zinc/22/97/03/590229703.db2.gz ALELWFDVRFPPAB-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCCO[C@H](C)C1 ZINC000876685068 590230630 /nfs/dbraw/zinc/23/06/30/590230630.db2.gz XBBXGNSWMLORSP-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO COC[C@@H]1CC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000876725752 590233590 /nfs/dbraw/zinc/23/35/90/590233590.db2.gz PHQPZVLCWJPQDH-GFCCVEGCSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H](CN(C)C)C1 ZINC000876730041 590233989 /nfs/dbraw/zinc/23/39/89/590233989.db2.gz AWNPXGJQWDBSCJ-ZDUSSCGKSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CC[C@@H](CN(C)C)C1 ZINC000876730041 590233991 /nfs/dbraw/zinc/23/39/91/590233991.db2.gz AWNPXGJQWDBSCJ-ZDUSSCGKSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1ccc(C[N@H+](C)Cc2ccon2)c(O)c1 ZINC000876754907 590239070 /nfs/dbraw/zinc/23/90/70/590239070.db2.gz HOCUMELXIOQTMA-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1ccc(C[N@@H+](C)Cc2ccon2)c(O)c1 ZINC000876754907 590239072 /nfs/dbraw/zinc/23/90/72/590239072.db2.gz HOCUMELXIOQTMA-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1ccc(C[N@@H+](C)C[C@H]2CCC[C@H]2O)c(O)c1 ZINC000876804921 590244442 /nfs/dbraw/zinc/24/44/42/590244442.db2.gz WCOSTJJWKMPLJR-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO COCC1=CC[N@@H+](Cc2c(C)cccc2O)CC1 ZINC000877418224 590324704 /nfs/dbraw/zinc/32/47/04/590324704.db2.gz WRLRZNVOUNUUHV-UHFFFAOYSA-N 1 1 247.338 2.479 20 10 BECDMO Cc1ccc(C[N@H+](C)[C@H]2CC[C@H](O)CC2)c(O)c1 ZINC000877463892 590332787 /nfs/dbraw/zinc/33/27/87/590332787.db2.gz JTVGKUFZBFDBCO-HDJSIYSDSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1noc([C@H](C)[NH2+]Cc2ccc(C)cc2O)n1 ZINC000877470970 590334755 /nfs/dbraw/zinc/33/47/55/590334755.db2.gz ONBSTNPTRVGZNU-VIFPVBQESA-N 1 1 247.298 2.243 20 10 BECDMO Cc1noc([C@H](C)[NH2+]Cc2c(C)cccc2O)n1 ZINC000877470616 590334853 /nfs/dbraw/zinc/33/48/53/590334853.db2.gz KYHGRLUEDHCPCQ-VIFPVBQESA-N 1 1 247.298 2.243 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@](C)(O)CC1 ZINC000877489191 590338472 /nfs/dbraw/zinc/33/84/72/590338472.db2.gz LETTVPJLGLICSI-OAHLLOKOSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@](C)(O)CC2)c(O)c1 ZINC000877489192 590339130 /nfs/dbraw/zinc/33/91/30/590339130.db2.gz LEVYPFAHFBPZJU-HNNXBMFYSA-N 1 1 249.354 2.438 20 10 BECDMO Oc1cccc2c1C[N@@H+](C[C@H]1CCSC1)C2 ZINC000877702978 590395466 /nfs/dbraw/zinc/39/54/66/590395466.db2.gz MWQGOXALONZVLD-SNVBAGLBSA-N 1 1 235.352 2.461 20 10 BECDMO Oc1cccc2c1C[N@@H+](CC[C@@H]1CCOC1)C2 ZINC000877702592 590395654 /nfs/dbraw/zinc/39/56/54/590395654.db2.gz CVJZGPVJHPHGEQ-LLVKDONJSA-N 1 1 233.311 2.134 20 10 BECDMO CCSCC[N@H+]1Cc2cccc(O)c2C1 ZINC000877703030 590396285 /nfs/dbraw/zinc/39/62/85/590396285.db2.gz OXNNMSHJOVAFQJ-UHFFFAOYSA-N 1 1 223.341 2.461 20 10 BECDMO Oc1cccc2c1C[N@@H+](C[C@@H]1CCSC1)C2 ZINC000877702977 590396736 /nfs/dbraw/zinc/39/67/36/590396736.db2.gz MWQGOXALONZVLD-JTQLQIEISA-N 1 1 235.352 2.461 20 10 BECDMO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)o1 ZINC000879651852 590843483 /nfs/dbraw/zinc/84/34/83/590843483.db2.gz MXRQGGXYAKRXST-IUCAKERBSA-N 1 1 247.298 2.495 20 10 BECDMO C[C@H]([NH2+]Cc1cnsn1)c1ccccc1O ZINC000879650313 590843830 /nfs/dbraw/zinc/84/38/30/590843830.db2.gz SXGPMUYKQIQCON-QMMMGPOBSA-N 1 1 235.312 2.095 20 10 BECDMO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H](O)C1 ZINC000127988454 590864049 /nfs/dbraw/zinc/86/40/49/590864049.db2.gz JPVYURLZZLFOOO-VIFPVBQESA-N 1 1 241.718 2.002 20 10 BECDMO OCC[N@@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000128120301 590899406 /nfs/dbraw/zinc/89/94/06/590899406.db2.gz UPYSXLAPKBEAHV-UHFFFAOYSA-N 1 1 241.718 2.002 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCC[C@@](C)(O)C2)cc1C ZINC000129466566 591303716 /nfs/dbraw/zinc/30/37/16/591303716.db2.gz RHQYVWOMNYJJGF-OAHLLOKOSA-N 1 1 249.354 2.356 20 10 BECDMO CCC[N@H+]1CCC[C@H]1C(=O)Nc1ccc(N)cc1 ZINC000212586026 591417168 /nfs/dbraw/zinc/41/71/68/591417168.db2.gz DNKIUFOYTQVOSD-ZDUSSCGKSA-N 1 1 247.342 2.082 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CC[C@H](C)C2)c1 ZINC000132665644 591728561 /nfs/dbraw/zinc/72/85/61/591728561.db2.gz RUNWUJUKDWBTSH-JTQLQIEISA-N 1 1 221.300 2.243 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@@H](C)O)C2)c1 ZINC000136823889 592151132 /nfs/dbraw/zinc/15/11/32/592151132.db2.gz FHYXHEGYJKYZLH-OLZOCXBDSA-N 1 1 249.354 2.293 20 10 BECDMO COCCC[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886489882 592235986 /nfs/dbraw/zinc/23/59/86/592235986.db2.gz UDGXUHINNQEIPJ-VIFPVBQESA-N 1 1 227.279 2.218 20 10 BECDMO C[C@H]([NH2+]C[C@H]1CCCO1)c1c(O)cccc1F ZINC000886489388 592236112 /nfs/dbraw/zinc/23/61/12/592236112.db2.gz HMYNUAKBIVXFCW-VHSXEESVSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@@H]([NH2+]C1CCOCC1)c1c(O)cccc1F ZINC000886507477 592239443 /nfs/dbraw/zinc/23/94/43/592239443.db2.gz MSABQXLTLKUZMX-SECBINFHSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@@H]([NH2+]C[C@H]1CCOC1)c1c(O)cccc1F ZINC000886510892 592240642 /nfs/dbraw/zinc/24/06/42/592240642.db2.gz CBFAWXPHDJLODM-NXEZZACHSA-N 1 1 239.290 2.218 20 10 BECDMO C[C@H]([NH2+]C[C@H](C)N(C)C)c1c(O)cccc1F ZINC000886523049 592243983 /nfs/dbraw/zinc/24/39/83/592243983.db2.gz VZQGYXLSJUTAHV-UWVGGRQHSA-N 1 1 240.322 2.132 20 10 BECDMO CCC[C@H](O)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886526495 592246289 /nfs/dbraw/zinc/24/62/89/592246289.db2.gz NBQWSDOKFZJRTL-ZJUUUORDSA-N 1 1 241.306 2.343 20 10 BECDMO CCC[C@@H](O)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886526492 592246359 /nfs/dbraw/zinc/24/63/59/592246359.db2.gz NBQWSDOKFZJRTL-NXEZZACHSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@H](CCO)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886535200 592250386 /nfs/dbraw/zinc/25/03/86/592250386.db2.gz WLNAKJPLQDURAC-ZJUUUORDSA-N 1 1 241.306 2.200 20 10 BECDMO C[C@H](CCCO)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886538487 592252054 /nfs/dbraw/zinc/25/20/54/592252054.db2.gz IYOWZMNGKKNRIA-ZJUUUORDSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1n[nH]cc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886550374 592258396 /nfs/dbraw/zinc/25/83/96/592258396.db2.gz YOBLTPMEGHCRQC-SECBINFHSA-N 1 1 249.289 2.414 20 10 BECDMO COCC1([NH2+][C@@H](C)c2c(O)cccc2F)CC1 ZINC000886577114 592266983 /nfs/dbraw/zinc/26/69/83/592266983.db2.gz XHISYZXZGXXXGW-VIFPVBQESA-N 1 1 239.290 2.361 20 10 BECDMO C[C@@H]([NH2+]CCC(C)(C)O)c1c(O)cccc1F ZINC000886594036 592271205 /nfs/dbraw/zinc/27/12/05/592271205.db2.gz FAVGGKSGLMZWPI-SECBINFHSA-N 1 1 241.306 2.343 20 10 BECDMO CO[C@@]1(C)C[C@H]1[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886640034 592286473 /nfs/dbraw/zinc/28/64/73/592286473.db2.gz PUXNFJKECLBQRE-KDDOJWQBSA-N 1 1 239.290 2.359 20 10 BECDMO C[C@@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccccc1O ZINC000044534648 640400691 /nfs/dbraw/zinc/40/06/91/640400691.db2.gz GBFBEJFNKLDXOT-OLZOCXBDSA-N 1 1 248.370 2.385 20 10 BECDMO CCO[C@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000932973824 640659016 /nfs/dbraw/zinc/65/90/16/640659016.db2.gz LMASNPUZODFNIR-HNNXBMFYSA-N 1 1 248.370 2.363 20 10 BECDMO CC[C@H](CCO)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168793717 640827263 /nfs/dbraw/zinc/82/72/63/640827263.db2.gz HOKBFRDIURLYDV-MWLCHTKSSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@H]([NH2+]Cc1cncn1C)c1ccc(F)cc1O ZINC000290004244 642413594 /nfs/dbraw/zinc/41/35/94/642413594.db2.gz ZIZNIONSOLCSKS-VIFPVBQESA-N 1 1 249.289 2.116 20 10 BECDMO C[C@H]1OCC[N@@H+](Cc2ccccc2O)[C@@H]1C ZINC000179575445 642726553 /nfs/dbraw/zinc/72/65/53/642726553.db2.gz GFRAFCAIAAKLRZ-GHMZBOCLSA-N 1 1 221.300 2.001 20 10 BECDMO CC(C)[C@@H]1CN(C)CC[N@H+]1Cc1ccccc1O ZINC000184739450 643232578 /nfs/dbraw/zinc/23/25/78/643232578.db2.gz HKHJQFUQIQNHHQ-AWEZNQCLSA-N 1 1 248.370 2.164 20 10 BECDMO C[C@H]([NH2+]Cc1ncc[nH]1)c1ccc(N(C)C)cc1 ZINC000080581632 644277536 /nfs/dbraw/zinc/27/75/36/644277536.db2.gz ZFPCYBZCIKCWLS-NSHDSACASA-N 1 1 244.342 2.327 20 10 BECDMO CCOCC[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000194563877 644328810 /nfs/dbraw/zinc/32/88/10/644328810.db2.gz PEXJBLUWIVTCMS-UHFFFAOYSA-N 1 1 236.359 2.221 20 10 BECDMO CCN(C)c1ccc(C[N@@H+](C)[C@@H]2CCOC2)cc1 ZINC000773758464 644696135 /nfs/dbraw/zinc/69/61/35/644696135.db2.gz TXWXJSCEIPDGRG-OAHLLOKOSA-N 1 1 248.370 2.363 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](OC)C2)cc1 ZINC000773756189 644696319 /nfs/dbraw/zinc/69/63/19/644696319.db2.gz ULQIKNFFWVXKCX-OAHLLOKOSA-N 1 1 248.370 2.363 20 10 BECDMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc(C)ccc1O ZINC000824636624 645057603 /nfs/dbraw/zinc/05/76/03/645057603.db2.gz RWMSNHSHTJOTLC-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000843129615 645267011 /nfs/dbraw/zinc/26/70/11/645267011.db2.gz QKZKCXPZHDCQIY-DTWKUNHWSA-N 1 1 242.750 2.261 20 10 BECDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](CC)CO ZINC000929753564 646285193 /nfs/dbraw/zinc/28/51/93/646285193.db2.gz SCLGDEWLUOTTMI-ZDUSSCGKSA-N 1 1 237.343 2.375 20 10 BECDMO Cc1cn(C)nc1C[N@H+](C)Cc1ccccc1O ZINC000929975892 646382669 /nfs/dbraw/zinc/38/26/69/646382669.db2.gz JYYMFZBWMGYNPA-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO Cc1cn(C)nc1C[N@@H+](C)Cc1ccccc1O ZINC000929975892 646382675 /nfs/dbraw/zinc/38/26/75/646382675.db2.gz JYYMFZBWMGYNPA-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO CC[N@H+](Cc1cc(F)ccc1O)C[C@H](C)OC ZINC000383341987 710980404 /nfs/dbraw/zinc/98/04/04/710980404.db2.gz RTJVQXPEWIAZEV-JTQLQIEISA-N 1 1 241.306 2.388 20 10 BECDMO Cc1ccc(O)c(C[NH2+][C@H](C)C(F)F)c1 ZINC000389964848 711101101 /nfs/dbraw/zinc/10/11/01/711101101.db2.gz LAXBANSIJSYMSJ-MRVPVSSYSA-N 1 1 215.243 2.444 20 10 BECDMO Cc1nnc(C[NH2+]Cc2cc(C)ccc2O)s1 ZINC000391774625 711140427 /nfs/dbraw/zinc/14/04/27/711140427.db2.gz IJOSYMCRHMCDLC-UHFFFAOYSA-N 1 1 249.339 2.150 20 10 BECDMO CC[N@@H+](Cc1cccc(C)c1O)[C@H]1CCOC1 ZINC000310473683 711777125 /nfs/dbraw/zinc/77/71/25/711777125.db2.gz BHCWTGNPJBDHOJ-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO COc1ccc(C[NH2+]C2CC(N(C)C)C2)cc1C ZINC000701500231 712025112 /nfs/dbraw/zinc/02/51/12/712025112.db2.gz WABJHAOWVZCTEC-UHFFFAOYSA-N 1 1 248.370 2.186 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]Cc2ncccn2)c(O)c1 ZINC000702325658 712047059 /nfs/dbraw/zinc/04/70/59/712047059.db2.gz JGQYGXLACMDYSG-NSHDSACASA-N 1 1 243.310 2.341 20 10 BECDMO CC[C@]1(C)COCC[N@H+]1Cc1ccccc1O ZINC000708286166 712185710 /nfs/dbraw/zinc/18/57/10/712185710.db2.gz DUQICNKWFODKOW-CQSZACIVSA-N 1 1 235.327 2.393 20 10 BECDMO C[C@H]1C[C@@H]1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708386991 712192056 /nfs/dbraw/zinc/19/20/56/712192056.db2.gz AALRLFISOXNCJR-JGVFFNPUSA-N 1 1 227.254 2.416 20 10 BECDMO Oc1c(F)cc(F)cc1C[NH2+]CCCF ZINC000708387203 712192083 /nfs/dbraw/zinc/19/20/83/712192083.db2.gz AMLPUZHEYRJOEW-UHFFFAOYSA-N 1 1 219.206 2.120 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](CF)C1 ZINC000711488413 712306376 /nfs/dbraw/zinc/30/63/76/712306376.db2.gz DCCXOPCXAVFNKY-SECBINFHSA-N 1 1 227.254 2.323 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)CCO1 ZINC000720485465 712846962 /nfs/dbraw/zinc/84/69/62/712846962.db2.gz VGOQUWHJKYKXCY-SNVBAGLBSA-N 1 1 239.290 2.142 20 10 BECDMO COc1cc(C[N@@H+](C)CC(C)C)c(O)cc1O ZINC001231633916 977651549 /nfs/dbraw/zinc/65/15/49/977651549.db2.gz DEGXPWBSTSDWEI-UHFFFAOYSA-N 1 1 239.315 2.194 20 10 BECDMO CCC[N@@H+](C)Cc1ccc(N(C)C)cc1O ZINC001232834096 978305236 /nfs/dbraw/zinc/30/52/36/978305236.db2.gz GJXYXWBLHARZDO-UHFFFAOYSA-N 1 1 222.332 2.300 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2ccccc2O)[C@H](C)CO1 ZINC000403885662 971084402 /nfs/dbraw/zinc/08/44/02/971084402.db2.gz PBXOIKSCIMPETB-YPMHNXCESA-N 1 1 235.327 2.392 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2ccccc2O)[C@H](C)CO1 ZINC000403885658 971085700 /nfs/dbraw/zinc/08/57/00/971085700.db2.gz PBXOIKSCIMPETB-DGCLKSJQSA-N 1 1 235.327 2.392 20 10 BECDMO C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(N)cc2)CCN1C ZINC001345160839 957162236 /nfs/dbraw/zinc/16/22/36/957162236.db2.gz ZYEXCKMJQVDIBC-IUODEOHRSA-N 1 1 247.386 2.183 20 10 BECDMO CC[N@@H+](Cc1cnccn1)Cc1ccccc1O ZINC001209787108 957532093 /nfs/dbraw/zinc/53/20/93/957532093.db2.gz OSYDDPHEZLMCNH-UHFFFAOYSA-N 1 1 243.310 2.204 20 10 BECDMO Oc1c(F)cccc1C[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000397728544 957788331 /nfs/dbraw/zinc/78/83/31/957788331.db2.gz DHEQVIZOKMVCHK-JGPRNRPPSA-N 1 1 221.275 2.419 20 10 BECDMO CC[N@@H+](Cc1cnc[nH]1)Cc1ccccc1O ZINC001136871961 972292999 /nfs/dbraw/zinc/29/29/99/972292999.db2.gz WQWUPEOHOOMNCH-UHFFFAOYSA-N 1 1 231.299 2.137 20 10 BECDMO CC[N@H+](Cc1c[nH]cn1)Cc1ccccc1O ZINC001136871961 972293001 /nfs/dbraw/zinc/29/30/01/972293001.db2.gz WQWUPEOHOOMNCH-UHFFFAOYSA-N 1 1 231.299 2.137 20 10 BECDMO CC[N@@H+](Cc1c[nH]cn1)Cc1ccccc1O ZINC001136871961 972293004 /nfs/dbraw/zinc/29/30/04/972293004.db2.gz WQWUPEOHOOMNCH-UHFFFAOYSA-N 1 1 231.299 2.137 20 10 BECDMO C[N@@H+](Cc1ccc(N)cc1)[C@H]1CCSC1 ZINC000037174271 960136226 /nfs/dbraw/zinc/13/62/26/960136226.db2.gz NPXQLHLTSJVKMY-LBPRGKRZSA-N 1 1 222.357 2.206 20 10 BECDMO COc1cc(O)c(C[N@@H+](C)C2CC2)c(OC)c1 ZINC001141032199 960221190 /nfs/dbraw/zinc/22/11/90/960221190.db2.gz VIWMBOJGEUMCMF-UHFFFAOYSA-N 1 1 237.299 2.004 20 10 BECDMO CCOc1cccc(C[N@H+]2CC[C@@H](F)C2)c1O ZINC000689865741 960296948 /nfs/dbraw/zinc/29/69/48/960296948.db2.gz ZGHSITGFWIJHOI-LLVKDONJSA-N 1 1 239.290 2.335 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](C)[C@@H](O)CC2)c1 ZINC001140617698 960458399 /nfs/dbraw/zinc/45/83/99/960458399.db2.gz YBKXZAIVSRCHDS-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](C)[C@@H](O)CC2)c1 ZINC001140617697 960462201 /nfs/dbraw/zinc/46/22/01/960462201.db2.gz YBKXZAIVSRCHDS-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@H]3[C@H](CF)[C@H]3C2)c1 ZINC001140623409 960465501 /nfs/dbraw/zinc/46/55/01/960465501.db2.gz RAQVZOIOXZYXRI-XYYAHUGASA-N 1 1 235.302 2.348 20 10 BECDMO Cc1c(O)ccc(C[N@@H+]2CC[C@@H]2C)c1O ZINC001140744434 960543950 /nfs/dbraw/zinc/54/39/50/960543950.db2.gz XEWZXNFAQNGRIC-QMMMGPOBSA-N 1 1 207.273 2.000 20 10 BECDMO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2C)c1O ZINC001140742195 960545629 /nfs/dbraw/zinc/54/56/29/960545629.db2.gz JUHAXOPTADDUEG-SECBINFHSA-N 1 1 221.300 2.391 20 10 BECDMO Cc1c(O)ccc(C[N@@H+]2C[C@H](F)C[C@H]2C)c1O ZINC001140742494 960546211 /nfs/dbraw/zinc/54/62/11/960546211.db2.gz PNCWOCLOQHXNEI-LDYMZIIASA-N 1 1 239.290 2.339 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@]3(CCCO3)C2)c(O)c1 ZINC001140947873 960750243 /nfs/dbraw/zinc/75/02/43/960750243.db2.gz JECQLHVQXMIHJL-HNNXBMFYSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1ccc(C[N@@H+](C)Cc2ccncn2)c(O)c1 ZINC001140953548 960762627 /nfs/dbraw/zinc/76/26/27/960762627.db2.gz BERARRLIMJABRL-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2ccc3c(c2)OCCN3C)C1 ZINC001141140895 960885390 /nfs/dbraw/zinc/88/53/90/960885390.db2.gz REECWXHLSZIUPT-LBPRGKRZSA-N 1 1 246.354 2.357 20 10 BECDMO CC1CC([N@@H+](C)Cc2cc(O)ccc2O)C1 ZINC001141156753 960889703 /nfs/dbraw/zinc/88/97/03/960889703.db2.gz UCWMFOOEDQKNCQ-UHFFFAOYSA-N 1 1 221.300 2.328 20 10 BECDMO C[N@@H+](Cc1cccnc1)Cc1cc(O)ccc1O ZINC001141156444 960890265 /nfs/dbraw/zinc/89/02/65/960890265.db2.gz YAKRHTDKGKIOCB-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)C2CCOCC2)c1 ZINC000132315942 962409869 /nfs/dbraw/zinc/40/98/69/962409869.db2.gz XCEMJDZBULRGKY-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO C[C@@H](CCNCc1ccc(N(C)C)cc1)[NH+](C)C ZINC000697869859 964596976 /nfs/dbraw/zinc/59/69/76/964596976.db2.gz JGUZRJDDMLWFPY-ZDUSSCGKSA-N 1 1 249.402 2.182 20 10 BECDMO COc1cccc(C[N@H+]2CCC[C@@H](F)C2)c1O ZINC000689902886 965454718 /nfs/dbraw/zinc/45/47/18/965454718.db2.gz GLDDWFWKEXBHQN-LLVKDONJSA-N 1 1 239.290 2.335 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC2(CC2)C1 ZINC001203550226 966679421 /nfs/dbraw/zinc/67/94/21/966679421.db2.gz NAOWGXVHEQABPW-UHFFFAOYSA-N 1 1 203.285 2.378 20 10 BECDMO CC[N@@H+](CCn1ccnc1)Cc1ccccc1O ZINC001203561288 966688060 /nfs/dbraw/zinc/68/80/60/966688060.db2.gz PBBLUPRWLKHNQO-UHFFFAOYSA-N 1 1 245.326 2.111 20 10 BECDMO CC(=O)[C@@H]1CCCC[N@H+]1Cc1ccccc1O ZINC001203558464 966688849 /nfs/dbraw/zinc/68/88/49/966688849.db2.gz IAINNNLQDZMWNU-ZDUSSCGKSA-N 1 1 233.311 2.336 20 10 BECDMO Oc1ccccc1C[N@H+]1CCc2cccnc2C1 ZINC001203558486 966692102 /nfs/dbraw/zinc/69/21/02/966692102.db2.gz JSFGXNUOEGKTIS-UHFFFAOYSA-N 1 1 240.306 2.346 20 10 BECDMO COc1ccc(C[N@H+]2C[C@@H](F)C[C@H]2C)c(O)c1 ZINC001203621317 966711400 /nfs/dbraw/zinc/71/14/00/966711400.db2.gz SZMHHCCHOKYUQV-KOLCDFICSA-N 1 1 239.290 2.333 20 10 BECDMO COc1ccc(C[N@H+]2CCC[C@H]3C[C@H]32)c(O)c1 ZINC001203634752 966713756 /nfs/dbraw/zinc/71/37/56/966713756.db2.gz UDIPMOJVYGVEBW-GXFFZTMASA-N 1 1 233.311 2.385 20 10 BECDMO CC1(C)CC[N@@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203879145 966805115 /nfs/dbraw/zinc/80/51/15/966805115.db2.gz MNRMDDDXBVPUJO-UHFFFAOYSA-N 1 1 221.300 2.330 20 10 BECDMO Oc1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)cc1O ZINC001203874109 966806941 /nfs/dbraw/zinc/80/69/41/966806941.db2.gz OIBBSSFYJCUDCV-TXEJJXNPSA-N 1 1 233.311 2.330 20 10 BECDMO Oc1ccc(C[N@H+]2CC3CCC2CC3)cc1O ZINC001203880450 966810668 /nfs/dbraw/zinc/81/06/68/966810668.db2.gz BGBMAZKUIJZDPR-UHFFFAOYSA-N 1 1 233.311 2.472 20 10 BECDMO C[C@H]1C[C@H](O)CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001203936292 966824154 /nfs/dbraw/zinc/82/41/54/966824154.db2.gz CFNLKUOHZMYTAJ-SWLSCSKDSA-N 1 1 248.370 2.098 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CC[C@H]3OCC[C@H]32)cc1 ZINC001203930703 966824383 /nfs/dbraw/zinc/82/43/83/966824383.db2.gz FCFMYXDQMXXDHE-HUUCEWRRSA-N 1 1 246.354 2.116 20 10 BECDMO C[C@@H]1C[C@@H](O)CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001203936289 966825831 /nfs/dbraw/zinc/82/58/31/966825831.db2.gz CFNLKUOHZMYTAJ-DOMZBBRYSA-N 1 1 248.370 2.098 20 10 BECDMO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccccc1O ZINC001203550121 966933579 /nfs/dbraw/zinc/93/35/79/966933579.db2.gz IMSYQTJBCPEOQD-KOLCDFICSA-N 1 1 209.264 2.325 20 10 BECDMO CC[N@H+](Cc1nccn1C)Cc1ccccc1O ZINC001205144108 967391305 /nfs/dbraw/zinc/39/13/05/967391305.db2.gz VMQQCXYYUSRSRS-UHFFFAOYSA-N 1 1 245.326 2.148 20 10 BECDMO CC[N@@H+](Cc1nccn1C)Cc1ccccc1O ZINC001205144108 967391318 /nfs/dbraw/zinc/39/13/18/967391318.db2.gz VMQQCXYYUSRSRS-UHFFFAOYSA-N 1 1 245.326 2.148 20 10 BECDMO CC(C)(C)c1cccc(C[N@H+]2CC[C@@H](O)C2)c1O ZINC001143103296 967472979 /nfs/dbraw/zinc/47/29/79/967472979.db2.gz AAZCQSAQKUXDMN-GFCCVEGCSA-N 1 1 249.354 2.256 20 10 BECDMO 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BECDMO CC(C)N1CC[C@H]([N@H+](C)Cc2ccc(N)cc2)C1 ZINC001575697089 993094796 /nfs/dbraw/zinc/09/47/96/993094796.db2.gz PBUSYPPZSVBGLN-HNNXBMFYSA-N 1 1 247.386 2.183 20 10 BECDMO CC(C)N1CC[C@H]([N@@H+](C)Cc2ccc(N)cc2)C1 ZINC001575697089 993094801 /nfs/dbraw/zinc/09/48/01/993094801.db2.gz PBUSYPPZSVBGLN-HNNXBMFYSA-N 1 1 247.386 2.183 20 10 BECDMO C[C@H]1CCC[N@H+](CCNCc2ccc(N)cc2)C1 ZINC001576709132 993400992 /nfs/dbraw/zinc/40/09/92/993400992.db2.gz OADFDIRQEMDMIX-ZDUSSCGKSA-N 1 1 247.386 2.090 20 10 BECDMO C[C@H]1CCC[N@@H+](CCNCc2ccc(N)cc2)C1 ZINC001576709132 993400997 /nfs/dbraw/zinc/40/09/97/993400997.db2.gz OADFDIRQEMDMIX-ZDUSSCGKSA-N 1 1 247.386 2.090 20 10 BECDMO CC[N@H+]1C[C@H](C)N(Cc2ccc(N)cc2)C[C@H]1C ZINC001336116473 994954068 /nfs/dbraw/zinc/95/40/68/994954068.db2.gz FFZNMKDNLIXNQP-OLZOCXBDSA-N 1 1 247.386 2.183 20 10 BECDMO CCN1C[C@H](C)[N@H+](Cc2ccc(N)cc2)C[C@H]1C ZINC001336116473 994954078 /nfs/dbraw/zinc/95/40/78/994954078.db2.gz FFZNMKDNLIXNQP-OLZOCXBDSA-N 1 1 247.386 2.183 20 10 BECDMO CCN1C[C@H](C)[N@@H+](Cc2ccc(N)cc2)C[C@H]1C ZINC001336116473 994954087 /nfs/dbraw/zinc/95/40/87/994954087.db2.gz FFZNMKDNLIXNQP-OLZOCXBDSA-N 1 1 247.386 2.183 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@@H](O)C(C)(C)C2)cc1C ZINC000280404125 178195785 /nfs/dbraw/zinc/19/57/85/178195785.db2.gz HJXBJFRIONOYMP-CQSZACIVSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)[C@H](CO)C2)cc1C ZINC000191719014 178196100 /nfs/dbraw/zinc/19/61/00/178196100.db2.gz PPZUNCASAQCUSO-OCCSQVGLSA-N 1 1 249.354 2.069 20 10 BECDMO C[C@H]1[C@@H](O)CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000294928158 398264810 /nfs/dbraw/zinc/26/48/10/398264810.db2.gz GAVHQGVIORQNRM-WFASDCNBSA-N 1 1 248.370 2.098 20 10 BECDMO C[N@H+](Cc1nccs1)Cc1ccccc1O ZINC000140856004 345823816 /nfs/dbraw/zinc/82/38/16/345823816.db2.gz ZBPMEPOOKQLRIC-UHFFFAOYSA-N 1 1 234.324 2.481 20 10 BECDMO C[N@@H+](Cc1nccs1)Cc1ccccc1O ZINC000140856004 345823817 /nfs/dbraw/zinc/82/38/17/345823817.db2.gz ZBPMEPOOKQLRIC-UHFFFAOYSA-N 1 1 234.324 2.481 20 10 BECDMO Cc1cccc(C[N@H+]2CCOC[C@@H]2C2CC2)c1O ZINC000180425828 179078996 /nfs/dbraw/zinc/07/89/96/179078996.db2.gz LXLFOGUOZCEUBU-CQSZACIVSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H](CN(C)C)C2)c1O ZINC000180230047 179081663 /nfs/dbraw/zinc/08/16/63/179081663.db2.gz MRBFRIRAQCBUQP-CYBMUJFWSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1cccc(C[N@@H+]2CC[C@H](CN(C)C)C2)c1O ZINC000180230047 179081664 /nfs/dbraw/zinc/08/16/64/179081664.db2.gz MRBFRIRAQCBUQP-CYBMUJFWSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@]23CCOC3)c1O ZINC000310969771 179076306 /nfs/dbraw/zinc/07/63/06/179076306.db2.gz PGBBCVCFUUADFI-OAHLLOKOSA-N 1 1 247.338 2.456 20 10 BECDMO Cc1cccc(C[N@@H+]2CC[C@H](O)C[C@@H]2C)c1O ZINC000292733046 179082290 /nfs/dbraw/zinc/08/22/90/179082290.db2.gz GLQKADMQSPDHLY-AAEUAGOBSA-N 1 1 235.327 2.046 20 10 BECDMO CC[N@@H+](Cc1cccc(Cl)c1[O-])[C@H](C)CO ZINC000292815751 352329971 /nfs/dbraw/zinc/32/99/71/352329971.db2.gz PGGFAXNHBYDYRV-SECBINFHSA-N 1 1 243.734 2.248 20 10 BECDMO CC[C@@H]([NH2+][C@H]1C[C@@H](O)C1)c1ccc(F)cc1O ZINC000295919101 353813491 /nfs/dbraw/zinc/81/34/91/353813491.db2.gz JTRXPYBSRGOPAF-JFGNBEQYSA-N 1 1 239.290 2.095 20 10 BECDMO CCC[N@@H+](C)Cc1cc(OC)c(OC)cc1O ZINC000160028977 169081053 /nfs/dbraw/zinc/08/10/53/169081053.db2.gz CLOPTOXAGLCBBW-UHFFFAOYSA-N 1 1 239.315 2.251 20 10 BECDMO Oc1c(F)cccc1C[NH2+]C[C@H]1CCCOC1 ZINC000158729176 183255063 /nfs/dbraw/zinc/25/50/63/183255063.db2.gz PJQAILKCWHEDIR-SNVBAGLBSA-N 1 1 239.290 2.048 20 10 BECDMO Oc1c(F)cccc1C[NH2+]C[C@@H]1CCCOC1 ZINC000158729034 183255385 /nfs/dbraw/zinc/25/53/85/183255385.db2.gz PJQAILKCWHEDIR-JTQLQIEISA-N 1 1 239.290 2.048 20 10 BECDMO Oc1ccccc1C[N@@H+]1CC[C@@H](O)C12CCCC2 ZINC000293903224 183301335 /nfs/dbraw/zinc/30/13/35/183301335.db2.gz LFOUEJKYCYWWQC-CQSZACIVSA-N 1 1 247.338 2.272 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000361050124 183302472 /nfs/dbraw/zinc/30/24/72/183302472.db2.gz FUQBVQJKWDANNP-GXTWGEPZSA-N 1 1 247.338 2.251 20 10 BECDMO CCC[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000273393147 169275605 /nfs/dbraw/zinc/27/56/05/169275605.db2.gz LHLUHOAWMLGRPY-VIFPVBQESA-N 1 1 237.299 2.239 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]CCCN(C)C)c1 ZINC000035628700 383865386 /nfs/dbraw/zinc/86/53/86/383865386.db2.gz CXOGHPNKHUESQS-LBPRGKRZSA-N 1 1 236.359 2.303 20 10 BECDMO CC[C@@H](C[NH2+]Cc1cccc(F)c1O)OC ZINC000290371816 384029409 /nfs/dbraw/zinc/02/94/09/384029409.db2.gz AOTWVIIJNDFIDH-JTQLQIEISA-N 1 1 227.279 2.046 20 10 BECDMO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000093417620 384236018 /nfs/dbraw/zinc/23/60/18/384236018.db2.gz ODIYBPQUZMKDTA-OLZOCXBDSA-N 1 1 248.370 2.362 20 10 BECDMO CC(C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000161703385 384516529 /nfs/dbraw/zinc/51/65/29/384516529.db2.gz MADAEKASCDOQJW-UHFFFAOYSA-N 1 1 248.370 2.363 20 10 BECDMO C[C@H]([NH2+]C[C@@H]1CCCO1)c1ccc(F)cc1O ZINC000062744938 385183499 /nfs/dbraw/zinc/18/34/99/385183499.db2.gz CTJSTKHOGADAFO-ONGXEEELSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@@H]([NH2+][C@@H](C)CN(C)C)c1ccc(F)cc1O ZINC000168708700 385383435 /nfs/dbraw/zinc/38/34/35/385383435.db2.gz HWYMVHLKPPMZAN-VHSXEESVSA-N 1 1 240.322 2.132 20 10 BECDMO C[C@H]1OCC[N@H+](Cc2cc(F)ccc2O)[C@H]1C ZINC000180158747 385385968 /nfs/dbraw/zinc/38/59/68/385385968.db2.gz GQFYFYAWQJJAET-VHSXEESVSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@H]1OCC[N@@H+](Cc2cc(F)ccc2O)[C@H]1C ZINC000180158747 385385972 /nfs/dbraw/zinc/38/59/72/385385972.db2.gz GQFYFYAWQJJAET-VHSXEESVSA-N 1 1 239.290 2.141 20 10 BECDMO COC[C@@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000179573828 385474437 /nfs/dbraw/zinc/47/44/37/385474437.db2.gz DTTDDZXKWNCNEE-GFCCVEGCSA-N 1 1 235.327 2.251 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@@H]1CCC[NH+](C)C1 ZINC000179559528 385474467 /nfs/dbraw/zinc/47/44/67/385474467.db2.gz ARUUMLHQYHGOPO-CYBMUJFWSA-N 1 1 248.370 2.166 20 10 BECDMO CN1CCC[C@@H](C[N@H+](C)Cc2ccccc2O)C1 ZINC000179559528 385474475 /nfs/dbraw/zinc/47/44/75/385474475.db2.gz ARUUMLHQYHGOPO-CYBMUJFWSA-N 1 1 248.370 2.166 20 10 BECDMO CN1CCC[C@@H](C[N@@H+](C)Cc2ccccc2O)C1 ZINC000179559528 385474477 /nfs/dbraw/zinc/47/44/77/385474477.db2.gz ARUUMLHQYHGOPO-CYBMUJFWSA-N 1 1 248.370 2.166 20 10 BECDMO CC(C)COCC[N@@H+](C)Cc1ccccc1O ZINC000283150994 385809655 /nfs/dbraw/zinc/80/96/55/385809655.db2.gz CIDRMZSKQNOZCU-UHFFFAOYSA-N 1 1 237.343 2.497 20 10 BECDMO CC[C@H]([NH2+]CC[C@H](C)O)c1ccc(F)cc1O ZINC000285530963 385937551 /nfs/dbraw/zinc/93/75/51/385937551.db2.gz BQOKFDRPWBPVBG-CABZTGNLSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1cc(C[N@H+](C)Cc2ccccc2O)on1 ZINC000264722579 386267878 /nfs/dbraw/zinc/26/78/78/386267878.db2.gz PKQGGLMVLIWGGT-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)[C@@H]2CCC[C@H]2O)c1 ZINC000289199483 386270826 /nfs/dbraw/zinc/27/08/26/386270826.db2.gz BGPGVJSFYJTVNA-TZMCWYRMSA-N 1 1 235.327 2.046 20 10 BECDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(F)ccc2O)C1 ZINC000289579889 386328212 /nfs/dbraw/zinc/32/82/12/386328212.db2.gz TYAMHHCDCWOIGH-TXEJJXNPSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@H]([NH2+]Cc1cccc(F)c1O)[C@H]1CCOC1 ZINC000166137129 386474133 /nfs/dbraw/zinc/47/41/33/386474133.db2.gz GNBPFTMQXLZCFB-ONGXEEELSA-N 1 1 239.290 2.046 20 10 BECDMO CC[C@H](CO)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293615080 386661655 /nfs/dbraw/zinc/66/16/55/386661655.db2.gz MDDLUDMKGRNLGP-MRVPVSSYSA-N 1 1 247.697 2.045 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](O)CC2)cc1 ZINC000293021048 386765470 /nfs/dbraw/zinc/76/54/70/386765470.db2.gz FMFWLXDZPXIIFO-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO COC[C@H]1CC[N@H+]1Cc1cc(C)c(C)cc1O ZINC000293629402 386851109 /nfs/dbraw/zinc/85/11/09/386851109.db2.gz LHMJSQFXERGEQP-CYBMUJFWSA-N 1 1 235.327 2.230 20 10 BECDMO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)CN(C)C ZINC000293688662 388390381 /nfs/dbraw/zinc/39/03/81/388390381.db2.gz NQBQNBAREJFAMS-RYUDHWBXSA-N 1 1 236.359 2.241 20 10 BECDMO C[C@@H](CCCCO)[NH2+]Cc1cccc(F)c1O ZINC000294951809 388406868 /nfs/dbraw/zinc/40/68/68/388406868.db2.gz DDAMZSSTXIXUAI-JTQLQIEISA-N 1 1 241.306 2.172 20 10 BECDMO CN(C)c1ccc(C[N@H+](C)Cc2cc[nH]n2)cc1 ZINC000155184491 397750816 /nfs/dbraw/zinc/75/08/16/397750816.db2.gz NVXCMFHKYLJQOQ-UHFFFAOYSA-N 1 1 244.342 2.108 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc[nH]n2)cc1 ZINC000155184491 397750820 /nfs/dbraw/zinc/75/08/20/397750820.db2.gz NVXCMFHKYLJQOQ-UHFFFAOYSA-N 1 1 244.342 2.108 20 10 BECDMO CN(C)c1ccc(C[N@@H+](CCCO)C2CC2)cc1 ZINC000298682636 398023155 /nfs/dbraw/zinc/02/31/55/398023155.db2.gz AYELKBQYADMNTQ-UHFFFAOYSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](O)C[C@@H]2C)c1 ZINC000292812968 398109229 /nfs/dbraw/zinc/10/92/29/398109229.db2.gz OZPODOWNJDZUNX-AAEUAGOBSA-N 1 1 235.327 2.046 20 10 BECDMO CC(C)[C@@H](O)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168775498 167457212 /nfs/dbraw/zinc/45/72/12/167457212.db2.gz CJIZHXASSOJQQW-RNCFNFMXSA-N 1 1 241.306 2.199 20 10 BECDMO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccccc1O ZINC000131486947 171113444 /nfs/dbraw/zinc/11/34/44/171113444.db2.gz PPIWFNPWUHFHMM-DGCLKSJQSA-N 1 1 235.327 2.392 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@H](CO)[C@@H]2C)c1O ZINC001652321039 1173061497 /nfs/dbraw/zinc/06/14/97/1173061497.db2.gz HACBOJHHAYOREO-SMDDNHRTSA-N 1 1 249.354 2.157 20 10 BECDMO COCCCC[N@@H+](C)Cc1ccccc1O ZINC000117881615 174188847 /nfs/dbraw/zinc/18/88/47/174188847.db2.gz PKMSZJKDLLTXMP-UHFFFAOYSA-N 1 1 223.316 2.251 20 10 BECDMO COCCC[N@@H+](C)Cc1cc(C)ccc1O ZINC000132720121 174218530 /nfs/dbraw/zinc/21/85/30/174218530.db2.gz NVCRKSBVCJMEGS-UHFFFAOYSA-N 1 1 223.316 2.169 20 10 BECDMO COc1ccc(C[NH2+]Cc2cc[nH]n2)cc1C ZINC000041015508 175107770 /nfs/dbraw/zinc/10/77/70/175107770.db2.gz QHECXDNMBFWMBP-UHFFFAOYSA-N 1 1 231.299 2.017 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2C)c1 ZINC000132650526 175157345 /nfs/dbraw/zinc/15/73/45/175157345.db2.gz NAFSTUJLQKKTLR-SNVBAGLBSA-N 1 1 221.300 2.385 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)C[C@@H](C2CC2)O1 ZINC000366245717 176307119 /nfs/dbraw/zinc/30/71/19/176307119.db2.gz CQNMKKYRNFMGCC-ABAIWWIYSA-N 1 1 247.338 2.392 20 10 BECDMO C[C@H]1COCC[C@@H]1[NH2+]Cc1cccc(F)c1O ZINC000277660895 177294875 /nfs/dbraw/zinc/29/48/75/177294875.db2.gz ZTMKLWWHDFOHHY-CABZTGNLSA-N 1 1 239.290 2.046 20 10 BECDMO C[C@H]1OCC[N@H+](Cc2cc(F)ccc2O)[C@@H]1C ZINC000180158728 177398769 /nfs/dbraw/zinc/39/87/69/177398769.db2.gz GQFYFYAWQJJAET-NXEZZACHSA-N 1 1 239.290 2.141 20 10 BECDMO C[C@H]1OCC[N@@H+](Cc2cc(F)ccc2O)[C@@H]1C ZINC000180158728 177398771 /nfs/dbraw/zinc/39/87/71/177398771.db2.gz GQFYFYAWQJJAET-NXEZZACHSA-N 1 1 239.290 2.141 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](CC(C)(C)O)C2CC2)c1 ZINC000189947073 518189345 /nfs/dbraw/zinc/18/93/45/518189345.db2.gz ROSDUYYHHQISDQ-UHFFFAOYSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCC3(COC3)C2)cc1C ZINC000853594578 588749949 /nfs/dbraw/zinc/74/99/49/588749949.db2.gz GLMSFNJCTUAOCE-UHFFFAOYSA-N 1 1 247.338 2.231 20 10 BECDMO CNC[C@H](C)[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000854233137 588781242 /nfs/dbraw/zinc/78/12/42/588781242.db2.gz YCKQDCJQKOQWDE-RYUDHWBXSA-N 1 1 236.359 2.268 20 10 BECDMO CNC[C@@H](C)[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000854233240 588781570 /nfs/dbraw/zinc/78/15/70/588781570.db2.gz YCKQDCJQKOQWDE-VXGBXAGGSA-N 1 1 236.359 2.268 20 10 BECDMO Cc1nccnc1C[N@@H+](C)Cc1ccccc1O ZINC000857018308 588882667 /nfs/dbraw/zinc/88/26/67/588882667.db2.gz LTTRLSWHXSZTIR-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](C)[C@H](CO)C2)c1 ZINC000857061259 588884885 /nfs/dbraw/zinc/88/48/85/588884885.db2.gz NBBNZIYXJOKPNV-JSGCOSHPSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@@H+](CCO)C2CCC2)c(O)c1 ZINC000877465389 583316271 /nfs/dbraw/zinc/31/62/71/583316271.db2.gz WOUHMYIWOFVNBB-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO C[C@H]1OCC[C@@H]1C[N@@H+](C)Cc1ccccc1O ZINC000878241897 583368528 /nfs/dbraw/zinc/36/85/28/583368528.db2.gz JPZOQRFSRDSPEO-VXGBXAGGSA-N 1 1 235.327 2.249 20 10 BECDMO Cc1cccc(CN2C[C@H]3CCC[C@]3([NH3+])C2)c1O ZINC000857226682 588895891 /nfs/dbraw/zinc/89/58/91/588895891.db2.gz WHTHKVBDQVOSBJ-HIFRSBDPSA-N 1 1 246.354 2.014 20 10 BECDMO Cc1ccc(O)c(CN2C[C@@H]3CCC[C@@]3([NH3+])C2)c1 ZINC000857226428 588896058 /nfs/dbraw/zinc/89/60/58/588896058.db2.gz NUJFXYGVQPRETI-DZGCQCFKSA-N 1 1 246.354 2.014 20 10 BECDMO Cc1ccc(O)c(CN2C[C@H]3CCC[C@]3([NH3+])C2)c1 ZINC000857226429 588896163 /nfs/dbraw/zinc/89/61/63/588896163.db2.gz NUJFXYGVQPRETI-HIFRSBDPSA-N 1 1 246.354 2.014 20 10 BECDMO CCCN(Cc1cnc[nH]1)c1ccc(C[NH3+])cc1 ZINC000894570454 583485872 /nfs/dbraw/zinc/48/58/72/583485872.db2.gz WICCRSVYSDGBER-UHFFFAOYSA-N 1 1 244.342 2.285 20 10 BECDMO OC[C@@H]1CCCCC[N@H+]1Cc1ccccc1O ZINC000895151505 583606416 /nfs/dbraw/zinc/60/64/16/583606416.db2.gz JZMZNGLDCRNTKS-ZDUSSCGKSA-N 1 1 235.327 2.129 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CC[C@H](CF)C1 ZINC000895572489 583692028 /nfs/dbraw/zinc/69/20/28/583692028.db2.gz FCPLLSBZDHHCPZ-SNVBAGLBSA-N 1 1 239.290 2.192 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c1O ZINC000895778903 583726444 /nfs/dbraw/zinc/72/64/44/583726444.db2.gz IDRMZRPTQRGYSA-BETUJISGSA-N 1 1 249.379 2.495 20 10 BECDMO C[C@H]1COCC[C@@H]1[NH2+]Cc1c(O)cccc1F ZINC000896636374 583818905 /nfs/dbraw/zinc/81/89/05/583818905.db2.gz CCCVCQUKEHKJFA-CABZTGNLSA-N 1 1 239.290 2.046 20 10 BECDMO C[C@@H]1CC[C@@H]1[NH2+]Cc1c(O)cccc1F ZINC000896636884 583818932 /nfs/dbraw/zinc/81/89/32/583818932.db2.gz IJFZJJPOCSBGNZ-KCJUWKMLSA-N 1 1 209.264 2.419 20 10 BECDMO CC[C@H](COC)[NH2+]Cc1c(O)cccc1F ZINC000896636775 583819056 /nfs/dbraw/zinc/81/90/56/583819056.db2.gz HDKSWZSJXLTNRO-SECBINFHSA-N 1 1 227.279 2.046 20 10 BECDMO C[C@H]1CC[C@H]1[NH2+]Cc1c(O)cccc1F ZINC000896636882 583819091 /nfs/dbraw/zinc/81/90/91/583819091.db2.gz IJFZJJPOCSBGNZ-GZMMTYOYSA-N 1 1 209.264 2.419 20 10 BECDMO C[C@H]1C[C@H]([NH2+]Cc2c(O)cccc2F)CCO1 ZINC000896637510 583819769 /nfs/dbraw/zinc/81/97/69/583819769.db2.gz NYSCFAKKIXMKNQ-VHSXEESVSA-N 1 1 239.290 2.188 20 10 BECDMO CCOC[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896637954 583819866 /nfs/dbraw/zinc/81/98/66/583819866.db2.gz SNEUPKMXHZPPQG-VIFPVBQESA-N 1 1 227.279 2.046 20 10 BECDMO CCN(C)c1ccc([C@H](C)[NH2+]CC2(N)CC2)cc1 ZINC000902416295 584590171 /nfs/dbraw/zinc/59/01/71/584590171.db2.gz MNZICTSKDJXAQV-LBPRGKRZSA-N 1 1 247.386 2.285 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CC[C@@H]2CO)cc1C(C)C ZINC000902629710 584646145 /nfs/dbraw/zinc/64/61/45/584646145.db2.gz ILNXQHATZAEKJE-CYBMUJFWSA-N 1 1 249.354 2.391 20 10 BECDMO CC(C)([NH3+])CC[NH2+]Cc1c([O-])cccc1Cl ZINC000903939177 584823253 /nfs/dbraw/zinc/82/32/53/584823253.db2.gz SWIWYUWTWJUSAC-UHFFFAOYSA-N 1 1 242.750 2.263 20 10 BECDMO CC(C)([NH3+])CC[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000903938883 584824411 /nfs/dbraw/zinc/82/44/11/584824411.db2.gz OMLCXAJNQZZUFK-UHFFFAOYSA-N 1 1 242.750 2.263 20 10 BECDMO CC[C@@H](NCC[NH2+]C1CC1)c1ccccc1O ZINC000817952324 584991265 /nfs/dbraw/zinc/99/12/65/584991265.db2.gz DPZYGRWXEPPVLO-CYBMUJFWSA-N 1 1 234.343 2.185 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)N)c(O)c1C ZINC000817971485 584993491 /nfs/dbraw/zinc/99/34/91/584993491.db2.gz DMKROIUVTWFNDM-KOLCDFICSA-N 1 1 222.332 2.007 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)[C@@H](C)N)c(O)c1 ZINC000817977375 584994203 /nfs/dbraw/zinc/99/42/03/584994203.db2.gz JATZFBXBSZEMHT-UTUOFQBUSA-N 1 1 236.359 2.395 20 10 BECDMO CC[C@H](N)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000817980061 584994850 /nfs/dbraw/zinc/99/48/50/584994850.db2.gz RACLEPHSZDDBHW-AAEUAGOBSA-N 1 1 236.359 2.479 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@@H]3C[C@H]2CS3)c1O ZINC000839192879 585097963 /nfs/dbraw/zinc/09/79/63/585097963.db2.gz PXFLLVZWGYYBKW-RYUDHWBXSA-N 1 1 235.352 2.390 20 10 BECDMO Cc1cc(O)c(C[N@H+](CCO)C(C)C)cc1C ZINC000768176076 585533411 /nfs/dbraw/zinc/53/34/11/585533411.db2.gz YPTPZWLCUVBUGN-UHFFFAOYSA-N 1 1 237.343 2.212 20 10 BECDMO CC[N@@H+](Cc1c(O)cccc1OC)C1CC1 ZINC000768303617 585535445 /nfs/dbraw/zinc/53/54/45/585535445.db2.gz ZPDSDQDDTXTFFL-UHFFFAOYSA-N 1 1 221.300 2.385 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CCC1(C)C ZINC000769447148 585556581 /nfs/dbraw/zinc/55/65/81/585556581.db2.gz STYCCYIHZOTBPR-UHFFFAOYSA-N 1 1 221.300 2.385 20 10 BECDMO C[C@]1(O)CC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000769543272 585559305 /nfs/dbraw/zinc/55/93/05/585559305.db2.gz LSWCSAROSCOBNV-LBPRGKRZSA-N 1 1 241.718 2.002 20 10 BECDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCN(C2CC2)C1 ZINC000770511093 585575226 /nfs/dbraw/zinc/57/52/26/585575226.db2.gz ZRXBOZGMEZKHHU-CQSZACIVSA-N 1 1 246.354 2.061 20 10 BECDMO CN(Cc1ccccc1O)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000770511093 585575227 /nfs/dbraw/zinc/57/52/27/585575227.db2.gz ZRXBOZGMEZKHHU-CQSZACIVSA-N 1 1 246.354 2.061 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)CC2(O)CCC2)cc1 ZINC000771526765 585595727 /nfs/dbraw/zinc/59/57/27/585595727.db2.gz NNHDTURAKWSYLL-UHFFFAOYSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@@H](CCO)C2)c1O ZINC000775681232 585683222 /nfs/dbraw/zinc/68/32/22/585683222.db2.gz NRXRLOBGRXKHOD-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO COc1cc(O)c(C[N@@H+]2CC=CCC2)cc1OC ZINC000778577953 585737746 /nfs/dbraw/zinc/73/77/46/585737746.db2.gz XYWIMUXXPKLGDI-UHFFFAOYSA-N 1 1 249.310 2.171 20 10 BECDMO CC[C@]1(O)CC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000779219014 585747377 /nfs/dbraw/zinc/74/73/77/585747377.db2.gz KQFDLCXXEITWFC-HNNXBMFYSA-N 1 1 249.354 2.356 20 10 BECDMO Oc1ccccc1C[N@H+]1CCOCC2(CC2)C1 ZINC000783599444 585837626 /nfs/dbraw/zinc/83/76/26/585837626.db2.gz MZTXNGDOUWWGPJ-UHFFFAOYSA-N 1 1 233.311 2.005 20 10 BECDMO C[N@@H+](CCCCO)Cc1cc(Cl)ccc1O ZINC000788268814 585920342 /nfs/dbraw/zinc/92/03/42/585920342.db2.gz IRSPNXYMQFIGLC-UHFFFAOYSA-N 1 1 243.734 2.250 20 10 BECDMO Cc1nccc(C[N@H+](C)Cc2ccccc2O)n1 ZINC000796451942 586103601 /nfs/dbraw/zinc/10/36/01/586103601.db2.gz ZYYOJGDXVXTURT-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](O)C2(C)C)cc1C ZINC000812779311 586583951 /nfs/dbraw/zinc/58/39/51/586583951.db2.gz LUZNQEQNZDFJRE-CQSZACIVSA-N 1 1 249.354 2.354 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCNC2)c1 ZINC000817941156 586845398 /nfs/dbraw/zinc/84/53/98/586845398.db2.gz MWEWUJFWTRBAJE-RYUDHWBXSA-N 1 1 234.343 2.103 20 10 BECDMO CC[C@H](N[C@H]1CCC[NH2+]C1)c1ccc(C)cc1O ZINC000817941980 586845492 /nfs/dbraw/zinc/84/54/92/586845492.db2.gz VHJKYVLQGTUYHE-JSGCOSHPSA-N 1 1 248.370 2.493 20 10 BECDMO C[C@@H]([NH2+][C@@H]1CCCNC1)c1ccc(N(C)C)cc1 ZINC000817941370 586845500 /nfs/dbraw/zinc/84/55/00/586845500.db2.gz PBIUIBUHVRLDRO-TZMCWYRMSA-N 1 1 247.386 2.155 20 10 BECDMO CC[C@H](NC1C[NH2+]C1)c1cccc(Cl)c1O ZINC000817955806 586849908 /nfs/dbraw/zinc/84/99/08/586849908.db2.gz IEVDLTYLIXMNKK-NSHDSACASA-N 1 1 240.734 2.058 20 10 BECDMO Nc1ccc(CC[NH2+][C@@H]2CCCCC[C@H]2N)cc1 ZINC000817958235 586850498 /nfs/dbraw/zinc/85/04/98/586850498.db2.gz UHEDDEZSWOAXNZ-HUUCEWRRSA-N 1 1 247.386 2.061 20 10 BECDMO CC(C)[C@@H]([NH3+])CN[C@@H](C)c1cc(F)ccc1O ZINC000817958441 586850792 /nfs/dbraw/zinc/85/07/92/586850792.db2.gz JTJTYJJDPHKKOB-CABZTGNLSA-N 1 1 240.322 2.165 20 10 BECDMO Nc1ccc(CC[NH2+][C@H]2CCCCC[C@H]2N)cc1 ZINC000817958233 586850847 /nfs/dbraw/zinc/85/08/47/586850847.db2.gz UHEDDEZSWOAXNZ-CABCVRRESA-N 1 1 247.386 2.061 20 10 BECDMO CC[C@H]([NH2+]CC(C)(C)N)c1ccccc1O ZINC000817960907 586851823 /nfs/dbraw/zinc/85/18/23/586851823.db2.gz TZXIDJNZGGUQTB-NSHDSACASA-N 1 1 222.332 2.170 20 10 BECDMO C[C@@H](N[C@H](C[NH3+])C1CC1)c1ccc(N(C)C)cc1 ZINC000817961210 586852255 /nfs/dbraw/zinc/85/22/55/586852255.db2.gz VJZWNQZEVJKHQJ-IAQYHMDHSA-N 1 1 247.386 2.141 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]C[C@H](N)C2CC2)c(O)c1C ZINC000817964924 586854338 /nfs/dbraw/zinc/85/43/38/586854338.db2.gz JHKADVUGKOQZEE-RISCZKNCSA-N 1 1 248.370 2.397 20 10 BECDMO CC[C@@H](NCC(F)(F)C[NH3+])c1ccccc1O ZINC000817965841 586854773 /nfs/dbraw/zinc/85/47/73/586854773.db2.gz DAHBPKGJZMDECO-SNVBAGLBSA-N 1 1 244.285 2.027 20 10 BECDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)CN)cc1 ZINC000817966543 586854940 /nfs/dbraw/zinc/85/49/40/586854940.db2.gz PVDSDIKIKZAJEH-VXGBXAGGSA-N 1 1 235.375 2.141 20 10 BECDMO Cc1ccc(O)c([C@H](C)N[C@@H]2C[NH2+]CC[C@H]2C)c1 ZINC000817969316 586856340 /nfs/dbraw/zinc/85/63/40/586856340.db2.gz UOPTUHIOBYOFIV-MBNYWOFBSA-N 1 1 248.370 2.349 20 10 BECDMO CC[C@H](NC[C@@H](C)[NH3+])c1ccc(N(C)C)cc1 ZINC000817970868 586857218 /nfs/dbraw/zinc/85/72/18/586857218.db2.gz GLFUMVTYXRAJNB-RISCZKNCSA-N 1 1 235.375 2.141 20 10 BECDMO CC[C@H]([NH2+]C[C@@H](C)N)c1ccc(N(C)C)cc1 ZINC000817970868 586857220 /nfs/dbraw/zinc/85/72/20/586857220.db2.gz GLFUMVTYXRAJNB-RISCZKNCSA-N 1 1 235.375 2.141 20 10 BECDMO CCN[C@H](C)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000817971270 586857574 /nfs/dbraw/zinc/85/75/74/586857574.db2.gz BNOLPXQEKSURDH-VXGBXAGGSA-N 1 1 236.359 2.349 20 10 BECDMO CCN[C@H](C)C[NH2+][C@H](CC)c1ccccc1O ZINC000817972061 586859776 /nfs/dbraw/zinc/85/97/76/586859776.db2.gz JMRJTUOYVLHEIS-DGCLKSJQSA-N 1 1 236.359 2.431 20 10 BECDMO CCN[C@H](C)C[NH2+][C@@H](CC)c1ccccc1O ZINC000817972064 586859801 /nfs/dbraw/zinc/85/98/01/586859801.db2.gz JMRJTUOYVLHEIS-YPMHNXCESA-N 1 1 236.359 2.431 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)CO)cc1Cl ZINC000825916361 587345361 /nfs/dbraw/zinc/34/53/61/587345361.db2.gz MSKYQHZFBSNJJA-VIFPVBQESA-N 1 1 243.734 2.167 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)CC2=CCCOC2)c1 ZINC000827184471 587372262 /nfs/dbraw/zinc/37/22/62/587372262.db2.gz BBOWGOTVUVJWFA-UHFFFAOYSA-N 1 1 247.338 2.479 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c1 ZINC000827285248 587375107 /nfs/dbraw/zinc/37/51/07/587375107.db2.gz YZAQCAOSWVFUNR-UKRRQHHQSA-N 1 1 247.338 2.169 20 10 BECDMO CC[N@H+]1CCCC[C@@H]1C(=O)Nc1ccc(N)cc1 ZINC000832244838 587652400 /nfs/dbraw/zinc/65/24/00/587652400.db2.gz ZTOFDGMQZCZEMU-CYBMUJFWSA-N 1 1 247.342 2.082 20 10 BECDMO COCC[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835025825 587779176 /nfs/dbraw/zinc/77/91/76/587779176.db2.gz NTUYRNGIHJDPQO-WAYWQWQTSA-N 1 1 248.370 2.344 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@@H]1CCOC1 ZINC000840913050 587929715 /nfs/dbraw/zinc/92/97/15/587929715.db2.gz DIKMNSOFZZDGFR-OAHLLOKOSA-N 1 1 248.370 2.282 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)C[C@H](C)O)c(Cl)c1 ZINC000840939545 587930522 /nfs/dbraw/zinc/93/05/22/587930522.db2.gz NMXHHRIJMSTPGR-VIFPVBQESA-N 1 1 243.734 2.167 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@@H](CO)[C@@H]2C)c1O ZINC000840977807 587932870 /nfs/dbraw/zinc/93/28/70/587932870.db2.gz KBBHAFVJGTXXJZ-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CN)c1O ZINC000843052400 588077008 /nfs/dbraw/zinc/07/70/08/588077008.db2.gz SOEKPJDVWZKLTO-RISCZKNCSA-N 1 1 248.370 2.260 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCN[C@H](C)[C@H]2C)cc1C ZINC000843057494 588077766 /nfs/dbraw/zinc/07/77/66/588077766.db2.gz ILMUHFIUCMHQIZ-CHWSQXEVSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CCN[C@H](C)[C@H]2C)cc1C ZINC000843057494 588077767 /nfs/dbraw/zinc/07/77/67/588077767.db2.gz ILMUHFIUCMHQIZ-CHWSQXEVSA-N 1 1 248.370 2.191 20 10 BECDMO C[C@H](CCO)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000846111452 588257224 /nfs/dbraw/zinc/25/72/24/588257224.db2.gz PGEIAPCJCQUFMI-SECBINFHSA-N 1 1 243.734 2.248 20 10 BECDMO CCc1cccc(C[N@H+]2CCC[C@H](CO)C2)c1O ZINC000848876720 588416044 /nfs/dbraw/zinc/41/60/44/588416044.db2.gz KMESCJGJKNPLMD-LBPRGKRZSA-N 1 1 249.354 2.159 20 10 BECDMO CCc1cccc(C[N@@H+](CCO)CC2CC2)c1O ZINC000848883425 588416966 /nfs/dbraw/zinc/41/69/66/588416966.db2.gz NOTDSWIVSONNIR-UHFFFAOYSA-N 1 1 249.354 2.159 20 10 BECDMO CCc1cccc(C[N@H+]2C[C@@H](O)[C@@H](CC)C2)c1O ZINC000848891464 588417656 /nfs/dbraw/zinc/41/76/56/588417656.db2.gz YPFYFBSFSRJPNR-GXTWGEPZSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@H](O)C2(C)C)c1O ZINC000848913271 588420267 /nfs/dbraw/zinc/42/02/67/588420267.db2.gz SPMAKDBMHGHKDI-ZDUSSCGKSA-N 1 1 249.354 2.300 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000876512322 590206081 /nfs/dbraw/zinc/20/60/81/590206081.db2.gz LNESBUSUQIECAE-TXEJJXNPSA-N 1 1 235.327 2.310 20 10 BECDMO CO[C@H]1CCC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000876609383 590221725 /nfs/dbraw/zinc/22/17/25/590221725.db2.gz LYSXNLNVXBDIAQ-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2c(C)cccc2O)C1 ZINC000876610473 590221744 /nfs/dbraw/zinc/22/17/44/590221744.db2.gz VEHHZAFETSZPMQ-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(C[N@H+]2CCCO[C@H](C)C2)c(O)c1 ZINC000876684425 590230338 /nfs/dbraw/zinc/23/03/38/590230338.db2.gz MXUKSPWPRKENLT-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@H](CCO)C1 ZINC000876693195 590231154 /nfs/dbraw/zinc/23/11/54/590231154.db2.gz AZEKTYJRQCXVFZ-CYBMUJFWSA-N 1 1 249.354 2.295 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)Cc1ccon1 ZINC000876754662 590238531 /nfs/dbraw/zinc/23/85/31/590238531.db2.gz OMRBCYIZNFPCPX-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)Cc1ccon1 ZINC000876754662 590238533 /nfs/dbraw/zinc/23/85/33/590238533.db2.gz OMRBCYIZNFPCPX-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000876802919 590243617 /nfs/dbraw/zinc/24/36/17/590243617.db2.gz BMSYNVIUQWYUAD-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)C[C@@H]1CCC[C@H]1O ZINC000876802917 590243951 /nfs/dbraw/zinc/24/39/51/590243951.db2.gz BMSYNVIUQWYUAD-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c(O)c1 ZINC000876804919 590244490 /nfs/dbraw/zinc/24/44/90/590244490.db2.gz WCOSTJJWKMPLJR-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@@H+](C)C[C@@H]2CCC[C@H]2O)c(O)c1 ZINC000876804918 590244640 /nfs/dbraw/zinc/24/46/40/590244640.db2.gz WCOSTJJWKMPLJR-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[NH2+]C[C@@H]2CCCN(C)C2)c(O)c1 ZINC000877026512 590270852 /nfs/dbraw/zinc/27/08/52/590270852.db2.gz BNZFDDBWIDDWKV-ZDUSSCGKSA-N 1 1 248.370 2.132 20 10 BECDMO Cc1cccc(O)c1C[NH2+]C[C@@H]1CCCN(C)C1 ZINC000877027757 590271332 /nfs/dbraw/zinc/27/13/32/590271332.db2.gz RSIHPUUSGCSDED-ZDUSSCGKSA-N 1 1 248.370 2.132 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)Cc1nccn1C ZINC000877168943 590295718 /nfs/dbraw/zinc/29/57/18/590295718.db2.gz ADECCPPMWJGFDW-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000877423884 590325204 /nfs/dbraw/zinc/32/52/04/590325204.db2.gz NDEWXRDSRCAQQM-OAHLLOKOSA-N 1 1 247.338 2.311 20 10 BECDMO CC[C@@H]1CN(C)CC[N@H+]1Cc1ccc(C)cc1O ZINC000877553800 590356148 /nfs/dbraw/zinc/35/61/48/590356148.db2.gz YPRSQGUPYLJELG-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[NH2+]C(CF)CF)c(O)c1 ZINC000877559477 590358909 /nfs/dbraw/zinc/35/89/09/590358909.db2.gz OKMQXCNDTKSRIN-UHFFFAOYSA-N 1 1 215.243 2.098 20 10 BECDMO Cc1ccc(C[NH2+][C@H](C)c2csnn2)c(O)c1 ZINC000877589860 590368628 /nfs/dbraw/zinc/36/86/28/590368628.db2.gz MDMJJIKSNMJZDN-SECBINFHSA-N 1 1 249.339 2.403 20 10 BECDMO Cc1ccc(C[N@H+](C[C@H](C)O)C2CC2)c(O)c1 ZINC000877621327 590375571 /nfs/dbraw/zinc/37/55/71/590375571.db2.gz QOQZUWUBSMREDV-NSHDSACASA-N 1 1 235.327 2.046 20 10 BECDMO Oc1cccc2c1C[N@@H+](CC1(F)CC1)C2 ZINC000877702817 590395951 /nfs/dbraw/zinc/39/59/51/590395951.db2.gz IUAMELQGRQYQKL-UHFFFAOYSA-N 1 1 207.248 2.210 20 10 BECDMO CCn1cc(C[N@H+]2Cc3cccc(O)c3C2)cn1 ZINC000877702755 590396696 /nfs/dbraw/zinc/39/66/96/590396696.db2.gz GJPJZQBXNNFWKI-UHFFFAOYSA-N 1 1 243.310 2.124 20 10 BECDMO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)o1 ZINC000879649156 590841947 /nfs/dbraw/zinc/84/19/47/590841947.db2.gz MXRQGGXYAKRXST-RKDXNWHRSA-N 1 1 247.298 2.495 20 10 BECDMO Cc1noc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000879651636 590843474 /nfs/dbraw/zinc/84/34/74/590843474.db2.gz FCVCRJMTFRRGCD-IUCAKERBSA-N 1 1 247.298 2.495 20 10 BECDMO Cc1ccnc(C[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000879650702 590843652 /nfs/dbraw/zinc/84/36/52/590843652.db2.gz ORZPTDDKHUHROT-NSHDSACASA-N 1 1 243.310 2.341 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCC[C@](C)(O)C2)cc1C ZINC000129466829 591303350 /nfs/dbraw/zinc/30/33/50/591303350.db2.gz RHQYVWOMNYJJGF-HNNXBMFYSA-N 1 1 249.354 2.356 20 10 BECDMO C[N@@H+](Cc1ccccc1O)C1CCOCC1 ZINC000132632816 591725935 /nfs/dbraw/zinc/72/59/35/591725935.db2.gz PGTLNVWZWBEZAW-UHFFFAOYSA-N 1 1 221.300 2.003 20 10 BECDMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000134957949 591962967 /nfs/dbraw/zinc/96/29/67/591962967.db2.gz XJQQACHLYWFCSF-VHSXEESVSA-N 1 1 249.310 2.351 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@@H](C)O)C2)c1 ZINC000136823938 592151149 /nfs/dbraw/zinc/15/11/49/592151149.db2.gz FHYXHEGYJKYZLH-CHWSQXEVSA-N 1 1 249.354 2.293 20 10 BECDMO C[C@H]([NH2+]C[C@@H]1CCCO1)c1c(O)cccc1F ZINC000886489387 592236231 /nfs/dbraw/zinc/23/62/31/592236231.db2.gz HMYNUAKBIVXFCW-UWVGGRQHSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@H]([NH2+]Cc1ccnn1C)c1c(O)cccc1F ZINC000886501221 592239420 /nfs/dbraw/zinc/23/94/20/592239420.db2.gz BBOMRVJXYRJITE-VIFPVBQESA-N 1 1 249.289 2.116 20 10 BECDMO COC[C@@H](C)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886512685 592240219 /nfs/dbraw/zinc/24/02/19/592240219.db2.gz LATLAVKGPWWYCC-UWVGGRQHSA-N 1 1 241.306 2.464 20 10 BECDMO C[C@@H]([NH2+][C@@H]1CCCOC1)c1c(O)cccc1F ZINC000886525158 592246489 /nfs/dbraw/zinc/24/64/89/592246489.db2.gz YRITXULCOBEVQB-NXEZZACHSA-N 1 1 239.290 2.361 20 10 BECDMO C[C@@H]([NH2+][C@H]1CCCOC1)c1c(O)cccc1F ZINC000886525161 592246497 /nfs/dbraw/zinc/24/64/97/592246497.db2.gz YRITXULCOBEVQB-ZJUUUORDSA-N 1 1 239.290 2.361 20 10 BECDMO Cc1cc(C[NH2+][C@@H](C)c2c(O)cccc2F)[nH]n1 ZINC000886530399 592247636 /nfs/dbraw/zinc/24/76/36/592247636.db2.gz JETAHTSWRNCISS-VIFPVBQESA-N 1 1 249.289 2.414 20 10 BECDMO C[C@H](C[C@H](C)O)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886588618 592271026 /nfs/dbraw/zinc/27/10/26/592271026.db2.gz WBJYBMBFIHNQKN-UTLUCORTSA-N 1 1 241.306 2.341 20 10 BECDMO C[C@H](C[C@H](C)O)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886588616 592271349 /nfs/dbraw/zinc/27/13/49/592271349.db2.gz WBJYBMBFIHNQKN-KXUCPTDWSA-N 1 1 241.306 2.341 20 10 BECDMO C[C@@H]([NH2+]CCF)c1c(O)cccc1F ZINC000886604743 592272183 /nfs/dbraw/zinc/27/21/83/592272183.db2.gz BQZAUTPJNZHAHH-SSDOTTSWSA-N 1 1 201.216 2.151 20 10 BECDMO CC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)[C@H](C)O ZINC000886620473 592278265 /nfs/dbraw/zinc/27/82/65/592278265.db2.gz KQLZAJHKDCQOMW-YWVKMMECSA-N 1 1 241.306 2.341 20 10 BECDMO CO[C@@]1(C)C[C@H]1[NH2+][C@H](C)c1c(O)cccc1F ZINC000886640033 592285865 /nfs/dbraw/zinc/28/58/65/592285865.db2.gz PUXNFJKECLBQRE-DYLAAIIWSA-N 1 1 239.290 2.359 20 10 BECDMO C[N@H+](C[C@H]1C[C@@]12CCOC2)c1ccc(N)cc1 ZINC000886841613 592363478 /nfs/dbraw/zinc/36/34/78/592363478.db2.gz QVVZQIWXXBUWIX-BXUZGUMPSA-N 1 1 232.327 2.132 20 10 BECDMO C[N@@H+](C[C@H]1C[C@@]12CCOC2)c1ccc(N)cc1 ZINC000886841613 592363483 /nfs/dbraw/zinc/36/34/83/592363483.db2.gz QVVZQIWXXBUWIX-BXUZGUMPSA-N 1 1 232.327 2.132 20 10 BECDMO C[C@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000096942640 631656195 /nfs/dbraw/zinc/65/61/95/631656195.db2.gz VQVDRPCXQLOKPX-JTQLQIEISA-N 1 1 249.310 2.495 20 10 BECDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000091937869 632661325 /nfs/dbraw/zinc/66/13/25/632661325.db2.gz HOKHIFWFUMVSKX-AOOOYVTPSA-N 1 1 249.310 2.494 20 10 BECDMO Cc1cc(C)c(O)c(C[N@@H+]2CCOC[C@@H]2C)c1 ZINC000163979457 633067491 /nfs/dbraw/zinc/06/74/91/633067491.db2.gz BNTAYWWAJXXNHW-LBPRGKRZSA-N 1 1 235.327 2.230 20 10 BECDMO CO[C@H](C)C[N@@H+](C)Cc1cc(C)ccc1O ZINC000304662762 635947080 /nfs/dbraw/zinc/94/70/80/635947080.db2.gz WIUSUOJOKBFOJU-LLVKDONJSA-N 1 1 223.316 2.167 20 10 BECDMO CNC[C@@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000854232445 634052360 /nfs/dbraw/zinc/05/23/60/634052360.db2.gz PVGQMFBFBNCZRD-ZYHUDNBSSA-N 1 1 236.359 2.268 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+](C)C1CC(O)C1 ZINC000840938375 635182528 /nfs/dbraw/zinc/18/25/28/635182528.db2.gz CQQFWDGZGADINZ-UHFFFAOYSA-N 1 1 248.370 2.016 20 10 BECDMO C[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000005066610 635197478 /nfs/dbraw/zinc/19/74/78/635197478.db2.gz VNNZMNLBBBKVPM-SNVBAGLBSA-N 1 1 249.310 2.353 20 10 BECDMO CC[C@](C)(C[NH2+]Cc1cccc(F)c1O)OC ZINC000322658411 636877055 /nfs/dbraw/zinc/87/70/55/636877055.db2.gz ZMCUAFGADVBWBL-CYBMUJFWSA-N 1 1 241.306 2.436 20 10 BECDMO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000128520539 637084916 /nfs/dbraw/zinc/08/49/16/637084916.db2.gz MFVBBFJZHCPSBN-OLZOCXBDSA-N 1 1 248.370 2.362 20 10 BECDMO C[C@@H]([NH2+]Cc1nncs1)c1ccccc1O ZINC000931553607 640273631 /nfs/dbraw/zinc/27/36/31/640273631.db2.gz FNXREWRIZYBAJE-MRVPVSSYSA-N 1 1 235.312 2.095 20 10 BECDMO C[C@@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccccc1O ZINC000044534652 640397012 /nfs/dbraw/zinc/39/70/12/640397012.db2.gz GBFBEJFNKLDXOT-CHWSQXEVSA-N 1 1 248.370 2.385 20 10 BECDMO C[C@H](C[C@H](C)O)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000228090116 640860383 /nfs/dbraw/zinc/86/03/83/640860383.db2.gz KXTAITJSWQDOKA-UTLUCORTSA-N 1 1 241.306 2.341 20 10 BECDMO Nc1ccc([NH2+]C[C@@H]2CCSC2)cc1 ZINC000228546728 640879801 /nfs/dbraw/zinc/87/98/01/640879801.db2.gz XYXYCXZOUZUTQT-VIFPVBQESA-N 1 1 208.330 2.434 20 10 BECDMO C[C@@H]1OCC[C@]1(C)[NH2+]Cc1cccc(F)c1O ZINC000230392087 641048436 /nfs/dbraw/zinc/04/84/36/641048436.db2.gz BZMWWAOQYBIIMI-ZANVPECISA-N 1 1 239.290 2.188 20 10 BECDMO C[C@@H]1OCC[C@@]1(C)[NH2+]Cc1cccc(F)c1O ZINC000230392082 641049516 /nfs/dbraw/zinc/04/95/16/641049516.db2.gz BZMWWAOQYBIIMI-TVQRCGJNSA-N 1 1 239.290 2.188 20 10 BECDMO C[C@@H]([NH2+]CCn1cccn1)c1ccc(F)cc1O ZINC000062748151 641092021 /nfs/dbraw/zinc/09/20/21/641092021.db2.gz YFMBXGMVTOHYKQ-SNVBAGLBSA-N 1 1 249.289 2.079 20 10 BECDMO COc1cccc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)c1O ZINC000827506364 641365236 /nfs/dbraw/zinc/36/52/36/641365236.db2.gz GRZTWKYFMFGTPN-ZYHUDNBSSA-N 1 1 233.311 2.243 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)C[C@H]2CCOC2)cc1 ZINC000047706998 641658492 /nfs/dbraw/zinc/65/84/92/641658492.db2.gz UEXGCSIJYHSHFJ-CQSZACIVSA-N 1 1 248.370 2.221 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)CC2(CO)CC2)cc1C ZINC000188953170 641779343 /nfs/dbraw/zinc/77/93/43/641779343.db2.gz IPBRGEYVCRTQME-UHFFFAOYSA-N 1 1 249.354 2.213 20 10 BECDMO CC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000190695716 641881389 /nfs/dbraw/zinc/88/13/89/641881389.db2.gz UCILAGZUYGLNKB-UHFFFAOYSA-N 1 1 203.644 2.294 20 10 BECDMO COCCC[N@@H+](C)Cc1cc2c(cc1O)CCC2 ZINC000921187010 642583569 /nfs/dbraw/zinc/58/35/69/642583569.db2.gz AJSLXQYFTGJUBW-UHFFFAOYSA-N 1 1 249.354 2.349 20 10 BECDMO C[C@@H]([NH2+][C@@H](C)C[C@H](C)O)c1ccc(F)cc1O ZINC000252758374 643111238 /nfs/dbraw/zinc/11/12/38/643111238.db2.gz KXTAITJSWQDOKA-LPEHRKFASA-N 1 1 241.306 2.341 20 10 BECDMO C[C@@H]([NH2+][C@H]1CCC[C@@H]1O)c1ccc(F)cc1O ZINC000186066978 643436378 /nfs/dbraw/zinc/43/63/78/643436378.db2.gz IPILXKHCDRUQGR-ZHAHWJHGSA-N 1 1 239.290 2.095 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](O)[C@@H](C)C2)cc1C ZINC000249839895 644741645 /nfs/dbraw/zinc/74/16/45/644741645.db2.gz FWELMNFXNUXWTQ-GXTWGEPZSA-N 1 1 249.354 2.212 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCCNC2)c1 ZINC000817984662 644993878 /nfs/dbraw/zinc/99/38/78/644993878.db2.gz XDMQPFYHTKTWQT-CHWSQXEVSA-N 1 1 248.370 2.493 20 10 BECDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ncc[nH]1 ZINC000115629555 645669223 /nfs/dbraw/zinc/66/92/23/645669223.db2.gz YEMYFTFZFQUTJG-UHFFFAOYSA-N 1 1 244.342 2.074 20 10 BECDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCSC1 ZINC000708435901 712195219 /nfs/dbraw/zinc/19/52/19/712195219.db2.gz GRBALSZJNZCWKA-SECBINFHSA-N 1 1 245.294 2.266 20 10 BECDMO Oc1c(F)cc(F)cc1C[NH2+]CC1CSC1 ZINC000708494460 712212096 /nfs/dbraw/zinc/21/20/96/712212096.db2.gz KJHMCAZRYSTABI-UHFFFAOYSA-N 1 1 245.294 2.123 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCCOC[C@@H]2C)c1 ZINC000398952808 710910576 /nfs/dbraw/zinc/91/05/76/710910576.db2.gz SQOAFMJTLGMZLV-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO CN(C)c1ccc(C[N@H+](C)C2(C[NH3+])CCC2)cc1 ZINC000385258038 711008105 /nfs/dbraw/zinc/00/81/05/711008105.db2.gz XCKGUXIABCFXOZ-UHFFFAOYSA-N 1 1 247.386 2.066 20 10 BECDMO CN(C)c1ccc(C[N@H+](C)C2(CN)CCC2)cc1 ZINC000385258038 711008114 /nfs/dbraw/zinc/00/81/14/711008114.db2.gz XCKGUXIABCFXOZ-UHFFFAOYSA-N 1 1 247.386 2.066 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)C2(CN)CCC2)cc1 ZINC000385258038 711008119 /nfs/dbraw/zinc/00/81/19/711008119.db2.gz XCKGUXIABCFXOZ-UHFFFAOYSA-N 1 1 247.386 2.066 20 10 BECDMO Cc1cccc(C[NH2+][C@H](C)C(F)F)c1O ZINC000389971813 711101095 /nfs/dbraw/zinc/10/10/95/711101095.db2.gz VRHKGWUBSAQCQB-MRVPVSSYSA-N 1 1 215.243 2.444 20 10 BECDMO C[C@@H]([NH2+]Cc1cocn1)c1cc(F)ccc1O ZINC000397958472 711397447 /nfs/dbraw/zinc/39/74/47/711397447.db2.gz GOFUIVBGAVWBER-MRVPVSSYSA-N 1 1 236.246 2.370 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCCOC[C@H]2C)c1 ZINC000398952807 710909979 /nfs/dbraw/zinc/90/99/79/710909979.db2.gz SQOAFMJTLGMZLV-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2O)C[C@H]1C[NH3+] ZINC000397322904 711380275 /nfs/dbraw/zinc/38/02/75/711380275.db2.gz TYSPKHNEKYQMHF-YRGRVCCFSA-N 1 1 248.370 2.197 20 10 BECDMO C[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2[O-])C[C@H]1C[NH3+] ZINC000397322904 711380278 /nfs/dbraw/zinc/38/02/78/711380278.db2.gz TYSPKHNEKYQMHF-YRGRVCCFSA-N 1 1 248.370 2.197 20 10 BECDMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2[O-])C[C@H]1C[NH3+] ZINC000397322904 711380281 /nfs/dbraw/zinc/38/02/81/711380281.db2.gz TYSPKHNEKYQMHF-YRGRVCCFSA-N 1 1 248.370 2.197 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c1 ZINC000724813723 711616621 /nfs/dbraw/zinc/61/66/21/711616621.db2.gz GZLHDVCLYGEUPI-DOMZBBRYSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1cccc(C[N@H+](C)C[C@@H]2CCCN2C)c1O ZINC000160248597 711806313 /nfs/dbraw/zinc/80/63/13/711806313.db2.gz MMQIZXUVCORDSQ-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(CN(C)C[C@@H]2CCC[N@@H+]2C)c1O ZINC000160248597 711806314 /nfs/dbraw/zinc/80/63/14/711806314.db2.gz MMQIZXUVCORDSQ-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(CN(C)C[C@@H]2CCC[N@H+]2C)c1O ZINC000160248597 711806315 /nfs/dbraw/zinc/80/63/15/711806315.db2.gz MMQIZXUVCORDSQ-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO CCO[C@H]1CC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000701662464 712026872 /nfs/dbraw/zinc/02/68/72/712026872.db2.gz PVIXDAAGQJUOTE-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO COCCCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000708486902 712211049 /nfs/dbraw/zinc/21/10/49/712211049.db2.gz SBWPUJMGPNREIA-UHFFFAOYSA-N 1 1 245.269 2.187 20 10 BECDMO Cc1c[nH]nc1C[NH2+][C@@H](C)c1ccccc1O ZINC000716483456 712565312 /nfs/dbraw/zinc/56/53/12/712565312.db2.gz OCGWHHFWIQNJQJ-JTQLQIEISA-N 1 1 231.299 2.275 20 10 BECDMO Cc1c[nH]nc1C[NH2+][C@H](C)c1ccccc1O ZINC000716483458 712565415 /nfs/dbraw/zinc/56/54/15/712565415.db2.gz OCGWHHFWIQNJQJ-SNVBAGLBSA-N 1 1 231.299 2.275 20 10 BECDMO C[C@@H]1CC[N@H+](Cc2cccc(F)c2O)CCO1 ZINC000720482331 712847024 /nfs/dbraw/zinc/84/70/24/712847024.db2.gz KPALDNHYDYJACI-SNVBAGLBSA-N 1 1 239.290 2.142 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2cccc(F)c2O)CCO1 ZINC000720482331 712847025 /nfs/dbraw/zinc/84/70/25/712847025.db2.gz KPALDNHYDYJACI-SNVBAGLBSA-N 1 1 239.290 2.142 20 10 BECDMO CCOc1cccc(C[N@H+]2CC[C@H]2C)c1O ZINC001203602452 966701744 /nfs/dbraw/zinc/70/17/44/966701744.db2.gz XUTDSRPDLROPPF-SNVBAGLBSA-N 1 1 221.300 2.385 20 10 BECDMO CC[C@@H](C)[N@@H+](C)Cc1ccc(O)cc1O ZINC001204273549 966950032 /nfs/dbraw/zinc/95/00/32/966950032.db2.gz REKDJVLHSPGNGN-SECBINFHSA-N 1 1 209.289 2.328 20 10 BECDMO C[C@@H]1CCC[N@H+]1Cc1ccc(O)cc1O ZINC001204272545 966952966 /nfs/dbraw/zinc/95/29/66/966952966.db2.gz PZLZPLNKAJPHPT-SECBINFHSA-N 1 1 207.273 2.082 20 10 BECDMO C[C@@H]1C[C@H]([NH2+]Cc2cccc(F)c2O)[C@H](C)O1 ZINC000395192553 1166709348 /nfs/dbraw/zinc/70/93/48/1166709348.db2.gz XCRKXCDMBFACRY-PTRXPTGYSA-N 1 1 239.290 2.187 20 10 BECDMO C[N@H+](Cc1ccc(N)cc1)C[C@@H]1CCCC[C@H]1O ZINC000385577957 1167395681 /nfs/dbraw/zinc/39/56/81/1167395681.db2.gz FDAFYLHNPBLLBK-DZGCQCFKSA-N 1 1 248.370 2.252 20 10 BECDMO CC[C@H](C)[N@@H+](C)Cc1cc(OC)c(O)cc1O ZINC001231633768 977655348 /nfs/dbraw/zinc/65/53/48/977655348.db2.gz WSQUKYUCXMUWRU-VIFPVBQESA-N 1 1 239.315 2.337 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@H](O)[C@@H](C)C2)c1O ZINC001231590724 1167661090 /nfs/dbraw/zinc/66/10/90/1167661090.db2.gz GAYGXLIORJGJMP-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO CC(C)Cn1ccc(C2=C[NH2+]CCC2)cc1=O ZINC001243952070 971052565 /nfs/dbraw/zinc/05/25/65/971052565.db2.gz OSKCWAIZLAILDM-UHFFFAOYSA-N 1 1 232.327 2.229 20 10 BECDMO C[N@@H+](Cc1ccccc1O)[C@@H]1COC(C)(C)C1 ZINC000396497436 956883966 /nfs/dbraw/zinc/88/39/66/956883966.db2.gz HJTZRQBSXQVGBR-LBPRGKRZSA-N 1 1 235.327 2.392 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@@H]2CO)c1 ZINC001140617471 960459885 /nfs/dbraw/zinc/45/98/85/960459885.db2.gz QGKAEMXSCXJOCT-CYBMUJFWSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@]3(CCCO3)C2)c1 ZINC001140619692 960461918 /nfs/dbraw/zinc/46/19/18/960461918.db2.gz KTKVOQHTHRHVAI-OAHLLOKOSA-N 1 1 247.338 2.456 20 10 BECDMO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1cc(C)ccc1O)C2 ZINC001140622589 960464380 /nfs/dbraw/zinc/46/43/80/960464380.db2.gz BGHOMMDBDPFMAE-ZFWWWQNUSA-N 1 1 247.338 2.454 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2[C@@H](C)CC[C@H]2CO)c1 ZINC001140619794 960465080 /nfs/dbraw/zinc/46/50/80/960465080.db2.gz OYLOKUVKYAZAIQ-AAEUAGOBSA-N 1 1 235.327 2.046 20 10 BECDMO CC(=O)[C@@H]1CC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC001140623950 960465630 /nfs/dbraw/zinc/46/56/30/960465630.db2.gz YTNRMPMSMXNMJK-GFCCVEGCSA-N 1 1 233.311 2.112 20 10 BECDMO Cc1ccc(O)c(C[N@H+](CCCO)C(C)C)c1 ZINC001140621309 960467193 /nfs/dbraw/zinc/46/71/93/960467193.db2.gz VHZSJFRGXQTUFH-UHFFFAOYSA-N 1 1 237.343 2.293 20 10 BECDMO CCC[N@@H+](C)Cc1ccc(O)c(C)c1O ZINC001140742423 960541305 /nfs/dbraw/zinc/54/13/05/960541305.db2.gz NWZZKPQHWHWZJI-UHFFFAOYSA-N 1 1 209.289 2.248 20 10 BECDMO Cc1c(O)ccc(C[N@H+](C)C2CC2)c1O ZINC001140742557 960545083 /nfs/dbraw/zinc/54/50/83/960545083.db2.gz RWXXPKFTHCXBBK-UHFFFAOYSA-N 1 1 207.273 2.000 20 10 BECDMO Cc1c(O)ccc(C[N@H+](C)C(C)C)c1O ZINC001140742532 960546389 /nfs/dbraw/zinc/54/63/89/960546389.db2.gz RBPFDBMCZVEFRH-UHFFFAOYSA-N 1 1 209.289 2.246 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC(=O)[C@H](C)C2)c(O)c1 ZINC001140947697 960734644 /nfs/dbraw/zinc/73/46/44/960734644.db2.gz BAQPKSWFIIVBOM-LLVKDONJSA-N 1 1 233.311 2.112 20 10 BECDMO Cc1ccc(C[N@H+]2CCC(=O)[C@H](C)C2)c(O)c1 ZINC001140947697 960734658 /nfs/dbraw/zinc/73/46/58/960734658.db2.gz BAQPKSWFIIVBOM-LLVKDONJSA-N 1 1 233.311 2.112 20 10 BECDMO CC[N@@H+](CCN(C)C)Cc1ccc(C)cc1O ZINC001140948537 960742364 /nfs/dbraw/zinc/74/23/64/960742364.db2.gz MQXOGVVWDLHDJO-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO CCN(CC[NH+](C)C)Cc1ccc(C)cc1O ZINC001140948537 960742372 /nfs/dbraw/zinc/74/23/72/960742372.db2.gz MQXOGVVWDLHDJO-UHFFFAOYSA-N 1 1 236.359 2.084 20 10 BECDMO Cc1ccc(C[N@@H+](C)Cc2ccno2)c(O)c1 ZINC001140953580 960763872 /nfs/dbraw/zinc/76/38/72/960763872.db2.gz CITQERZASQBLLM-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO C[C@H]1CCC[N@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141138914 960885199 /nfs/dbraw/zinc/88/51/99/960885199.db2.gz DAVCDPCOTBNSGC-LBPRGKRZSA-N 1 1 246.354 2.500 20 10 BECDMO CC[C@H](C)[N@@H+](C)Cc1cc(O)ccc1O ZINC001141157449 960894273 /nfs/dbraw/zinc/89/42/73/960894273.db2.gz IHAHLHBRGWHRPN-VIFPVBQESA-N 1 1 209.289 2.328 20 10 BECDMO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(O)ccc1O ZINC001141160993 960896071 /nfs/dbraw/zinc/89/60/71/960896071.db2.gz MIDOAWPLUURFBC-CYBMUJFWSA-N 1 1 249.310 2.041 20 10 BECDMO CC(=O)[C@H]1CCCC[N@H+]1Cc1cc(O)ccc1O ZINC001141160993 960896072 /nfs/dbraw/zinc/89/60/72/960896072.db2.gz MIDOAWPLUURFBC-CYBMUJFWSA-N 1 1 249.310 2.041 20 10 BECDMO C[N@@H+](Cc1cc(O)ccc1O)C1CCCC1 ZINC001141159666 960896477 /nfs/dbraw/zinc/89/64/77/960896477.db2.gz JCKFLIMZIFBZKO-UHFFFAOYSA-N 1 1 221.300 2.472 20 10 BECDMO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(O)ccc1O ZINC001141160994 960896674 /nfs/dbraw/zinc/89/66/74/960896674.db2.gz MIDOAWPLUURFBC-ZDUSSCGKSA-N 1 1 249.310 2.041 20 10 BECDMO CC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(O)ccc1O ZINC001141160994 960896675 /nfs/dbraw/zinc/89/66/75/960896675.db2.gz MIDOAWPLUURFBC-ZDUSSCGKSA-N 1 1 249.310 2.041 20 10 BECDMO Oc1ccc(O)c(C[N@@H+](CC2CC2)C2CC2)c1 ZINC001141161909 960897200 /nfs/dbraw/zinc/89/72/00/960897200.db2.gz HJQDJPIBEKYZQJ-UHFFFAOYSA-N 1 1 233.311 2.472 20 10 BECDMO CC[C@@H]1CC[N@@H+](Cc2cc(O)ccc2O)C1 ZINC001141162695 960901474 /nfs/dbraw/zinc/90/14/74/960901474.db2.gz ABDFYKFXSIDPGG-SNVBAGLBSA-N 1 1 221.300 2.330 20 10 BECDMO Cc1cc(C)c(C[N@H+]2CCC[C@@](C)(O)C2)c(O)c1 ZINC001231847394 965287916 /nfs/dbraw/zinc/28/79/16/965287916.db2.gz YGXRUGXLAOWHMM-OAHLLOKOSA-N 1 1 249.354 2.356 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2CCNC(C)(C)C2)c1O ZINC001235834077 966117773 /nfs/dbraw/zinc/11/77/73/966117773.db2.gz JAVXNUCPSYTMMW-UHFFFAOYSA-N 1 1 248.370 2.193 20 10 BECDMO Cc1ccc(C)c(CN2CC[NH2+]C(C)(C)C2)c1O ZINC001235834077 966117779 /nfs/dbraw/zinc/11/77/79/966117779.db2.gz JAVXNUCPSYTMMW-UHFFFAOYSA-N 1 1 248.370 2.193 20 10 BECDMO CCc1ccc(C[N@H+]2CCCC[C@@H]2CO)c(O)c1 ZINC001236783716 966533250 /nfs/dbraw/zinc/53/32/50/966533250.db2.gz OKYANYSYBJLLPM-CQSZACIVSA-N 1 1 249.354 2.301 20 10 BECDMO CC(C)c1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)c(O)c1 ZINC001237055373 966630195 /nfs/dbraw/zinc/63/01/95/966630195.db2.gz NLKNLUKEDGBYTH-HIFRSBDPSA-N 1 1 247.338 2.489 20 10 BECDMO CC(C)c1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)c(O)c1 ZINC001237055373 966630204 /nfs/dbraw/zinc/63/02/04/966630204.db2.gz NLKNLUKEDGBYTH-HIFRSBDPSA-N 1 1 247.338 2.489 20 10 BECDMO C[C@@H]1CC[N@@H+](Cc2ccccc2O)CC[C@@]1(C)O ZINC001203550363 966677733 /nfs/dbraw/zinc/67/77/33/966677733.db2.gz TWQILBFSKIMRGC-IUODEOHRSA-N 1 1 249.354 2.375 20 10 BECDMO CC[C@@H](C)[N@@H+](C)Cc1ccc(O)c(O)c1 ZINC001203878977 966805690 /nfs/dbraw/zinc/80/56/90/966805690.db2.gz YWHKSRDWIKIADC-SECBINFHSA-N 1 1 209.289 2.328 20 10 BECDMO Oc1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@H]3F)cc1O ZINC001203879399 966805784 /nfs/dbraw/zinc/80/57/84/966805784.db2.gz PJESWLKCHLIBMD-GARJFASQSA-N 1 1 237.274 2.030 20 10 BECDMO Oc1ccc(C[N@H+]2CCC3(CC3)C2)cc1O ZINC001203875796 966807084 /nfs/dbraw/zinc/80/70/84/966807084.db2.gz VKRCBQHKYSGBNG-UHFFFAOYSA-N 1 1 219.284 2.084 20 10 BECDMO CC(C)C[N@@H+](C)Cc1ccc(O)cc1O ZINC001204272459 966952272 /nfs/dbraw/zinc/95/22/72/966952272.db2.gz OGQAJLVNPKTDIU-UHFFFAOYSA-N 1 1 209.289 2.186 20 10 BECDMO CC1CC([N@@H+](C)Cc2ccc(O)cc2O)C1 ZINC001204276248 966952606 /nfs/dbraw/zinc/95/26/06/966952606.db2.gz IFHBSIUQYCTIPE-UHFFFAOYSA-N 1 1 221.300 2.328 20 10 BECDMO COC1C[NH+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204320191 966967624 /nfs/dbraw/zinc/96/76/24/966967624.db2.gz OEONQNQZEAYBDR-UHFFFAOYSA-N 1 1 246.354 2.117 20 10 BECDMO COCC[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001204319989 966971607 /nfs/dbraw/zinc/97/16/07/966971607.db2.gz KSTXAGXDODAKCZ-UHFFFAOYSA-N 1 1 248.370 2.365 20 10 BECDMO CCC[N@@H+](CC)Cc1cc(O)c(O)c(OC)c1 ZINC001204340103 966973077 /nfs/dbraw/zinc/97/30/77/966973077.db2.gz CGBSBBFTWYTIMX-UHFFFAOYSA-N 1 1 239.315 2.338 20 10 BECDMO CC[N@@H+](Cc1cc(O)c(O)c(OC)c1)C1CC1 ZINC001204341742 966977634 /nfs/dbraw/zinc/97/76/34/966977634.db2.gz FVXNOPPJYSLVHS-UHFFFAOYSA-N 1 1 237.299 2.091 20 10 BECDMO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1ccccc1O)C2 ZINC001203558737 967024930 /nfs/dbraw/zinc/02/49/30/967024930.db2.gz ZGESHSLXJCJUSH-JSGCOSHPSA-N 1 1 233.311 2.146 20 10 BECDMO Cc1cccc(C[N@H+]2C[C@H](C)CC[C@@H]2CN)c1O ZINC001205829639 967842774 /nfs/dbraw/zinc/84/27/74/967842774.db2.gz PIBWAHPFZQWPTO-BXUZGUMPSA-N 1 1 248.370 2.260 20 10 BECDMO CC[N@@H+](Cc1ccnn1C)Cc1ccccc1O ZINC001206355689 968253039 /nfs/dbraw/zinc/25/30/39/968253039.db2.gz WWXFYLUTXQWNMK-UHFFFAOYSA-N 1 1 245.326 2.148 20 10 BECDMO Oc1cc(O)c(C[N@H+]2CC3CCC2CC3)c(O)c1 ZINC001144514967 972856442 /nfs/dbraw/zinc/85/64/42/972856442.db2.gz ZLBPBDYHXMWYRF-UHFFFAOYSA-N 1 1 249.310 2.178 20 10 BECDMO COc1ccc(N2CC[C@H]3C[N@@H+](C)C[C@H]32)c(C)c1 ZINC001277019215 974187196 /nfs/dbraw/zinc/18/71/96/974187196.db2.gz WWMMFGHYOVHPPI-SWLSCSKDSA-N 1 1 246.354 2.144 20 10 BECDMO CC1(C)C[C@H]([N@H+]2CCc3cccc(O)c3C2)CO1 ZINC001172294128 974558965 /nfs/dbraw/zinc/55/89/65/974558965.db2.gz VGAGBKKOCLTVRT-LBPRGKRZSA-N 1 1 247.338 2.318 20 10 BECDMO COC1(C[NH2+]Cc2c(O)cccc2F)CCC1 ZINC001333810733 976099561 /nfs/dbraw/zinc/09/95/61/976099561.db2.gz ZGFIJQGKXIINGR-UHFFFAOYSA-N 1 1 239.290 2.190 20 10 BECDMO Nc1ccc(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)cc1 ZINC001334775441 976640478 /nfs/dbraw/zinc/64/04/78/976640478.db2.gz XYRQEMRXKKCFTQ-ZFWWWQNUSA-N 1 1 246.354 2.270 20 10 BECDMO Nc1ccc(C[N@H+]2CC[C@@H]3CSC[C@@H]3C2)cc1 ZINC001335289564 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/nfs/dbraw/zinc/63/79/01/583637901.db2.gz ATJYVXRXHURGTO-GFCCVEGCSA-N 1 1 236.359 2.130 20 10 BECDMO Oc1cccc(F)c1C[NH2+]CC1(F)CC1 ZINC000896636207 583818884 /nfs/dbraw/zinc/81/88/84/583818884.db2.gz AJYLDQXVBIQBMH-UHFFFAOYSA-N 1 1 213.227 2.123 20 10 BECDMO C[C@@H]1C[C@H]1C[NH2+]Cc1c(O)cccc1F ZINC000896637268 583819478 /nfs/dbraw/zinc/81/94/78/583819478.db2.gz LKUSFWSRNAPHOI-BDAKNGLRSA-N 1 1 209.264 2.277 20 10 BECDMO CCOC[C@@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896637953 583819560 /nfs/dbraw/zinc/81/95/60/583819560.db2.gz SNEUPKMXHZPPQG-SECBINFHSA-N 1 1 227.279 2.046 20 10 BECDMO C[C@H]([NH2+]Cc1c(O)cccc1F)C1CC1 ZINC000896638466 583819614 /nfs/dbraw/zinc/81/96/14/583819614.db2.gz UVVCSGOAPKNZAY-QMMMGPOBSA-N 1 1 209.264 2.419 20 10 BECDMO Oc1cccc(F)c1C[NH2+]C[C@H]1CCCOC1 ZINC000896637952 583819823 /nfs/dbraw/zinc/81/98/23/583819823.db2.gz SLAUPMWKPYCONS-SNVBAGLBSA-N 1 1 239.290 2.048 20 10 BECDMO C[C@H]1OCC[C@H]1C[N@H+](C)c1ccc(N)cc1 ZINC000866667918 584121611 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/nfs/dbraw/zinc/55/82/38/585558238.db2.gz UZDCBIAYBYFTKE-UHFFFAOYSA-N 1 1 243.734 2.250 20 10 BECDMO Cc1cccc(C[N@H+]2CCN(C)[C@H](C)[C@@H]2C)c1O ZINC000775985814 585688845 /nfs/dbraw/zinc/68/88/45/585688845.db2.gz OLOBGHLCSWHDES-OLZOCXBDSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@H]([C@H](C)O)C2)c1O ZINC000780893350 585785913 /nfs/dbraw/zinc/78/59/13/585785913.db2.gz WCXSXCUDTVXVFN-STQMWFEESA-N 1 1 249.354 2.293 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)[C@@H](C)[C@H](C)O1 ZINC000783738511 585841402 /nfs/dbraw/zinc/84/14/02/585841402.db2.gz WPPUDUOEXWEWPO-WOPDTQHZSA-N 1 1 235.327 2.390 20 10 BECDMO CN(C)c1ccc(C[N@H+](C)Cc2c[nH]cn2)cc1 ZINC000796439442 586103230 /nfs/dbraw/zinc/10/32/30/586103230.db2.gz PCGSYNACCLLQBJ-UHFFFAOYSA-N 1 1 244.342 2.108 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)Cc2c[nH]cn2)cc1 ZINC000796439442 586103231 /nfs/dbraw/zinc/10/32/31/586103231.db2.gz PCGSYNACCLLQBJ-UHFFFAOYSA-N 1 1 244.342 2.108 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCN[C@@H](C(C)C)C2)c1 ZINC000843103682 586367784 /nfs/dbraw/zinc/36/77/84/586367784.db2.gz DGQAHXLLVGGAPK-CQSZACIVSA-N 1 1 248.370 2.130 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCN[C@@H](C(C)C)C2)c1 ZINC000843103682 586367785 /nfs/dbraw/zinc/36/77/85/586367785.db2.gz DGQAHXLLVGGAPK-CQSZACIVSA-N 1 1 248.370 2.130 20 10 BECDMO Oc1cc2c(cc1C[N@H+]1CC[C@H](F)C1)CCC2 ZINC000840105693 586447590 /nfs/dbraw/zinc/44/75/90/586447590.db2.gz PYYCBSOCQVDOEF-ZDUSSCGKSA-N 1 1 235.302 2.425 20 10 BECDMO Cc1cc(C[N@@H+]2C[C@@H](O)C[C@H]2C)ccc1N(C)C ZINC000815079562 586666122 /nfs/dbraw/zinc/66/61/22/586666122.db2.gz SEPYIBASCMARIS-OCCSQVGLSA-N 1 1 248.370 2.016 20 10 BECDMO Oc1c(C[N@@H+]2CC[C@@H](O)C2)ccc2ccccc21 ZINC000816483898 586735873 /nfs/dbraw/zinc/73/58/73/586735873.db2.gz JGDFURKKSFCBOG-CYBMUJFWSA-N 1 1 243.306 2.112 20 10 BECDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCOC1 ZINC000816557809 586740758 /nfs/dbraw/zinc/74/07/58/586740758.db2.gz BSKINCFRWVZVKK-QMMMGPOBSA-N 1 1 245.681 2.063 20 10 BECDMO C[C@@H](O)CC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816556532 586740809 /nfs/dbraw/zinc/74/08/09/586740809.db2.gz LWBOJOWHHSHGPB-SSDOTTSWSA-N 1 1 247.697 2.045 20 10 BECDMO COc1ccc(O)c(C[N@H+]2C[C@@H](C)[C@H]2C)c1 ZINC000816648719 586751641 /nfs/dbraw/zinc/75/16/41/586751641.db2.gz OAZCILCFXPCRTH-NXEZZACHSA-N 1 1 221.300 2.241 20 10 BECDMO OCC[C@H]1CCC[N@@H+](Cc2ccccc2O)CC1 ZINC000817418970 586803258 /nfs/dbraw/zinc/80/32/58/586803258.db2.gz MSBNOZJDGGJSAP-ZDUSSCGKSA-N 1 1 249.354 2.377 20 10 BECDMO C[C@@H](NC1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817935072 586843250 /nfs/dbraw/zinc/84/32/50/586843250.db2.gz FVVRQBGBBNPQGP-GFCCVEGCSA-N 1 1 247.386 2.155 20 10 BECDMO C[NH2+]CCC[NH2+][C@H](C)c1cc(Cl)ccc1[O-] ZINC000817939615 586844699 /nfs/dbraw/zinc/84/46/99/586844699.db2.gz GGWAAUZYFJRMOU-SECBINFHSA-N 1 1 242.750 2.306 20 10 BECDMO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCCNC2)c(O)c1 ZINC000817941536 586844962 /nfs/dbraw/zinc/84/49/62/586844962.db2.gz RFIFEOLQFJOTDR-STQMWFEESA-N 1 1 248.370 2.412 20 10 BECDMO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCCNC2)c(O)c1 ZINC000817941531 586845211 /nfs/dbraw/zinc/84/52/11/586845211.db2.gz RFIFEOLQFJOTDR-CHWSQXEVSA-N 1 1 248.370 2.412 20 10 BECDMO CCNCC[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000817951192 586848009 /nfs/dbraw/zinc/84/80/09/586848009.db2.gz AZTJFUHQAZDUND-CYBMUJFWSA-N 1 1 236.359 2.351 20 10 BECDMO CNCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000817953653 586849484 /nfs/dbraw/zinc/84/94/84/586849484.db2.gz ROLYLCWNRFFCEB-LLVKDONJSA-N 1 1 248.370 2.141 20 10 BECDMO CC(C)[C@H]([NH3+])CN[C@@H](C)c1cc(F)ccc1O ZINC000817958443 586850713 /nfs/dbraw/zinc/85/07/13/586850713.db2.gz JTJTYJJDPHKKOB-JOYOIKCWSA-N 1 1 240.322 2.165 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](N)C(C)C)c1 ZINC000817958500 586850812 /nfs/dbraw/zinc/85/08/12/586850812.db2.gz KIAIGISKBRTAMW-WCQYABFASA-N 1 1 236.359 2.335 20 10 BECDMO Cc1ccc(O)c([C@H](C)NC[C@@H]([NH3+])C(C)C)c1 ZINC000817958500 586850813 /nfs/dbraw/zinc/85/08/13/586850813.db2.gz KIAIGISKBRTAMW-WCQYABFASA-N 1 1 236.359 2.335 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@H](N)C(C)C)c(O)c1 ZINC000817959900 586851659 /nfs/dbraw/zinc/85/16/59/586851659.db2.gz WLALWKCRVWQXSZ-AAEUAGOBSA-N 1 1 236.359 2.335 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)N)c(O)c1 ZINC000817960807 586851963 /nfs/dbraw/zinc/85/19/63/586851963.db2.gz QUPQUPNEEAEPGO-SNVBAGLBSA-N 1 1 222.332 2.089 20 10 BECDMO C[C@@H](N[C@@H](C[NH3+])C1CC1)c1ccc(N(C)C)cc1 ZINC000817961208 586852234 /nfs/dbraw/zinc/85/22/34/586852234.db2.gz VJZWNQZEVJKHQJ-ABAIWWIYSA-N 1 1 247.386 2.141 20 10 BECDMO CC[C@@H]([NH2+]CC(C)(C)N)c1ccc(C)cc1O ZINC000817961253 586852523 /nfs/dbraw/zinc/85/25/23/586852523.db2.gz ZSEIDNWMGYOXAT-GFCCVEGCSA-N 1 1 236.359 2.479 20 10 BECDMO C[C@H](C[NH3+])C[NH2+][C@@H](C)c1cc(Cl)ccc1[O-] ZINC000817961636 586853456 /nfs/dbraw/zinc/85/34/56/586853456.db2.gz BKVSRVGQBZVQES-BDAKNGLRSA-N 1 1 242.750 2.291 20 10 BECDMO CC[C@H]([NH2+]CC1(N)CCC1)c1ccccc1O ZINC000817964591 586853769 /nfs/dbraw/zinc/85/37/69/586853769.db2.gz FMVIZHYUMZCMGK-LBPRGKRZSA-N 1 1 234.343 2.314 20 10 BECDMO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](N)C2CC2)c(O)c1 ZINC000817964701 586853834 /nfs/dbraw/zinc/85/38/34/586853834.db2.gz FHLZMHILBLIREO-DGCLKSJQSA-N 1 1 248.370 2.397 20 10 BECDMO CC[C@H]([NH2+][C@H](C)C[NH3+])c1cccc(Cl)c1[O-] ZINC000817966633 586855090 /nfs/dbraw/zinc/85/50/90/586855090.db2.gz SCTFPGRUKIIBEK-KCJUWKMLSA-N 1 1 242.750 2.434 20 10 BECDMO CCN(C)c1ccc([C@H](C)NCC2C[NH2+]C2)cc1 ZINC000817965635 586855333 /nfs/dbraw/zinc/85/53/33/586855333.db2.gz SQRLWWOHYIAZLL-LBPRGKRZSA-N 1 1 247.386 2.013 20 10 BECDMO CC[C@@H](NC[C@@H](C)[NH3+])c1ccc(N(C)C)cc1 ZINC000817970866 586858417 /nfs/dbraw/zinc/85/84/17/586858417.db2.gz GLFUMVTYXRAJNB-BXUZGUMPSA-N 1 1 235.375 2.141 20 10 BECDMO CC[C@@H]([NH2+]C[C@@H](C)N)c1ccc(N(C)C)cc1 ZINC000817970866 586858419 /nfs/dbraw/zinc/85/84/19/586858419.db2.gz GLFUMVTYXRAJNB-BXUZGUMPSA-N 1 1 235.375 2.141 20 10 BECDMO C[C@@H]([NH2+]C[C@H](C)N)c1cc2c(cc1O)CCCC2 ZINC000817972302 586859197 /nfs/dbraw/zinc/85/91/97/586859197.db2.gz KWUQPRCAKXBPIO-WDEREUQCSA-N 1 1 248.370 2.269 20 10 BECDMO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)N)c(O)c1 ZINC000817973598 586859969 /nfs/dbraw/zinc/85/99/69/586859969.db2.gz VMXFJSLVFFWSCV-GHMZBOCLSA-N 1 1 222.332 2.007 20 10 BECDMO CC[C@@H](N)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000817978641 586861452 /nfs/dbraw/zinc/86/14/52/586861452.db2.gz CUEZHEJCLMHYSP-VXGBXAGGSA-N 1 1 236.359 2.397 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](C)N)c(O)c1C ZINC000817977468 586861770 /nfs/dbraw/zinc/86/17/70/586861770.db2.gz KTPONUNOFFUSRZ-WOPDTQHZSA-N 1 1 236.359 2.395 20 10 BECDMO CC[C@@H](N)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000817978638 586862292 /nfs/dbraw/zinc/86/22/92/586862292.db2.gz CUEZHEJCLMHYSP-NWDGAFQWSA-N 1 1 236.359 2.397 20 10 BECDMO CO[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccccc2O)C1 ZINC000821392199 587115936 /nfs/dbraw/zinc/11/59/36/587115936.db2.gz VSNVAZMJIAPUQZ-CHWSQXEVSA-N 1 1 235.327 2.392 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CC[C@@H]2C2CC2)c1 ZINC000824649086 587280993 /nfs/dbraw/zinc/28/09/93/587280993.db2.gz BCLQZKODKHJKFZ-CYBMUJFWSA-N 1 1 233.311 2.385 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@H]1C1CC1 ZINC000824649287 587281001 /nfs/dbraw/zinc/28/10/01/587281001.db2.gz CEBFNAZYZMGJOG-LBPRGKRZSA-N 1 1 203.285 2.377 20 10 BECDMO COc1cccc(O)c1C[N@H+]1CC[C@@H]1C1CC1 ZINC000824650671 587281097 /nfs/dbraw/zinc/28/10/97/587281097.db2.gz OTMOGWSEPCECRC-GFCCVEGCSA-N 1 1 233.311 2.385 20 10 BECDMO C[C@@H]1[C@@H](O)CC[N@H+]1Cc1cc(Cl)ccc1O ZINC000824959420 587294995 /nfs/dbraw/zinc/29/49/95/587294995.db2.gz GTZTZGRQXUKVMU-KCJUWKMLSA-N 1 1 241.718 2.001 20 10 BECDMO CC1(C)C[C@H](O)CC[N@@H+](Cc2ccccc2O)C1 ZINC000825091319 587303894 /nfs/dbraw/zinc/30/38/94/587303894.db2.gz YCOGKQZSVDWXJD-CYBMUJFWSA-N 1 1 249.354 2.375 20 10 BECDMO CC1(C)CCC[N@@H+]1CCNCc1ccccc1O ZINC000825326007 587315209 /nfs/dbraw/zinc/31/52/09/587315209.db2.gz JNQVMRJMAFNDRG-UHFFFAOYSA-N 1 1 248.370 2.356 20 10 BECDMO CC1(C)CCC[N@H+]1CCNCc1ccccc1O ZINC000825326007 587315211 /nfs/dbraw/zinc/31/52/11/587315211.db2.gz JNQVMRJMAFNDRG-UHFFFAOYSA-N 1 1 248.370 2.356 20 10 BECDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@H]2C)cc1 ZINC000832224491 587651638 /nfs/dbraw/zinc/65/16/38/587651638.db2.gz COIKDKBIWDVNMK-IUODEOHRSA-N 1 1 248.370 2.098 20 10 BECDMO COCC[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835025823 587779137 /nfs/dbraw/zinc/77/91/37/587779137.db2.gz NTUYRNGIHJDPQO-AATRIKPKSA-N 1 1 248.370 2.344 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](O)[C@H]1C ZINC000840950363 587931836 /nfs/dbraw/zinc/93/18/36/587931836.db2.gz JGUPJAVCDHDUPM-IUODEOHRSA-N 1 1 248.370 2.016 20 10 BECDMO CCCC[C@@H](C[NH3+])NCc1ccc(N(C)C)cc1 ZINC000841030226 587935863 /nfs/dbraw/zinc/93/58/63/587935863.db2.gz VBPCQRGWKNJZBK-AWEZNQCLSA-N 1 1 249.402 2.360 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@H]2CCCN[C@H]2C)cc1C ZINC000841064518 587941304 /nfs/dbraw/zinc/94/13/04/587941304.db2.gz HISVTFYHWLANGZ-JSGCOSHPSA-N 1 1 248.370 2.239 20 10 BECDMO COc1ccc(CN[C@@H]2CC[NH2+][C@@H](C)C2)cc1C ZINC000841061013 587941703 /nfs/dbraw/zinc/94/17/03/587941703.db2.gz DKWWEOKNZYIBQB-GXTWGEPZSA-N 1 1 248.370 2.234 20 10 BECDMO Cc1cc(Cl)cc(CN[C@@H](C)[C@@H](C)[NH3+])c1O ZINC000841076924 587943984 /nfs/dbraw/zinc/94/39/84/587943984.db2.gz UANHOJHKKOXEIG-BDAKNGLRSA-N 1 1 242.750 2.179 20 10 BECDMO C[C@@H](CCC[NH3+])[NH2+]Cc1c([O-])cccc1Cl ZINC000841078372 587944799 /nfs/dbraw/zinc/94/47/99/587944799.db2.gz BYNYPIKZWCDEJZ-VIFPVBQESA-N 1 1 242.750 2.263 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@H](C)[C@@H]2CN)c1O ZINC000843052399 588077364 /nfs/dbraw/zinc/07/73/64/588077364.db2.gz SOEKPJDVWZKLTO-FZMZJTMJSA-N 1 1 248.370 2.260 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)NC[C@@H]2C)cc1C ZINC000843119746 588083723 /nfs/dbraw/zinc/08/37/23/588083723.db2.gz GREFQDCXXWVRJW-STQMWFEESA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)NC[C@@H]2C)cc1C ZINC000843119746 588083725 /nfs/dbraw/zinc/08/37/25/588083725.db2.gz GREFQDCXXWVRJW-STQMWFEESA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)NC[C@@H]2C)cc1C ZINC000843119744 588083736 /nfs/dbraw/zinc/08/37/36/588083736.db2.gz GREFQDCXXWVRJW-OLZOCXBDSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)NC[C@@H]2C)cc1C ZINC000843119744 588083738 /nfs/dbraw/zinc/08/37/38/588083738.db2.gz GREFQDCXXWVRJW-OLZOCXBDSA-N 1 1 248.370 2.191 20 10 BECDMO CCc1cccc(C[N@@H+](C)CC(C)(C)O)c1O ZINC000848887223 588416592 /nfs/dbraw/zinc/41/65/92/588416592.db2.gz QSELIYZNTGZVMM-UHFFFAOYSA-N 1 1 237.343 2.157 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@H](C)[C@@H]2CO)c1O ZINC000848906661 588419547 /nfs/dbraw/zinc/41/95/47/588419547.db2.gz XPZRJKIQQGQSCZ-FZMZJTMJSA-N 1 1 249.354 2.157 20 10 BECDMO Cc1ccc(O)c(CNCC2([NH3+])CCCC2)c1 ZINC000849349815 588474250 /nfs/dbraw/zinc/47/42/50/588474250.db2.gz JSDPTJNAZXURIG-UHFFFAOYSA-N 1 1 234.343 2.062 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C)NC2)c(O)c1 ZINC000863544938 589297623 /nfs/dbraw/zinc/29/76/23/589297623.db2.gz FMYSYDVWMDTUPA-AVGNSLFASA-N 1 1 248.370 2.492 20 10 BECDMO C[N@@H+](Cc1ccncc1)Cc1ccccc1O ZINC000121139152 589503602 /nfs/dbraw/zinc/50/36/02/589503602.db2.gz LZFJFYRGJALRTN-UHFFFAOYSA-N 1 1 228.295 2.419 20 10 BECDMO Cc1cccc(C[NH2+]C[C@H]2CCCN(C)C2)c1O ZINC000124811972 590090738 /nfs/dbraw/zinc/09/07/38/590090738.db2.gz NWARMTVKTUWSAM-CYBMUJFWSA-N 1 1 248.370 2.132 20 10 BECDMO Cc1cccc(O)c1CN1CC[NH+](C(C)C)CC1 ZINC000876564010 590216548 /nfs/dbraw/zinc/21/65/48/590216548.db2.gz FRWUTFWRSJRPOI-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO COCCC[N@@H+](C)Cc1c(C)cccc1O ZINC000876646145 590225727 /nfs/dbraw/zinc/22/57/27/590225727.db2.gz SNOSDZGVOSTJJF-UHFFFAOYSA-N 1 1 223.316 2.169 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)Cc1cc[nH]n1 ZINC000876721095 590233453 /nfs/dbraw/zinc/23/34/53/590233453.db2.gz FYUJKGOQWHPKBC-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)Cc1cc[nH]n1 ZINC000876721095 590233455 /nfs/dbraw/zinc/23/34/55/590233455.db2.gz FYUJKGOQWHPKBC-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(O)c1 ZINC000876742466 590234732 /nfs/dbraw/zinc/23/47/32/590234732.db2.gz PAXICSWDIPDFIR-BETUJISGSA-N 1 1 233.311 2.064 20 10 BECDMO Cc1ccc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)c(O)c1 ZINC000876739311 590234868 /nfs/dbraw/zinc/23/48/68/590234868.db2.gz OAHLZAXCTZBZJW-RYUDHWBXSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1ccc(C[N@@H+](C)Cc2cn[nH]c2)c(O)c1 ZINC000876742817 590235245 /nfs/dbraw/zinc/23/52/45/590235245.db2.gz WVUGAXYARPHFEF-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2C[C@H](C)O)c(O)c1 ZINC000876748792 590237554 /nfs/dbraw/zinc/23/75/54/590237554.db2.gz FRMUARPXZOWQFC-GXTWGEPZSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ccc(C[NH2+][C@H](C)CCN(C)C)c(O)c1 ZINC000876992211 590266065 /nfs/dbraw/zinc/26/60/65/590266065.db2.gz NSIRLIGURLTXPK-GFCCVEGCSA-N 1 1 236.359 2.130 20 10 BECDMO Cc1ccc(C[N@H+](C)CC2(O)CCC2)c(O)c1 ZINC000877347099 590319126 /nfs/dbraw/zinc/31/91/26/590319126.db2.gz XOSSSHQPCMLCGG-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@@H](C)N(C)C[C@@H]2C)c(O)c1 ZINC000877407062 590323675 /nfs/dbraw/zinc/32/36/75/590323675.db2.gz MEYWLNFEZYYSJQ-OLZOCXBDSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(C[N@H+]2CCN(C)[C@@H](C)[C@@H]2C)c(O)c1 ZINC000877409689 590323983 /nfs/dbraw/zinc/32/39/83/590323983.db2.gz XZEXVQYYXKPBCQ-STQMWFEESA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(C[N@H+]2CCOCC23CC3)c(O)c1 ZINC000877504435 590342370 /nfs/dbraw/zinc/34/23/70/590342370.db2.gz KLLSCDSZQBKCOM-UHFFFAOYSA-N 1 1 233.311 2.065 20 10 BECDMO CC[N@@H+](Cc1c(C)cccc1O)[C@H]1CCOC1 ZINC000877543503 590351686 /nfs/dbraw/zinc/35/16/86/590351686.db2.gz CLFRYOCGJUVLGG-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO CC[N@@H+](Cc1ccc(C)cc1O)[C@H]1CCOC1 ZINC000877544716 590352881 /nfs/dbraw/zinc/35/28/81/590352881.db2.gz VAOZUBWTOXYTKT-ZDUSSCGKSA-N 1 1 235.327 2.311 20 10 BECDMO CC[N@@H+](Cc1ccc(C)cc1O)[C@@H]1CCOC1 ZINC000877544715 590352905 /nfs/dbraw/zinc/35/29/05/590352905.db2.gz VAOZUBWTOXYTKT-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1c(C)cccc1O ZINC000877562428 590360199 /nfs/dbraw/zinc/36/01/99/590360199.db2.gz ZVUFAAOPNXCOGQ-OCCSQVGLSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@@H](O)CC[C@H]2C)c(O)c1 ZINC000877596555 590370057 /nfs/dbraw/zinc/37/00/57/590370057.db2.gz UGJZDGFIVRTVET-YPMHNXCESA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@@H](C)[C@@](C)(CO)C1 ZINC000877640351 590381675 /nfs/dbraw/zinc/38/16/75/590381675.db2.gz LWYXVAKGJVAYEV-IUODEOHRSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H]2COC[C@H]2C1 ZINC000877637463 590382134 /nfs/dbraw/zinc/38/21/34/590382134.db2.gz ILDOCCFIJZSDMB-CHWSQXEVSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@H](C(C)(C)O)C2)c1O ZINC000877836401 590431123 /nfs/dbraw/zinc/43/11/23/590431123.db2.gz WIVOUSCZXMTXBH-CYBMUJFWSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1noc([C@H](C)[NH2+][C@H](C)c2ccccc2O)n1 ZINC000879648799 590841863 /nfs/dbraw/zinc/84/18/63/590841863.db2.gz FCVCRJMTFRRGCD-BDAKNGLRSA-N 1 1 247.298 2.495 20 10 BECDMO Cc1ccnc(C[NH2+][C@H](C)c2ccccc2O)n1 ZINC000879649367 590842044 /nfs/dbraw/zinc/84/20/44/590842044.db2.gz ORZPTDDKHUHROT-LLVKDONJSA-N 1 1 243.310 2.341 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCOCC2(C)C)cc1 ZINC000130856131 591530422 /nfs/dbraw/zinc/53/04/22/591530422.db2.gz HUEADLGKYLEKMT-UHFFFAOYSA-N 1 1 248.370 2.363 20 10 BECDMO CCC[N@@H+](C)Cc1cccc(OC)c1O ZINC000132580355 591721045 /nfs/dbraw/zinc/72/10/45/591721045.db2.gz WDGOKHFZFLNUHH-UHFFFAOYSA-N 1 1 209.289 2.243 20 10 BECDMO COC[C@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886487599 592234697 /nfs/dbraw/zinc/23/46/97/592234697.db2.gz KSKHGCFECOURRZ-DTWKUNHWSA-N 1 1 227.279 2.217 20 10 BECDMO C[C@@H]([NH2+]Cc1ccnn1C)c1c(O)cccc1F ZINC000886501220 592239535 /nfs/dbraw/zinc/23/95/35/592239535.db2.gz BBOMRVJXYRJITE-SECBINFHSA-N 1 1 249.289 2.116 20 10 BECDMO C[C@@H]([NH2+]C[C@@H](C)N(C)C)c1c(O)cccc1F ZINC000886523048 592243480 /nfs/dbraw/zinc/24/34/80/592243480.db2.gz VZQGYXLSJUTAHV-NXEZZACHSA-N 1 1 240.322 2.132 20 10 BECDMO C[C@H](C[NH2+][C@@H](C)c1c(O)cccc1F)N(C)C ZINC000886523051 592244604 /nfs/dbraw/zinc/24/46/04/592244604.db2.gz VZQGYXLSJUTAHV-ZJUUUORDSA-N 1 1 240.322 2.132 20 10 BECDMO C[C@H](CCO)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886535197 592251044 /nfs/dbraw/zinc/25/10/44/592251044.db2.gz WLNAKJPLQDURAC-NXEZZACHSA-N 1 1 241.306 2.200 20 10 BECDMO CC[C@H](O)CC[NH2+][C@H](C)c1c(O)cccc1F ZINC000886540200 592253681 /nfs/dbraw/zinc/25/36/81/592253681.db2.gz ARJCSJAMKHOHEI-ZJUUUORDSA-N 1 1 241.306 2.343 20 10 BECDMO CO[C@@H](C)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886596263 592271091 /nfs/dbraw/zinc/27/10/91/592271091.db2.gz AHIJPAZLOCUQLD-DTWKUNHWSA-N 1 1 227.279 2.217 20 10 BECDMO C[C@H]([NH2+]CCC(C)(C)O)c1c(O)cccc1F ZINC000886594037 592271099 /nfs/dbraw/zinc/27/10/99/592271099.db2.gz FAVGGKSGLMZWPI-VIFPVBQESA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H]([NH2+]Cc1cncn1C)c1c(O)cccc1F ZINC000886610425 592274848 /nfs/dbraw/zinc/27/48/48/592274848.db2.gz AWVSGZFKIHTDHG-SECBINFHSA-N 1 1 249.289 2.116 20 10 BECDMO C[C@@H]([NH2+][C@H]1C[C@@](C)(O)C1)c1c(O)cccc1F ZINC000886627107 592281447 /nfs/dbraw/zinc/28/14/47/592281447.db2.gz SVBWSDBAOWHXHI-KKFJDGPESA-N 1 1 239.290 2.095 20 10 BECDMO C[NH+](C)CC(C)(C)NCc1ccc2c(c1)CCO2 ZINC000308609919 631447326 /nfs/dbraw/zinc/44/73/26/631447326.db2.gz UNIXQBUWPXCUCT-UHFFFAOYSA-N 1 1 248.370 2.051 20 10 BECDMO Oc1c(F)cccc1C[NH2+][C@H]1[C@@H]2CCC[C@@H]21 ZINC000309480944 633150594 /nfs/dbraw/zinc/15/05/94/633150594.db2.gz DQSCPBQPHXXYTK-IAZYJMLFSA-N 1 1 221.275 2.419 20 10 BECDMO Cc1ccc(C[N@@H+]2CCN(C)C(C)(C)C2)c(O)c1 ZINC000895563624 636158726 /nfs/dbraw/zinc/15/87/26/636158726.db2.gz JLAKDSHIPMQZRV-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN2CC[N@@H+](C)C(C)(C)C2)c(O)c1 ZINC000895563624 636158729 /nfs/dbraw/zinc/15/87/29/636158729.db2.gz JLAKDSHIPMQZRV-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN2CC[N@H+](C)C(C)(C)C2)c(O)c1 ZINC000895563624 636158734 /nfs/dbraw/zinc/15/87/34/636158734.db2.gz JLAKDSHIPMQZRV-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO OCCCC[N@@H+](Cc1ccccc1O)C1CC1 ZINC000305741988 636329715 /nfs/dbraw/zinc/32/97/15/636329715.db2.gz GSFGFDWVICZTLC-UHFFFAOYSA-N 1 1 235.327 2.129 20 10 BECDMO C[C@H]([NH2+]Cc1ccon1)c1cc(F)ccc1O ZINC000148705018 636831445 /nfs/dbraw/zinc/83/14/45/636831445.db2.gz NIZBRNKURLGCQY-QMMMGPOBSA-N 1 1 236.246 2.370 20 10 BECDMO CCOCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062745944 641085424 /nfs/dbraw/zinc/08/54/24/641085424.db2.gz VIVNIVBAKWYMHD-VIFPVBQESA-N 1 1 227.279 2.218 20 10 BECDMO COc1cc(C[N@@H+](C)C2CC2)c(O)cc1C ZINC000159773470 641699192 /nfs/dbraw/zinc/69/91/92/641699192.db2.gz YKGOEATWYHCBHU-UHFFFAOYSA-N 1 1 221.300 2.303 20 10 BECDMO COC[C@@H]1CC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000754740953 641816053 /nfs/dbraw/zinc/81/60/53/641816053.db2.gz KACMZVQGIBQHOK-CYBMUJFWSA-N 1 1 249.354 2.477 20 10 BECDMO C[N@@H+](Cc1ccnc(N)c1)Cc1ccccc1O ZINC000191571794 641930353 /nfs/dbraw/zinc/93/03/53/641930353.db2.gz LPHFIGNAESZABG-UHFFFAOYSA-N 1 1 243.310 2.001 20 10 BECDMO CCOCC[N@@H+](C)Cc1cc2c(cc1O)CCC2 ZINC000179879435 642752353 /nfs/dbraw/zinc/75/23/53/642752353.db2.gz MQZRJLQVYQCJNR-UHFFFAOYSA-N 1 1 249.354 2.349 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](C)[C@@H]2CN)c1 ZINC000070175263 642987580 /nfs/dbraw/zinc/98/75/80/642987580.db2.gz QGVBZLYWLAAQBM-JSGCOSHPSA-N 1 1 248.370 2.260 20 10 BECDMO Cc1ccc(O)c(C[NH2+]C[C@H]2CCCN(C)C2)c1 ZINC000071408614 643142276 /nfs/dbraw/zinc/14/22/76/643142276.db2.gz YIJOMLOWDUSWBK-CYBMUJFWSA-N 1 1 248.370 2.132 20 10 BECDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)[C@@H](C)CO1 ZINC000253358179 643208679 /nfs/dbraw/zinc/20/86/79/643208679.db2.gz MFVBBFJZHCPSBN-STQMWFEESA-N 1 1 248.370 2.362 20 10 BECDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000192597112 644167558 /nfs/dbraw/zinc/16/75/58/644167558.db2.gz BPIPLCXUXVQTQK-GFCCVEGCSA-N 1 1 235.327 2.230 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C[C@H](C)O)C(C)C)c1 ZINC000093145246 644679573 /nfs/dbraw/zinc/67/95/73/644679573.db2.gz HRCVZMPNUGZBKF-LBPRGKRZSA-N 1 1 237.343 2.292 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C[C@@H](C)O)C(C)C)c1 ZINC000093145243 644679953 /nfs/dbraw/zinc/67/99/53/644679953.db2.gz HRCVZMPNUGZBKF-GFCCVEGCSA-N 1 1 237.343 2.292 20 10 BECDMO Oc1ccccc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252667262 644873832 /nfs/dbraw/zinc/87/38/32/644873832.db2.gz HRFGCPQFMNVOTH-KBPBESRZSA-N 1 1 246.354 2.109 20 10 BECDMO Oc1ccccc1CN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000252667262 644873834 /nfs/dbraw/zinc/87/38/34/644873834.db2.gz HRFGCPQFMNVOTH-KBPBESRZSA-N 1 1 246.354 2.109 20 10 BECDMO C[N@H+](Cc1ccccc1O)Cc1cccnc1N ZINC000809575486 644892777 /nfs/dbraw/zinc/89/27/77/644892777.db2.gz FYOZNXLVYCGEMN-UHFFFAOYSA-N 1 1 243.310 2.001 20 10 BECDMO CC[C@@H](N)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000817980059 644993224 /nfs/dbraw/zinc/99/32/24/644993224.db2.gz QXSABOSCHGXBHM-VXGBXAGGSA-N 1 1 236.359 2.397 20 10 BECDMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1cccc(C)c1O ZINC000824636280 645057338 /nfs/dbraw/zinc/05/73/38/645057338.db2.gz NWJLSJGFHXKKBI-KBPBESRZSA-N 1 1 249.354 2.293 20 10 BECDMO C[C@H](O)C[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835047251 645163949 /nfs/dbraw/zinc/16/39/49/645163949.db2.gz DQIYCDNMHYPUFV-GFUIURDCSA-N 1 1 248.370 2.078 20 10 BECDMO C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1c([O-])cccc1Cl ZINC000843129119 645267142 /nfs/dbraw/zinc/26/71/42/645267142.db2.gz MKEAGPQHWACYIY-RKDXNWHRSA-N 1 1 242.750 2.261 20 10 BECDMO CCOCC[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000708413056 712193278 /nfs/dbraw/zinc/19/32/78/712193278.db2.gz LPHPPJDMOVKCMO-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO CCOCC[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000708413056 712193280 /nfs/dbraw/zinc/19/32/80/712193280.db2.gz LPHPPJDMOVKCMO-UHFFFAOYSA-N 1 1 245.269 2.139 20 10 BECDMO C[N@@H+](CCCF)Cc1cc(F)ccc1O ZINC000716631662 712568048 /nfs/dbraw/zinc/56/80/48/712568048.db2.gz YCRBYUQQYNCNAI-UHFFFAOYSA-N 1 1 215.243 2.323 20 10 BECDMO Cc1cccc(C[N@@H+]2CCCOC[C@H]2C)c1O ZINC000398959994 711417511 /nfs/dbraw/zinc/41/75/11/711417511.db2.gz YFFNNMCBPFVHIC-GFCCVEGCSA-N 1 1 235.327 2.311 20 10 BECDMO C[C@@H]1C[C@@H]1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708386963 711957007 /nfs/dbraw/zinc/95/70/07/711957007.db2.gz AALRLFISOXNCJR-HTQZYQBOSA-N 1 1 227.254 2.416 20 10 BECDMO CC[C@H]([NH2+]Cc1ncccn1)c1ccccc1O ZINC000702326169 712046918 /nfs/dbraw/zinc/04/69/18/712046918.db2.gz ORLCWARTPFPKMQ-LBPRGKRZSA-N 1 1 243.310 2.423 20 10 BECDMO C[C@H]([NH2+]CCOCCF)c1ccc(F)cc1O ZINC000702654705 712058477 /nfs/dbraw/zinc/05/84/77/712058477.db2.gz QINSLYPVZXAJGJ-VIFPVBQESA-N 1 1 245.269 2.168 20 10 BECDMO CN(C)c1ccc(CN2CCC(C)([NH3+])CC2)cc1 ZINC000704600801 712112037 /nfs/dbraw/zinc/11/20/37/712112037.db2.gz MQLLVIQAWPNWKV-UHFFFAOYSA-N 1 1 247.386 2.066 20 10 BECDMO Oc1ccccc1CNc1[nH+]cnc2[nH]ccc21 ZINC000705194506 712126671 /nfs/dbraw/zinc/12/66/71/712126671.db2.gz CAOZOOTYQVNWNN-UHFFFAOYSA-N 1 1 240.266 2.276 20 10 BECDMO CO[C@H](C)C[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000708415628 712372988 /nfs/dbraw/zinc/37/29/88/712372988.db2.gz ZZPLZNXAXXDTGU-MRVPVSSYSA-N 1 1 245.269 2.137 20 10 BECDMO CO[C@H](C)C[N@@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000708415628 712372984 /nfs/dbraw/zinc/37/29/84/712372984.db2.gz ZZPLZNXAXXDTGU-MRVPVSSYSA-N 1 1 245.269 2.137 20 10 BECDMO CO[C@H](C)C[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000708415628 712372987 /nfs/dbraw/zinc/37/29/87/712372987.db2.gz ZZPLZNXAXXDTGU-MRVPVSSYSA-N 1 1 245.269 2.137 20 10 BECDMO CN1CC[N@@H+](Cc2ccccc2O)CCC1(C)C ZINC000712664208 712439948 /nfs/dbraw/zinc/43/99/48/712439948.db2.gz RBOZHGSZDLUWLP-UHFFFAOYSA-N 1 1 248.370 2.308 20 10 BECDMO C[N@@H+]1CCN(Cc2ccccc2O)CCC1(C)C ZINC000712664208 712439949 /nfs/dbraw/zinc/43/99/49/712439949.db2.gz RBOZHGSZDLUWLP-UHFFFAOYSA-N 1 1 248.370 2.308 20 10 BECDMO C[N@H+]1CCN(Cc2ccccc2O)CCC1(C)C ZINC000712664208 712439950 /nfs/dbraw/zinc/43/99/50/712439950.db2.gz RBOZHGSZDLUWLP-UHFFFAOYSA-N 1 1 248.370 2.308 20 10 BECDMO Oc1ccccc1CN[C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000036996576 712528583 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C[NH2+][C@@H](C)CCNCc1ccc2c(c1)CCCO2 ZINC001356083278 983572438 /nfs/dbraw/zinc/57/24/38/983572438.db2.gz MLRBVFWRJLCUSR-LBPRGKRZSA-N 1 1 248.370 2.099 20 10 BECDMO CCc1cccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1O ZINC000692116092 985405528 /nfs/dbraw/zinc/40/55/28/985405528.db2.gz QZPPWMYRXNFCKJ-OKILXGFUSA-N 1 1 247.338 2.318 20 10 BECDMO C[C@@]1(CN)CCCC[N@H+](Cc2ccc(N)cc2)C1 ZINC001206563884 986384841 /nfs/dbraw/zinc/38/48/41/986384841.db2.gz JQUUMSHNCSIULD-HNNXBMFYSA-N 1 1 247.386 2.220 20 10 BECDMO C[C@@]1(CN)CCCC[N@@H+](Cc2ccc(N)cc2)C1 ZINC001206563884 986384843 /nfs/dbraw/zinc/38/48/43/986384843.db2.gz JQUUMSHNCSIULD-HNNXBMFYSA-N 1 1 247.386 2.220 20 10 BECDMO CC(C)[C@@H]1C[C@H](NCc2ccc(N)cc2)CC[NH2+]1 ZINC001246174575 987543782 /nfs/dbraw/zinc/54/37/82/987543782.db2.gz WDNNADSUNCWRDQ-CABCVRRESA-N 1 1 247.386 2.135 20 10 BECDMO CC[N@@H+](CCO)Cc1cc(C(C)C)ccc1O ZINC001474404665 987715056 /nfs/dbraw/zinc/71/50/56/987715056.db2.gz QEDWLXLZELQMMD-UHFFFAOYSA-N 1 1 237.343 2.330 20 10 BECDMO 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COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2(C)CC2)c1 ZINC001320252690 992145854 /nfs/dbraw/zinc/14/58/54/992145854.db2.gz JEADPEXHQNAUTJ-SECBINFHSA-N 1 1 249.310 2.382 20 10 BECDMO CNCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001261423622 992293988 /nfs/dbraw/zinc/29/39/88/992293988.db2.gz ANCZGBTVCGCZLO-QWRGUYRKSA-N 1 1 234.343 2.058 20 10 BECDMO C[NH2+][C@H](C)CCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC001261424290 992298376 /nfs/dbraw/zinc/29/83/76/992298376.db2.gz QMDSUMTZCGOFCI-OLZOCXBDSA-N 1 1 249.402 2.401 20 10 BECDMO CC(C)c1ccc(O)c(CN2CC[NH+](C)CC2)c1 ZINC001621113095 1170719100 /nfs/dbraw/zinc/71/91/00/1170719100.db2.gz VROOPJWNZPVVSQ-UHFFFAOYSA-N 1 1 248.370 2.263 20 10 BECDMO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(N)cc1 ZINC000036797828 1170914161 /nfs/dbraw/zinc/91/41/61/1170914161.db2.gz PVIAWRHNSGFBCG-RISCZKNCSA-N 1 1 234.343 2.268 20 10 BECDMO CN(C)c1ccc(C[N@H+](C2CC2)C2COC2)cc1 ZINC000296014260 398137428 /nfs/dbraw/zinc/13/74/28/398137428.db2.gz LUUZBHRKXBFMGT-UHFFFAOYSA-N 1 1 246.354 2.116 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C2CC2)C2COC2)cc1 ZINC000296014260 398137431 /nfs/dbraw/zinc/13/74/31/398137431.db2.gz LUUZBHRKXBFMGT-UHFFFAOYSA-N 1 1 246.354 2.116 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cc1C ZINC000369816316 178196698 /nfs/dbraw/zinc/19/66/98/178196698.db2.gz QZOSHFRBLBDLOG-OKILXGFUSA-N 1 1 247.338 2.372 20 10 BECDMO CC[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000070976155 343958364 /nfs/dbraw/zinc/95/83/64/343958364.db2.gz ZITDVRLBVWVRQX-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCCC[C@@H]1O ZINC000089912285 345565397 /nfs/dbraw/zinc/56/53/97/345565397.db2.gz LCQSRMMAEFABKW-JSGCOSHPSA-N 1 1 235.327 2.128 20 10 BECDMO Cc1cccc(C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c1O ZINC000271870944 179066527 /nfs/dbraw/zinc/06/65/27/179066527.db2.gz SDKMYWDNMIWTEE-JSGCOSHPSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(C[N@@H+](C)C[C@H]2CCC[C@H]2O)c1O ZINC000271870947 179067667 /nfs/dbraw/zinc/06/76/67/179067667.db2.gz SDKMYWDNMIWTEE-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)c1O ZINC000180256943 179079253 /nfs/dbraw/zinc/07/92/53/179079253.db2.gz ZHPJIPUILDOJGO-NWDGAFQWSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1O ZINC000124605764 179084811 /nfs/dbraw/zinc/08/48/11/179084811.db2.gz UDDCPEOMCIKYMF-BETUJISGSA-N 1 1 233.311 2.064 20 10 BECDMO CC(C)[C@@]1(CO)CC[N@@H+](Cc2ccccc2O)C1 ZINC000368225657 187384911 /nfs/dbraw/zinc/38/49/11/187384911.db2.gz LWZLJCBYXPTLDE-HNNXBMFYSA-N 1 1 249.354 2.233 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CCCSCC1 ZINC000273356407 183274805 /nfs/dbraw/zinc/27/48/05/183274805.db2.gz CETSTEUEZAIWOE-UHFFFAOYSA-N 1 1 241.331 2.470 20 10 BECDMO Oc1ccccc1C[N@H+]1CCC2(C1)CCOCC2 ZINC000272356787 183301205 /nfs/dbraw/zinc/30/12/05/183301205.db2.gz DUKZMZGJLHGPHU-UHFFFAOYSA-N 1 1 247.338 2.395 20 10 BECDMO CO[C@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000091772169 384142911 /nfs/dbraw/zinc/14/29/11/384142911.db2.gz PRPZQXXWOQPUNR-HNNXBMFYSA-N 1 1 248.370 2.363 20 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248.370 2.167 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCOCC2(C)C)c1 ZINC000133540584 384297713 /nfs/dbraw/zinc/29/77/13/384297713.db2.gz OPWTWKNHRXAGLA-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000120851703 384383456 /nfs/dbraw/zinc/38/34/56/384383456.db2.gz FGDLKPJBQAENIS-VIFPVBQESA-N 1 1 249.310 2.351 20 10 BECDMO C[N@@H+](CCCCCCO)Cc1ccccc1O ZINC000079321499 384491799 /nfs/dbraw/zinc/49/17/99/384491799.db2.gz JSIMQHQNPUCDFN-UHFFFAOYSA-N 1 1 237.343 2.377 20 10 BECDMO CN(C)c1ccc(C[N@@H+](C)C[C@@H]2CCCO2)cc1 ZINC000102675125 384721717 /nfs/dbraw/zinc/72/17/17/384721717.db2.gz ZPULARXVNSAWTE-HNNXBMFYSA-N 1 1 248.370 2.363 20 10 BECDMO C[C@H](O)CC[N@@H+](C)Cc1c(O)cccc1Cl ZINC000127679768 384935834 /nfs/dbraw/zinc/93/58/34/384935834.db2.gz GQMWWPVUMVKLCO-VIFPVBQESA-N 1 1 243.734 2.248 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCC[C@@](C)(O)C2)cc1 ZINC000129396533 385148778 /nfs/dbraw/zinc/14/87/78/385148778.db2.gz BOXYSCUZHMRSSR-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO CC[C@]1(CO)CCC[N@@H+](Cc2ccccc2O)C1 ZINC000190212042 385218189 /nfs/dbraw/zinc/21/81/89/385218189.db2.gz GNBDFWBUMLCYJS-HNNXBMFYSA-N 1 1 249.354 2.377 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@@H]1CCCOC1 ZINC000153881570 385288088 /nfs/dbraw/zinc/28/80/88/385288088.db2.gz RZTWJKZVTFVPFA-LBPRGKRZSA-N 1 1 235.327 2.251 20 10 BECDMO CC[C@H](O)CC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168825014 385389187 /nfs/dbraw/zinc/38/91/87/385389187.db2.gz PEQKZUCTEPAWPI-ONGXEEELSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](N(C)C)C2)c1 ZINC000156068036 385433639 /nfs/dbraw/zinc/43/36/39/385433639.db2.gz UMISVKRRRCQERJ-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(O)c(CN2CCC[C@H]([NH+](C)C)C2)c1 ZINC000156068036 385433643 /nfs/dbraw/zinc/43/36/43/385433643.db2.gz UMISVKRRRCQERJ-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO CO[C@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000179570659 385473969 /nfs/dbraw/zinc/47/39/69/385473969.db2.gz BNAGLGGBTDPDIQ-LBPRGKRZSA-N 1 1 221.300 2.003 20 10 BECDMO CCCCC[N@@H+](CCO)Cc1ccccc1O ZINC000179556182 385474664 /nfs/dbraw/zinc/47/46/64/385474664.db2.gz ZCXPOQRREMAYSO-UHFFFAOYSA-N 1 1 237.343 2.377 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2ccccc2O)CCCO1 ZINC000281253096 385650897 /nfs/dbraw/zinc/65/08/97/385650897.db2.gz MRIPQEOJAXIBDJ-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO CC[N@H+](CCCN(C)C)Cc1ccccc1O ZINC000230744743 385754833 /nfs/dbraw/zinc/75/48/33/385754833.db2.gz GFHYLEPGNHMFOV-UHFFFAOYSA-N 1 1 236.359 2.166 20 10 BECDMO CC[N@@H+](CCCN(C)C)Cc1ccccc1O ZINC000230744743 385754835 /nfs/dbraw/zinc/75/48/35/385754835.db2.gz GFHYLEPGNHMFOV-UHFFFAOYSA-N 1 1 236.359 2.166 20 10 BECDMO Cc1noc(C(C)(C)[NH2+]Cc2ccccc2O)n1 ZINC000284013017 385845347 /nfs/dbraw/zinc/84/53/47/385845347.db2.gz NBNROMALVOSHMJ-UHFFFAOYSA-N 1 1 247.298 2.109 20 10 BECDMO CO[C@H](C)C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000272781256 385932026 /nfs/dbraw/zinc/93/20/26/385932026.db2.gz HQLZUYCTZZEIHM-GFCCVEGCSA-N 1 1 236.359 2.219 20 10 BECDMO CS[C@H]1CC[N@H+](Cc2cccc(F)c2O)C1 ZINC000295021318 385944778 /nfs/dbraw/zinc/94/47/78/385944778.db2.gz KQVMUAZLULNSGR-JTQLQIEISA-N 1 1 241.331 2.469 20 10 BECDMO CS[C@H]1CC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000295021318 385944782 /nfs/dbraw/zinc/94/47/82/385944782.db2.gz KQVMUAZLULNSGR-JTQLQIEISA-N 1 1 241.331 2.469 20 10 BECDMO C[N@@H+](CCOC1CCC1)Cc1ccccc1O ZINC000287931376 386157347 /nfs/dbraw/zinc/15/73/47/386157347.db2.gz WVCHKWRGPQJEFY-UHFFFAOYSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)[C@H]2CC[C@H](O)CC2)c1 ZINC000276003854 386259546 /nfs/dbraw/zinc/25/95/46/386259546.db2.gz NWHOCWVLWVBNTA-HDJSIYSDSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1cnn(C)c1C[N@@H+](C)Cc1ccccc1O ZINC000288966176 386246368 /nfs/dbraw/zinc/24/63/68/386246368.db2.gz BICSNUCEYQTCCL-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2O)C1 ZINC000289337367 386285266 /nfs/dbraw/zinc/28/52/66/386285266.db2.gz HKDUGSNKBRMNPC-TXEJJXNPSA-N 1 1 221.300 2.001 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2cccc(F)c2[O-])C1 ZINC000226562457 386334002 /nfs/dbraw/zinc/33/40/02/386334002.db2.gz NXRVQKUWVAAYCG-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000226562457 386334011 /nfs/dbraw/zinc/33/40/11/386334011.db2.gz NXRVQKUWVAAYCG-LLVKDONJSA-N 1 1 239.290 2.142 20 10 BECDMO C[N@@H+](Cc1ccccc1O)C1CCC(CO)CC1 ZINC000290530818 386450269 /nfs/dbraw/zinc/45/02/69/386450269.db2.gz QPRSNXLIDXUYQR-UHFFFAOYSA-N 1 1 249.354 2.375 20 10 BECDMO CC(C)C[C@H](CO)[N@@H+](C)Cc1ccccc1O ZINC000290375636 386426978 /nfs/dbraw/zinc/42/69/78/386426978.db2.gz HTZXTMQXLXVTKL-CYBMUJFWSA-N 1 1 237.343 2.231 20 10 BECDMO C[C@@H]([NH2+]Cc1cccc(F)c1O)[C@H]1CCOC1 ZINC000166137237 386474441 /nfs/dbraw/zinc/47/44/41/386474441.db2.gz GNBPFTMQXLZCFB-KOLCDFICSA-N 1 1 239.290 2.046 20 10 BECDMO C[C@@H](O)CCC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000228032347 386532575 /nfs/dbraw/zinc/53/25/75/386532575.db2.gz YDSJVMHEOMGFGL-NXEZZACHSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H]([NH2+]CCC[C@H](C)O)c1ccc(F)cc1O ZINC000228032364 386533106 /nfs/dbraw/zinc/53/31/06/386533106.db2.gz YDSJVMHEOMGFGL-VHSXEESVSA-N 1 1 241.306 2.343 20 10 BECDMO CC(C)(CO)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293743986 386667108 /nfs/dbraw/zinc/66/71/08/386667108.db2.gz XKVAKALLWISWOF-UHFFFAOYSA-N 1 1 247.697 2.045 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](O)CC2)c1 ZINC000293991658 386672094 /nfs/dbraw/zinc/67/20/94/386672094.db2.gz LQGXGXBAZYKARE-CYBMUJFWSA-N 1 1 235.327 2.047 20 10 BECDMO C[C@@]1(O)CCC[N@@H+](Cc2ccccc2O)CC1 ZINC000279720422 386728132 /nfs/dbraw/zinc/72/81/32/386728132.db2.gz UPAOZFUYMMEIGJ-CQSZACIVSA-N 1 1 235.327 2.129 20 10 BECDMO CO[C@@H]1CCC[N@@H+](Cc2ccccc2O)CC1 ZINC000378637461 387791012 /nfs/dbraw/zinc/79/10/12/387791012.db2.gz NJXNYELMLVEYFG-CYBMUJFWSA-N 1 1 235.327 2.393 20 10 BECDMO C[C@H](CCCO)C[NH2+]Cc1cccc(F)c1O ZINC000294675024 388403386 /nfs/dbraw/zinc/40/33/86/388403386.db2.gz BBSMSLNPDKYJRL-SNVBAGLBSA-N 1 1 241.306 2.030 20 10 BECDMO Oc1ccccc1C[N@H+]1CCOC[C@H]1C1CC1 ZINC000179579768 134321685 /nfs/dbraw/zinc/32/16/85/134321685.db2.gz FEEPRHYCMMLXMB-ZDUSSCGKSA-N 1 1 233.311 2.003 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@]3(CCOC3)C2)c1O ZINC000180615660 134330523 /nfs/dbraw/zinc/33/05/23/134330523.db2.gz UUCWONHFJSUHQM-OAHLLOKOSA-N 1 1 247.338 2.313 20 10 BECDMO C[N@@H+](Cc1ccno1)Cc1ccccc1O ZINC000264687207 397923401 /nfs/dbraw/zinc/92/34/01/397923401.db2.gz FXWYVMQQROLWHB-UHFFFAOYSA-N 1 1 218.256 2.012 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2ccccc2O)C[C@H](C)O1 ZINC000179563403 171662421 /nfs/dbraw/zinc/66/24/21/171662421.db2.gz AKIIDPHMIZDKBI-AAEUAGOBSA-N 1 1 235.327 2.392 20 10 BECDMO C[NH+](C)C(C)(C)CNCc1ccc2c(c1)CCO2 ZINC000037362783 172395039 /nfs/dbraw/zinc/39/50/39/172395039.db2.gz SERAIRZIYMLAPM-UHFFFAOYSA-N 1 1 248.370 2.051 20 10 BECDMO COCC(C)(C)C[NH2+]Cc1cccc(F)c1O ZINC000292770328 174073305 /nfs/dbraw/zinc/07/33/05/174073305.db2.gz KLQJPHLPBQIGFN-UHFFFAOYSA-N 1 1 241.306 2.294 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2C)c1 ZINC000132650722 175158163 /nfs/dbraw/zinc/15/81/63/175158163.db2.gz NAFSTUJLQKKTLR-JTQLQIEISA-N 1 1 221.300 2.385 20 10 BECDMO C[C@@H]1CC[C@@H](C[N@@H+](C)Cc2ccccc2O)O1 ZINC000190860984 176202760 /nfs/dbraw/zinc/20/27/60/176202760.db2.gz RYTOPCITNQFVAQ-YPMHNXCESA-N 1 1 235.327 2.392 20 10 BECDMO C[C@@H]1CC[C@H](C[N@@H+](C)Cc2ccccc2O)O1 ZINC000190860952 176224027 /nfs/dbraw/zinc/22/40/27/176224027.db2.gz RYTOPCITNQFVAQ-DGCLKSJQSA-N 1 1 235.327 2.392 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)CCCO1 ZINC000132722136 176307692 /nfs/dbraw/zinc/30/76/92/176307692.db2.gz NKEHTLWNOQWLEV-LLVKDONJSA-N 1 1 221.300 2.003 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000226563348 177162826 /nfs/dbraw/zinc/16/28/26/177162826.db2.gz XTVZESCXSGFQMS-VIFPVBQESA-N 1 1 209.264 2.373 20 10 BECDMO CC[C@H]([NH2+]CC1COC1)c1ccc(F)cc1O ZINC000528031007 517825606 /nfs/dbraw/zinc/82/56/06/517825606.db2.gz PHPNWUNMUFLAJL-LBPRGKRZSA-N 1 1 239.290 2.218 20 10 BECDMO COc1ccc(N(C)CCn2cc[nH+]c2C)cc1 ZINC000844352673 582580215 /nfs/dbraw/zinc/58/02/15/582580215.db2.gz BPSDVNFQGXYLBG-UHFFFAOYSA-N 1 1 245.326 2.337 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](C)[C@H](CO)C2)c1 ZINC000857061260 588884634 /nfs/dbraw/zinc/88/46/34/588884634.db2.gz NBBNZIYXJOKPNV-OCCSQVGLSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(CN2C[C@@H]3CCC[C@@]3([NH3+])C2)c1O ZINC000857226681 588895955 /nfs/dbraw/zinc/89/59/55/588895955.db2.gz WHTHKVBDQVOSBJ-DZGCQCFKSA-N 1 1 246.354 2.014 20 10 BECDMO Cc1ccc(C[NH2+]CC[C@H](C)N(C)C)c(O)c1 ZINC000895289981 583637658 /nfs/dbraw/zinc/63/76/58/583637658.db2.gz ATJYVXRXHURGTO-LBPRGKRZSA-N 1 1 236.359 2.130 20 10 BECDMO C[C@@H]([NH2+]Cc1c(O)cccc1F)[C@H]1CCOC1 ZINC000896637331 583819029 /nfs/dbraw/zinc/81/90/29/583819029.db2.gz JDTRDOMNELOHAQ-ZJUUUORDSA-N 1 1 239.290 2.046 20 10 BECDMO C[C@@H]1COCC[C@H]1[NH2+]Cc1c(O)cccc1F ZINC000896636373 583819144 /nfs/dbraw/zinc/81/91/44/583819144.db2.gz CCCVCQUKEHKJFA-BXKDBHETSA-N 1 1 239.290 2.046 20 10 BECDMO CC[C@@H](COC)[NH2+]Cc1c(O)cccc1F ZINC000896636776 583819205 /nfs/dbraw/zinc/81/92/05/583819205.db2.gz HDKSWZSJXLTNRO-VIFPVBQESA-N 1 1 227.279 2.046 20 10 BECDMO C[C@@H]([NH2+]Cc1c(O)cccc1F)C1CC1 ZINC000896638464 583819785 /nfs/dbraw/zinc/81/97/85/583819785.db2.gz UVVCSGOAPKNZAY-MRVPVSSYSA-N 1 1 209.264 2.419 20 10 BECDMO CCn1cncc1C[NH2+]Cc1c(O)cccc1F ZINC000896638877 583819799 /nfs/dbraw/zinc/81/97/99/583819799.db2.gz RRARZEPZAUQXCJ-UHFFFAOYSA-N 1 1 249.289 2.038 20 10 BECDMO CC[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2F)CO1 ZINC000896638039 583819928 /nfs/dbraw/zinc/81/99/28/583819928.db2.gz NRGSUMBCHXADSZ-NXEZZACHSA-N 1 1 239.290 2.188 20 10 BECDMO Oc1cccc(F)c1C[NH2+][C@H]1CCCOCC1 ZINC000896637677 583819961 /nfs/dbraw/zinc/81/99/61/583819961.db2.gz PYGBBLPOYVUPDU-JTQLQIEISA-N 1 1 239.290 2.190 20 10 BECDMO CO[C@H](C)[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC000896641586 583820295 /nfs/dbraw/zinc/82/02/95/583820295.db2.gz NCBNPJQUHBNZPU-DTWKUNHWSA-N 1 1 227.279 2.044 20 10 BECDMO CCn1cc(C[NH2+]Cc2c(O)cccc2F)cn1 ZINC000896640311 583820409 /nfs/dbraw/zinc/82/04/09/583820409.db2.gz JTQCWDGQCMWTNS-UHFFFAOYSA-N 1 1 249.289 2.038 20 10 BECDMO C/C=C/C[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000858537760 588963534 /nfs/dbraw/zinc/96/35/34/588963534.db2.gz PRFDRGWQEFITBO-YEZKRMTDSA-N 1 1 249.310 2.406 20 10 BECDMO CC[C@@H]([NH2+]CC1(N)CC1)c1ccc(C)cc1O ZINC000902404874 584589251 /nfs/dbraw/zinc/58/92/51/584589251.db2.gz GMFCFNSHJVZMPI-GFCCVEGCSA-N 1 1 234.343 2.233 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@](C)(CO)C2)c1 ZINC000827700666 584900704 /nfs/dbraw/zinc/90/07/04/584900704.db2.gz WOAMURYYSCYKAY-WFASDCNBSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@H](C)N)c(O)c1C ZINC000817971487 584993513 /nfs/dbraw/zinc/99/35/13/584993513.db2.gz DMKROIUVTWFNDM-ONGXEEELSA-N 1 1 222.332 2.007 20 10 BECDMO C[C@H]([NH2+][C@@H]1CCOC1)c1cc(F)cc(F)c1O ZINC000756766522 585028507 /nfs/dbraw/zinc/02/85/07/585028507.db2.gz AAVAJWASCZAABV-IONNQARKSA-N 1 1 243.253 2.110 20 10 BECDMO C[C@H]1C[C@H]1C[N@@H+](C)Cc1ccccc1O ZINC000754100740 585278155 /nfs/dbraw/zinc/27/81/55/585278155.db2.gz FDWJXRBBWXFAOZ-JQWIXIFHSA-N 1 1 205.301 2.480 20 10 BECDMO Cc1cc(C)c(O)c(C[N@@H+]2CCOC[C@H](C)C2)c1 ZINC000754748984 585290490 /nfs/dbraw/zinc/29/04/90/585290490.db2.gz UVNSCNLYPCEZCB-GFCCVEGCSA-N 1 1 249.354 2.477 20 10 BECDMO COc1ccc(O)c(C[N@H+]2CCC2(C)C)c1 ZINC000775702991 585683285 /nfs/dbraw/zinc/68/32/85/585683285.db2.gz HGFXYAKVWJKKMB-UHFFFAOYSA-N 1 1 221.300 2.385 20 10 BECDMO CC(C)[N@H+](Cc1cc(F)ccc1O)C[C@H](C)O ZINC000779013659 585744055 /nfs/dbraw/zinc/74/40/55/585744055.db2.gz HQWFAAILIXCDAZ-JTQLQIEISA-N 1 1 241.306 2.123 20 10 BECDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2CCO)cc1 ZINC000779202654 585747262 /nfs/dbraw/zinc/74/72/62/585747262.db2.gz RSCZILYRFRWFAD-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO CC[C@]1(O)CC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000779219354 585747481 /nfs/dbraw/zinc/74/74/81/585747481.db2.gz OBVDOGVSOYCDBX-HNNXBMFYSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@@H]([C@@H](C)O)C2)c1O ZINC000780893310 585785835 /nfs/dbraw/zinc/78/58/35/585785835.db2.gz WCXSXCUDTVXVFN-CHWSQXEVSA-N 1 1 249.354 2.293 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)[C@H](C)[C@@H](C)O1 ZINC000783738505 585841674 /nfs/dbraw/zinc/84/16/74/585841674.db2.gz WPPUDUOEXWEWPO-IJLUTSLNSA-N 1 1 235.327 2.390 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@]2(C)CO)c1O ZINC000789557762 585944124 /nfs/dbraw/zinc/94/41/24/585944124.db2.gz LTLFANYIDVPZAF-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@H](O)C2(C)C)c1O ZINC000812778175 586584044 /nfs/dbraw/zinc/58/40/44/586584044.db2.gz CKYJYVFKQBWPOZ-GFCCVEGCSA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cccc(C[NH2+]CC(C)(F)F)c1O ZINC000816643033 586747759 /nfs/dbraw/zinc/74/77/59/586747759.db2.gz SOIXJHXKEOHZBR-UHFFFAOYSA-N 1 1 215.243 2.445 20 10 BECDMO C[C@H]1C[N@H+](Cc2cccc(F)c2O)[C@H]1C ZINC000816646814 586749660 /nfs/dbraw/zinc/74/96/60/586749660.db2.gz JHYPPZRXJGRMRM-IUCAKERBSA-N 1 1 209.264 2.372 20 10 BECDMO C[C@H]1C[N@@H+](Cc2cccc(F)c2O)[C@H]1C ZINC000816646814 586749662 /nfs/dbraw/zinc/74/96/62/586749662.db2.gz JHYPPZRXJGRMRM-IUCAKERBSA-N 1 1 209.264 2.372 20 10 BECDMO C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000817289305 586793188 /nfs/dbraw/zinc/79/31/88/586793188.db2.gz WUKKNHJXYGENLJ-IUODEOHRSA-N 1 1 248.370 2.098 20 10 BECDMO C[NH2+]CCCN[C@H](C)c1ccc(N(C)C)cc1 ZINC000817940469 586844988 /nfs/dbraw/zinc/84/49/88/586844988.db2.gz MZKIFNHTSWTLHA-GFCCVEGCSA-N 1 1 235.375 2.013 20 10 BECDMO CC[NH2+]CCCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000817943615 586846249 /nfs/dbraw/zinc/84/62/49/586846249.db2.gz PRBWIQZDTOCWAM-ZDUSSCGKSA-N 1 1 249.402 2.403 20 10 BECDMO C[C@@H]([NH2+]C[C@@H]1CCCCN1)c1ccccc1O ZINC000817950062 586847031 /nfs/dbraw/zinc/84/70/31/586847031.db2.gz RKCIMZYHWXXODO-NEPJUHHUSA-N 1 1 234.343 2.185 20 10 BECDMO CCNCC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000817952005 586847502 /nfs/dbraw/zinc/84/75/02/586847502.db2.gz MSVGGXYXYAXLGH-LBPRGKRZSA-N 1 1 236.359 2.269 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]CCNC2CC2)c(O)c1C ZINC000817952600 586848103 /nfs/dbraw/zinc/84/81/03/586848103.db2.gz GEXWWKSHKQDSML-LBPRGKRZSA-N 1 1 248.370 2.412 20 10 BECDMO Cc1[nH]ncc1[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817956228 586850136 /nfs/dbraw/zinc/85/01/36/586850136.db2.gz ULBUDMZSHMTBLF-JTQLQIEISA-N 1 1 244.342 2.194 20 10 BECDMO C[C@H](NCC1([NH3+])CCC1)c1ccc(N(C)C)cc1 ZINC000817965023 586854169 /nfs/dbraw/zinc/85/41/69/586854169.db2.gz NEJNWKMYWHUXJM-LBPRGKRZSA-N 1 1 247.386 2.285 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]C[C@@H](N)C2CC2)c(O)c1C ZINC000817964922 586854303 /nfs/dbraw/zinc/85/43/03/586854303.db2.gz JHKADVUGKOQZEE-BXUZGUMPSA-N 1 1 248.370 2.397 20 10 BECDMO CC[C@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(C)cc1O ZINC000817965680 586855403 /nfs/dbraw/zinc/85/54/03/586855403.db2.gz TUIOACTZTMHENG-KGLIPLIRSA-N 1 1 248.370 2.479 20 10 BECDMO CC[C@@H]([NH2+]C[C@@H](N)CC)c1ccccc1O ZINC000817979372 586862110 /nfs/dbraw/zinc/86/21/10/586862110.db2.gz JYHQIRZUUXHMFT-CMPLNLGQSA-N 1 1 222.332 2.170 20 10 BECDMO Cc1nnsc1C[N@@H+](C)Cc1ccccc1O ZINC000821390432 587116109 /nfs/dbraw/zinc/11/61/09/587116109.db2.gz ARKJCOXYXLDPSK-UHFFFAOYSA-N 1 1 249.339 2.184 20 10 BECDMO Cc1nnsc1C[N@H+](C)Cc1ccccc1O ZINC000821390432 587116111 /nfs/dbraw/zinc/11/61/11/587116111.db2.gz ARKJCOXYXLDPSK-UHFFFAOYSA-N 1 1 249.339 2.184 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C(C)C)C2COC2)c1 ZINC000824472350 587271429 /nfs/dbraw/zinc/27/14/29/587271429.db2.gz QWSKNVJSABMNQJ-UHFFFAOYSA-N 1 1 235.327 2.310 20 10 BECDMO C[C@H](CO)[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835053913 587779674 /nfs/dbraw/zinc/77/96/74/587779674.db2.gz QDZJIGZYAQCPCM-URWSZGRFSA-N 1 1 248.370 2.078 20 10 BECDMO COCC[N@@H+](C)Cc1c(O)cc(C)cc1Cl ZINC000840909204 587929266 /nfs/dbraw/zinc/92/92/66/587929266.db2.gz CAZQYNQSHSIVSB-UHFFFAOYSA-N 1 1 243.734 2.432 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H](O)C[C@H]1C ZINC000840942345 587931268 /nfs/dbraw/zinc/93/12/68/587931268.db2.gz ZPUHVCIXAUDNHX-DOMZBBRYSA-N 1 1 248.370 2.016 20 10 BECDMO Cc1cc(O)c(C[N@@H+](C)CCCO)c(Cl)c1 ZINC000840942375 587931352 /nfs/dbraw/zinc/93/13/52/587931352.db2.gz CQPUEFICWANRBN-UHFFFAOYSA-N 1 1 243.734 2.168 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@H](CO)[C@@H]2C)c1O ZINC000840977805 587932918 /nfs/dbraw/zinc/93/29/18/587932918.db2.gz KBBHAFVJGTXXJZ-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO CCC([NH3+])(CC)CNCc1ccc(N(C)C)cc1 ZINC000841030471 587936043 /nfs/dbraw/zinc/93/60/43/587936043.db2.gz IKUSLDLDYXVBMB-UHFFFAOYSA-N 1 1 249.402 2.360 20 10 BECDMO C[NH2+]CCCNCc1c(O)cc(C)cc1Cl ZINC000841043674 587939237 /nfs/dbraw/zinc/93/92/37/587939237.db2.gz ZUXQJEUJPKBYRY-UHFFFAOYSA-N 1 1 242.750 2.053 20 10 BECDMO C[C@@H](C[NH3+])[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000841063873 587941320 /nfs/dbraw/zinc/94/13/20/587941320.db2.gz RNNALCYEQYJBHA-LURJTMIESA-N 1 1 249.141 2.136 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@H]2CCCCNC2)cc1C ZINC000841089547 587945924 /nfs/dbraw/zinc/94/59/24/587945924.db2.gz IFBOIEOKIBVPKQ-AWEZNQCLSA-N 1 1 248.370 2.241 20 10 BECDMO C[C@@H](CCO)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841757653 587974316 /nfs/dbraw/zinc/97/43/16/587974316.db2.gz DWJXLMIURNFZKJ-IUCAKERBSA-N 1 1 243.734 2.467 20 10 BECDMO Cc1cccc(CN2CCCC[C@H]2[C@H](C)[NH3+])c1O ZINC000843046411 588076050 /nfs/dbraw/zinc/07/60/50/588076050.db2.gz VCHGGXVCFPVAGI-JSGCOSHPSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cccc(C[N@H+]2CCCC[C@H]2[C@H](C)N)c1O ZINC000843046411 588076051 /nfs/dbraw/zinc/07/60/51/588076051.db2.gz VCHGGXVCFPVAGI-JSGCOSHPSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cccc(C[N@@H+]2CCCC[C@H]2[C@H](C)N)c1O ZINC000843046411 588076053 /nfs/dbraw/zinc/07/60/53/588076053.db2.gz VCHGGXVCFPVAGI-JSGCOSHPSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CCNCC2(C)C)cc1C ZINC000843054526 588077343 /nfs/dbraw/zinc/07/73/43/588077343.db2.gz QQJJBWYSOZLJNM-UHFFFAOYSA-N 1 1 248.370 2.193 20 10 BECDMO Cc1cc(O)c(C[N@H+]2CCNCC2(C)C)cc1C ZINC000843054526 588077345 /nfs/dbraw/zinc/07/73/45/588077345.db2.gz QQJJBWYSOZLJNM-UHFFFAOYSA-N 1 1 248.370 2.193 20 10 BECDMO CCC[C@@H]1CNCC[N@@H+]1Cc1cc(C)ccc1O ZINC000843058626 588077934 /nfs/dbraw/zinc/07/79/34/588077934.db2.gz XNKWEYLEUGMLJE-CQSZACIVSA-N 1 1 248.370 2.275 20 10 BECDMO CCC[C@@H]1CNCC[N@H+]1Cc1cc(C)ccc1O ZINC000843058626 588077936 /nfs/dbraw/zinc/07/79/36/588077936.db2.gz XNKWEYLEUGMLJE-CQSZACIVSA-N 1 1 248.370 2.275 20 10 BECDMO COc1ccc(N(C)CC[N@@H+](C)CCF)cc1 ZINC000844402073 588190306 /nfs/dbraw/zinc/19/03/06/588190306.db2.gz UDTCJWYMMFBXNN-UHFFFAOYSA-N 1 1 240.322 2.033 20 10 BECDMO C[C@@H](CCO)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000846113106 588257346 /nfs/dbraw/zinc/25/73/46/588257346.db2.gz ZHSIRBGUWCOZPH-VIFPVBQESA-N 1 1 243.734 2.248 20 10 BECDMO CCc1cccc(C[N@@H+]2C[C@@H](CC)[C@H](O)C2)c1O ZINC000848891467 588417986 /nfs/dbraw/zinc/41/79/86/588417986.db2.gz YPFYFBSFSRJPNR-TZMCWYRMSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@@H]2COC)c1O ZINC000848914446 588420188 /nfs/dbraw/zinc/42/01/88/588420188.db2.gz NABWLIQPTDLMMG-CYBMUJFWSA-N 1 1 235.327 2.175 20 10 BECDMO CCc1cccc(C[N@@H+](C)[C@H](C)CCO)c1O ZINC000848918616 588420792 /nfs/dbraw/zinc/42/07/92/588420792.db2.gz GAIHHRKWEKEPAL-LLVKDONJSA-N 1 1 237.343 2.157 20 10 BECDMO Cc1cccc(CNCC2([NH3+])CCCC2)c1O ZINC000849349650 588474512 /nfs/dbraw/zinc/47/45/12/588474512.db2.gz GBTGJCRCNUCAOL-UHFFFAOYSA-N 1 1 234.343 2.062 20 10 BECDMO CCOc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c(O)c1 ZINC000862441366 589213417 /nfs/dbraw/zinc/21/34/17/589213417.db2.gz QTIGBDONRHNCFK-TXEJJXNPSA-N 1 1 233.311 2.243 20 10 BECDMO CCOc1cccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1O ZINC000862441719 589213482 /nfs/dbraw/zinc/21/34/82/589213482.db2.gz UQOSPNVZBYZYDA-TXEJJXNPSA-N 1 1 233.311 2.243 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)CC2(C)COC2)c1 ZINC000862476579 589216566 /nfs/dbraw/zinc/21/65/66/589216566.db2.gz DFEJEBOFKVFFII-UHFFFAOYSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1cc(O)c(C[NH2+][C@@H]2CC[C@@H](C)NC2)cc1C ZINC000863484175 589293120 /nfs/dbraw/zinc/29/31/20/589293120.db2.gz HPZDHJOGURHQET-TZMCWYRMSA-N 1 1 248.370 2.239 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[C@H](C)NC2)c1 ZINC000863545807 589298068 /nfs/dbraw/zinc/29/80/68/589298068.db2.gz HRRNOLHBWZJTGP-AVGNSLFASA-N 1 1 248.370 2.492 20 10 BECDMO CCCN1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000020189622 590082920 /nfs/dbraw/zinc/08/29/20/590082920.db2.gz PFVMOHMVLWVHIG-UHFFFAOYSA-N 1 1 248.370 2.356 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(O)c1 ZINC000876512688 590205798 /nfs/dbraw/zinc/20/57/98/590205798.db2.gz VZRBXRGWUGJIBP-TXEJJXNPSA-N 1 1 235.327 2.310 20 10 BECDMO CC[C@H]1C[N@@H+](Cc2c(C)cccc2O)CCO1 ZINC000876560276 590215565 /nfs/dbraw/zinc/21/55/65/590215565.db2.gz JOFXVWUQSXESLF-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC[C@H](N(C)C)C2)c(O)c1 ZINC000876678130 590229762 /nfs/dbraw/zinc/22/97/62/590229762.db2.gz BXTRHGPQQPTRBU-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(CN2CCC[C@H]([NH+](C)C)C2)c(O)c1 ZINC000876678130 590229763 /nfs/dbraw/zinc/22/97/63/590229763.db2.gz BXTRHGPQQPTRBU-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO COC[C@H]1CC[N@@H+](Cc2c(C)cccc2O)C1 ZINC000876726030 590233786 /nfs/dbraw/zinc/23/37/86/590233786.db2.gz TYAABGSNJQTSFJ-LBPRGKRZSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1ccc(C[N@@H+]2CCC[C@H]2C[C@H](C)O)c(O)c1 ZINC000876748794 590237486 /nfs/dbraw/zinc/23/74/86/590237486.db2.gz FRMUARPXZOWQFC-JSGCOSHPSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@](C)(O)C2)c(O)c1 ZINC000876760514 590239086 /nfs/dbraw/zinc/23/90/86/590239086.db2.gz SNLICNRGTLJDNX-CQSZACIVSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1ccc(C[N@H+]2CCO[C@@H](C3CC3)C2)c(O)c1 ZINC000877423951 590325531 /nfs/dbraw/zinc/32/55/31/590325531.db2.gz NSEMHCQOJRBEQH-OAHLLOKOSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@H](O)C(C)(C)C2)c(O)c1 ZINC000877461859 590332063 /nfs/dbraw/zinc/33/20/63/590332063.db2.gz KZMMBYQSMCZFSA-CQSZACIVSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1ccc(C[N@H+]2CCC[C@@](C)(O)CC2)c(O)c1 ZINC000877489193 590339005 /nfs/dbraw/zinc/33/90/05/590339005.db2.gz LEVYPFAHFBPZJU-OAHLLOKOSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1ccc(C[N@@H+](C2CC2)C2COC2)c(O)c1 ZINC000877557731 590358882 /nfs/dbraw/zinc/35/88/82/590358882.db2.gz PGOSIHFJZHVAGU-UHFFFAOYSA-N 1 1 233.311 2.064 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@H](F)C2)c(O)c1 ZINC000877559467 590358933 /nfs/dbraw/zinc/35/89/33/590358933.db2.gz ODKWDDWWTPWOIH-LLVKDONJSA-N 1 1 209.264 2.244 20 10 BECDMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(C)cc1O ZINC000877561389 590360256 /nfs/dbraw/zinc/36/02/56/590360256.db2.gz LWMYCIMVRNTZAJ-KGLIPLIRSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@H](CCCO)C1 ZINC000877576485 590363722 /nfs/dbraw/zinc/36/37/22/590363722.db2.gz LLDHTGDOBALOMA-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO Cc1ccc(C[N@H+]2C[C@@H]3C[C@H]2CS3)c(O)c1 ZINC000877586423 590367769 /nfs/dbraw/zinc/36/77/69/590367769.db2.gz DLBUIXHBKUGYDM-RYUDHWBXSA-N 1 1 235.352 2.390 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@@H](C)C[C@H](CO)C1 ZINC000877595156 590369734 /nfs/dbraw/zinc/36/97/34/590369734.db2.gz UAKHETPPBSMPIP-AAEUAGOBSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@H+](C[C@@H](C)O)C2CC2)c(O)c1 ZINC000877621325 590376122 /nfs/dbraw/zinc/37/61/22/590376122.db2.gz QOQZUWUBSMREDV-LLVKDONJSA-N 1 1 235.327 2.046 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c(O)c1 ZINC000877638025 590381661 /nfs/dbraw/zinc/38/16/61/590381661.db2.gz RKVOYVSJWOQJDO-ZIAGYGMSSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CC[C@H](C)[C@H](CO)C1 ZINC000877646880 590384220 /nfs/dbraw/zinc/38/42/20/590384220.db2.gz MNWQTTKHZAANSZ-AAEUAGOBSA-N 1 1 249.354 2.151 20 10 BECDMO Oc1cccc2c1C[N@@H+](CC[C@H]1CCOC1)C2 ZINC000877702593 590396355 /nfs/dbraw/zinc/39/63/55/590396355.db2.gz CVJZGPVJHPHGEQ-NSHDSACASA-N 1 1 233.311 2.134 20 10 BECDMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2O)CCN1C ZINC000877751193 590414564 /nfs/dbraw/zinc/41/45/64/590414564.db2.gz YABPYFXUJBRJEK-CQSZACIVSA-N 1 1 248.370 2.164 20 10 BECDMO CC(C)[C@@H](O)CC[N@@H+](C)Cc1ccccc1O ZINC000878242318 590528605 /nfs/dbraw/zinc/52/86/05/590528605.db2.gz OMENLGARRXRUJZ-ZDUSSCGKSA-N 1 1 237.343 2.231 20 10 BECDMO CCc1nnc(C[NH2+][C@H](C)c2ccccc2O)o1 ZINC000879647870 590841208 /nfs/dbraw/zinc/84/12/08/590841208.db2.gz OTIALOJRAQSUQR-SECBINFHSA-N 1 1 247.298 2.188 20 10 BECDMO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)o1 ZINC000879651851 590843414 /nfs/dbraw/zinc/84/34/14/590843414.db2.gz MXRQGGXYAKRXST-DTWKUNHWSA-N 1 1 247.298 2.495 20 10 BECDMO CO[C@H](C)[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883122380 591543782 /nfs/dbraw/zinc/54/37/82/591543782.db2.gz LPQNEFOQYMLFRJ-HTQZYQBOSA-N 1 1 245.269 2.183 20 10 BECDMO CC[C@@H](C)N1CC[NH+](Cc2ccccc2O)CC1 ZINC000133814805 591860789 /nfs/dbraw/zinc/86/07/89/591860789.db2.gz LNOXWKCPXCQAPB-CYBMUJFWSA-N 1 1 248.370 2.308 20 10 BECDMO C[C@@H]([NH2+]C[C@H]1CCCO1)c1c(O)cccc1F ZINC000886489386 592236169 /nfs/dbraw/zinc/23/61/69/592236169.db2.gz HMYNUAKBIVXFCW-NXEZZACHSA-N 1 1 239.290 2.361 20 10 BECDMO COCCC[NH2+][C@H](C)c1c(O)cccc1F ZINC000886489881 592236228 /nfs/dbraw/zinc/23/62/28/592236228.db2.gz UDGXUHINNQEIPJ-SECBINFHSA-N 1 1 227.279 2.218 20 10 BECDMO CCC[C@H](O)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886526493 592245680 /nfs/dbraw/zinc/24/56/80/592245680.db2.gz NBQWSDOKFZJRTL-UWVGGRQHSA-N 1 1 241.306 2.343 20 10 BECDMO CC[C@](C)(O)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886524968 592246347 /nfs/dbraw/zinc/24/63/47/592246347.db2.gz UTPBSGQNABUZLE-RNCFNFMXSA-N 1 1 241.306 2.343 20 10 BECDMO CC[C@@H](O)CC[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886540199 592253301 /nfs/dbraw/zinc/25/33/01/592253301.db2.gz ARJCSJAMKHOHEI-VHSXEESVSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H]([NH2+]CCC[C@H](C)O)c1c(O)cccc1F ZINC000886603391 592272211 /nfs/dbraw/zinc/27/22/11/592272211.db2.gz MXUKHQQVTSMERK-VHSXEESVSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H]([NH2+]CCCCCO)c1c(O)cccc1F ZINC000886602854 592272615 /nfs/dbraw/zinc/27/26/15/592272615.db2.gz AVBCAAKCAQIGMC-SNVBAGLBSA-N 1 1 241.306 2.345 20 10 BECDMO C[C@@H]([NH2+][C@H]1CO[C@H](C)C1)c1c(O)cccc1F ZINC000886631549 592283397 /nfs/dbraw/zinc/28/33/97/592283397.db2.gz PRBYOTAIPRYNJX-OPRDCNLKSA-N 1 1 239.290 2.359 20 10 BECDMO C[N@H+](C[C@@H]1C[C@]12CCOC2)c1ccc(N)cc1 ZINC000886841614 592363239 /nfs/dbraw/zinc/36/32/39/592363239.db2.gz QVVZQIWXXBUWIX-FZMZJTMJSA-N 1 1 232.327 2.132 20 10 BECDMO C[N@@H+](C[C@@H]1C[C@]12CCOC2)c1ccc(N)cc1 ZINC000886841614 592363244 /nfs/dbraw/zinc/36/32/44/592363244.db2.gz QVVZQIWXXBUWIX-FZMZJTMJSA-N 1 1 232.327 2.132 20 10 BECDMO Oc1ccc(F)cc1C[NH2+]Cc1nccs1 ZINC000226585656 635436988 /nfs/dbraw/zinc/43/69/88/635436988.db2.gz DLYALEJHHAUSJL-UHFFFAOYSA-N 1 1 238.287 2.278 20 10 BECDMO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000934114646 631690820 /nfs/dbraw/zinc/69/08/20/631690820.db2.gz UZCHRRDPHWLWFD-LSDHHAIUSA-N 1 1 248.370 2.362 20 10 BECDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCOC1 ZINC000309513625 632432719 /nfs/dbraw/zinc/43/27/19/632432719.db2.gz QNEUNOQREXBUSH-SSDOTTSWSA-N 1 1 245.681 2.063 20 10 BECDMO Oc1ccccc1C[NH+]1CC(C(F)(F)F)C1 ZINC000894891674 636000562 /nfs/dbraw/zinc/00/05/62/636000562.db2.gz BUWTXBPCZBIALQ-UHFFFAOYSA-N 1 1 231.217 2.386 20 10 BECDMO Cc1cccc(C[N@H+]2CCC[C@H](CO)CC2)c1O ZINC000294081435 633751326 /nfs/dbraw/zinc/75/13/26/633751326.db2.gz QZJLYEXRHCOHAD-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO C[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000005066617 635197566 /nfs/dbraw/zinc/19/75/66/635197566.db2.gz VNNZMNLBBBKVPM-JTQLQIEISA-N 1 1 249.310 2.353 20 10 BECDMO Oc1ccccc1C[N@H+]1CCO[C@@H](C2CCC2)C1 ZINC000840955250 635385837 /nfs/dbraw/zinc/38/58/37/635385837.db2.gz SPDYJKYLLNUAHD-OAHLLOKOSA-N 1 1 247.338 2.393 20 10 BECDMO C[C@H]([NH2+]Cc1nncs1)c1ccccc1O ZINC000931556939 640273837 /nfs/dbraw/zinc/27/38/37/640273837.db2.gz FNXREWRIZYBAJE-QMMMGPOBSA-N 1 1 235.312 2.095 20 10 BECDMO Cc1ccc(O)c(CN2CCCC[C@H]2[C@H](C)[NH3+])c1 ZINC000226933324 640803834 /nfs/dbraw/zinc/80/38/34/640803834.db2.gz BIAHQWNJYKKWRI-JSGCOSHPSA-N 1 1 248.370 2.402 20 10 BECDMO C[C@H]1OCC[C@@]1(C)[NH2+]Cc1cccc(F)c1O ZINC000230392084 641048888 /nfs/dbraw/zinc/04/88/88/641048888.db2.gz BZMWWAOQYBIIMI-NOZJJQNGSA-N 1 1 239.290 2.188 20 10 BECDMO CCOCC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062745945 641084539 /nfs/dbraw/zinc/08/45/39/641084539.db2.gz VIVNIVBAKWYMHD-SECBINFHSA-N 1 1 227.279 2.218 20 10 BECDMO COC[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062744758 641086787 /nfs/dbraw/zinc/08/67/87/641086787.db2.gz SVXXSQMIDZHEQF-IUCAKERBSA-N 1 1 227.279 2.217 20 10 BECDMO COCC1=CC[N@@H+](Cc2cccc(C)c2O)CC1 ZINC000187622866 641716456 /nfs/dbraw/zinc/71/64/56/641716456.db2.gz PFBJKZBAHMZJMG-UHFFFAOYSA-N 1 1 247.338 2.479 20 10 BECDMO COC[C@H]1CC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000754740964 641815192 /nfs/dbraw/zinc/81/51/92/641815192.db2.gz KACMZVQGIBQHOK-ZDUSSCGKSA-N 1 1 249.354 2.477 20 10 BECDMO C[N@H+](CCNCc1ccccc1O)C1CCCC1 ZINC000071376628 642456178 /nfs/dbraw/zinc/45/61/78/642456178.db2.gz RVGDBJTXLNZWPS-UHFFFAOYSA-N 1 1 248.370 2.356 20 10 BECDMO C[N@@H+](CCNCc1ccccc1O)C1CCCC1 ZINC000071376628 642456188 /nfs/dbraw/zinc/45/61/88/642456188.db2.gz RVGDBJTXLNZWPS-UHFFFAOYSA-N 1 1 248.370 2.356 20 10 BECDMO CC1(C)C[N@H+](Cc2cc(F)ccc2O)CCO1 ZINC000179941766 642756724 /nfs/dbraw/zinc/75/67/24/642756724.db2.gz YOJDAFJXSCOIBS-UHFFFAOYSA-N 1 1 239.290 2.142 20 10 BECDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2O)CCO1 ZINC000179941766 642756729 /nfs/dbraw/zinc/75/67/29/642756729.db2.gz YOJDAFJXSCOIBS-UHFFFAOYSA-N 1 1 239.290 2.142 20 10 BECDMO COc1cccc(C[N@H+]2C[C@H](C)[C@@H]2C)c1O ZINC000816647592 643554313 /nfs/dbraw/zinc/55/43/13/643554313.db2.gz VIQPEGIBVJQPLD-UWVGGRQHSA-N 1 1 221.300 2.241 20 10 BECDMO COc1cccc(O)c1C[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000769488853 644682454 /nfs/dbraw/zinc/68/24/54/644682454.db2.gz RWCKFEMWMHLMQD-TXEJJXNPSA-N 1 1 247.338 2.489 20 10 BECDMO COC[C@H]1CC[N@H+]1Cc1cc(C)cc(C)c1O ZINC000840083735 644857656 /nfs/dbraw/zinc/85/76/56/644857656.db2.gz QWBNBYPEOOHSNO-CYBMUJFWSA-N 1 1 235.327 2.230 20 10 BECDMO Oc1ccccc1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252667263 644873133 /nfs/dbraw/zinc/87/31/33/644873133.db2.gz HRFGCPQFMNVOTH-KGLIPLIRSA-N 1 1 246.354 2.109 20 10 BECDMO Oc1ccccc1CN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000252667263 644873137 /nfs/dbraw/zinc/87/31/37/644873137.db2.gz HRFGCPQFMNVOTH-KGLIPLIRSA-N 1 1 246.354 2.109 20 10 BECDMO CC[C@@H](N)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000817981035 644994510 /nfs/dbraw/zinc/99/45/10/644994510.db2.gz ZAHOOMAJRYIPJI-GHMZBOCLSA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@@H]([NH3+])CN[C@H](C)c1cc(C)ccc1O ZINC000817981035 644994516 /nfs/dbraw/zinc/99/45/16/644994516.db2.gz ZAHOOMAJRYIPJI-GHMZBOCLSA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@@H](N)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000817981042 644994556 /nfs/dbraw/zinc/99/45/56/644994556.db2.gz ZAHOOMAJRYIPJI-WDEREUQCSA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@@H]([NH3+])CN[C@@H](C)c1cc(C)ccc1O ZINC000817981042 644994564 /nfs/dbraw/zinc/99/45/64/644994564.db2.gz ZAHOOMAJRYIPJI-WDEREUQCSA-N 1 1 222.332 2.089 20 10 BECDMO C[C@H](O)C[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835047252 645163665 /nfs/dbraw/zinc/16/36/65/645163665.db2.gz DQIYCDNMHYPUFV-SZZPACECSA-N 1 1 248.370 2.078 20 10 BECDMO CC(=O)c1cc(F)cc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1O ZINC000380375940 712900200 /nfs/dbraw/zinc/90/02/00/712900200.db2.gz IBTNIIHUBMOPJG-AOOOYVTPSA-N 1 1 249.285 2.186 20 10 BECDMO CC(=O)c1cc(F)cc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1O ZINC000380375940 712900201 /nfs/dbraw/zinc/90/02/01/712900201.db2.gz IBTNIIHUBMOPJG-AOOOYVTPSA-N 1 1 249.285 2.186 20 10 BECDMO Cc1nnc(C[NH2+][C@H](C)c2ccccc2O)s1 ZINC000391774476 711140284 /nfs/dbraw/zinc/14/02/84/711140284.db2.gz AYPXUKDDNWGYHP-MRVPVSSYSA-N 1 1 249.339 2.403 20 10 BECDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)C(C)(C)O ZINC000393968983 711180559 /nfs/dbraw/zinc/18/05/59/711180559.db2.gz ITQPQXDEZFKNEC-DTWKUNHWSA-N 1 1 241.306 2.341 20 10 BECDMO COCCCC[N@@H+](C)Cc1cc(F)ccc1O ZINC000397088607 711377060 /nfs/dbraw/zinc/37/70/60/711377060.db2.gz GSRMXLVRALYLQE-UHFFFAOYSA-N 1 1 241.306 2.390 20 10 BECDMO CC[C@H](C[NH2+]Cc1cc(F)cc(F)c1O)OC ZINC000708483645 712183821 /nfs/dbraw/zinc/18/38/21/712183821.db2.gz FDCWBSXVVGYQFC-SNVBAGLBSA-N 1 1 245.269 2.185 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCCCC[C@@H](N)C2)c1 ZINC000709049623 712206517 /nfs/dbraw/zinc/20/65/17/712206517.db2.gz LJJFISTUNPATBF-CQSZACIVSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1ccc(O)c(CN2CCCCC[C@@H]([NH3+])C2)c1 ZINC000709049623 712206514 /nfs/dbraw/zinc/20/65/14/712206514.db2.gz LJJFISTUNPATBF-CQSZACIVSA-N 1 1 248.370 2.404 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCCCC[C@@H](N)C2)c1 ZINC000709049623 712206515 /nfs/dbraw/zinc/20/65/15/712206515.db2.gz LJJFISTUNPATBF-CQSZACIVSA-N 1 1 248.370 2.404 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@H](COC)C2)c1O ZINC000709309204 712219392 /nfs/dbraw/zinc/21/93/92/712219392.db2.gz SOJZBSZDYDMACZ-LBPRGKRZSA-N 1 1 249.354 2.423 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@H](CF)C2)c1O ZINC000711492874 712307559 /nfs/dbraw/zinc/30/75/59/712307559.db2.gz UYYWTAVOTGHYMR-NSHDSACASA-N 1 1 223.291 2.492 20 10 BECDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@H]1CCOC1 ZINC000380145667 712699654 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COc1ccc(O)c(C[N@@H+]2CC=CCC2)c1 ZINC000779159399 585746108 /nfs/dbraw/zinc/74/61/08/585746108.db2.gz IOXZLEAZBZJYAO-UHFFFAOYSA-N 1 1 219.284 2.163 20 10 BECDMO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1cc(Cl)ccc1O ZINC000788268504 585919979 /nfs/dbraw/zinc/91/99/79/585919979.db2.gz DVSFCMQEYSFKQB-LDYMZIIASA-N 1 1 241.718 2.001 20 10 BECDMO CCN(C)c1ccc(C[N@@H+](C)C2(CO)CC2)cc1 ZINC000815118495 586667149 /nfs/dbraw/zinc/66/71/49/586667149.db2.gz WJANBRPFUCCHLE-UHFFFAOYSA-N 1 1 248.370 2.099 20 10 BECDMO COc1cccc(O)c1C[N@H+]1C[C@@H](C)[C@H]1C ZINC000816649131 586751763 /nfs/dbraw/zinc/75/17/63/586751763.db2.gz URQBEHJEVSLERC-NXEZZACHSA-N 1 1 221.300 2.241 20 10 BECDMO Cc1cc(N(C)C)ccc1CN[C@H]1CCC[C@H]1[NH3+] ZINC000817893958 586833681 /nfs/dbraw/zinc/83/36/81/586833681.db2.gz JMXDBVVTBKTVBC-CABCVRRESA-N 1 1 247.386 2.030 20 10 BECDMO C[C@H]([NH2+]CC[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000817934441 586843325 /nfs/dbraw/zinc/84/33/25/586843325.db2.gz ILDKMMXHQSAKON-LURJTMIESA-N 1 1 249.141 2.308 20 10 BECDMO CC[C@@H]([NH2+]CC[NH3+])c1cccc(Cl)c1[O-] ZINC000817934980 586843564 /nfs/dbraw/zinc/84/35/64/586843564.db2.gz DHSZVEGASVLCBF-SNVBAGLBSA-N 1 1 228.723 2.045 20 10 BECDMO C[NH2+]CCC[NH2+][C@@H](C)c1cc(Cl)ccc1[O-] ZINC000817939616 586844538 /nfs/dbraw/zinc/84/45/38/586844538.db2.gz GGWAAUZYFJRMOU-VIFPVBQESA-N 1 1 242.750 2.306 20 10 BECDMO C[C@H]([NH2+][C@@H]1CCCNC1)c1ccc(N(C)C)cc1 ZINC000817941260 586844931 /nfs/dbraw/zinc/84/49/31/586844931.db2.gz PBIUIBUHVRLDRO-GXTWGEPZSA-N 1 1 247.386 2.155 20 10 BECDMO C[C@H]([NH2+]C[C@@H]1CCCCN1)c1ccccc1O ZINC000817950064 586847373 /nfs/dbraw/zinc/84/73/73/586847373.db2.gz RKCIMZYHWXXODO-RYUDHWBXSA-N 1 1 234.343 2.185 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](N)C(C)C)c1 ZINC000817958497 586850465 /nfs/dbraw/zinc/85/04/65/586850465.db2.gz KIAIGISKBRTAMW-AAEUAGOBSA-N 1 1 236.359 2.335 20 10 BECDMO Cc1ccc(O)c([C@H](C)NC[C@H]([NH3+])C(C)C)c1 ZINC000817958497 586850468 /nfs/dbraw/zinc/85/04/68/586850468.db2.gz KIAIGISKBRTAMW-AAEUAGOBSA-N 1 1 236.359 2.335 20 10 BECDMO CC[C@@H]([NH2+]CC1(N)CCC1)c1ccccc1O ZINC000817964590 586854309 /nfs/dbraw/zinc/85/43/09/586854309.db2.gz FMVIZHYUMZCMGK-GFCCVEGCSA-N 1 1 234.343 2.314 20 10 BECDMO C[C@H](N[C@H]1C[NH2+]CC[C@@H]1C)c1ccccc1O ZINC000817967839 586856239 /nfs/dbraw/zinc/85/62/39/586856239.db2.gz MLBAJMPNWKQSPA-GVXVVHGQSA-N 1 1 234.343 2.041 20 10 BECDMO C[C@H](N[C@H]1C[NH2+]CC[C@H]1C)c1ccccc1O ZINC000817967842 586856270 /nfs/dbraw/zinc/85/62/70/586856270.db2.gz MLBAJMPNWKQSPA-MDZLAQPJSA-N 1 1 234.343 2.041 20 10 BECDMO Cc1ccc(O)c([C@H](C)N[C@H]2C[NH2+]CC[C@H]2C)c1 ZINC000817969314 586856321 /nfs/dbraw/zinc/85/63/21/586856321.db2.gz UOPTUHIOBYOFIV-DYEKYZERSA-N 1 1 248.370 2.349 20 10 BECDMO Cc1ccc(O)c([C@H](C)N[C@@H]2C[NH2+]CC[C@@H]2C)c1 ZINC000817969319 586856849 /nfs/dbraw/zinc/85/68/49/586856849.db2.gz UOPTUHIOBYOFIV-SGMGOOAPSA-N 1 1 248.370 2.349 20 10 BECDMO CC[C@@H](N[C@H](C)C[NH3+])c1ccc(N(C)C)cc1 ZINC000817966944 586856934 /nfs/dbraw/zinc/85/69/34/586856934.db2.gz ZZEMRYNDGZXZNT-BXUZGUMPSA-N 1 1 235.375 2.141 20 10 BECDMO N[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000818614448 586906746 /nfs/dbraw/zinc/90/67/46/586906746.db2.gz AVWUKHZUOVDVOO-UPJWGTAASA-N 1 1 246.354 2.239 20 10 BECDMO Cc1cc(O)c(C[NH2+]C(CF)CF)cc1C ZINC000824555465 587276428 /nfs/dbraw/zinc/27/64/28/587276428.db2.gz USZOJCXVSVNYMP-UHFFFAOYSA-N 1 1 229.270 2.406 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H](CCCO)C2)c1O ZINC000825338764 587315835 /nfs/dbraw/zinc/31/58/35/587315835.db2.gz UMFXKPCAUQERRD-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000827506315 587384620 /nfs/dbraw/zinc/38/46/20/587384620.db2.gz GKXLBCBOBFZCQZ-NXEZZACHSA-N 1 1 221.275 2.373 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C)C2(CO)CCC2)c1 ZINC000827904021 587409460 /nfs/dbraw/zinc/40/94/60/587409460.db2.gz SZANLBFSUWCVBY-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO CN(C)c1ccc(/C=C/C[N@@H+](C)CCCO)cc1 ZINC000835052131 587779683 /nfs/dbraw/zinc/77/96/83/587779683.db2.gz OFLWQZURWYOMBX-GQCTYLIASA-N 1 1 248.370 2.080 20 10 BECDMO CC[N@@H+](CCO)Cc1c(O)cc(C)cc1Cl ZINC000840907295 587928807 /nfs/dbraw/zinc/92/88/07/587928807.db2.gz CAVOZDZZGSGMFA-UHFFFAOYSA-N 1 1 243.734 2.168 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H](O)C1 ZINC000840908308 587928907 /nfs/dbraw/zinc/92/89/07/587928907.db2.gz RSUPIPNBYJVUKN-OAHLLOKOSA-N 1 1 248.370 2.018 20 10 BECDMO Cc1ccc(O)c(CNCC2([NH3+])CCCCC2)c1 ZINC000841039161 587938272 /nfs/dbraw/zinc/93/82/72/587938272.db2.gz DBJGECMGIYCRLC-UHFFFAOYSA-N 1 1 248.370 2.452 20 10 BECDMO Cc1cc([O-])c(C[NH2+][C@H](C)CC[NH3+])c(Cl)c1 ZINC000841051087 587940046 /nfs/dbraw/zinc/94/00/46/587940046.db2.gz NELCMMVBDSCGTA-SECBINFHSA-N 1 1 242.750 2.181 20 10 BECDMO COc1ccc(CN[C@@H]2CC[NH2+]C[C@@H]2C)cc1C ZINC000841063277 587941374 /nfs/dbraw/zinc/94/13/74/587941374.db2.gz HYKRIQVNXSRVFV-GXTWGEPZSA-N 1 1 248.370 2.091 20 10 BECDMO COc1ccc(CN[C@H]2CC[NH2+][C@@H](C)C2)cc1C ZINC000841061014 587942173 /nfs/dbraw/zinc/94/21/73/587942173.db2.gz DKWWEOKNZYIBQB-JSGCOSHPSA-N 1 1 248.370 2.234 20 10 BECDMO C[C@H](CCC[NH3+])[NH2+]Cc1c([O-])cccc1Cl ZINC000841078371 587944919 /nfs/dbraw/zinc/94/49/19/587944919.db2.gz BYNYPIKZWCDEJZ-SECBINFHSA-N 1 1 242.750 2.263 20 10 BECDMO C[C@H](CCC[NH3+])[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000841080123 587944983 /nfs/dbraw/zinc/94/49/83/587944983.db2.gz NVHNDKULJVFBRH-SECBINFHSA-N 1 1 242.750 2.263 20 10 BECDMO COc1ccc(CNCCC[NH2+]C2CC2)cc1C ZINC000841092012 587946137 /nfs/dbraw/zinc/94/61/37/587946137.db2.gz JLAWNZAYYXHNCG-UHFFFAOYSA-N 1 1 248.370 2.235 20 10 BECDMO Cc1cccc(CN2CCCC[C@@H]2[C@H](C)[NH3+])c1O ZINC000843046410 588075896 /nfs/dbraw/zinc/07/58/96/588075896.db2.gz VCHGGXVCFPVAGI-GXTWGEPZSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2[C@H](C)N)c1O ZINC000843046410 588075898 /nfs/dbraw/zinc/07/58/98/588075898.db2.gz VCHGGXVCFPVAGI-GXTWGEPZSA-N 1 1 248.370 2.402 20 10 BECDMO Cc1cccc(C[N@@H+]2CCCC[C@@H]2[C@H](C)N)c1O ZINC000843046410 588075900 /nfs/dbraw/zinc/07/59/00/588075900.db2.gz VCHGGXVCFPVAGI-GXTWGEPZSA-N 1 1 248.370 2.402 20 10 BECDMO CN(C)c1ccc(/C=C/CN(C)CCC[NH3+])cc1 ZINC000843050107 588076740 /nfs/dbraw/zinc/07/67/40/588076740.db2.gz CRHQZOOTPAIXAL-GQCTYLIASA-N 1 1 247.386 2.046 20 10 BECDMO COc1ccc(N(C)CC[N@@H+](C)C(C)C)cc1 ZINC000844400272 588189880 /nfs/dbraw/zinc/18/98/80/588189880.db2.gz YXGSBAJQPWDNOM-UHFFFAOYSA-N 1 1 236.359 2.472 20 10 BECDMO CCc1cccc(C[N@@H+](CCO)C(C)C)c1O ZINC000848881190 588416185 /nfs/dbraw/zinc/41/61/85/588416185.db2.gz WHQREXJUVFJIBZ-UHFFFAOYSA-N 1 1 237.343 2.157 20 10 BECDMO CCc1cccc(C[N@H+]2CCC[C@@]2(C)CO)c1O ZINC000848906046 588418916 /nfs/dbraw/zinc/41/89/16/588418916.db2.gz QBTSSUSLQCPFMS-HNNXBMFYSA-N 1 1 249.354 2.301 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@H](C)[C@H]2CO)c1O ZINC000848906665 588419625 /nfs/dbraw/zinc/41/96/25/588419625.db2.gz XPZRJKIQQGQSCZ-SMDDNHRTSA-N 1 1 249.354 2.157 20 10 BECDMO CCc1cccc(C[N@H+](CC)[C@H](C)CO)c1O ZINC000848913391 588419974 /nfs/dbraw/zinc/41/99/74/588419974.db2.gz VPPPDYWHEKLMEG-LLVKDONJSA-N 1 1 237.343 2.157 20 10 BECDMO Oc1ccc(F)cc1C[NH+]1CC2(CC2(F)F)C1 ZINC000848921660 588421152 /nfs/dbraw/zinc/42/11/52/588421152.db2.gz FGXBZHNZKKMKPI-UHFFFAOYSA-N 1 1 243.228 2.372 20 10 BECDMO CC[C@@H]([NH2+]C/C=C/CO)c1ccc(F)cc1O ZINC000850509735 588554397 /nfs/dbraw/zinc/55/43/97/588554397.db2.gz RJXLDASIUJHCEM-AAOUONPWSA-N 1 1 239.290 2.121 20 10 BECDMO CC[C@@H]([NH2+]C/C=C\CO)c1ccc(F)cc1O ZINC000850509738 588554585 /nfs/dbraw/zinc/55/45/85/588554585.db2.gz RJXLDASIUJHCEM-VSQXVHSFSA-N 1 1 239.290 2.121 20 10 BECDMO Oc1cccc(Cl)c1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC000862439780 589212919 /nfs/dbraw/zinc/21/29/19/589212919.db2.gz BJFGAYBGPPQPRI-DTORHVGOSA-N 1 1 223.703 2.497 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)CC2(C)COC2)cc1C ZINC000862476606 589216364 /nfs/dbraw/zinc/21/63/64/589216364.db2.gz DWWZZNJYPDKCEW-UHFFFAOYSA-N 1 1 249.354 2.477 20 10 BECDMO Cc1cc(C)c(O)c(C[N@H+](C)CC2(C)COC2)c1 ZINC000863298404 589277186 /nfs/dbraw/zinc/27/71/86/589277186.db2.gz CYPPSBRZQLKNPC-UHFFFAOYSA-N 1 1 249.354 2.477 20 10 BECDMO CC[NH+](CC)CCCNCc1ccccc1O ZINC000019942875 590053142 /nfs/dbraw/zinc/05/31/42/590053142.db2.gz ROFFSZAFTPGMQL-UHFFFAOYSA-N 1 1 236.359 2.214 20 10 BECDMO CCN1CC[N@@H+](Cc2cccc(C)c2O)C[C@@H]1C ZINC000124596531 590061126 /nfs/dbraw/zinc/06/11/26/590061126.db2.gz FYDCKMANKTWSBY-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2cccc(C)c2O)C[C@@H]1C ZINC000124596531 590061128 /nfs/dbraw/zinc/06/11/28/590061128.db2.gz FYDCKMANKTWSBY-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2cccc(C)c2O)C[C@@H]1C ZINC000124596531 590061131 /nfs/dbraw/zinc/06/11/31/590061131.db2.gz FYDCKMANKTWSBY-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO COC[C@H]1CC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000124599272 590061165 /nfs/dbraw/zinc/06/11/65/590061165.db2.gz YMCCWEDACKYHOA-LBPRGKRZSA-N 1 1 235.327 2.169 20 10 BECDMO CCCN1CC[NH+](Cc2ccc(C)cc2O)CC1 ZINC000876523009 590207849 /nfs/dbraw/zinc/20/78/49/590207849.db2.gz IHQDCQIFKWKNEV-UHFFFAOYSA-N 1 1 248.370 2.228 20 10 BECDMO CC[C@@H]1C[N@@H+](Cc2ccc(C)cc2O)CCO1 ZINC000876561321 590215777 /nfs/dbraw/zinc/21/57/77/590215777.db2.gz QYGZBQYSCCMNHY-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)Cc1cnccn1 ZINC000876644457 590225657 /nfs/dbraw/zinc/22/56/57/590225657.db2.gz XOUJTNZAVGGEHT-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@H](CCO)C1 ZINC000876693196 590231165 /nfs/dbraw/zinc/23/11/65/590231165.db2.gz AZEKTYJRQCXVFZ-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO CCN1CC[N@@H+](Cc2c(C)cccc2O)C[C@H]1C ZINC000876715763 590232612 /nfs/dbraw/zinc/23/26/12/590232612.db2.gz SKJVQPZWNCKKLH-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2c(C)cccc2O)C[C@H]1C ZINC000876715763 590232613 /nfs/dbraw/zinc/23/26/13/590232613.db2.gz SKJVQPZWNCKKLH-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2c(C)cccc2O)C[C@H]1C ZINC000876715763 590232615 /nfs/dbraw/zinc/23/26/15/590232615.db2.gz SKJVQPZWNCKKLH-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@@H+](C)CCn2cccn2)c(O)c1 ZINC000876730103 590234322 /nfs/dbraw/zinc/23/43/22/590234322.db2.gz CSZNZGLRCMDPPW-UHFFFAOYSA-N 1 1 245.326 2.029 20 10 BECDMO Cc1ccc(C[N@H+]2CCOC[C@@H]2C2CC2)c(O)c1 ZINC000876765932 590239456 /nfs/dbraw/zinc/23/94/56/590239456.db2.gz WYAKUUXPWNRFHV-CQSZACIVSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1ccc(C[N@H+]2CCOC[C@H]2C2CC2)c(O)c1 ZINC000876765931 590239944 /nfs/dbraw/zinc/23/99/44/590239944.db2.gz WYAKUUXPWNRFHV-AWEZNQCLSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1ccc(C[NH2+]C[C@H]2CCCN(C)C2)c(O)c1 ZINC000877026509 590270812 /nfs/dbraw/zinc/27/08/12/590270812.db2.gz BNZFDDBWIDDWKV-CYBMUJFWSA-N 1 1 248.370 2.132 20 10 BECDMO Cc1ccc(C[N@H+]2CCN(C)[C@H](C)[C@@H]2C)c(O)c1 ZINC000877409687 590323694 /nfs/dbraw/zinc/32/36/94/590323694.db2.gz XZEXVQYYXKPBCQ-OLZOCXBDSA-N 1 1 248.370 2.225 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@@H](C)N(C)C[C@H]2C)c(O)c1 ZINC000877407057 590324352 /nfs/dbraw/zinc/32/43/52/590324352.db2.gz MEYWLNFEZYYSJQ-CHWSQXEVSA-N 1 1 248.370 2.225 20 10 BECDMO CC[C@]1(CO)CCC[N@H+]1Cc1ccc(C)cc1O ZINC000877463207 590332420 /nfs/dbraw/zinc/33/24/20/590332420.db2.gz AETVFCWZJRWNBW-OAHLLOKOSA-N 1 1 249.354 2.438 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)[C@H]1CC[C@H](O)CC1 ZINC000877464575 590334241 /nfs/dbraw/zinc/33/42/41/590334241.db2.gz QKXSWEWVYWMXNV-JOCQHMNTSA-N 1 1 249.354 2.436 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H](O)C2(C)C)c(O)c1 ZINC000877542238 590352291 /nfs/dbraw/zinc/35/22/91/590352291.db2.gz QLZXDBXBRBIPDP-ZDUSSCGKSA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cccc(O)c1C[NH+]1CC(OC(F)F)C1 ZINC000877581598 590366162 /nfs/dbraw/zinc/36/61/62/590366162.db2.gz KJQQVEYHTWXSGR-UHFFFAOYSA-N 1 1 243.253 2.124 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)C[C@H]1CCCN1C ZINC000877596025 590370096 /nfs/dbraw/zinc/37/00/96/590370096.db2.gz GZWZWTFXMHEJFU-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1CN(C)C[C@H]1CCC[N@@H+]1C ZINC000877596025 590370097 /nfs/dbraw/zinc/37/00/97/590370097.db2.gz GZWZWTFXMHEJFU-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1CN(C)C[C@H]1CCC[N@H+]1C ZINC000877596025 590370099 /nfs/dbraw/zinc/37/00/99/590370099.db2.gz GZWZWTFXMHEJFU-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H](CO)C[C@H](C)C2)c(O)c1 ZINC000877594865 590370521 /nfs/dbraw/zinc/37/05/21/590370521.db2.gz LGXCDSDYFDKNNN-QWHCGFSZSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H](O)CC[C@H]2C)c(O)c1 ZINC000877596552 590370608 /nfs/dbraw/zinc/37/06/08/590370608.db2.gz UGJZDGFIVRTVET-DGCLKSJQSA-N 1 1 235.327 2.046 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@@H](C)[C@@](C)(CO)C2)c(O)c1 ZINC000877640704 590381234 /nfs/dbraw/zinc/38/12/34/590381234.db2.gz QVOFAJNOBQLUCT-IUODEOHRSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c(O)c1 ZINC000877638024 590381243 /nfs/dbraw/zinc/38/12/43/590381243.db2.gz RKVOYVSJWOQJDO-UONOGXRCSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@@H](C)[C@](C)(CO)C1 ZINC000877640350 590381523 /nfs/dbraw/zinc/38/15/23/590381523.db2.gz LWYXVAKGJVAYEV-DOMZBBRYSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@@H](O)CC(C)(C)C1 ZINC000877752271 590416301 /nfs/dbraw/zinc/41/63/01/590416301.db2.gz ODCZPUYGQZVJMS-LBPRGKRZSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H](C(C)(C)O)C2)c1O ZINC000877836402 590431931 /nfs/dbraw/zinc/43/19/31/590431931.db2.gz WIVOUSCZXMTXBH-ZDUSSCGKSA-N 1 1 249.354 2.293 20 10 BECDMO CC(=O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000877977742 590464320 /nfs/dbraw/zinc/46/43/20/590464320.db2.gz SYKIDGCEITUUCR-UHFFFAOYSA-N 1 1 246.354 2.306 20 10 BECDMO CC(=O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000877977742 590464322 /nfs/dbraw/zinc/46/43/22/590464322.db2.gz SYKIDGCEITUUCR-UHFFFAOYSA-N 1 1 246.354 2.306 20 10 BECDMO C[C@@H]([NH2+]Cc1cnsn1)c1ccccc1O ZINC000879649435 590842134 /nfs/dbraw/zinc/84/21/34/590842134.db2.gz SXGPMUYKQIQCON-MRVPVSSYSA-N 1 1 235.312 2.095 20 10 BECDMO C[C@H]([NH2+]C1CCOCC1)c1c(O)cccc1F ZINC000886507478 592239626 /nfs/dbraw/zinc/23/96/26/592239626.db2.gz MSABQXLTLKUZMX-VIFPVBQESA-N 1 1 239.290 2.361 20 10 BECDMO C[C@@H]([NH2+]Cc1cnn(C)c1)c1c(O)cccc1F ZINC000886510024 592240452 /nfs/dbraw/zinc/24/04/52/592240452.db2.gz PTFIZHKWEPJREP-SECBINFHSA-N 1 1 249.289 2.116 20 10 BECDMO CC[C@@](C)(O)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886524969 592246419 /nfs/dbraw/zinc/24/64/19/592246419.db2.gz UTPBSGQNABUZLE-TVQRCGJNSA-N 1 1 241.306 2.343 20 10 BECDMO C[C@@H](CN(C)C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886609349 592274286 /nfs/dbraw/zinc/27/42/86/592274286.db2.gz RAMSLZLOBRGBSV-UWVGGRQHSA-N 1 1 240.322 2.132 20 10 BECDMO CC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@H](C)O ZINC000886620472 592277282 /nfs/dbraw/zinc/27/72/82/592277282.db2.gz KQLZAJHKDCQOMW-QXEWZRGKSA-N 1 1 241.306 2.341 20 10 BECDMO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000300045221 592501609 /nfs/dbraw/zinc/50/16/09/592501609.db2.gz ICYNKNKZVVSSAX-LLVKDONJSA-N 1 1 241.718 2.266 20 10 BECDMO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000934114635 631692703 /nfs/dbraw/zinc/69/27/03/631692703.db2.gz UZCHRRDPHWLWFD-CABCVRRESA-N 1 1 248.370 2.362 20 10 BECDMO CC[C@@H](CO)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000309895465 633912792 /nfs/dbraw/zinc/91/27/92/633912792.db2.gz FRRFBPCRXANFIT-ZETCQYMHSA-N 1 1 247.697 2.045 20 10 BECDMO Oc1ccccc1C[N@H+]1CCO[C@H](C2CCC2)C1 ZINC000840955247 635386315 /nfs/dbraw/zinc/38/63/15/635386315.db2.gz SPDYJKYLLNUAHD-HNNXBMFYSA-N 1 1 247.338 2.393 20 10 BECDMO CC(C)[N@H+](C)CCNCc1ccc(N(C)C)cc1 ZINC000054110677 635389145 /nfs/dbraw/zinc/38/91/45/635389145.db2.gz PUXBIEFKRREIPZ-UHFFFAOYSA-N 1 1 249.402 2.182 20 10 BECDMO CC(C)[N@@H+](C)CCNCc1ccc(N(C)C)cc1 ZINC000054110677 635389155 /nfs/dbraw/zinc/38/91/55/635389155.db2.gz PUXBIEFKRREIPZ-UHFFFAOYSA-N 1 1 249.402 2.182 20 10 BECDMO Cc1ccc(C[NH2+][C@H](C)C(F)F)c(O)c1 ZINC000895725959 636175257 /nfs/dbraw/zinc/17/52/57/636175257.db2.gz VXRPTDYZKGIOJJ-MRVPVSSYSA-N 1 1 215.243 2.444 20 10 BECDMO COCC[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000164208624 640454336 /nfs/dbraw/zinc/45/43/36/640454336.db2.gz GYSQFKIDRCLGQN-UHFFFAOYSA-N 1 1 223.316 2.087 20 10 BECDMO Cc1cc(C)c(O)c(C[N@H+](C)[C@@H]2CCOC2)c1 ZINC000164306763 640472094 /nfs/dbraw/zinc/47/20/94/640472094.db2.gz WVBRMMIFTRMTAN-CYBMUJFWSA-N 1 1 235.327 2.230 20 10 BECDMO CC[N@@H+](C)Cc1cc(C)cc(OC)c1O ZINC000164371576 640475299 /nfs/dbraw/zinc/47/52/99/640475299.db2.gz NAGRWUBOMXSTNV-UHFFFAOYSA-N 1 1 209.289 2.161 20 10 BECDMO Cc1cc(C)c(O)c(C[N@@H+](C)C[C@H]2CCOC2)c1 ZINC000164459733 640484120 /nfs/dbraw/zinc/48/41/20/640484120.db2.gz BKCHHGZEOFDOMO-CYBMUJFWSA-N 1 1 249.354 2.477 20 10 BECDMO COC[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062744761 641087900 /nfs/dbraw/zinc/08/79/00/641087900.db2.gz SVXXSQMIDZHEQF-RKDXNWHRSA-N 1 1 227.279 2.217 20 10 BECDMO COC[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062744759 641087924 /nfs/dbraw/zinc/08/79/24/641087924.db2.gz SVXXSQMIDZHEQF-BDAKNGLRSA-N 1 1 227.279 2.217 20 10 BECDMO COC[C@@H]1CCCC[N@H+]1Cc1ccccc1O ZINC000307781902 641202191 /nfs/dbraw/zinc/20/21/91/641202191.db2.gz QAXJMGXSXWZKDK-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO COCCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000190672890 641880515 /nfs/dbraw/zinc/88/05/15/641880515.db2.gz JNUCQXMZCZITBZ-UHFFFAOYSA-N 1 1 247.697 2.311 20 10 BECDMO C[C@@H](O)CC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000191068726 641900453 /nfs/dbraw/zinc/90/04/53/641900453.db2.gz CMPJTXSVEUTLBQ-SSDOTTSWSA-N 1 1 247.697 2.045 20 10 BECDMO CC[C@@H]1COCC[N@@H+]1Cc1cc(F)ccc1O ZINC000179943115 642760253 /nfs/dbraw/zinc/76/02/53/642760253.db2.gz XHNYSYRYKVMZRD-GFCCVEGCSA-N 1 1 239.290 2.142 20 10 BECDMO CC[C@@H]1COCC[N@H+]1Cc1cc(F)ccc1O ZINC000179943115 642760257 /nfs/dbraw/zinc/76/02/57/642760257.db2.gz XHNYSYRYKVMZRD-GFCCVEGCSA-N 1 1 239.290 2.142 20 10 BECDMO Cc1noc([C@@H](C)[NH2+]Cc2cc(C)ccc2O)n1 ZINC000733328211 643329261 /nfs/dbraw/zinc/32/92/61/643329261.db2.gz LFCVLRYSYSWDFV-SECBINFHSA-N 1 1 247.298 2.243 20 10 BECDMO Oc1cccc(Cl)c1C[NH2+]Cc1cc[nH]n1 ZINC000083599838 643593814 /nfs/dbraw/zinc/59/38/14/643593814.db2.gz WJWHJYPZRIOBIQ-UHFFFAOYSA-N 1 1 237.690 2.059 20 10 BECDMO COCC[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000792162862 644791351 /nfs/dbraw/zinc/79/13/51/644791351.db2.gz QOVONTDJGKTMHK-UHFFFAOYSA-N 1 1 247.697 2.263 20 10 BECDMO COCC[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000792162862 644791358 /nfs/dbraw/zinc/79/13/58/644791358.db2.gz QOVONTDJGKTMHK-UHFFFAOYSA-N 1 1 247.697 2.263 20 10 BECDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815058109 644949084 /nfs/dbraw/zinc/94/90/84/644949084.db2.gz NZDRMBUJAMPTMP-CQSZACIVSA-N 1 1 248.370 2.282 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCCNC2)c1 ZINC000817984664 644994990 /nfs/dbraw/zinc/99/49/90/644994990.db2.gz XDMQPFYHTKTWQT-QWHCGFSZSA-N 1 1 248.370 2.493 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCCNC2)c1 ZINC000817984663 644995354 /nfs/dbraw/zinc/99/53/54/644995354.db2.gz XDMQPFYHTKTWQT-OLZOCXBDSA-N 1 1 248.370 2.493 20 10 BECDMO CN(C)c1ccc(CN[C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC000818431928 644996293 /nfs/dbraw/zinc/99/62/93/644996293.db2.gz WPWANZYSOASVKK-HUUCEWRRSA-N 1 1 247.386 2.112 20 10 BECDMO Cc1ccc(O)c(C[N@H+](C[C@@H](C)O)C2CC2)c1 ZINC000848928577 645445176 /nfs/dbraw/zinc/44/51/76/645445176.db2.gz HVJNZWFMZQXALN-LLVKDONJSA-N 1 1 235.327 2.046 20 10 BECDMO COCC[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708487401 712211265 /nfs/dbraw/zinc/21/12/65/712211265.db2.gz WCOFRQKESYNXNX-MRVPVSSYSA-N 1 1 245.269 2.185 20 10 BECDMO COC[C@@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000390436062 711116845 /nfs/dbraw/zinc/11/68/45/711116845.db2.gz SFDHNHZSAUHFPM-SSDOTTSWSA-N 1 1 247.697 2.309 20 10 BECDMO Cc1ncc(C[NH2+]Cc2ccc3c(c2)CCO3)o1 ZINC000397908229 711397178 /nfs/dbraw/zinc/39/71/78/711397178.db2.gz BKYPQBXYYOGUNQ-UHFFFAOYSA-N 1 1 244.294 2.208 20 10 BECDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cocn2)c1 ZINC000397950835 711707883 /nfs/dbraw/zinc/70/78/83/711707883.db2.gz ZMPQGAZGFFHTBV-SECBINFHSA-N 1 1 248.282 2.240 20 10 BECDMO COCC[N@@H+](CCF)Cc1cccc(C)c1O ZINC000700401779 711992157 /nfs/dbraw/zinc/99/21/57/711992157.db2.gz AQUJAUJOMRAWDA-UHFFFAOYSA-N 1 1 241.306 2.119 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]Cc2ncccn2)c(O)c1 ZINC000702325657 712047244 /nfs/dbraw/zinc/04/72/44/712047244.db2.gz JGQYGXLACMDYSG-LLVKDONJSA-N 1 1 243.310 2.341 20 10 BECDMO COC(=O)CCCC[N@H+](C)c1ccc(N)cc1 ZINC000707519100 712171428 /nfs/dbraw/zinc/17/14/28/712171428.db2.gz AMKOZLXNQHEDBK-UHFFFAOYSA-N 1 1 236.315 2.048 20 10 BECDMO COC(=O)CCCC[N@@H+](C)c1ccc(N)cc1 ZINC000707519100 712171430 /nfs/dbraw/zinc/17/14/30/712171430.db2.gz AMKOZLXNQHEDBK-UHFFFAOYSA-N 1 1 236.315 2.048 20 10 BECDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@@H]1CCOC1 ZINC000380145666 712699686 /nfs/dbraw/zinc/69/96/86/712699686.db2.gz HIWDABSOVGNBSB-GFCCVEGCSA-N 1 1 239.290 2.142 20 10 BECDMO C[C@H]1CCCC[N@H+]1Cc1cc(O)ccc1O ZINC001141155591 960890948 /nfs/dbraw/zinc/89/09/48/960890948.db2.gz AEVBCASDNQCXNV-JTQLQIEISA-N 1 1 221.300 2.472 20 10 BECDMO CC1CC([N@@H+](C)Cc2ccc(O)c(O)c2)C1 ZINC001203875829 966804636 /nfs/dbraw/zinc/80/46/36/966804636.db2.gz WRGIYWBLPWIUCZ-UHFFFAOYSA-N 1 1 221.300 2.328 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@@H](F)C2)c1O ZINC000689849211 1166365791 /nfs/dbraw/zinc/36/57/91/1166365791.db2.gz ODVBGAMLQWLFKH-LLVKDONJSA-N 1 1 209.264 2.244 20 10 BECDMO CC(C)[C@@](C)(CO)[NH2+]Cc1cccc(F)c1O ZINC000398555098 1167082073 /nfs/dbraw/zinc/08/20/73/1167082073.db2.gz GUHFURQYFNBVAN-CYBMUJFWSA-N 1 1 241.306 2.028 20 10 BECDMO C[N@H+](Cc1ccc(N)cc1)C[C@H]1CCCC[C@H]1O ZINC000385577959 1167395527 /nfs/dbraw/zinc/39/55/27/1167395527.db2.gz FDAFYLHNPBLLBK-UKRRQHHQSA-N 1 1 248.370 2.252 20 10 BECDMO CC[N@@H+](Cc1cccc(Cl)c1[O-])C1COC1 ZINC001231912516 977796213 /nfs/dbraw/zinc/79/62/13/977796213.db2.gz KEKVBGCIYJDPNP-UHFFFAOYSA-N 1 1 241.718 2.266 20 10 BECDMO CCN(Cc1cccc(Cl)c1[O-])C1COC1 ZINC001231912516 977796223 /nfs/dbraw/zinc/79/62/23/977796223.db2.gz KEKVBGCIYJDPNP-UHFFFAOYSA-N 1 1 241.718 2.266 20 10 BECDMO COc1cc(O)c(C[N@H+](C)CCF)cc1Cl ZINC001232270557 977970992 /nfs/dbraw/zinc/97/09/92/977970992.db2.gz FGTARFTUHQKCGF-UHFFFAOYSA-N 1 1 247.697 2.456 20 10 BECDMO COc1cc(O)c(C[N@@H+](C)CCF)cc1Cl ZINC001232270557 977971001 /nfs/dbraw/zinc/97/10/01/977971001.db2.gz FGTARFTUHQKCGF-UHFFFAOYSA-N 1 1 247.697 2.456 20 10 BECDMO COCC[N@@H+](C)Cc1ccc2c(c1)CCCN2C ZINC001138354523 1169353630 /nfs/dbraw/zinc/35/36/30/1169353630.db2.gz MLBAWYDXXGVWFQ-UHFFFAOYSA-N 1 1 248.370 2.147 20 10 BECDMO Cc1ccc(C)c(C[N@@H+]2CC[C@H](O)C[C@@H]2C)c1O ZINC001140182536 957722496 /nfs/dbraw/zinc/72/24/96/957722496.db2.gz UQOJDHDFWOBJSN-STQMWFEESA-N 1 1 249.354 2.354 20 10 BECDMO Cc1ccc(C)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1O ZINC001140181949 957723293 /nfs/dbraw/zinc/72/32/93/957723293.db2.gz XYQJNPRNLRYZOF-TXEJJXNPSA-N 1 1 217.312 2.461 20 10 BECDMO C[N@@H+](Cc1cccc(=O)[nH]1)Cc1ccccc1O ZINC001207073242 957918450 /nfs/dbraw/zinc/91/84/50/957918450.db2.gz HLBZBXMHAGVPSV-UHFFFAOYSA-N 1 1 244.294 2.125 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]2OCC[C@H]2C1 ZINC000724813890 959684411 /nfs/dbraw/zinc/68/44/11/959684411.db2.gz HWKSNURYTFCKSR-JSGCOSHPSA-N 1 1 233.311 2.003 20 10 BECDMO Cc1c(O)ccc(C[N@@H+]2CC[C@@H](C)C2)c1O ZINC001140744369 959792998 /nfs/dbraw/zinc/79/29/98/959792998.db2.gz VJRKCWCLGPVMTJ-SECBINFHSA-N 1 1 221.300 2.248 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c1 ZINC000690788535 959810301 /nfs/dbraw/zinc/81/03/01/959810301.db2.gz FYXDOFHQKWXOGN-JSGCOSHPSA-N 1 1 247.338 2.169 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@@H](O)[C@@H](C)CC2)c(O)c1 ZINC001140948096 960122578 /nfs/dbraw/zinc/12/25/78/960122578.db2.gz SPSAMHXSCNGCAZ-GXTWGEPZSA-N 1 1 249.354 2.293 20 10 BECDMO CCOc1cccc(C[N@H+]2CC[C@H](F)C2)c1O ZINC000689865743 960295191 /nfs/dbraw/zinc/29/51/91/960295191.db2.gz ZGHSITGFWIJHOI-NSHDSACASA-N 1 1 239.290 2.335 20 10 BECDMO Oc1ccc(O)c(C[N@@H+]2CCc3occc3C2)c1 ZINC001141161169 960414561 /nfs/dbraw/zinc/41/45/61/960414561.db2.gz NQSLGAMLNGEHIH-UHFFFAOYSA-N 1 1 245.278 2.249 20 10 BECDMO Oc1ccc(O)c(C[N@H+]2CCc3occc3C2)c1 ZINC001141161169 960414566 /nfs/dbraw/zinc/41/45/66/960414566.db2.gz NQSLGAMLNGEHIH-UHFFFAOYSA-N 1 1 245.278 2.249 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCCC3(COC3)C2)c1 ZINC001140619449 960462804 /nfs/dbraw/zinc/46/28/04/960462804.db2.gz DBIQGNBMUAFXIM-UHFFFAOYSA-N 1 1 247.338 2.313 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@@H](O)C2)c1 ZINC001140619786 960466613 /nfs/dbraw/zinc/46/66/13/960466613.db2.gz ORXWHOWPXIONHM-CYBMUJFWSA-N 1 1 235.327 2.047 20 10 BECDMO CC(=O)[C@@H]1CCC[N@H+]1Cc1cc(C)ccc1O ZINC001140624255 960467968 /nfs/dbraw/zinc/46/79/68/960467968.db2.gz NHMOGYSHQQMMES-ZDUSSCGKSA-N 1 1 233.311 2.254 20 10 BECDMO Oc1cccc2c1C[N@@H+](Cc1cc[nH]c1)CC2 ZINC001140709327 960530900 /nfs/dbraw/zinc/53/09/00/960530900.db2.gz YQVTXHUUASPKNR-UHFFFAOYSA-N 1 1 228.295 2.279 20 10 BECDMO Cc1c(O)ccc(C[N@@H+](C)CC2CC2)c1O ZINC001140742565 960544923 /nfs/dbraw/zinc/54/49/23/960544923.db2.gz SBLZUPKAYBXNQX-UHFFFAOYSA-N 1 1 221.300 2.248 20 10 BECDMO 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20 10 BECDMO CCc1ccc(C[N@H+]2CC[C@@H](O)C[C@H]2C)c(O)c1 ZINC001236789629 979733211 /nfs/dbraw/zinc/73/32/11/979733211.db2.gz BWKCOWXIYKRHBA-BXUZGUMPSA-N 1 1 249.354 2.300 20 10 BECDMO CCc1ccc(C[N@H+]2CCCC[C@H](O)C2)c(O)c1 ZINC001236783282 979733980 /nfs/dbraw/zinc/73/39/80/979733980.db2.gz JOGGUPCWTLKBFZ-AWEZNQCLSA-N 1 1 249.354 2.301 20 10 BECDMO CCc1ccc(C[N@@H+](C)[C@H]2CCN(C)C2)c(O)c1 ZINC001236795665 979741966 /nfs/dbraw/zinc/74/19/66/979741966.db2.gz YKSGVQWYCGRWET-AWEZNQCLSA-N 1 1 248.370 2.091 20 10 BECDMO CCc1ccc(CN(C)[C@H]2CC[N@H+](C)C2)c(O)c1 ZINC001236795665 979741972 /nfs/dbraw/zinc/74/19/72/979741972.db2.gz YKSGVQWYCGRWET-AWEZNQCLSA-N 1 1 248.370 2.091 20 10 BECDMO CCc1ccc(CN(C)[C@H]2CC[N@@H+](C)C2)c(O)c1 ZINC001236795665 979741986 /nfs/dbraw/zinc/74/19/86/979741986.db2.gz YKSGVQWYCGRWET-AWEZNQCLSA-N 1 1 248.370 2.091 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@H](O)CC[C@H]1C ZINC001237484855 979908597 /nfs/dbraw/zinc/90/85/97/979908597.db2.gz IUWCMWXQMHUKAZ-VXGBXAGGSA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H](C)[C@H]1CO ZINC001237486211 979911264 /nfs/dbraw/zinc/91/12/64/979911264.db2.gz XYZCKJQSGISREA-TZMCWYRMSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@]2(CCO2)C1 ZINC001237486681 979915266 /nfs/dbraw/zinc/91/52/66/979915266.db2.gz BHMWKYOKNUYQLA-OAHLLOKOSA-N 1 1 247.338 2.456 20 10 BECDMO CC[C@H]1COCC[N@H+]1Cc1c(C)cccc1O ZINC001237487877 979916507 /nfs/dbraw/zinc/91/65/07/979916507.db2.gz NZDSFCPPPFDXQW-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@]12CCOC2 ZINC001237495328 979917175 /nfs/dbraw/zinc/91/71/75/979917175.db2.gz PPOKQPVVEBAIJU-CQSZACIVSA-N 1 1 233.311 2.065 20 10 BECDMO CCN1CC[N@@H+](Cc2c(C)cccc2O)[C@H](C)C1 ZINC001237492956 979917214 /nfs/dbraw/zinc/91/72/14/979917214.db2.gz YNIDGDXISLDKKC-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@@H+]1CCN(Cc2c(C)cccc2O)[C@H](C)C1 ZINC001237492956 979917221 /nfs/dbraw/zinc/91/72/21/979917221.db2.gz YNIDGDXISLDKKC-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO CC[N@H+]1CCN(Cc2c(C)cccc2O)[C@H](C)C1 ZINC001237492956 979917231 /nfs/dbraw/zinc/91/72/31/979917231.db2.gz YNIDGDXISLDKKC-CYBMUJFWSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cc(F)cc(C[N@@H+]2CC[C@H]2C)c1O ZINC001238064884 980132593 /nfs/dbraw/zinc/13/25/93/980132593.db2.gz RFRTZWNJIIKGRL-SECBINFHSA-N 1 1 209.264 2.434 20 10 BECDMO Cc1cc(F)cc(C[N@@H+]2CC[C@@H](F)C2)c1O ZINC001238062767 980134509 /nfs/dbraw/zinc/13/45/09/980134509.db2.gz RFBHOQGBCVHESU-SNVBAGLBSA-N 1 1 227.254 2.384 20 10 BECDMO Cc1cc(F)cc(C[N@H+]2CC[C@@H](F)C2)c1O ZINC001238062767 980134514 /nfs/dbraw/zinc/13/45/14/980134514.db2.gz RFBHOQGBCVHESU-SNVBAGLBSA-N 1 1 227.254 2.384 20 10 BECDMO CC[N@H+](Cc1cc(F)cc(C)c1O)C1COC1 ZINC001238069921 980139533 /nfs/dbraw/zinc/13/95/33/980139533.db2.gz LJZUZJQVYGFXBC-UHFFFAOYSA-N 1 1 239.290 2.060 20 10 BECDMO CC[N@@H+](Cc1cc(F)cc(C)c1O)C1COC1 ZINC001238069921 980139540 /nfs/dbraw/zinc/13/95/40/980139540.db2.gz LJZUZJQVYGFXBC-UHFFFAOYSA-N 1 1 239.290 2.060 20 10 BECDMO Nc1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)cc1 ZINC001345159316 980569727 /nfs/dbraw/zinc/56/97/27/980569727.db2.gz GBVXXWUQXJAVNY-HIFRSBDPSA-N 1 1 246.354 2.270 20 10 BECDMO C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(N)cc2)CC[N@@H+]1C ZINC001345160836 980570920 /nfs/dbraw/zinc/57/09/20/980570920.db2.gz ZYEXCKMJQVDIBC-DOMZBBRYSA-N 1 1 247.386 2.183 20 10 BECDMO C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(N)cc2)CC[N@H+]1C ZINC001345160836 980570927 /nfs/dbraw/zinc/57/09/27/980570927.db2.gz ZYEXCKMJQVDIBC-DOMZBBRYSA-N 1 1 247.386 2.183 20 10 BECDMO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(O)c(O)c1 ZINC001203875599 982558049 /nfs/dbraw/zinc/55/80/49/982558049.db2.gz RNWXFTAVHGRYII-SCZZXKLOSA-N 1 1 225.263 2.030 20 10 BECDMO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(O)c(O)c1 ZINC001203875599 982558057 /nfs/dbraw/zinc/55/80/57/982558057.db2.gz RNWXFTAVHGRYII-SCZZXKLOSA-N 1 1 225.263 2.030 20 10 BECDMO Cn1ccc2c1cc[nH+]c2-c1ccnnc1 ZINC001242044349 983250685 /nfs/dbraw/zinc/25/06/85/983250685.db2.gz RAFMEVREGHIRCL-UHFFFAOYSA-N 1 1 210.240 2.030 20 10 BECDMO CCc1cccc(C[N@H+]2CCOC[C@H](C)C2)c1O ZINC000692112847 985407316 /nfs/dbraw/zinc/40/73/16/985407316.db2.gz BPXBSZSTIBNBCL-GFCCVEGCSA-N 1 1 249.354 2.423 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@H](OC)C2)c1O ZINC000692108013 985408107 /nfs/dbraw/zinc/40/81/07/985408107.db2.gz GNMYUEGBTDANCW-ZDUSSCGKSA-N 1 1 235.327 2.175 20 10 BECDMO CCc1cccc(C[N@H+]2CCOC[C@H]2C)c1O ZINC000692110396 985408871 /nfs/dbraw/zinc/40/88/71/985408871.db2.gz UNHINXUNXRYXSE-LLVKDONJSA-N 1 1 235.327 2.175 20 10 BECDMO CO[C@H](C)CC[NH2+]Cc1cc(F)c(F)cc1O ZINC001462250474 986326613 /nfs/dbraw/zinc/32/66/13/986326613.db2.gz ODYIBSARVNNRKI-MRVPVSSYSA-N 1 1 245.269 2.185 20 10 BECDMO CC(C)[C@H]1C[C@@H](NCc2ccc(N)cc2)CC[NH2+]1 ZINC001246174585 987544071 /nfs/dbraw/zinc/54/40/71/987544071.db2.gz WDNNADSUNCWRDQ-LSDHHAIUSA-N 1 1 247.386 2.135 20 10 BECDMO CC(C)c1ccc(O)c(C[NH+]2CC(C)(O)C2)c1 ZINC001474568960 987762262 /nfs/dbraw/zinc/76/22/62/987762262.db2.gz QQAKBPZXIJHGCS-UHFFFAOYSA-N 1 1 235.327 2.082 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2ccc(N)cc2)C2(CCC2)CO1 ZINC001120269637 989625205 /nfs/dbraw/zinc/62/52/05/989625205.db2.gz WVLFOWDSWTXSJY-GFCCVEGCSA-N 1 1 246.354 2.412 20 10 BECDMO CC1(C)C[NH+](Cc2c(O)cccc2F)C1 ZINC001137832049 990855997 /nfs/dbraw/zinc/85/59/97/990855997.db2.gz YNOPBAOICRSOAB-UHFFFAOYSA-N 1 1 209.264 2.373 20 10 BECDMO CC(C)[N@H+](CCCO)Cc1c(O)cccc1F ZINC001137837370 990857969 /nfs/dbraw/zinc/85/79/69/990857969.db2.gz DIVNHXJMXHCAQB-UHFFFAOYSA-N 1 1 241.306 2.124 20 10 BECDMO CC(C)[N@@H+](CCCO)Cc1c(O)cccc1F ZINC001137837370 990857971 /nfs/dbraw/zinc/85/79/71/990857971.db2.gz DIVNHXJMXHCAQB-UHFFFAOYSA-N 1 1 241.306 2.124 20 10 BECDMO C[C@@H]1C[N@H+](Cc2cccc(F)c2O)C[C@@H]1F ZINC001138122387 990884930 /nfs/dbraw/zinc/88/49/30/990884930.db2.gz ATZAAWTURSUBJP-KCJUWKMLSA-N 1 1 227.254 2.321 20 10 BECDMO C[C@@H]1C[N@@H+](Cc2cccc(F)c2O)C[C@@H]1F ZINC001138122387 990884933 /nfs/dbraw/zinc/88/49/33/990884933.db2.gz ATZAAWTURSUBJP-KCJUWKMLSA-N 1 1 227.254 2.321 20 10 BECDMO COC1C[NH+](Cc2c(C)n(C)c3ccccc32)C1 ZINC001138252729 990903761 /nfs/dbraw/zinc/90/37/61/990903761.db2.gz SBJYHUCYZJZTJQ-UHFFFAOYSA-N 1 1 244.338 2.317 20 10 BECDMO C[C@@H](O)CCC[NH2+]Cc1ccc(Cl)cc1O ZINC001308722241 991106903 /nfs/dbraw/zinc/10/69/03/991106903.db2.gz GUANDJONCDCQNT-SECBINFHSA-N 1 1 243.734 2.296 20 10 BECDMO CC(C)c1ccc(O)c(C[N@@H+](C)[C@H](C)CO)c1 ZINC001308744678 991116703 /nfs/dbraw/zinc/11/67/03/991116703.db2.gz HWRZVBTURQOGAM-LLVKDONJSA-N 1 1 237.343 2.328 20 10 BECDMO Cc1cc(C[N@@H+](C)CCF)ccc1N(C)C ZINC001139673939 991309735 /nfs/dbraw/zinc/30/97/35/991309735.db2.gz JKSRLMAFUXAIGJ-UHFFFAOYSA-N 1 1 224.323 2.462 20 10 BECDMO Oc1ccc(F)cc1C[N@H+]1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001140058818 991511916 /nfs/dbraw/zinc/51/19/16/991511916.db2.gz MSCBVRHDHCFBBX-CNDDSTCGSA-N 1 1 239.265 2.179 20 10 BECDMO COC[C@@H]1CC[N@@H+](Cc2c(C)ccc(C)c2O)C1 ZINC001140178685 991552541 /nfs/dbraw/zinc/55/25/41/991552541.db2.gz UQXGWTFLPANICG-CYBMUJFWSA-N 1 1 249.354 2.477 20 10 BECDMO CC(=O)[C@@H]1CC[N@@H+](Cc2c(C)ccc(C)c2O)C1 ZINC001140184397 991555717 /nfs/dbraw/zinc/55/57/17/991555717.db2.gz RUFAOJHSZMQBST-CYBMUJFWSA-N 1 1 247.338 2.420 20 10 BECDMO CCc1cccc(C[N@H+]2CC[C@@H](C)[C@H](O)C2)c1O ZINC001560811560 991611007 /nfs/dbraw/zinc/61/10/07/991611007.db2.gz PENYBKZLBABDDT-BXUZGUMPSA-N 1 1 249.354 2.157 20 10 BECDMO CCCC[N@@H+](CCCO)Cc1ccc(N)cc1 ZINC001577454512 993663923 /nfs/dbraw/zinc/66/39/23/993663923.db2.gz GUTLEWBJOHWFPT-UHFFFAOYSA-N 1 1 236.359 2.253 20 10 BECDMO CCCOc1ccc(CN[C@H]2C[C@@H]([NH3+])C2)cc1C ZINC001577585732 993690304 /nfs/dbraw/zinc/69/03/04/993690304.db2.gz AJQUFDBZCAWARW-OKILXGFUSA-N 1 1 248.370 2.363 20 10 BECDMO CCO[C@@H]1CC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000701662463 993900802 /nfs/dbraw/zinc/90/08/02/993900802.db2.gz PVIXDAAGQJUOTE-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO C[C@H]([NH2+]Cc1ccnn1C)c1ccc(F)cc1O ZINC000071333652 398146918 /nfs/dbraw/zinc/14/69/18/398146918.db2.gz JWNZXKUHKNLSKY-VIFPVBQESA-N 1 1 249.289 2.116 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](O)C[C@@H]2C)cc1C ZINC000292707557 178196429 /nfs/dbraw/zinc/19/64/29/178196429.db2.gz CZUYVNINFARJDW-JSGCOSHPSA-N 1 1 249.354 2.354 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCN(C)CC2(C)C)c1 ZINC000093457411 345671493 /nfs/dbraw/zinc/67/14/93/345671493.db2.gz CZNARXZVJHPLJV-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(O)c(CN2CC[N@@H+](C)CC2(C)C)c1 ZINC000093457411 345671495 /nfs/dbraw/zinc/67/14/95/345671495.db2.gz CZNARXZVJHPLJV-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(O)c(CN2CC[N@H+](C)CC2(C)C)c1 ZINC000093457411 345671498 /nfs/dbraw/zinc/67/14/98/345671498.db2.gz CZNARXZVJHPLJV-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(C[N@@H+](C)Cc2nccn2C)c1O ZINC000160234489 179068758 /nfs/dbraw/zinc/06/87/58/179068758.db2.gz OKBRTSDUIQTDIS-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO Cc1cccc(C[N@H+](C)Cc2nccn2C)c1O ZINC000160234489 179068761 /nfs/dbraw/zinc/06/87/61/179068761.db2.gz OKBRTSDUIQTDIS-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO Cc1cccc(C[N@@H+](C)C[C@H]2CCOC2)c1O ZINC000180624140 179067378 /nfs/dbraw/zinc/06/73/78/179067378.db2.gz FOGCVITZBZCKLK-GFCCVEGCSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1cccc(C[N@@H+]2CCOC[C@H](C)C2)c1O ZINC000378445179 179079825 /nfs/dbraw/zinc/07/98/25/179079825.db2.gz SLMLMAFQXUOJJI-LLVKDONJSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1cccc(C[N@H+]2CCOCC2(C)C)c1O ZINC000124565121 179080122 /nfs/dbraw/zinc/08/01/22/179080122.db2.gz JNKSJJDDRMFSDQ-UHFFFAOYSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(C[N@H+]2CCOC[C@H]2C2CC2)c1O ZINC000180425850 179080433 /nfs/dbraw/zinc/08/04/33/179080433.db2.gz LXLFOGUOZCEUBU-AWEZNQCLSA-N 1 1 247.338 2.311 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@H](N(C)C)C2)c1O ZINC000124586036 179076868 /nfs/dbraw/zinc/07/68/68/179076868.db2.gz ZBDFLTSMOLXHLH-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(CN2CCC[C@H]([NH+](C)C)C2)c1O ZINC000124586036 179076870 /nfs/dbraw/zinc/07/68/70/179076870.db2.gz ZBDFLTSMOLXHLH-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1nn(C)cc1C[N@@H+](C)Cc1ccccc1O ZINC000091956485 180373787 /nfs/dbraw/zinc/37/37/87/180373787.db2.gz KBFXLODCDBNLHT-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO CO[C@@H](C)C[N@@H+](C)Cc1cccc(C)c1O ZINC000289186395 188210800 /nfs/dbraw/zinc/21/08/00/188210800.db2.gz APKLOHBNDDUGAZ-NSHDSACASA-N 1 1 223.316 2.167 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H](N2CCCC2)C1 ZINC000133945400 358773230 /nfs/dbraw/zinc/77/32/30/358773230.db2.gz PKSWHBPJLFGILT-CQSZACIVSA-N 1 1 246.354 2.062 20 10 BECDMO Oc1ccccc1CN1CC[C@@H]([NH+]2CCCC2)C1 ZINC000133945400 358773232 /nfs/dbraw/zinc/77/32/32/358773232.db2.gz PKSWHBPJLFGILT-CQSZACIVSA-N 1 1 246.354 2.062 20 10 BECDMO OCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000267174728 183071234 /nfs/dbraw/zinc/07/12/34/183071234.db2.gz WIORHCUPTSFEBW-UHFFFAOYSA-N 1 1 235.327 2.129 20 10 BECDMO C[C@H]([NH2+]CCCN(C)C)c1ccc(N(C)C)cc1 ZINC000037213642 383959648 /nfs/dbraw/zinc/95/96/48/383959648.db2.gz BVOBXBVXYYJROK-ZDUSSCGKSA-N 1 1 249.402 2.355 20 10 BECDMO C[C@H]([NH2+]Cc1nccn1C)c1ccc(F)cc1O ZINC000071273442 384158291 /nfs/dbraw/zinc/15/82/91/384158291.db2.gz MNEXBCCMVIVKIR-VIFPVBQESA-N 1 1 249.289 2.116 20 10 BECDMO Cn1ccc(C[N@@H+](C)Cc2ccccc2O)c1 ZINC000091956723 384157416 /nfs/dbraw/zinc/15/74/16/384157416.db2.gz BMOWQWJDSYQNND-UHFFFAOYSA-N 1 1 230.311 2.363 20 10 BECDMO Cc1ccc(O)c(C[N@@H+](C)Cc2cnccn2)c1 ZINC000092591586 384185875 /nfs/dbraw/zinc/18/58/75/384185875.db2.gz ISNUNGSUAKTPQA-UHFFFAOYSA-N 1 1 243.310 2.123 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)c1 ZINC000132181814 384219023 /nfs/dbraw/zinc/21/90/23/384219023.db2.gz NWFYHKVFZGLUBI-NWDGAFQWSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CCOC[C@@H]2C2CC2)c1 ZINC000093645755 384255077 /nfs/dbraw/zinc/25/50/77/384255077.db2.gz RPFOOMUXWWUGTG-CQSZACIVSA-N 1 1 247.338 2.311 20 10 BECDMO C[C@H]([NH2+]CC1(C)COC1)c1ccc(F)cc1O ZINC000094721854 384310643 /nfs/dbraw/zinc/31/06/43/384310643.db2.gz NVNWWNYXUGNGON-VIFPVBQESA-N 1 1 239.290 2.218 20 10 BECDMO COC[C@@]1(C)CC[N@@H+](Cc2ccccc2O)C1 ZINC000294288993 384729230 /nfs/dbraw/zinc/72/92/30/384729230.db2.gz UCIYZUCQARQTTO-AWEZNQCLSA-N 1 1 235.327 2.251 20 10 BECDMO CC[C@](C)(O)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000087011625 385063884 /nfs/dbraw/zinc/06/38/84/385063884.db2.gz AXTWEHYLPVKTKP-ZANVPECISA-N 1 1 241.306 2.343 20 10 BECDMO C[C@H]([NH2+]CCn1ccnc1)c1ccc(F)cc1O ZINC000062748113 385187443 /nfs/dbraw/zinc/18/74/43/385187443.db2.gz RYMYTNMPCHFAFG-JTQLQIEISA-N 1 1 249.289 2.079 20 10 BECDMO CCC[C@H](O)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168770586 385384635 /nfs/dbraw/zinc/38/46/35/385384635.db2.gz RFRCBNCEHWTBDU-KOLCDFICSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](N(C)C)C2)c1 ZINC000156068178 385434253 /nfs/dbraw/zinc/43/42/53/385434253.db2.gz UMISVKRRRCQERJ-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(O)c(CN2CCC[C@@H]([NH+](C)C)C2)c1 ZINC000156068178 385434260 /nfs/dbraw/zinc/43/42/60/385434260.db2.gz UMISVKRRRCQERJ-CQSZACIVSA-N 1 1 248.370 2.227 20 10 BECDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCSC1 ZINC000179560714 385474459 /nfs/dbraw/zinc/47/44/59/385474459.db2.gz JFLDEFJXNKDSIT-NSHDSACASA-N 1 1 223.341 2.330 20 10 BECDMO CC[C@H]([NH2+]Cc1cccc(F)c1O)C(C)(C)O ZINC000293608003 385681948 /nfs/dbraw/zinc/68/19/48/385681948.db2.gz JTNWQFUCDYKVEE-NSHDSACASA-N 1 1 241.306 2.170 20 10 BECDMO CO[C@]1(C)CCC[N@@H+](Cc2ccccc2O)C1 ZINC000230299918 385728886 /nfs/dbraw/zinc/72/88/86/385728886.db2.gz BHXRQSSZZCFJQD-CQSZACIVSA-N 1 1 235.327 2.393 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2C[C@H](C)O)c1 ZINC000271204815 385802284 /nfs/dbraw/zinc/80/22/84/385802284.db2.gz VOZIKSISFUZGII-JSGCOSHPSA-N 1 1 249.354 2.436 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@@H](O)C(C)(C)C ZINC000283867131 385837004 /nfs/dbraw/zinc/83/70/04/385837004.db2.gz IEACBWKYGJHBEJ-CYBMUJFWSA-N 1 1 237.343 2.231 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@H]1CCCC[C@@H]1O ZINC000272587408 385915808 /nfs/dbraw/zinc/91/58/08/385915808.db2.gz HIJKCXIFKZCQPB-HIFRSBDPSA-N 1 1 249.354 2.375 20 10 BECDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2CCC2)c1 ZINC000273522839 386009165 /nfs/dbraw/zinc/00/91/65/386009165.db2.gz UPHWUTWVUHYJNX-SECBINFHSA-N 1 1 249.310 2.382 20 10 BECDMO CC[C@@H]([NH2+]CCN(C)C)c1ccc(F)cc1O ZINC000287234473 386103979 /nfs/dbraw/zinc/10/39/79/386103979.db2.gz YJLOBKNDRZJLFU-GFCCVEGCSA-N 1 1 240.322 2.134 20 10 BECDMO CO[C@H](C)C[N@@H+](C)Cc1cccc(C)c1O ZINC000289186392 386268350 /nfs/dbraw/zinc/26/83/50/386268350.db2.gz APKLOHBNDDUGAZ-LLVKDONJSA-N 1 1 223.316 2.167 20 10 BECDMO C[C@@H](O)CCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000228032322 386533396 /nfs/dbraw/zinc/53/33/96/386533396.db2.gz YDSJVMHEOMGFGL-ZJUUUORDSA-N 1 1 241.306 2.343 20 10 BECDMO CC[C@H]1CC[N@H+]1Cc1cccc(OC)c1O ZINC000292872610 386739346 /nfs/dbraw/zinc/73/93/46/386739346.db2.gz WOCHNUWQSZCABZ-NSHDSACASA-N 1 1 221.300 2.385 20 10 BECDMO CO[C@H]1CCC[N@@H+](Cc2ccccc2O)CC1 ZINC000378637465 387790595 /nfs/dbraw/zinc/79/05/95/387790595.db2.gz NJXNYELMLVEYFG-ZDUSSCGKSA-N 1 1 235.327 2.393 20 10 BECDMO CC1(C)OCC[C@@H]1[NH2+]Cc1cccc(F)c1O ZINC000294822656 388404565 /nfs/dbraw/zinc/40/45/65/388404565.db2.gz PDCWNWASNBMOBA-NSHDSACASA-N 1 1 239.290 2.188 20 10 BECDMO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccccc1O ZINC000293688652 388390328 /nfs/dbraw/zinc/39/03/28/388390328.db2.gz NQBQNBAREJFAMS-NWDGAFQWSA-N 1 1 236.359 2.241 20 10 BECDMO CC(C)(CO)CC[NH2+]Cc1cccc(F)c1O ZINC000294766680 388403109 /nfs/dbraw/zinc/40/31/09/388403109.db2.gz JTPMSPVRMVFPEF-UHFFFAOYSA-N 1 1 241.306 2.030 20 10 BECDMO C[C@@H](CCCO)C[NH2+]Cc1cccc(F)c1O ZINC000294675022 388403867 /nfs/dbraw/zinc/40/38/67/388403867.db2.gz BBSMSLNPDKYJRL-JTQLQIEISA-N 1 1 241.306 2.030 20 10 BECDMO COc1ccc(O)c(C[N@@H+](C)CC2CC2)c1 ZINC000179793099 175157736 /nfs/dbraw/zinc/15/77/36/175157736.db2.gz PLRFQVTXTTVLSP-UHFFFAOYSA-N 1 1 221.300 2.243 20 10 BECDMO C[C@H]1CCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000097987284 177109928 /nfs/dbraw/zinc/10/99/28/177109928.db2.gz YSNKXOYQHQMGRL-VIFPVBQESA-N 1 1 235.283 2.105 20 10 BECDMO C[C@H]1CC[N@H+](Cc2cccc(F)c2O)C1 ZINC000165416039 177165750 /nfs/dbraw/zinc/16/57/50/177165750.db2.gz IHEOYTWUJMZCDT-VIFPVBQESA-N 1 1 209.264 2.373 20 10 BECDMO C[C@H]1CC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000165416039 177165752 /nfs/dbraw/zinc/16/57/52/177165752.db2.gz IHEOYTWUJMZCDT-VIFPVBQESA-N 1 1 209.264 2.373 20 10 BECDMO C[C@H]1C[C@@H](O)CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000292288197 177335918 /nfs/dbraw/zinc/33/59/18/177335918.db2.gz CFNLKUOHZMYTAJ-WFASDCNBSA-N 1 1 248.370 2.098 20 10 BECDMO Cc1ccc(CN(C)CC[N@@H+](C)C2CC2)c(O)c1 ZINC000877528813 583323751 /nfs/dbraw/zinc/32/37/51/583323751.db2.gz LHPAMKMLLGPQMN-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@@H+](C)CCN(C)C2CC2)c(O)c1 ZINC000877528813 583323755 /nfs/dbraw/zinc/32/37/55/583323755.db2.gz LHPAMKMLLGPQMN-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@H+](C)CCN(C)C2CC2)c(O)c1 ZINC000877528813 583323758 /nfs/dbraw/zinc/32/37/58/583323758.db2.gz LHPAMKMLLGPQMN-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H](C(C)(C)O)C1 ZINC000877836395 583350697 /nfs/dbraw/zinc/35/06/97/583350697.db2.gz WFDCBOZSWNLGDI-GFCCVEGCSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CCN(C)C(C)(C)C1 ZINC000895564773 583691294 /nfs/dbraw/zinc/69/12/94/583691294.db2.gz LYLHFEMHVMJRJZ-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)CCCF ZINC000895895832 583743840 /nfs/dbraw/zinc/74/38/40/583743840.db2.gz DYCOUFQBJNVUMK-UHFFFAOYSA-N 1 1 211.280 2.492 20 10 BECDMO CC1(C)CC[C@@H](CO)[N@@H+](Cc2ccccc2O)C1 ZINC000895925630 583747588 /nfs/dbraw/zinc/74/75/88/583747588.db2.gz HAJDPRHRWCAEPQ-ZDUSSCGKSA-N 1 1 249.354 2.375 20 10 BECDMO C[C@H]([NH2+]Cc1c(O)cccc1F)[C@H]1CCOC1 ZINC000896637319 583819020 /nfs/dbraw/zinc/81/90/20/583819020.db2.gz JDTRDOMNELOHAQ-UWVGGRQHSA-N 1 1 239.290 2.046 20 10 BECDMO Oc1cccc(F)c1C[NH2+]CC[C@H]1CCOC1 ZINC000896637937 583819634 /nfs/dbraw/zinc/81/96/34/583819634.db2.gz RTWCIOKAYIMYAP-JTQLQIEISA-N 1 1 239.290 2.048 20 10 BECDMO Oc1cccc(F)c1C[NH2+]C[C@H]1CCSC1 ZINC000896638642 583819984 /nfs/dbraw/zinc/81/99/84/583819984.db2.gz XBEMVFYWQWKUIP-SECBINFHSA-N 1 1 241.331 2.374 20 10 BECDMO CCn1nccc1C[NH2+]Cc1c(O)cccc1F ZINC000896640943 583820212 /nfs/dbraw/zinc/82/02/12/583820212.db2.gz NCHHDXIWFFVHAK-UHFFFAOYSA-N 1 1 249.289 2.038 20 10 BECDMO C[C@H]1CSC[C@H]1[NH2+]Cc1c(O)cccc1F ZINC000896640168 583820351 /nfs/dbraw/zinc/82/03/51/583820351.db2.gz ZOWDXZYTCAYDRV-GZMMTYOYSA-N 1 1 241.331 2.372 20 10 BECDMO Oc1cccc(F)c1C[NH2+][C@H]1CCSC1 ZINC000896640290 583820382 /nfs/dbraw/zinc/82/03/82/583820382.db2.gz IVBJKXWHGAGVBJ-QMMMGPOBSA-N 1 1 227.304 2.126 20 10 BECDMO C[C@@H]1CSC[C@@H]1[NH2+]Cc1c(O)cccc1F ZINC000896640171 583820400 /nfs/dbraw/zinc/82/04/00/583820400.db2.gz ZOWDXZYTCAYDRV-KCJUWKMLSA-N 1 1 241.331 2.372 20 10 BECDMO Oc1cccc(F)c1C[NH2+][C@@H]1CCSC1 ZINC000896640289 583820412 /nfs/dbraw/zinc/82/04/12/583820412.db2.gz IVBJKXWHGAGVBJ-MRVPVSSYSA-N 1 1 227.304 2.126 20 10 BECDMO C[C@@H]1OCC[C@@H]1C[N@H+](C)c1ccc(N)cc1 ZINC000866667920 584121561 /nfs/dbraw/zinc/12/15/61/584121561.db2.gz BPSWTJWFBVRCKX-WDEREUQCSA-N 1 1 220.316 2.130 20 10 BECDMO C[C@@H]1OCC[C@@H]1C[N@@H+](C)c1ccc(N)cc1 ZINC000866667920 584121562 /nfs/dbraw/zinc/12/15/62/584121562.db2.gz BPSWTJWFBVRCKX-WDEREUQCSA-N 1 1 220.316 2.130 20 10 BECDMO C[C@H]([NH2+][C@H]1COC[C@@H]1C)c1c(O)cccc1F ZINC000903393065 584756206 /nfs/dbraw/zinc/75/62/06/584756206.db2.gz FLAJGTCENUTOLJ-QXEWZRGKSA-N 1 1 239.290 2.217 20 10 BECDMO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(F)c1O ZINC000839131268 585093657 /nfs/dbraw/zinc/09/36/57/585093657.db2.gz HZOMHEOJEGODAW-PHIMTYICSA-N 1 1 249.285 2.227 20 10 BECDMO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(F)c1O ZINC000839131268 585093658 /nfs/dbraw/zinc/09/36/58/585093658.db2.gz HZOMHEOJEGODAW-PHIMTYICSA-N 1 1 249.285 2.227 20 10 BECDMO C[C@H]1COC(C)(C)C[N@H+]1Cc1ccccc1O ZINC000754155927 585279358 /nfs/dbraw/zinc/27/93/58/585279358.db2.gz LVMHQATVKWWOKK-NSHDSACASA-N 1 1 235.327 2.392 20 10 BECDMO Cc1cc(C)c(O)c(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000754736145 585290212 /nfs/dbraw/zinc/29/02/12/585290212.db2.gz HOHLAHCHHXYJRO-OKILXGFUSA-N 1 1 247.338 2.372 20 10 BECDMO Cc1cccc(C[N@H+](C)CC2(O)CCC2)c1O ZINC000761219301 585412415 /nfs/dbraw/zinc/41/24/15/585412415.db2.gz MVCZXTYDJJNQMH-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1cccc(C[N@H+]2CCN(C)[C@H](C)[C@H]2C)c1O ZINC000775985813 585689002 /nfs/dbraw/zinc/68/90/02/585689002.db2.gz OLOBGHLCSWHDES-CHWSQXEVSA-N 1 1 248.370 2.225 20 10 BECDMO C[C@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccccc1O ZINC000777824410 585720863 /nfs/dbraw/zinc/72/08/63/585720863.db2.gz FBQVPOFHWAVVHU-GXTWGEPZSA-N 1 1 248.370 2.164 20 10 BECDMO Cc1ccc(O)c(C[N@@H+]2CC=CCC2)c1 ZINC000779159669 585746028 /nfs/dbraw/zinc/74/60/28/585746028.db2.gz PTPBMRNINGSEOW-UHFFFAOYSA-N 1 1 203.285 2.463 20 10 BECDMO CC[C@]1(O)CC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000779220086 585747553 /nfs/dbraw/zinc/74/75/53/585747553.db2.gz WQDAGQDRBRXILP-AWEZNQCLSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1cccc(C[N@@H+]2CCC[C@@H]([C@H](C)O)C2)c1O ZINC000780893312 585785844 /nfs/dbraw/zinc/78/58/44/585785844.db2.gz WCXSXCUDTVXVFN-QWHCGFSZSA-N 1 1 249.354 2.293 20 10 BECDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCOC1 ZINC000794550146 586043722 /nfs/dbraw/zinc/04/37/22/586043722.db2.gz KODRSMSYEGGOLU-OAHLLOKOSA-N 1 1 248.370 2.363 20 10 BECDMO Cc1cccc(C[N@@H+]2C[C@H]3CCC[C@@H](C2)N3)c1O ZINC000843106009 586385074 /nfs/dbraw/zinc/38/50/74/586385074.db2.gz JKAZBCKAVXCBGC-OKILXGFUSA-N 1 1 246.354 2.027 20 10 BECDMO Cc1cccc(CN2C[C@H]3CCC[C@@H](C2)[NH2+]3)c1O ZINC000843106009 586385076 /nfs/dbraw/zinc/38/50/76/586385076.db2.gz JKAZBCKAVXCBGC-OKILXGFUSA-N 1 1 246.354 2.027 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](O)C2(C)C)c1 ZINC000812778121 586583906 /nfs/dbraw/zinc/58/39/06/586583906.db2.gz CCECIIGKZIULOI-CYBMUJFWSA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cccc(C[N@H+]2CC[C@H](O)C2(C)C)c1O ZINC000812778176 586584080 /nfs/dbraw/zinc/58/40/80/586584080.db2.gz CKYJYVFKQBWPOZ-LBPRGKRZSA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cc(C[N@H+]2CCCOCC2)ccc1N(C)C ZINC000815029005 586664372 /nfs/dbraw/zinc/66/43/72/586664372.db2.gz LCDWKLQIENGXDJ-UHFFFAOYSA-N 1 1 248.370 2.283 20 10 BECDMO CCOc1ccc(C[N@@H+](C)CCF)c(O)c1 ZINC000816640068 586747371 /nfs/dbraw/zinc/74/73/71/586747371.db2.gz RUBSGFQHURXQBM-UHFFFAOYSA-N 1 1 227.279 2.192 20 10 BECDMO COc1ccc(O)c(C[N@H+]2C[C@H](C)[C@H]2C)c1 ZINC000816648721 586751368 /nfs/dbraw/zinc/75/13/68/586751368.db2.gz OAZCILCFXPCRTH-VHSXEESVSA-N 1 1 221.300 2.241 20 10 BECDMO COc1cccc(O)c1C[N@H+]1C[C@@H](C)[C@@H]1C ZINC000816649134 586751744 /nfs/dbraw/zinc/75/17/44/586751744.db2.gz URQBEHJEVSLERC-ZJUUUORDSA-N 1 1 221.300 2.241 20 10 BECDMO C[C@@H]1CC[C@H](O)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000817289304 586793328 /nfs/dbraw/zinc/79/33/28/586793328.db2.gz WUKKNHJXYGENLJ-DOMZBBRYSA-N 1 1 248.370 2.098 20 10 BECDMO C[C@@H]([NH2+]CC[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000817934442 586843410 /nfs/dbraw/zinc/84/34/10/586843410.db2.gz ILDKMMXHQSAKON-ZCFIWIBFSA-N 1 1 249.141 2.308 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCNC2)c(O)c1C ZINC000817942487 586845301 /nfs/dbraw/zinc/84/53/01/586845301.db2.gz ZRSXTPQPXWEVEH-OLZOCXBDSA-N 1 1 248.370 2.412 20 10 BECDMO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCNC2)c(O)c1 ZINC000817942426 586845306 /nfs/dbraw/zinc/84/53/06/586845306.db2.gz YMAGPWCEAFAIKJ-NWDGAFQWSA-N 1 1 234.343 2.103 20 10 BECDMO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCCN2)c(O)c1 ZINC000817949018 586846665 /nfs/dbraw/zinc/84/66/65/586846665.db2.gz GEMRZPWHLXRPQE-CHWSQXEVSA-N 1 1 248.370 2.493 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCCN2)c1 ZINC000817948489 586846833 /nfs/dbraw/zinc/84/68/33/586846833.db2.gz AMGQTWSNKKBPOL-QWHCGFSZSA-N 1 1 248.370 2.493 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCCN2)c(O)c1 ZINC000817949021 586847076 /nfs/dbraw/zinc/84/70/76/586847076.db2.gz GEMRZPWHLXRPQE-STQMWFEESA-N 1 1 248.370 2.493 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCCN2)c(O)c1 ZINC000817949020 586847214 /nfs/dbraw/zinc/84/72/14/586847214.db2.gz GEMRZPWHLXRPQE-QWHCGFSZSA-N 1 1 248.370 2.493 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](N)C(C)C)c1 ZINC000817958498 586850905 /nfs/dbraw/zinc/85/09/05/586850905.db2.gz KIAIGISKBRTAMW-DGCLKSJQSA-N 1 1 236.359 2.335 20 10 BECDMO Cc1ccc(O)c([C@@H](C)NC[C@@H]([NH3+])C(C)C)c1 ZINC000817958498 586850906 /nfs/dbraw/zinc/85/09/06/586850906.db2.gz KIAIGISKBRTAMW-DGCLKSJQSA-N 1 1 236.359 2.335 20 10 BECDMO Cc1ccc([C@H](C)[NH2+]C[C@@H](N)C(C)C)c(O)c1 ZINC000817959902 586851719 /nfs/dbraw/zinc/85/17/19/586851719.db2.gz WLALWKCRVWQXSZ-WCQYABFASA-N 1 1 236.359 2.335 20 10 BECDMO Cc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)N)c1 ZINC000817960630 586851792 /nfs/dbraw/zinc/85/17/92/586851792.db2.gz PAHKFXRJUZCPFB-SNVBAGLBSA-N 1 1 222.332 2.089 20 10 BECDMO Cc1ccc(O)c([C@@H](C)NCC(C)(C)[NH3+])c1 ZINC000817960630 586851794 /nfs/dbraw/zinc/85/17/94/586851794.db2.gz PAHKFXRJUZCPFB-SNVBAGLBSA-N 1 1 222.332 2.089 20 10 BECDMO C[C@H](N[C@@H](C[NH3+])C1CC1)c1ccc(N(C)C)cc1 ZINC000817961212 586852735 /nfs/dbraw/zinc/85/27/35/586852735.db2.gz VJZWNQZEVJKHQJ-NHYWBVRUSA-N 1 1 247.386 2.141 20 10 BECDMO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](N)C2CC2)c(O)c1 ZINC000817964703 586853665 /nfs/dbraw/zinc/85/36/65/586853665.db2.gz FHLZMHILBLIREO-YPMHNXCESA-N 1 1 248.370 2.397 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](N)C2CC2)c1 ZINC000817966044 586855262 /nfs/dbraw/zinc/85/52/62/586855262.db2.gz ZOGRYDIHZWKDCA-GWCFXTLKSA-N 1 1 234.343 2.089 20 10 BECDMO Cc1ccc(O)c([C@H](C)NC[C@H]([NH3+])C2CC2)c1 ZINC000817966044 586855264 /nfs/dbraw/zinc/85/52/64/586855264.db2.gz ZOGRYDIHZWKDCA-GWCFXTLKSA-N 1 1 234.343 2.089 20 10 BECDMO Cc1ccc([C@H](C)N[C@@H]2C[NH2+]CC[C@H]2C)c(O)c1 ZINC000817969330 586855935 /nfs/dbraw/zinc/85/59/35/586855935.db2.gz USFUTYMVDQJJMB-MBNYWOFBSA-N 1 1 248.370 2.349 20 10 BECDMO CC[C@H](N[C@H](C)C[NH3+])c1ccc(N(C)C)cc1 ZINC000817966945 586856255 /nfs/dbraw/zinc/85/62/55/586856255.db2.gz ZZEMRYNDGZXZNT-RISCZKNCSA-N 1 1 235.375 2.141 20 10 BECDMO Cc1ccc([C@H](C)N[C@H]2C[NH2+]CC[C@H]2C)c(O)c1 ZINC000817969328 586856478 /nfs/dbraw/zinc/85/64/78/586856478.db2.gz USFUTYMVDQJJMB-DYEKYZERSA-N 1 1 248.370 2.349 20 10 BECDMO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)N)cc1 ZINC000817970988 586857356 /nfs/dbraw/zinc/85/73/56/586857356.db2.gz IWTRAHJWUNQALD-VXGBXAGGSA-N 1 1 235.375 2.141 20 10 BECDMO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)N)cc1 ZINC000817970986 586858364 /nfs/dbraw/zinc/85/83/64/586858364.db2.gz IWTRAHJWUNQALD-NWDGAFQWSA-N 1 1 235.375 2.141 20 10 BECDMO C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)[C@H](C)[NH3+] ZINC000817977076 586860108 /nfs/dbraw/zinc/86/01/08/586860108.db2.gz ANLMUFYFPBJTEM-TUAOUCFPSA-N 1 1 235.375 2.139 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@H](C)N)c1 ZINC000817978030 586861709 /nfs/dbraw/zinc/86/17/09/586861709.db2.gz UFMLZPKKCWJXPM-DCAQKATOSA-N 1 1 222.332 2.087 20 10 BECDMO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@H](C)N)c1 ZINC000817978029 586862140 /nfs/dbraw/zinc/86/21/40/586862140.db2.gz UFMLZPKKCWJXPM-AXFHLTTASA-N 1 1 222.332 2.087 20 10 BECDMO CC[C@H](CO)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000824533250 587273524 /nfs/dbraw/zinc/27/35/24/587273524.db2.gz CIRJZPJDAROHFN-LLVKDONJSA-N 1 1 243.734 2.248 20 10 BECDMO CCOc1ccc(O)c(C[NH2+]C(CF)CF)c1 ZINC000824555638 587276423 /nfs/dbraw/zinc/27/64/23/587276423.db2.gz VWJPDQXMNNAVGG-UHFFFAOYSA-N 1 1 245.269 2.188 20 10 BECDMO Oc1ccccc1C[N@H+]1CC[C@@H]1C1CC1 ZINC000824649263 587280682 /nfs/dbraw/zinc/28/06/82/587280682.db2.gz CEBFNAZYZMGJOG-GFCCVEGCSA-N 1 1 203.285 2.377 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](CCCO)C2)c1 ZINC000825338846 587315766 /nfs/dbraw/zinc/31/57/66/587315766.db2.gz VLPZQNQZQIRTNE-ZDUSSCGKSA-N 1 1 249.354 2.295 20 10 BECDMO Cc1cccc(C[N@H+](C)Cc2cnc[nH]2)c1O ZINC000826770710 587361831 /nfs/dbraw/zinc/36/18/31/587361831.db2.gz ZUZYXHJZMHWQFX-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cccc(C[N@@H+](C)Cc2cnc[nH]2)c1O ZINC000826770710 587361832 /nfs/dbraw/zinc/36/18/32/587361832.db2.gz ZUZYXHJZMHWQFX-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cccc(C[N@H+](C)Cc2c[nH]cn2)c1O ZINC000826770710 587361833 /nfs/dbraw/zinc/36/18/33/587361833.db2.gz ZUZYXHJZMHWQFX-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cccc(C[N@@H+](C)Cc2c[nH]cn2)c1O ZINC000826770710 587361834 /nfs/dbraw/zinc/36/18/34/587361834.db2.gz ZUZYXHJZMHWQFX-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@@H+](C)C1(CO)CC1 ZINC000827897932 587408318 /nfs/dbraw/zinc/40/83/18/587408318.db2.gz CDJWGHBGNGJZRN-UHFFFAOYSA-N 1 1 248.370 2.018 20 10 BECDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H]1CO ZINC000840911633 587929254 /nfs/dbraw/zinc/92/92/54/587929254.db2.gz KWLPEQRHNFCODZ-HNNXBMFYSA-N 1 1 248.370 2.018 20 10 BECDMO Cc1cc(O)c(C[N@H+](C)C[C@@H](C)O)c(Cl)c1 ZINC000840939542 587930784 /nfs/dbraw/zinc/93/07/84/587930784.db2.gz NMXHHRIJMSTPGR-SECBINFHSA-N 1 1 243.734 2.167 20 10 BECDMO Cc1cc([O-])c(C[NH2+][C@@H](C)CC[NH3+])c(Cl)c1 ZINC000841051088 587939849 /nfs/dbraw/zinc/93/98/49/587939849.db2.gz NELCMMVBDSCGTA-VIFPVBQESA-N 1 1 242.750 2.181 20 10 BECDMO COc1ccc(CN[C@@H]2CC[NH2+][C@H](C)C2)cc1C ZINC000841061016 587941529 /nfs/dbraw/zinc/94/15/29/587941529.db2.gz DKWWEOKNZYIBQB-TZMCWYRMSA-N 1 1 248.370 2.234 20 10 BECDMO CCN[C@H](C)C[NH2+]Cc1cc(C)c(C)cc1O ZINC000841066864 587942921 /nfs/dbraw/zinc/94/29/21/587942921.db2.gz XFFSGOFTZMYZEV-GFCCVEGCSA-N 1 1 236.359 2.097 20 10 BECDMO C[NH2+]CCCN(C)Cc1cc(C)c(C)cc1O ZINC000841103369 587946785 /nfs/dbraw/zinc/94/67/85/587946785.db2.gz HGHQGUNJRKIVGA-UHFFFAOYSA-N 1 1 236.359 2.050 20 10 BECDMO C[C@H](O)CC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841752496 587973522 /nfs/dbraw/zinc/97/35/22/587973522.db2.gz OZVOBYDZXXNQCA-IUCAKERBSA-N 1 1 243.734 2.467 20 10 BECDMO C[C@@H](O)CC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841751949 587973556 /nfs/dbraw/zinc/97/35/56/587973556.db2.gz OZVOBYDZXXNQCA-BDAKNGLRSA-N 1 1 243.734 2.467 20 10 BECDMO Cc1cc(C[N@@H+](C)Cc2ccccc2O)n(C)n1 ZINC000841834323 587976660 /nfs/dbraw/zinc/97/66/60/587976660.db2.gz NIPLPBBJWYQSJK-UHFFFAOYSA-N 1 1 245.326 2.066 20 10 BECDMO CC[C@@H](C[N@@H+](C)Cc1ccccc1O)OC ZINC000842153857 588004290 /nfs/dbraw/zinc/00/42/90/588004290.db2.gz RNFXWUDMSGHFFI-LBPRGKRZSA-N 1 1 223.316 2.249 20 10 BECDMO CN(C)c1ccc(/C=C\CN(C)CCC[NH3+])cc1 ZINC000843050108 588076702 /nfs/dbraw/zinc/07/67/02/588076702.db2.gz CRHQZOOTPAIXAL-XQRVVYSFSA-N 1 1 247.386 2.046 20 10 BECDMO Cc1cc(O)c(C[N@H+]2[C@H](C)CNC[C@@H]2C)cc1C ZINC000843063381 588078764 /nfs/dbraw/zinc/07/87/64/588078764.db2.gz AILDYLDARLOLBA-BETUJISGSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1cc(O)c(C[N@@H+]2[C@H](C)CNC[C@@H]2C)cc1C ZINC000843063381 588078766 /nfs/dbraw/zinc/07/87/66/588078766.db2.gz AILDYLDARLOLBA-BETUJISGSA-N 1 1 248.370 2.191 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c1 ZINC000846113511 588257653 /nfs/dbraw/zinc/25/76/53/588257653.db2.gz YHEZPNJHKINDIZ-PHIMTYICSA-N 1 1 239.265 2.398 20 10 BECDMO CCc1cccc(C[N@@H+](CC)CCCO)c1O ZINC000848887664 588417950 /nfs/dbraw/zinc/41/79/50/588417950.db2.gz BQTSDCZCGDMYFJ-UHFFFAOYSA-N 1 1 237.343 2.159 20 10 BECDMO CCc1cccc(C[N@@H+](C)CC2(CO)CC2)c1O ZINC000848905120 588418962 /nfs/dbraw/zinc/41/89/62/588418962.db2.gz HLJGJBRLRNXWCV-UHFFFAOYSA-N 1 1 249.354 2.159 20 10 BECDMO CCc1cccc(C[N@H+](C)[C@@H](CC)CO)c1O ZINC000848914665 588420274 /nfs/dbraw/zinc/42/02/74/588420274.db2.gz QQQHWNSZAOEDIN-ZDUSSCGKSA-N 1 1 237.343 2.157 20 10 BECDMO CCc1cccc(C[N@@H+](C[C@@H](C)O)C2CC2)c1O ZINC000848929719 588422171 /nfs/dbraw/zinc/42/21/71/588422171.db2.gz ZAARVAUHIJIYNK-LLVKDONJSA-N 1 1 249.354 2.300 20 10 BECDMO C[N@@H+](Cc1cccc(Cl)c1[O-])CC(C)(C)[NH3+] ZINC000849350865 588474993 /nfs/dbraw/zinc/47/49/93/588474993.db2.gz ZGURBGSFNFGBOB-UHFFFAOYSA-N 1 1 242.750 2.215 20 10 BECDMO C[C@@H](O)[C@H]1CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000852558135 588690344 /nfs/dbraw/zinc/69/03/44/588690344.db2.gz HAGRFWFFCZMAJC-IUODEOHRSA-N 1 1 248.370 2.098 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1 ZINC000862440292 589212683 /nfs/dbraw/zinc/21/26/83/589212683.db2.gz HIKSUNRKGUXIDP-PHIMTYICSA-N 1 1 203.285 2.152 20 10 BECDMO CN(C)c1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1 ZINC000862442357 589213465 /nfs/dbraw/zinc/21/34/65/589213465.db2.gz YZXSLMKCVBVNHS-BETUJISGSA-N 1 1 216.328 2.204 20 10 BECDMO Cc1cccc(C[N@H+](C)CC2(C)COC2)c1O ZINC000862477910 589216283 /nfs/dbraw/zinc/21/62/83/589216283.db2.gz UKXCNXMIYHVYBJ-UHFFFAOYSA-N 1 1 235.327 2.169 20 10 BECDMO CN(C)c1ccc(C[NH+]2CC3(C2)CCCO3)cc1 ZINC000862483695 589216838 /nfs/dbraw/zinc/21/68/38/589216838.db2.gz RKRMUHUVMURURS-UHFFFAOYSA-N 1 1 246.354 2.117 20 10 BECDMO C[C@H]([NH2+][C@@H]1CC[C@@H](C)NC1)c1ccccc1O ZINC000863545548 589297808 /nfs/dbraw/zinc/29/78/08/589297808.db2.gz UZJWVTAPQAGZCU-GRYCIOLGSA-N 1 1 234.343 2.183 20 10 BECDMO C[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)CN1 ZINC000863548024 589298390 /nfs/dbraw/zinc/29/83/90/589298390.db2.gz UEZQIWYCOUIPHR-KGYLQXTDSA-N 1 1 246.354 2.110 20 10 BECDMO C[C@@H]1CC[C@H]([NH2+][C@H]2CCc3cccc(O)c32)CN1 ZINC000863548030 589298457 /nfs/dbraw/zinc/29/84/57/589298457.db2.gz UEZQIWYCOUIPHR-WXHSDQCUSA-N 1 1 246.354 2.110 20 10 BECDMO C[C@@H]([NH2+]CC(C)(C)CO)c1ccc(F)cc1O ZINC000122021497 589549910 /nfs/dbraw/zinc/54/99/10/589549910.db2.gz IOXSBELRRXUDKM-SECBINFHSA-N 1 1 241.306 2.200 20 10 BECDMO CC[C@@H]1COCC[N@H+]1Cc1cccc(C)c1O ZINC000124554191 590050145 /nfs/dbraw/zinc/05/01/45/590050145.db2.gz KTAXFMYLYCOFLV-CYBMUJFWSA-N 1 1 235.327 2.311 20 10 BECDMO Cc1cccc(O)c1CN1CCC([NH+](C)C)CC1 ZINC000876596160 590219661 /nfs/dbraw/zinc/21/96/61/590219661.db2.gz OLCFOXAGIHRDPQ-UHFFFAOYSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)c(O)c1 ZINC000876598049 590220465 /nfs/dbraw/zinc/22/04/65/590220465.db2.gz TXCARNIGCULFQG-RYUDHWBXSA-N 1 1 235.327 2.310 20 10 BECDMO CO[C@H]1CCC[N@@H+](Cc2c(C)cccc2O)C1 ZINC000876610474 590221982 /nfs/dbraw/zinc/22/19/82/590221982.db2.gz VEHHZAFETSZPMQ-LBPRGKRZSA-N 1 1 235.327 2.311 20 10 BECDMO COC[C@@H]1CC[N@@H+](Cc2c(C)cccc2O)C1 ZINC000876726029 590233742 /nfs/dbraw/zinc/23/37/42/590233742.db2.gz TYAABGSNJQTSFJ-GFCCVEGCSA-N 1 1 235.327 2.169 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@H](CN(C)C)C1 ZINC000876730040 590234569 /nfs/dbraw/zinc/23/45/69/590234569.db2.gz AWNPXGJQWDBSCJ-CYBMUJFWSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CC[C@H](CN(C)C)C1 ZINC000876730040 590234571 /nfs/dbraw/zinc/23/45/71/590234571.db2.gz AWNPXGJQWDBSCJ-CYBMUJFWSA-N 1 1 248.370 2.084 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000876741112 590235262 /nfs/dbraw/zinc/23/52/62/590235262.db2.gz IVCWSFODESFBKX-TXEJJXNPSA-N 1 1 233.311 2.064 20 10 BECDMO Cc1ccc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)c(O)c1 ZINC000876739310 590235466 /nfs/dbraw/zinc/23/54/66/590235466.db2.gz OAHLZAXCTZBZJW-NWDGAFQWSA-N 1 1 235.327 2.310 20 10 BECDMO Cc1cccc(O)c1C[N@@H+](C)Cc1cn[nH]c1 ZINC000876738574 590235556 /nfs/dbraw/zinc/23/55/56/590235556.db2.gz HIWSKHXWPLDPGE-UHFFFAOYSA-N 1 1 231.299 2.056 20 10 BECDMO CC[C@H]1CN(C)CC[N@H+]1Cc1ccc(C)cc1O ZINC000877553798 590357014 /nfs/dbraw/zinc/35/70/14/590357014.db2.gz YPRSQGUPYLJELG-AWEZNQCLSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H](F)C1 ZINC000877558353 590358680 /nfs/dbraw/zinc/35/86/80/590358680.db2.gz FKMGAVZSPXZKDQ-SNVBAGLBSA-N 1 1 209.264 2.244 20 10 BECDMO Cc1ccc(C[N@H+]2CC[C@H](F)C2)c(O)c1 ZINC000877559468 590359050 /nfs/dbraw/zinc/35/90/50/590359050.db2.gz ODKWDDWWTPWOIH-NSHDSACASA-N 1 1 209.264 2.244 20 10 BECDMO CCN(CC)c1ccc(C[NH+]2CC(C)(O)C2)cc1 ZINC000877581356 590365917 /nfs/dbraw/zinc/36/59/17/590365917.db2.gz YSIIXNPDRVEVDS-UHFFFAOYSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1cccc(O)c1CN(C)C[C@@H]1CCC[N@@H+]1C ZINC000877596026 590370598 /nfs/dbraw/zinc/37/05/98/590370598.db2.gz GZWZWTFXMHEJFU-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)C[C@@H]1CCCN1C ZINC000877596026 590370597 /nfs/dbraw/zinc/37/05/97/590370597.db2.gz GZWZWTFXMHEJFU-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1CN(C)C[C@@H]1CCC[N@H+]1C ZINC000877596026 590370601 /nfs/dbraw/zinc/37/06/01/590370601.db2.gz GZWZWTFXMHEJFU-ZDUSSCGKSA-N 1 1 248.370 2.227 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C[C@@H](C)O)C1CC1 ZINC000877621839 590376064 /nfs/dbraw/zinc/37/60/64/590376064.db2.gz XOQVMQBITYPZOZ-LLVKDONJSA-N 1 1 235.327 2.046 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1C[C@H](C)[C@](C)(CO)C1 ZINC000877640353 590382095 /nfs/dbraw/zinc/38/20/95/590382095.db2.gz LWYXVAKGJVAYEV-WFASDCNBSA-N 1 1 249.354 2.151 20 10 BECDMO Cc1cccc(O)c1C[N@H+](C)C1(CO)CCC1 ZINC000877641973 590382643 /nfs/dbraw/zinc/38/26/43/590382643.db2.gz NLCOEPJGILGUCO-UHFFFAOYSA-N 1 1 235.327 2.047 20 10 BECDMO Cc1cccc(O)c1C[N@@H+]1CC[C@H](C)[C@@H](CO)C1 ZINC000877646882 590384571 /nfs/dbraw/zinc/38/45/71/590384571.db2.gz MNWQTTKHZAANSZ-WCQYABFASA-N 1 1 249.354 2.151 20 10 BECDMO CC[C@@]1(O)CCC[N@@H+](Cc2c(C)cccc2O)C1 ZINC000877691760 590392333 /nfs/dbraw/zinc/39/23/33/590392333.db2.gz VOXDXRSNMLWGON-OAHLLOKOSA-N 1 1 249.354 2.438 20 10 BECDMO CC[C@]1(O)CCC[N@@H+](Cc2ccccc2O)C1 ZINC000877691113 590392718 /nfs/dbraw/zinc/39/27/18/590392718.db2.gz IXFBTZGTKMQIGO-AWEZNQCLSA-N 1 1 235.327 2.129 20 10 BECDMO Oc1cccc2c1C[N@@H+](C[C@H]1CCCOC1)C2 ZINC000877703026 590396202 /nfs/dbraw/zinc/39/62/02/590396202.db2.gz OVEZEPZZKFEVRP-LLVKDONJSA-N 1 1 233.311 2.134 20 10 BECDMO Cc1ccc(O)c(C[N@H+]2C[C@H](O)CC(C)(C)C2)c1 ZINC000877752984 590417079 /nfs/dbraw/zinc/41/70/79/590417079.db2.gz KYLVOCHHBYJEFO-CYBMUJFWSA-N 1 1 249.354 2.293 20 10 BECDMO Cc1conc1C[N@@H+](C)Cc1ccccc1O ZINC000878241988 590528197 /nfs/dbraw/zinc/52/81/97/590528197.db2.gz MACLRMWMSNOWEH-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO Cc1conc1C[N@H+](C)Cc1ccccc1O ZINC000878241988 590528200 /nfs/dbraw/zinc/52/82/00/590528200.db2.gz MACLRMWMSNOWEH-UHFFFAOYSA-N 1 1 232.283 2.321 20 10 BECDMO C[N@H+](Cc1ccccc1O)C[C@@H]1C[C@]12CCOC2 ZINC000886065362 592142037 /nfs/dbraw/zinc/14/20/37/592142037.db2.gz SPQOCVPPIHOWJN-ZFWWWQNUSA-N 1 1 247.338 2.251 20 10 BECDMO Oc1ccccc1CN[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000217655105 592148523 /nfs/dbraw/zinc/14/85/23/592148523.db2.gz AWHVUWOKNHGRFW-KGLIPLIRSA-N 1 1 246.354 2.109 20 10 BECDMO C[C@@H]([NH2+]C[C@@H]1CCCO1)c1c(O)cccc1F ZINC000886489389 592235821 /nfs/dbraw/zinc/23/58/21/592235821.db2.gz HMYNUAKBIVXFCW-ZJUUUORDSA-N 1 1 239.290 2.361 20 10 BECDMO Cc1cc(C[NH2+][C@H](C)c2c(O)cccc2F)[nH]n1 ZINC000886530398 592247419 /nfs/dbraw/zinc/24/74/19/592247419.db2.gz JETAHTSWRNCISS-SECBINFHSA-N 1 1 249.289 2.414 20 10 BECDMO CC[C@H](CCO)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886531151 592247675 /nfs/dbraw/zinc/24/76/75/592247675.db2.gz XHJLNLSZGFRFKG-VHSXEESVSA-N 1 1 241.306 2.343 20 10 BECDMO Cc1n[nH]cc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886550375 592259440 /nfs/dbraw/zinc/25/94/40/592259440.db2.gz YOBLTPMEGHCRQC-VIFPVBQESA-N 1 1 249.289 2.414 20 10 BECDMO C[C@H]([NH2+]CCCCCO)c1c(O)cccc1F ZINC000886602853 592272802 /nfs/dbraw/zinc/27/28/02/592272802.db2.gz AVBCAAKCAQIGMC-JTQLQIEISA-N 1 1 241.306 2.345 20 10 BECDMO C[C@H]([NH2+]Cc1cncn1C)c1c(O)cccc1F ZINC000886610426 592274639 /nfs/dbraw/zinc/27/46/39/592274639.db2.gz AWVSGZFKIHTDHG-VIFPVBQESA-N 1 1 249.289 2.116 20 10 BECDMO C[C@H]([NH2+][C@@H]1CCC[C@H]1O)c1c(O)cccc1F ZINC000886623871 592279601 /nfs/dbraw/zinc/27/96/01/592279601.db2.gz QRQSITXPWXQDFK-JMJZKYOTSA-N 1 1 239.290 2.095 20 10 BECDMO Nc1ccc([NH2+]C[C@@H]2CCCOC2)cc1 ZINC000044981777 631827103 /nfs/dbraw/zinc/82/71/03/631827103.db2.gz BKUATKAZUGWHAQ-JTQLQIEISA-N 1 1 206.289 2.107 20 10 BECDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCOC1 ZINC000309513626 632433286 /nfs/dbraw/zinc/43/32/86/632433286.db2.gz QNEUNOQREXBUSH-ZETCQYMHSA-N 1 1 245.681 2.063 20 10 BECDMO Cc1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2O)c(O)c1 ZINC000895438848 636143482 /nfs/dbraw/zinc/14/34/82/636143482.db2.gz NPPSWADZWTXDCB-ZIAGYGMSSA-N 1 1 249.354 2.436 20 10 BECDMO CC[C@H](O)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000309915366 633935637 /nfs/dbraw/zinc/93/56/37/633935637.db2.gz OZZGWBPSCCEJCQ-ZETCQYMHSA-N 1 1 247.697 2.045 20 10 BECDMO c1cc(C[NH2+]Cc2ccc3c(c2)CCCO3)on1 ZINC000893549408 635140735 /nfs/dbraw/zinc/14/07/35/635140735.db2.gz SVVAEIYZINWEMK-UHFFFAOYSA-N 1 1 244.294 2.289 20 10 BECDMO CC[C@@](C)(C[NH2+]Cc1cccc(F)c1O)OC ZINC000322658412 636876729 /nfs/dbraw/zinc/87/67/29/636876729.db2.gz ZMCUAFGADVBWBL-ZDUSSCGKSA-N 1 1 241.306 2.436 20 10 BECDMO CC[C@H](CCO)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168793535 640827135 /nfs/dbraw/zinc/82/71/35/640827135.db2.gz HOKBFRDIURLYDV-GXSJLCMTSA-N 1 1 241.306 2.343 20 10 BECDMO COC1(C[NH2+]Cc2cccc(F)c2O)CCC1 ZINC000227520851 640837177 /nfs/dbraw/zinc/83/71/77/640837177.db2.gz CIRLFXTVEDAVRW-UHFFFAOYSA-N 1 1 239.290 2.190 20 10 BECDMO C[C@H]([NH2+]Cc1ccccc1O)C(F)F ZINC000228522415 640878593 /nfs/dbraw/zinc/87/85/93/640878593.db2.gz UMCCXEHQKHUBLX-ZETCQYMHSA-N 1 1 201.216 2.135 20 10 BECDMO COc1ccc(C[NH2+]Cc2ccno2)cc1C ZINC000231883526 641210186 /nfs/dbraw/zinc/21/01/86/641210186.db2.gz OSEWQVRKWZNMCR-UHFFFAOYSA-N 1 1 232.283 2.281 20 10 BECDMO C[C@@H]([NH2+]Cc1ccon1)c1ccccc1O ZINC000088052788 641281464 /nfs/dbraw/zinc/28/14/64/641281464.db2.gz OITIHMFTXIAZRQ-SECBINFHSA-N 1 1 218.256 2.231 20 10 BECDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000305732926 642684361 /nfs/dbraw/zinc/68/43/61/642684361.db2.gz OKCGVEGGJHQNEL-OAHLLOKOSA-N 1 1 248.370 2.099 20 10 BECDMO Cc1cccc(C[N@H+](C[C@H](C)O)C(C)C)c1O ZINC000305775778 642694081 /nfs/dbraw/zinc/69/40/81/642694081.db2.gz NXYZBYAXEPZSBC-LBPRGKRZSA-N 1 1 237.343 2.292 20 10 BECDMO C[C@H]1OCC[N@@H+](Cc2ccccc2O)[C@H]1C ZINC000179575454 642725519 /nfs/dbraw/zinc/72/55/19/642725519.db2.gz GFRAFCAIAAKLRZ-WDEREUQCSA-N 1 1 221.300 2.001 20 10 BECDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccccc1O ZINC000180243763 642781433 /nfs/dbraw/zinc/78/14/33/642781433.db2.gz QGVCTTJJTPDIKC-UHFFFAOYSA-N 1 1 216.284 2.352 20 10 BECDMO CC[N@H+](Cc1cc2c(cc1O)OCO2)CC1CC1 ZINC000069797316 642915256 /nfs/dbraw/zinc/91/52/56/642915256.db2.gz CBDTYXANDMEKMQ-UHFFFAOYSA-N 1 1 249.310 2.353 20 10 BECDMO Cc1ccc(O)c(CN2CCCC[C@@H]2[C@@H](C)[NH3+])c1 ZINC000071409527 643143230 /nfs/dbraw/zinc/14/32/30/643143230.db2.gz BIAHQWNJYKKWRI-TZMCWYRMSA-N 1 1 248.370 2.402 20 10 BECDMO COc1cccc(C[N@H+]2C[C@H](C)[C@H]2C)c1O ZINC000816647593 643555102 /nfs/dbraw/zinc/55/51/02/643555102.db2.gz VIQPEGIBVJQPLD-VHSXEESVSA-N 1 1 221.300 2.241 20 10 BECDMO C[C@H]1C[C@@H]([NH3+])CCN1Cc1ccc(N(C)C)cc1 ZINC000084946394 643676894 /nfs/dbraw/zinc/67/68/94/643676894.db2.gz WRCSVYMFXRWOAI-JSGCOSHPSA-N 1 1 247.386 2.064 20 10 BECDMO C[NH2+]CCCN(C)Cc1ccc(N(C)C)c(C)c1 ZINC000923378603 644392043 /nfs/dbraw/zinc/39/20/43/644392043.db2.gz VLOXHWMSEHFJMO-UHFFFAOYSA-N 1 1 249.402 2.102 20 10 BECDMO OC[C@@H]1CCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000092455764 644658336 /nfs/dbraw/zinc/65/83/36/644658336.db2.gz LRQLQFALFDCLBE-NSHDSACASA-N 1 1 241.718 2.002 20 10 BECDMO CCN(C)c1ccc(C[N@@H+](C)[C@H]2CCOC2)cc1 ZINC000773758462 644695680 /nfs/dbraw/zinc/69/56/80/644695680.db2.gz TXWXJSCEIPDGRG-HNNXBMFYSA-N 1 1 248.370 2.363 20 10 BECDMO CC[C@H](N)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000817981038 644994856 /nfs/dbraw/zinc/99/48/56/644994856.db2.gz ZAHOOMAJRYIPJI-MNOVXSKESA-N 1 1 222.332 2.089 20 10 BECDMO CC[C@H]([NH3+])CN[C@H](C)c1cc(C)ccc1O ZINC000817981038 644994863 /nfs/dbraw/zinc/99/48/63/644994863.db2.gz ZAHOOMAJRYIPJI-MNOVXSKESA-N 1 1 222.332 2.089 20 10 BECDMO C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1c([O-])cccc1Cl ZINC000843129115 645266176 /nfs/dbraw/zinc/26/61/76/645266176.db2.gz MKEAGPQHWACYIY-DTWKUNHWSA-N 1 1 242.750 2.261 20 10 BECDMO Cc1cccc(O)c1C[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1 ZINC000877628825 645804943 /nfs/dbraw/zinc/80/49/43/645804943.db2.gz NDECYORMSKBRAP-JYAVWHMHSA-N 1 1 249.354 2.149 20 10 BECDMO CCC[N@@H+](Cc1ccccc1O)[C@H](CC)CO ZINC000929753562 646286189 /nfs/dbraw/zinc/28/61/89/646286189.db2.gz SCLGDEWLUOTTMI-CYBMUJFWSA-N 1 1 237.343 2.375 20 10 BECDMO C[C@H](c1ncccn1)[N@H+](C)Cc1ccccc1O ZINC000929971535 646382315 /nfs/dbraw/zinc/38/23/15/646382315.db2.gz OJGKRVDYQGODSQ-LLVKDONJSA-N 1 1 243.310 2.375 20 10 BECDMO C[C@H](c1ncccn1)[N@@H+](C)Cc1ccccc1O ZINC000929971535 646382318 /nfs/dbraw/zinc/38/23/18/646382318.db2.gz OJGKRVDYQGODSQ-LLVKDONJSA-N 1 1 243.310 2.375 20 10 BECDMO CC[C@@H](COC)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708483716 712184243 /nfs/dbraw/zinc/18/42/43/712184243.db2.gz GAPGNUVBNFKVKN-JTQLQIEISA-N 1 1 245.269 2.185 20 10 BECDMO COC[C@@H](C)C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708486481 712211184 /nfs/dbraw/zinc/21/11/84/712211184.db2.gz RQPZJGOTBZDFAB-QMMMGPOBSA-N 1 1 245.269 2.043 20 10 BECDMO