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]1C[N@H+](Cc2ccc(Cl)cc2O)CCN1c1cc[nH+]cc1 ZINC001183532573 1083971363 /nfs/dbraw/zinc/97/13/63/1083971363.db2.gz DSNPVVHPPSZQJC-ZDUSSCGKSA-N 2 0 317.820 3.151 20 10 DGCDRP CCCSC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001183532125 1083971452 /nfs/dbraw/zinc/97/14/52/1083971452.db2.gz AKZHFUQGSZICKR-MRXNPFEDSA-N 2 0 321.534 3.060 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001203560831 1090757301 /nfs/dbraw/zinc/75/73/01/1090757301.db2.gz HDZOMLYEMDZSAV-ICSRJNTNSA-N 2 0 322.452 3.346 20 10 DGCDRP COc1cccc(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c1O ZINC001203596009 1090764180 /nfs/dbraw/zinc/76/41/80/1090764180.db2.gz YIUOVXJAWOMHQY-QGZVFWFLSA-N 2 0 318.461 3.241 20 10 DGCDRP CCCC[NH+]1CCC([N@H+](C)Cc2cccc(OC)c2O)CC1 ZINC001203601763 1090765277 /nfs/dbraw/zinc/76/52/77/1090765277.db2.gz KFKVPWAZACVPDW-UHFFFAOYSA-N 2 0 306.450 3.097 20 10 DGCDRP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(OC)cc2O)CC1 ZINC001203634939 1090770019 /nfs/dbraw/zinc/77/00/19/1090770019.db2.gz BXZMDCLHAQMMNG-UHFFFAOYSA-N 2 0 306.450 3.097 20 10 DGCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(N(CC)CC)cc3)C[C@@H]2C1 ZINC001203946560 1090847957 /nfs/dbraw/zinc/84/79/57/1090847957.db2.gz VPSIPDGCCAYZPY-KDURUIRLSA-N 2 0 315.505 3.306 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3ccc(N(CC)CC)cc3)C[C@H]2C1 ZINC001203946562 1090848240 /nfs/dbraw/zinc/84/82/40/1090848240.db2.gz VPSIPDGCCAYZPY-RTBURBONSA-N 2 0 315.505 3.306 20 10 DGCDRP C[NH+]1CCC2(C[NH+](Cc3ccc(N4CCCCC4)cc3)C2)CC1 ZINC001138220862 1091119627 /nfs/dbraw/zinc/11/96/27/1091119627.db2.gz QOUKUCPBZMEVLL-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)CC[C@@H]1C[NH3+] ZINC001205625963 1091286093 /nfs/dbraw/zinc/28/60/93/1091286093.db2.gz DAOWPOLOGIBUBR-HUUCEWRRSA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001205904958 1091403787 /nfs/dbraw/zinc/40/37/87/1091403787.db2.gz YUAFNBPIKTXGIK-HZPDHXFCSA-N 2 0 311.473 3.465 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@H](C)[C@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139255251 1091502342 /nfs/dbraw/zinc/50/23/42/1091502342.db2.gz OMRLRZZXBLQKBE-LSDHHAIUSA-N 2 0 320.477 3.330 20 10 DGCDRP COc1cc(C[NH+]2CCC3(CCC3)CC2)cc(C[NH+](C)C)c1O ZINC001139254295 1091502571 /nfs/dbraw/zinc/50/25/71/1091502571.db2.gz FVVVVIHWRWOSLD-UHFFFAOYSA-N 2 0 318.461 3.229 20 10 DGCDRP COc1cc(C[N@@H+]2CCCC3(CCC3)C2)cc(C[NH+](C)C)c1O ZINC001139260969 1091503890 /nfs/dbraw/zinc/50/38/90/1091503890.db2.gz QSYOTZBVRUWHTR-UHFFFAOYSA-N 2 0 318.461 3.229 20 10 DGCDRP C[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139411427 1091551967 /nfs/dbraw/zinc/55/19/67/1091551967.db2.gz LFQKCSCFPZYRLW-UAPYVXQJSA-N 2 0 315.505 3.449 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@@H+]3CCCC[C@H](C[NH3+])C3)c2c1 ZINC001206639904 1092879447 /nfs/dbraw/zinc/87/94/47/1092879447.db2.gz GEPMFMZEWNCQJX-CQSZACIVSA-N 2 0 314.429 3.115 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)cc1F ZINC001119990900 1094338249 /nfs/dbraw/zinc/33/82/49/1094338249.db2.gz YTAVELKVBXGJPE-YESZJQIVSA-N 2 0 319.468 3.054 20 10 DGCDRP Cc1ccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c(O)c1 ZINC001222167828 1095473377 /nfs/dbraw/zinc/47/33/77/1095473377.db2.gz SKNVQYKPVLFORL-IBGZPJMESA-N 2 0 302.462 3.446 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC3(CCC[NH2+]C3)CC2)c(Cl)c1 ZINC001222457908 1095623041 /nfs/dbraw/zinc/62/30/41/1095623041.db2.gz XZIPNMDZZBVIAL-UHFFFAOYSA-N 2 0 321.896 3.372 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c1 ZINC001222629483 1095699656 /nfs/dbraw/zinc/69/96/56/1095699656.db2.gz JEZZPRRZPFHMKR-GASCZTMLSA-N 2 0 302.462 3.121 20 10 DGCDRP Cc1cc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c(C)n1-c1ccccc1 ZINC001137856327 1095766191 /nfs/dbraw/zinc/76/61/91/1095766191.db2.gz ZJYYBUYWANNPKC-QUCCMNQESA-N 2 0 323.484 3.478 20 10 DGCDRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC001172358224 1097124476 /nfs/dbraw/zinc/12/44/76/1097124476.db2.gz GNUFUVNKJVLXPI-AOIWGVFYSA-N 2 0 315.505 3.353 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)c(O)c1 ZINC001234999620 1098743871 /nfs/dbraw/zinc/74/38/71/1098743871.db2.gz NEEUDKOFLKUODX-LJQANCHMSA-N 2 0 302.462 3.265 20 10 DGCDRP Cc1c(C[NH+]2CCC3(CC[NH2+]CC3)CC2)c2ccccc2n1C ZINC001235135991 1098830406 /nfs/dbraw/zinc/83/04/06/1098830406.db2.gz SJDWYUXTCXHCLC-UHFFFAOYSA-N 2 0 311.473 3.452 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)cc1 ZINC001235232556 1098906221 /nfs/dbraw/zinc/90/62/21/1098906221.db2.gz YLDSENUECUUAHI-LJQANCHMSA-N 2 0 301.478 3.107 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001235363824 1098981645 /nfs/dbraw/zinc/98/16/45/1098981645.db2.gz KFEWILNDOSPVRY-PZJWPPBQSA-N 2 0 322.452 3.145 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001235363822 1098982021 /nfs/dbraw/zinc/98/20/21/1098982021.db2.gz KFEWILNDOSPVRY-CTNGQTDRSA-N 2 0 322.452 3.145 20 10 DGCDRP Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235432903 1099029943 /nfs/dbraw/zinc/02/99/43/1099029943.db2.gz ZILYUHLFPOIYSI-KBPBESRZSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1ccc(C[N@H+]2C[C@@H]3C[NH+](Cc4ccc(N)cc4)C[C@@H]3C2)cc1 ZINC001235520789 1099071876 /nfs/dbraw/zinc/07/18/76/1099071876.db2.gz XZHIMFJGHUGJNV-BGYRXZFFSA-N 2 0 321.468 3.141 20 10 DGCDRP C[NH2+]CC1CC[NH+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CC1 ZINC001235680023 1099123651 /nfs/dbraw/zinc/12/36/51/1099123651.db2.gz QHWVBISTUHNJIH-UHFFFAOYSA-N 2 0 316.445 3.008 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)c2ccccc12)C1CC[NH2+]CC1 ZINC001235762441 1099168205 /nfs/dbraw/zinc/16/82/05/1099168205.db2.gz UKAPAVYTIAIQBW-UHFFFAOYSA-N 2 0 311.473 3.480 20 10 DGCDRP CCC[N@H+](Cc1cc(C(F)(F)F)ccc1O)C1CC[NH2+]CC1 ZINC001236184176 1099453182 /nfs/dbraw/zinc/45/31/82/1099453182.db2.gz GCJUFMQMYUAJDM-UHFFFAOYSA-N 2 0 316.367 3.375 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)Cc2cc3c(s2)C[NH2+]CC3)cc1 ZINC001236189790 1099456926 /nfs/dbraw/zinc/45/69/26/1099456926.db2.gz NRWBIRYIBISVQI-UHFFFAOYSA-N 2 0 315.486 3.092 20 10 DGCDRP C[N@H+](Cc1cc2c3c(c1)CCCN3CCC2)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236222138 1099480361 /nfs/dbraw/zinc/48/03/61/1099480361.db2.gz LEBMFGKNIFACQK-WGSAOQKQSA-N 2 0 313.489 3.087 20 10 DGCDRP Cc1cccc(O)c1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374633 1099561150 /nfs/dbraw/zinc/56/11/50/1099561150.db2.gz FOQJIKOFTJAARO-INIZCTEOSA-N 2 0 302.462 3.445 20 10 DGCDRP COc1cc(C)c(CN([C@H]2CC[NH2+]C2)C2CCCCC2)c(O)c1 ZINC001236662663 1099730899 /nfs/dbraw/zinc/73/08/99/1099730899.db2.gz LKTIZSAPKQFYFT-INIZCTEOSA-N 2 0 318.461 3.206 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3cc4ccccc4cc3O)C[C@@H]2C1 ZINC001236838269 1099823017 /nfs/dbraw/zinc/82/30/17/1099823017.db2.gz XOYKICZOUOMNDT-OALUTQOASA-N 2 0 310.441 3.319 20 10 DGCDRP C[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@H]1CCc2ccccc21 ZINC001237257589 1100050210 /nfs/dbraw/zinc/05/02/10/1100050210.db2.gz HOYLWSGVCVIIOF-NRFANRHFSA-N 2 0 321.468 3.216 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)c1O ZINC001237408159 1100115287 /nfs/dbraw/zinc/11/52/87/1100115287.db2.gz YYZOSOIEPIIHDK-WMLDXEAASA-N 2 0 302.462 3.264 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)c1 ZINC001237418593 1100121916 /nfs/dbraw/zinc/12/19/16/1100121916.db2.gz XPKLHXSQEYNDQU-RHSMWYFYSA-N 2 0 302.462 3.264 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CC3(C2)CC[NH+](C)CC3)cc1 ZINC001203943389 1102237118 /nfs/dbraw/zinc/23/71/18/1102237118.db2.gz YWTDOYHCTHHDQF-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP CC[C@@H]([NH2+]CC[C@H](C)[NH2+]C)c1ccc(C(F)(F)F)cc1O ZINC001326037081 1103189070 /nfs/dbraw/zinc/18/90/70/1103189070.db2.gz VRKHMTMTANBJCL-GXFFZTMASA-N 2 0 304.356 3.450 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)[C@@H]1CC[NH3+] ZINC001326465728 1103327556 /nfs/dbraw/zinc/32/75/56/1103327556.db2.gz WIIKHYJAHVXZDP-VQIMIIECSA-N 2 0 301.478 3.236 20 10 DGCDRP C[NH2+]CCC1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001326503450 1103346207 /nfs/dbraw/zinc/34/62/07/1103346207.db2.gz SVWOIOQNFWXFBK-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H](C)C1 ZINC001246172267 1104418886 /nfs/dbraw/zinc/41/88/86/1104418886.db2.gz HINDZYWEGGSYAV-VQFNDLOPSA-N 2 0 301.478 3.011 20 10 DGCDRP CSC(C)(C)C[C@@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246172814 1104419232 /nfs/dbraw/zinc/41/92/32/1104419232.db2.gz IPCSBKSIQVPCCL-OAHLLOKOSA-N 2 0 321.534 3.106 20 10 DGCDRP CC(C)CCC[C@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246175089 1104421253 /nfs/dbraw/zinc/42/12/53/1104421253.db2.gz SFVUXHUIKXLCCA-KRWDZBQOSA-N 2 0 303.494 3.401 20 10 DGCDRP CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246175584 1104422768 /nfs/dbraw/zinc/42/27/68/1104422768.db2.gz UHMZZRUPHDAGPI-FQEVSTJZSA-N 2 0 323.484 3.207 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246524131 1104578224 /nfs/dbraw/zinc/57/82/24/1104578224.db2.gz JSJXMIVYPLQFAZ-KDOFPFPSSA-N 2 0 314.473 3.364 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1CCC2(C[NH2+]C2)C1 ZINC001246524132 1104578499 /nfs/dbraw/zinc/57/84/99/1104578499.db2.gz JSJXMIVYPLQFAZ-KSSFIOAISA-N 2 0 314.473 3.364 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246529358 1104579174 /nfs/dbraw/zinc/57/91/74/1104579174.db2.gz GXGKQTUPBQBBHR-QWQRMKEZSA-N 2 0 302.462 3.363 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246924888 1104739725 /nfs/dbraw/zinc/73/97/25/1104739725.db2.gz NKLDCNRBXSHGLR-GOSISDBHSA-N 2 0 301.478 3.249 20 10 DGCDRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001275959464 1104968496 /nfs/dbraw/zinc/96/84/96/1104968496.db2.gz AZNVQLDQUAIGFZ-HXUWFJFHSA-N 2 0 313.489 3.205 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC3(CCC[N@@H+](C)C3)CC2)c1O ZINC001275965710 1104970929 /nfs/dbraw/zinc/97/09/29/1104970929.db2.gz NICFGBSEVBXOFL-UHFFFAOYSA-N 2 0 302.462 3.317 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC(C)(C)C3)cc2)CC1 ZINC001258273046 1106706200 /nfs/dbraw/zinc/70/62/00/1106706200.db2.gz GYGMUMFYLHEJRV-GOSISDBHSA-N 2 0 315.505 3.497 20 10 DGCDRP CC(C)C([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC001308325159 1111416478 /nfs/dbraw/zinc/41/64/78/1111416478.db2.gz UNPGLUHIPHBCQW-UHFFFAOYSA-N 2 0 303.494 3.209 20 10 DGCDRP CCc1cccc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@H](C)C2)c1O ZINC001308917670 1111493558 /nfs/dbraw/zinc/49/35/58/1111493558.db2.gz DMWWBGSVTKOPPF-OAHLLOKOSA-N 2 0 311.429 3.060 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1O ZINC000093563843 193268147 /nfs/dbraw/zinc/26/81/47/193268147.db2.gz WVRQIQYWBBXSCW-KRWDZBQOSA-N 2 0 318.461 3.241 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000093564089 193269712 /nfs/dbraw/zinc/26/97/12/193269712.db2.gz XJSUAPRBOBQQAX-QGZVFWFLSA-N 2 0 318.461 3.241 20 10 DGCDRP CC[C@@H]([NH2+]CCC[NH+](C)C)c1cc(Br)ccc1O ZINC000019958817 182169995 /nfs/dbraw/zinc/16/99/95/182169995.db2.gz HTFAQLZYKWYVDT-CYBMUJFWSA-N 2 0 315.255 3.147 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1C ZINC000270050774 432227530 /nfs/dbraw/zinc/22/75/30/432227530.db2.gz MEGZOLPRRHYGGH-KRWDZBQOSA-N 2 0 302.462 3.173 20 10 DGCDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000177974477 228336330 /nfs/dbraw/zinc/33/63/30/228336330.db2.gz JPAVXLSUMFIYAD-GPMSIDNRSA-N 2 0 301.478 3.105 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423085842 280269670 /nfs/dbraw/zinc/26/96/70/280269670.db2.gz LOUACBYTVMNRKL-RCCFBDPRSA-N 2 0 311.473 3.497 20 10 DGCDRP CCCOc1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)c(O)c1 ZINC000263685455 432566777 /nfs/dbraw/zinc/56/67/77/432566777.db2.gz NOCMJRMYHPNNTD-UHFFFAOYSA-N 2 0 318.461 3.288 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)c(O)c1 ZINC000290401519 433046897 /nfs/dbraw/zinc/04/68/97/433046897.db2.gz JJUAJSPHJCFYOK-YJBOKZPZSA-N 2 0 318.461 3.097 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)c1 ZINC000375997977 433636996 /nfs/dbraw/zinc/63/69/96/433636996.db2.gz DMXRXFHDQYWTMY-UHFFFAOYSA-N 2 0 318.461 3.099 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000293069493 433615739 /nfs/dbraw/zinc/61/57/39/433615739.db2.gz SSXHMNJVLQOKNN-UHFFFAOYSA-N 2 0 306.450 3.147 20 10 DGCDRP C[C@H](C[NH2+][C@@H](C)c1ccc(Br)cc1O)C[NH+](C)C ZINC000293714122 433837984 /nfs/dbraw/zinc/83/79/84/433837984.db2.gz PBZZJOZPAABSEJ-MNOVXSKESA-N 2 0 315.255 3.003 20 10 DGCDRP C[C@H](C[NH2+][C@H](C)c1cc(Br)ccc1O)C[NH+](C)C ZINC000293759967 433858269 /nfs/dbraw/zinc/85/82/69/433858269.db2.gz RZSGMAYRMHFULJ-GHMZBOCLSA-N 2 0 315.255 3.003 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(-n3ccnc3)nc2)c(O)c1 ZINC000363861506 434167385 /nfs/dbraw/zinc/16/73/85/434167385.db2.gz WUYTXDXSEVWMEU-CQSZACIVSA-N 2 0 308.385 3.132 20 10 DGCDRP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3O)C2)CC1 ZINC000179564206 528251599 /nfs/dbraw/zinc/25/15/99/528251599.db2.gz TZFCJAODVGYNAK-KRWDZBQOSA-N 2 0 302.462 3.336 20 10 DGCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000743387916 575048384 /nfs/dbraw/zinc/04/83/84/575048384.db2.gz PLSNRZGUKQXPAA-OAHLLOKOSA-N 2 0 313.445 3.104 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000853239253 620681066 /nfs/dbraw/zinc/68/10/66/620681066.db2.gz CVWNBAXPMOPASN-HOCLYGCPSA-N 2 0 318.461 3.173 20 10 DGCDRP COc1ccc(N2CC[C@H]([NH2+][C@@H]3C[C@H]([NH3+])c4ccccc43)C2)cc1 ZINC000854217188 620784951 /nfs/dbraw/zinc/78/49/51/620784951.db2.gz KKDCPIPQSGMKDN-PNHOKKKMSA-N 2 0 323.440 3.008 20 10 DGCDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(C)cc(OC)c1O ZINC000894383333 618299137 /nfs/dbraw/zinc/29/91/37/618299137.db2.gz GHRDJJGJBRSWOX-OAHLLOKOSA-N 2 0 308.466 3.309 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000894939893 618502204 /nfs/dbraw/zinc/50/22/04/618502204.db2.gz ORJLYBYGXOGWGT-SHFXZJCHSA-N 2 0 315.505 3.207 20 10 DGCDRP CCCC[NH+]1CCC([NH2+]Cc2ccc(N(C)C)cc2C)CC1 ZINC000840930597 618604002 /nfs/dbraw/zinc/60/40/02/618604002.db2.gz MDMGLSQLIWHDMA-UHFFFAOYSA-N 2 0 303.494 3.415 20 10 DGCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])c1O ZINC000817977872 620897482 /nfs/dbraw/zinc/89/74/82/620897482.db2.gz QWDZLAWUDXIJAQ-QWRGUYRKSA-N 2 0 315.255 3.241 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000858179553 621162172 /nfs/dbraw/zinc/16/21/72/621162172.db2.gz NWTPWPKHXGRDBL-WMZOPIPTSA-N 2 0 317.521 3.454 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C(C)(C)C)C3)cc2)CC1 ZINC000753592657 621452467 /nfs/dbraw/zinc/45/24/67/621452467.db2.gz ZMHFOYPUUBPPTC-GOSISDBHSA-N 2 0 315.505 3.306 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]CCC2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756546843 621646623 /nfs/dbraw/zinc/64/66/23/621646623.db2.gz SHIRRNZRLKLTCP-SWLSCSKDSA-N 2 0 306.425 3.401 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000122674609 622378033 /nfs/dbraw/zinc/37/80/33/622378033.db2.gz XWIRFVXHRYETCP-UHFFFAOYSA-N 2 0 301.478 3.025 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC(C[NH+](CC)CC)CC2)c(O)c1 ZINC000768301809 622449404 /nfs/dbraw/zinc/44/94/04/622449404.db2.gz BOIKIZLZIMVJQT-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP CC[NH+](CC)CC1CC[NH+](Cc2cc(OC)c(C)cc2O)CC1 ZINC000768447325 622456850 /nfs/dbraw/zinc/45/68/50/622456850.db2.gz OEVIJUBDTTVNCT-UHFFFAOYSA-N 2 0 320.477 3.263 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@H]3[C@H](CC[NH+]3C)C2)cc1C(C)C ZINC000872725336 622960882 /nfs/dbraw/zinc/96/08/82/622960882.db2.gz RSLOWICQZYQYLT-QAPCUYQASA-N 2 0 302.462 3.350 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000773753963 623067923 /nfs/dbraw/zinc/06/79/23/623067923.db2.gz NVVAZFBOMWLDBI-SFHVURJKSA-N 2 0 301.478 3.060 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)cc1 ZINC000773757072 623068426 /nfs/dbraw/zinc/06/84/26/623068426.db2.gz YIFRJURBCFGZNN-QFBILLFUSA-N 2 0 303.494 3.447 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c2c1c(F)ccc2O ZINC000873244524 623089416 /nfs/dbraw/zinc/08/94/16/623089416.db2.gz MITFFRGYQYYDCV-YRGRVCCFSA-N 2 0 306.425 3.447 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]3c3ccccc3)cc2)CC1 ZINC000775634735 623299262 /nfs/dbraw/zinc/29/92/62/623299262.db2.gz VUINDJRUAJNPIC-NRFANRHFSA-N 2 0 321.468 3.385 20 10 DGCDRP CC(C)C[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775652773 623304352 /nfs/dbraw/zinc/30/43/52/623304352.db2.gz SLCBNAQRIPZJEN-FQEVSTJZSA-N 2 0 315.505 3.449 20 10 DGCDRP CC(C)C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775653688 623304835 /nfs/dbraw/zinc/30/48/35/623304835.db2.gz MSLYUVPASZYZKL-UHFFFAOYSA-N 2 0 301.478 3.059 20 10 DGCDRP C[C@@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775999001 623362098 /nfs/dbraw/zinc/36/20/98/623362098.db2.gz UFJFFVLXGRDFAG-QGZVFWFLSA-N 2 0 301.478 3.060 20 10 DGCDRP Cc1cccc(O)c1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000877486782 623907895 /nfs/dbraw/zinc/90/78/95/623907895.db2.gz NKIUIXWPQIMGNR-GOSISDBHSA-N 2 0 310.441 3.312 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000796694288 626073899 /nfs/dbraw/zinc/07/38/99/626073899.db2.gz KZNPKPNRUFKILB-VAMGGRTRSA-N 2 0 315.505 3.495 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000796694287 626073927 /nfs/dbraw/zinc/07/39/27/626073927.db2.gz KZNPKPNRUFKILB-AQNXPRMDSA-N 2 0 315.505 3.495 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[N@H+](C)[C@H]4CCC[C@@H]43)ccc21 ZINC000796726879 626076566 /nfs/dbraw/zinc/07/65/66/626076566.db2.gz GIUFSKXTQIACGC-GGPKGHCWSA-N 2 0 313.489 3.031 20 10 DGCDRP C[N@@H+]1CC[C@H]([NH2+]CCCSc2nccs2)[C@H]2CCC[C@@H]21 ZINC000796772782 626081042 /nfs/dbraw/zinc/08/10/42/626081042.db2.gz VUMDGBSGUJPVKT-RDBSUJKOSA-N 2 0 311.520 3.088 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccsc1 ZINC000800888473 626382966 /nfs/dbraw/zinc/38/29/66/626382966.db2.gz FJAJTLWPDDDVED-HNNXBMFYSA-N 2 0 315.486 3.351 20 10 DGCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccncc1 ZINC000883290980 626638126 /nfs/dbraw/zinc/63/81/26/626638126.db2.gz OPKFPNCSYMRLOZ-HXUWFJFHSA-N 2 0 324.472 3.074 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000809703749 626939207 /nfs/dbraw/zinc/93/92/07/626939207.db2.gz PHIZOVJNBBVAOF-OAQYLSRUSA-N 2 0 322.452 3.490 20 10 DGCDRP CC[N@H+](CCC[NH+](C)C)Cc1ccc(N2CCCCC2)cc1 ZINC000809750477 626946647 /nfs/dbraw/zinc/94/66/47/626946647.db2.gz XRSWDZXOGXWSPB-UHFFFAOYSA-N 2 0 303.494 3.451 20 10 DGCDRP CC[C@@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccccc1O ZINC000810252339 626992777 /nfs/dbraw/zinc/99/27/77/626992777.db2.gz BXLOXUFBBHEHPQ-OAHLLOKOSA-N 2 0 308.491 3.260 20 10 DGCDRP CSC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC[NH+](C)CC1 ZINC000810253227 626993271 /nfs/dbraw/zinc/99/32/71/626993271.db2.gz ONNRCWCSWZFCBD-OAHLLOKOSA-N 2 0 321.534 3.231 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000815616811 627690793 /nfs/dbraw/zinc/69/07/93/627690793.db2.gz YRIGMQFORQLSJA-INIZCTEOSA-N 2 0 308.466 3.018 20 10 DGCDRP C[C@H]([NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1)c1cc(F)ccc1O ZINC000925886988 627812369 /nfs/dbraw/zinc/81/23/69/627812369.db2.gz PAKCTARGHJVIJM-IYJAJMOOSA-N 2 0 314.404 3.241 20 10 DGCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000816611918 627814334 /nfs/dbraw/zinc/81/43/34/627814334.db2.gz AJFHRZIIZQOHTK-ABAIWWIYSA-N 2 0 312.816 3.101 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]C2CCC([NH+](C)C)CC2)cc1 ZINC000817414092 627896480 /nfs/dbraw/zinc/89/64/80/627896480.db2.gz RBMJIGSJWGDKCL-WAYWQWQTSA-N 2 0 301.478 3.228 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000817894296 627954574 /nfs/dbraw/zinc/95/45/74/627954574.db2.gz LEIRYSHWIKUNEA-GUDVDZBRSA-N 2 0 301.478 3.071 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)cc1F ZINC000817903191 627957256 /nfs/dbraw/zinc/95/72/56/627957256.db2.gz JOEXHFAMTHSZCH-YOEHRIQHSA-N 2 0 307.457 3.150 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CC[NH2+]CC[C@H]3C)cc2)CC1 ZINC000817902385 627957367 /nfs/dbraw/zinc/95/73/67/627957367.db2.gz PAXUKAJZPJKRNC-YLJYHZDGSA-N 2 0 315.505 3.401 20 10 DGCDRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817941718 627968491 /nfs/dbraw/zinc/96/84/91/627968491.db2.gz VWWFBNUFXLVYRA-HNNXBMFYSA-N 2 0 319.468 3.466 20 10 DGCDRP CC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817945797 627970885 /nfs/dbraw/zinc/97/08/85/627970885.db2.gz MIFOOHYKRPMRNM-BXUZGUMPSA-N 2 0 316.367 3.451 20 10 DGCDRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Br)cc1O ZINC000817948070 627971513 /nfs/dbraw/zinc/97/15/13/627971513.db2.gz UDPDAXCNNWZWML-OIKLOGQESA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(CC[NH3+])cc2)c2c1c(F)ccc2O ZINC000817950252 627972520 /nfs/dbraw/zinc/97/25/20/627972520.db2.gz XDFSHVSVVMAAMJ-MLGOLLRUSA-N 2 0 314.404 3.371 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2c1c(F)ccc2O ZINC000817968543 627979039 /nfs/dbraw/zinc/97/90/39/627979039.db2.gz LIKUULRVQGKKFO-BDJLRTHQSA-N 2 0 312.388 3.473 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000817971196 627980338 /nfs/dbraw/zinc/98/03/38/627980338.db2.gz KKEHYUWFIWEFMY-JTDSTZFVSA-N 2 0 301.478 3.326 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c2c1c(F)ccc2O ZINC000817985091 627983655 /nfs/dbraw/zinc/98/36/55/627983655.db2.gz ABZXAGCRHJYLSG-KDBYPZKRSA-N 2 0 304.409 3.057 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000817984833 627983857 /nfs/dbraw/zinc/98/38/57/627983857.db2.gz ASAYBCAGRJAFQQ-DZJNRPSUSA-N 2 0 301.478 3.181 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1cc(Br)ccc1O ZINC000818615031 628042723 /nfs/dbraw/zinc/04/27/23/628042723.db2.gz KTMIYGRDTZEWNY-ZWKOPEQDSA-N 2 0 313.239 3.075 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2CCCC23CC[NH+](C)CC3)cc1Cl ZINC000825622059 628778514 /nfs/dbraw/zinc/77/85/14/628778514.db2.gz RZPUFWJWDAQUCF-UHFFFAOYSA-N 2 0 308.853 3.414 20 10 DGCDRP CCc1cccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c1O ZINC000827844741 628996300 /nfs/dbraw/zinc/99/63/00/628996300.db2.gz NSDPWGYBWMBTDS-UHFFFAOYSA-N 2 0 302.462 3.166 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000835025049 629827603 /nfs/dbraw/zinc/82/76/03/629827603.db2.gz GBFSXYOKKARYRF-WAYWQWQTSA-N 2 0 301.478 3.039 20 10 DGCDRP CCC[NH+]1CCC([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835043471 629833088 /nfs/dbraw/zinc/83/30/88/629833088.db2.gz UTUCITIWWRIRDA-WAYWQWQTSA-N 2 0 301.478 3.230 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)c2c1c(F)ccc2O ZINC000840811204 630361267 /nfs/dbraw/zinc/36/12/67/630361267.db2.gz ZOPXSFSWUFGXLH-IPYPFGDCSA-N 2 0 306.425 3.401 20 10 DGCDRP CCOc1ccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c(O)c1 ZINC000841029339 630398489 /nfs/dbraw/zinc/39/84/89/630398489.db2.gz PYFRVIUXORGVQG-CYBMUJFWSA-N 2 0 300.402 3.100 20 10 DGCDRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc(N)cc3)CC2)C1 ZINC000841034704 630399957 /nfs/dbraw/zinc/39/99/57/630399957.db2.gz JSPJGNAWCJJUHM-OXQOHEQNSA-N 2 0 315.505 3.444 20 10 DGCDRP CCCN(CCC)c1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000841064653 630403646 /nfs/dbraw/zinc/40/36/46/630403646.db2.gz RZOQSUQLHPACPZ-LPHOPBHVSA-N 2 0 303.494 3.401 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000843043846 630607460 /nfs/dbraw/zinc/60/74/60/630607460.db2.gz LAFKMTHOKYBONV-MRXNPFEDSA-N 2 0 308.853 3.318 20 10 DGCDRP CC[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1[NH3+] ZINC000843053696 630609105 /nfs/dbraw/zinc/60/91/05/630609105.db2.gz RERHFNABBUBCHQ-MJGOQNOKSA-N 2 0 301.478 3.236 20 10 DGCDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000843129968 630617560 /nfs/dbraw/zinc/61/75/60/630617560.db2.gz VUJTWOPRHYYCRJ-CABCVRRESA-N 2 0 314.429 3.187 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000843343145 630647773 /nfs/dbraw/zinc/64/77/73/630647773.db2.gz UEPKZARFZHGCBJ-KZNAEPCWSA-N 2 0 301.478 3.011 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CCC[NH+]2CCC(C)CC2)c1O ZINC000846136297 631211466 /nfs/dbraw/zinc/21/14/66/631211466.db2.gz IEOVVQZSPXUKFQ-OAHLLOKOSA-N 2 0 306.450 3.173 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1O ZINC000848891545 631774394 /nfs/dbraw/zinc/77/43/94/631774394.db2.gz ZYOWWLUIFSRUNE-APWZRJJASA-N 2 0 314.473 3.403 20 10 DGCDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000850034829 632034314 /nfs/dbraw/zinc/03/43/14/632034314.db2.gz REIREGXTXQZYSL-AWEZNQCLSA-N 2 0 320.477 3.130 20 10 DGCDRP CC[C@H]([NH2+][C@@H](C)CN(C)CCC[NH+](C)C)c1ccc(C)cc1O ZINC000850502174 632173408 /nfs/dbraw/zinc/17/34/08/632173408.db2.gz SIBPRNDZDBNTRD-WMZOPIPTSA-N 2 0 321.509 3.013 20 10 DGCDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185359409 660218563 /nfs/dbraw/zinc/21/85/63/660218563.db2.gz ULFLCHBTDTUFBH-AWEZNQCLSA-N 2 0 302.462 3.263 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000093604549 656363756 /nfs/dbraw/zinc/36/37/56/656363756.db2.gz CCCKEXYUPYQXJN-IBGZPJMESA-N 2 0 315.505 3.451 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]C(C)(C)CCC[NH+](C)C)c1O ZINC000387262676 685182806 /nfs/dbraw/zinc/18/28/06/685182806.db2.gz BZIUMMXUXGAEFL-UHFFFAOYSA-N 2 0 314.857 3.264 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]Cc2cccc3c2CC[NH2+]C3)cc1 ZINC001578425837 1191942838 /nfs/dbraw/zinc/94/28/38/1191942838.db2.gz PCDLTLLDFGJWLY-SNAWJCMRSA-N 2 0 321.468 3.201 20 10 DGCDRP C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001620904386 1192570450 /nfs/dbraw/zinc/57/04/50/1192570450.db2.gz BSHAVQHJACQGGG-MJGOQNOKSA-N 2 0 315.505 3.497 20 10 DGCDRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001335947483 1178974810 /nfs/dbraw/zinc/97/48/10/1178974810.db2.gz JQHLGJLFIUHASR-HXUWFJFHSA-N 2 0 315.505 3.484 20 10 DGCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001341569511 1179030398 /nfs/dbraw/zinc/03/03/98/1179030398.db2.gz PUJKOSAJJVWIOA-GOSISDBHSA-N 2 0 301.478 3.060 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC001345942724 1179627906 /nfs/dbraw/zinc/62/79/06/1179627906.db2.gz GNCFQECLVZLKFC-HXUWFJFHSA-N 2 0 313.489 3.251 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3cc(Cl)ccc3O)C[C@H]2C1 ZINC001352114253 1180298460 /nfs/dbraw/zinc/29/84/60/1180298460.db2.gz ZKNRPPKWHDEAAS-WOSRLPQWSA-N 2 0 308.853 3.208 20 10 DGCDRP CC[NH+](CC)CC[C@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001474305079 1183901445 /nfs/dbraw/zinc/90/14/45/1183901445.db2.gz FLTAULBRDRIGNG-JJEJIETFSA-N 2 0 303.494 3.476 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)cc1F ZINC001560533938 1189337598 /nfs/dbraw/zinc/33/75/98/1189337598.db2.gz IVRKFKAEPMYTOT-KRWDZBQOSA-N 2 0 321.484 3.493 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(C)cc(OC)cc2O)C[C@@H]1C ZINC001560636406 1189353225 /nfs/dbraw/zinc/35/32/25/1189353225.db2.gz FNPHRTZWYQRNFJ-LSDHHAIUSA-N 2 0 306.450 3.014 20 10 DGCDRP C[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)C[NH+]1CCCCC1 ZINC001656896036 1196080999 /nfs/dbraw/zinc/08/09/99/1196080999.db2.gz BLRWEPKXXYPJSM-JTHGQSKGSA-N 2 0 315.505 3.477 20 10 DGCDRP C[C@H](C[NH2+]Cc1ccc2c(c1)CCCO2)C[NH+]1CCCCC1 ZINC001656896988 1196081350 /nfs/dbraw/zinc/08/13/50/1196081350.db2.gz RFUUGZIOOGQHMK-MRXNPFEDSA-N 2 0 302.462 3.223 20 10 DGCDRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001657322248 1196130598 /nfs/dbraw/zinc/13/05/98/1196130598.db2.gz DXOMONJJQNCUJA-MJGOQNOKSA-N 2 0 301.478 3.249 20 10 DGCDRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001657322246 1196130685 /nfs/dbraw/zinc/13/06/85/1196130685.db2.gz DXOMONJJQNCUJA-HKUYNNGSSA-N 2 0 301.478 3.249 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccc(Cl)cc3O)C[C@H]2C1 ZINC001660892235 1196539051 /nfs/dbraw/zinc/53/90/51/1196539051.db2.gz HYPKSQGEPBRNOZ-XNRPHZJLSA-N 2 0 308.853 3.208 20 10 DGCDRP C[C@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)C[NH+]1CCCCC1 ZINC001661054801 1196559350 /nfs/dbraw/zinc/55/93/50/1196559350.db2.gz SNPBRSLYYXJVTN-OAHLLOKOSA-N 2 0 307.457 3.103 20 10 DGCDRP CC[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001204611487 1082775344 /nfs/dbraw/zinc/77/53/44/1082775344.db2.gz OJEKIBYKHJZUTD-UHFFFAOYSA-N 2 0 309.457 3.118 20 10 DGCDRP COc1cc(C[NH2+]CC[C@@H](C)[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC001203270064 1090710785 /nfs/dbraw/zinc/71/07/85/1090710785.db2.gz GNXWTZZPZMMFGF-CYBMUJFWSA-N 2 0 308.466 3.128 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc1Cl ZINC001204742994 1091027185 /nfs/dbraw/zinc/02/71/85/1091027185.db2.gz WDIFWPZJEZJJEI-UHFFFAOYSA-N 2 0 308.853 3.320 20 10 DGCDRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205015730 1091084411 /nfs/dbraw/zinc/08/44/11/1091084411.db2.gz DPMQWUGIXKRSBV-AWEZNQCLSA-N 2 0 316.445 3.008 20 10 DGCDRP C[NH2+]C[C@H]1CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001205016821 1091085087 /nfs/dbraw/zinc/08/50/87/1091085087.db2.gz KULSDXJYTQHRMD-MRXNPFEDSA-N 2 0 310.441 3.491 20 10 DGCDRP Cc1c(C[NH+]2CCN(c3cc[nH+]cc3)CC2)c2ccccc2n1C ZINC001138252337 1091126085 /nfs/dbraw/zinc/12/60/85/1091126085.db2.gz CLCUBKBCUOUPIH-UHFFFAOYSA-N 2 0 320.440 3.204 20 10 DGCDRP C[C@H]1CC[NH2+]CC[N@@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001205333315 1091189758 /nfs/dbraw/zinc/18/97/58/1091189758.db2.gz ZZHJAUXCLKGFPR-AWEZNQCLSA-N 2 0 314.404 3.382 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H]2C)c(OC)c1 ZINC001205901324 1091399922 /nfs/dbraw/zinc/39/99/22/1091399922.db2.gz CMBSGPATONBLJS-HZPDHXFCSA-N 2 0 319.493 3.101 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCC[C@@H]1C[NH3+] ZINC001205992047 1091439247 /nfs/dbraw/zinc/43/92/47/1091439247.db2.gz CYLFGVZSNZFTEO-PKOBYXMFSA-N 2 0 315.505 3.484 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@](C)(F)CC2)cc(C[NH+](C)C)c1O ZINC001139253506 1091501964 /nfs/dbraw/zinc/50/19/64/1091501964.db2.gz WHIAKSJGEQCUAJ-GOSISDBHSA-N 2 0 324.440 3.177 20 10 DGCDRP CC[C@H]1CCCC[N@@H+]1Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139258029 1091502102 /nfs/dbraw/zinc/50/21/02/1091502102.db2.gz KBCZQGOFHAOGRQ-INIZCTEOSA-N 2 0 306.450 3.227 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)c(Cl)c1 ZINC001206556861 1091668815 /nfs/dbraw/zinc/66/88/15/1091668815.db2.gz YNGBLRQXZGBTAG-KRWDZBQOSA-N 2 0 309.885 3.357 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)c2ccccc21 ZINC001206615928 1091690839 /nfs/dbraw/zinc/69/08/39/1091690839.db2.gz KLZASHPWDCYUQB-INIZCTEOSA-N 2 0 311.473 3.467 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C)[C@H]3C)cc2)CC1 ZINC001140304027 1091819812 /nfs/dbraw/zinc/81/98/12/1091819812.db2.gz FBAMUINLKJBCNZ-QZTJIDSGSA-N 2 0 315.505 3.449 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C)[C@@H]3C)cc2)CC1 ZINC001140304026 1091820569 /nfs/dbraw/zinc/82/05/69/1091820569.db2.gz FBAMUINLKJBCNZ-MSOLQXFVSA-N 2 0 315.505 3.449 20 10 DGCDRP CN1CCC[C@H]2C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116417 1092617610 /nfs/dbraw/zinc/61/76/10/1092617610.db2.gz ANFDCINLQIZNDO-WMLDXEAASA-N 2 0 302.462 3.216 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])c1O ZINC000404315968 1094253803 /nfs/dbraw/zinc/25/38/03/1094253803.db2.gz OEYNQWIIOGITND-RISCZKNCSA-N 2 0 312.841 3.004 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)cc1F ZINC001119990899 1094337867 /nfs/dbraw/zinc/33/78/67/1094337867.db2.gz YTAVELKVBXGJPE-ULQDDVLXSA-N 2 0 319.468 3.054 20 10 DGCDRP CC(C)c1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)c(O)c1 ZINC001276815568 1095141070 /nfs/dbraw/zinc/14/10/70/1095141070.db2.gz WEBOMJVBOHPCNJ-LJQANCHMSA-N 2 0 302.462 3.433 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC[N@@H+]1C ZINC000316426121 1095174004 /nfs/dbraw/zinc/17/40/04/1095174004.db2.gz BETZFULSCWCIOO-SJLPKXTDSA-N 2 0 301.478 3.249 20 10 DGCDRP Cc1c(C[N@@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)c2ccccc2n1C ZINC001222264518 1095519255 /nfs/dbraw/zinc/51/92/55/1095519255.db2.gz CYUMJGGUPHMYCN-HXUWFJFHSA-N 2 0 311.473 3.452 20 10 DGCDRP Oc1cc(C(F)(F)F)ccc1CN1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222355713 1095569706 /nfs/dbraw/zinc/56/97/06/1095569706.db2.gz UDLVMWFWAVQZBO-HNNXBMFYSA-N 2 0 314.351 3.129 20 10 DGCDRP Oc1ccc(F)c(Cl)c1C[NH+]1CCC2(CCC[NH2+]C2)CC1 ZINC001222457309 1095623312 /nfs/dbraw/zinc/62/33/12/1095623312.db2.gz ICYLDLYZLQYVJE-UHFFFAOYSA-N 2 0 312.816 3.150 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC001118242848 1095964920 /nfs/dbraw/zinc/96/49/20/1095964920.db2.gz LFADTAATQPBKKR-OALUTQOASA-N 2 0 313.489 3.108 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC001119610862 1096232415 /nfs/dbraw/zinc/23/24/15/1096232415.db2.gz IJHJXAORXUUVLL-HXUWFJFHSA-N 2 0 313.489 3.252 20 10 DGCDRP C[NH+]1C(C)(C)CC([N@@H+]2CCc3cccc(O)c3C2)CC1(C)C ZINC001171643423 1096950134 /nfs/dbraw/zinc/95/01/34/1096950134.db2.gz SMELPAHIAUTWNV-UHFFFAOYSA-N 2 0 302.462 3.402 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2CCC3(C2)CC[NH+](C)CC3)cc1Cl ZINC001231870074 1097870525 /nfs/dbraw/zinc/87/05/25/1097870525.db2.gz IDTBXLWJVSREPT-UHFFFAOYSA-N 2 0 308.853 3.272 20 10 DGCDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc(Cl)c(O)cc1O)CC2 ZINC001232263070 1097985397 /nfs/dbraw/zinc/98/53/97/1097985397.db2.gz FBYPIWBMIBXEOU-UHFFFAOYSA-N 2 0 324.852 3.059 20 10 DGCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3cccc(-c4ccccc4)c3O)C[C@@H]2C1 ZINC001234987810 1098735934 /nfs/dbraw/zinc/73/59/34/1098735934.db2.gz KJYJEYVNKYBLMQ-MJGOQNOKSA-N 2 0 322.452 3.443 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c2ccccc21 ZINC001234991331 1098736223 /nfs/dbraw/zinc/73/62/23/1098736223.db2.gz FFWLPYSGGZLZEP-NRFANRHFSA-N 2 0 323.484 3.481 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c(O)c1 ZINC001234999618 1098742607 /nfs/dbraw/zinc/74/26/07/1098742607.db2.gz NEEUDKOFLKUODX-IBGZPJMESA-N 2 0 302.462 3.265 20 10 DGCDRP CC(C)c1ccc(C[NH+]2CCC3(CC[NH2+]CC3)CC2)c(O)c1 ZINC001235132138 1098827961 /nfs/dbraw/zinc/82/79/61/1098827961.db2.gz GCLSYVQBIBOKOJ-UHFFFAOYSA-N 2 0 302.462 3.481 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001235135782 1098830613 /nfs/dbraw/zinc/83/06/13/1098830613.db2.gz QOMNUAFGTQGMEN-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP Cc1cc(C)c(C[N@@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c(O)c1 ZINC001235156189 1098841493 /nfs/dbraw/zinc/84/14/93/1098841493.db2.gz FKVROBRJFDTPRS-SFHVURJKSA-N 2 0 302.462 3.363 20 10 DGCDRP Oc1cccc(Cl)c1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235228470 1098901237 /nfs/dbraw/zinc/90/12/37/1098901237.db2.gz MUDVZOXDYRPXCW-MRXNPFEDSA-N 2 0 308.853 3.400 20 10 DGCDRP CCOc1cccc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c1O ZINC001235232195 1098905808 /nfs/dbraw/zinc/90/58/08/1098905808.db2.gz VRZJGGNMOICDHQ-KRWDZBQOSA-N 2 0 318.461 3.145 20 10 DGCDRP Oc1cc(O)c(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)cc1Cl ZINC001235241201 1098914576 /nfs/dbraw/zinc/91/45/76/1098914576.db2.gz NGVZIORBIQPGKE-OAHLLOKOSA-N 2 0 324.852 3.105 20 10 DGCDRP Cc1cccc(C[N@@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c1O ZINC001235377085 1098985904 /nfs/dbraw/zinc/98/59/04/1098985904.db2.gz OUUSBODYWIBUAI-CTNGQTDRSA-N 2 0 322.452 3.280 20 10 DGCDRP Cc1c(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@@H]3F)c2ccccc2n1C ZINC001235404184 1099001024 /nfs/dbraw/zinc/00/10/24/1099001024.db2.gz MZSIYVBRFDKHEX-OALUTQOASA-N 2 0 315.436 3.010 20 10 DGCDRP Cc1c(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@H]3F)c2ccccc2n1C ZINC001235404180 1099002254 /nfs/dbraw/zinc/00/22/54/1099002254.db2.gz MZSIYVBRFDKHEX-MOPGFXCFSA-N 2 0 315.436 3.010 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)ccc1N(C)C ZINC001235421699 1099013761 /nfs/dbraw/zinc/01/37/61/1099013761.db2.gz BXSRGNLZTFLFSK-RTBURBONSA-N 2 0 315.505 3.273 20 10 DGCDRP CCc1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235423897 1099015455 /nfs/dbraw/zinc/01/54/55/1099015455.db2.gz GYGDGBMOFCYVLX-DLBZAZTESA-N 2 0 302.462 3.166 20 10 DGCDRP CCCC[NH+](CCCC)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235834992 1099200372 /nfs/dbraw/zinc/20/03/72/1099200372.db2.gz TYJBSZCXSSRZNJ-UHFFFAOYSA-N 2 0 306.450 3.276 20 10 DGCDRP Cc1cc(C[N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)c(C)n1-c1ccccc1 ZINC001235928545 1099265401 /nfs/dbraw/zinc/26/54/01/1099265401.db2.gz AGXYRZQOCFUJAN-MJGOQNOKSA-N 2 0 309.457 3.135 20 10 DGCDRP Cc1cccc(O)c1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374634 1099559048 /nfs/dbraw/zinc/55/90/48/1099559048.db2.gz FOQJIKOFTJAARO-MRXNPFEDSA-N 2 0 302.462 3.445 20 10 DGCDRP Oc1cc(O)c(CN([C@@H]2CC[NH2+]C2)C2CCCCC2)cc1Cl ZINC001236653713 1099725141 /nfs/dbraw/zinc/72/51/41/1099725141.db2.gz MIFHTIDSIRZPHH-CQSZACIVSA-N 2 0 324.852 3.248 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC001236818136 1099804828 /nfs/dbraw/zinc/80/48/28/1099804828.db2.gz GLLCHMVSBBEHQO-DFQSSKMNSA-N 2 0 309.457 3.263 20 10 DGCDRP CCCCC[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236929257 1099880516 /nfs/dbraw/zinc/88/05/16/1099880516.db2.gz CUHUJJMUKKEMIB-UHFFFAOYSA-N 2 0 307.457 3.200 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(C)(C)CC3)c(F)c2)CC1 ZINC001236937852 1099882581 /nfs/dbraw/zinc/88/25/81/1099882581.db2.gz FXWIAYJVMIFTIM-UHFFFAOYSA-N 2 0 319.468 3.200 20 10 DGCDRP C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236931989 1099883201 /nfs/dbraw/zinc/88/32/01/1099883201.db2.gz MXEBBTLNHHXNOD-HZPDHXFCSA-N 2 0 319.468 3.340 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)c1O ZINC001237408158 1100115375 /nfs/dbraw/zinc/11/53/75/1100115375.db2.gz YYZOSOIEPIIHDK-RHSMWYFYSA-N 2 0 302.462 3.264 20 10 DGCDRP Cc1cnccc1O[C@@H]1CC[N@H+](Cc2cc(F)cc(C)c2O)C1 ZINC001238066684 1100347637 /nfs/dbraw/zinc/34/76/37/1100347637.db2.gz OGTRQPWLNAMXQY-MRXNPFEDSA-N 2 0 316.376 3.196 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)CC[C@@H]1C[NH3+] ZINC001205626299 1100722189 /nfs/dbraw/zinc/72/21/89/1100722189.db2.gz FNAUXLQFRZFSPD-ZIAGYGMSSA-N 2 0 309.885 3.213 20 10 DGCDRP C[C@@H]1C[C@H](C)[N@H+](Cc2ccc(N3CCCC3)cc2)C[C@H]1C[NH3+] ZINC001325701911 1103104657 /nfs/dbraw/zinc/10/46/57/1103104657.db2.gz CLIDHIRRIKLNHK-SOLBZPMBSA-N 2 0 301.478 3.092 20 10 DGCDRP C[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(N3CCCC3)cc2)C[C@H]1C[NH3+] ZINC001325701908 1103106017 /nfs/dbraw/zinc/10/60/17/1103106017.db2.gz CLIDHIRRIKLNHK-JFIYKMOQSA-N 2 0 301.478 3.092 20 10 DGCDRP CC[C@H](C)C[C@H](CC)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246171817 1104419184 /nfs/dbraw/zinc/41/91/84/1104419184.db2.gz DYLWRJOWJSHUPT-WMZOPIPTSA-N 2 0 303.494 3.401 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)C2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001246903133 1104728917 /nfs/dbraw/zinc/72/89/17/1104728917.db2.gz WSFKLHJVNJMUQF-UHFFFAOYSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CC[NH2+][C@@H](C(C)C)C1 ZINC001246924387 1104740586 /nfs/dbraw/zinc/74/05/86/1104740586.db2.gz MFFVBEOUGYFTRE-RBUKOAKNSA-N 2 0 303.494 3.351 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC001251730425 1105688285 /nfs/dbraw/zinc/68/82/85/1105688285.db2.gz NPCGAJLUBKDLBN-UHFFFAOYSA-N 2 0 313.489 3.393 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@@H]1CCC[NH+](C)CC1 ZINC001254524815 1106092483 /nfs/dbraw/zinc/09/24/83/1106092483.db2.gz ZWFQDNOHEQDEIG-GOSISDBHSA-N 2 0 301.478 3.203 20 10 DGCDRP CCCC(CCC)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001257328621 1106568891 /nfs/dbraw/zinc/56/88/91/1106568891.db2.gz GQWJSJVDAAWHBH-UHFFFAOYSA-N 2 0 303.494 3.497 20 10 DGCDRP CCCC[C@@H](CC)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001257411026 1106583839 /nfs/dbraw/zinc/58/38/39/1106583839.db2.gz PMVYMSNRXBDSFS-GOSISDBHSA-N 2 0 303.494 3.497 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)c1 ZINC001308569784 1111445293 /nfs/dbraw/zinc/44/52/93/1111445293.db2.gz IWOJJBHKNMLHHI-WMZOPIPTSA-N 2 0 302.462 3.432 20 10 DGCDRP CCc1cccc(C[N@@H+]2C[C@@]34C[NH+](C)C[C@]3(C2)CCCC4)c1O ZINC001308984616 1111505463 /nfs/dbraw/zinc/50/54/63/1111505463.db2.gz KVWBFDKUWNAAFF-BGYRXZFFSA-N 2 0 314.473 3.262 20 10 DGCDRP CCOc1cccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1O ZINC000236921326 202072458 /nfs/dbraw/zinc/07/24/58/202072458.db2.gz DNXPSBLLKZWCRR-UHFFFAOYSA-N 2 0 306.450 3.143 20 10 DGCDRP CCOc1cccc(C[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c1O ZINC000236926918 202075098 /nfs/dbraw/zinc/07/50/98/202075098.db2.gz RUIRVNCFWCHWHV-HNNXBMFYSA-N 2 0 306.450 3.145 20 10 DGCDRP C[C@H](Cn1ccnc1)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000273301162 130105366 /nfs/dbraw/zinc/10/53/66/130105366.db2.gz BNHIOTSIZWRLKU-MNOVXSKESA-N 2 0 324.222 3.091 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)c1 ZINC000194190358 286339154 /nfs/dbraw/zinc/33/91/54/286339154.db2.gz ACCLFSRANQPSLA-GJZGRUSLSA-N 2 0 306.450 3.173 20 10 DGCDRP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(N(C)C)cc1 ZINC000269013672 432150802 /nfs/dbraw/zinc/15/08/02/432150802.db2.gz ODMCAZKFAUPANT-OAHLLOKOSA-N 2 0 301.478 3.420 20 10 DGCDRP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000292796231 277160695 /nfs/dbraw/zinc/16/06/95/277160695.db2.gz MZYKIQVCPIWSRG-HXUWFJFHSA-N 2 0 313.489 3.205 20 10 DGCDRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1O ZINC000183428215 432293167 /nfs/dbraw/zinc/29/31/67/432293167.db2.gz JEXOARGVIMXXMW-OAHLLOKOSA-N 2 0 314.429 3.183 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1O ZINC000278823408 432904640 /nfs/dbraw/zinc/90/46/40/432904640.db2.gz ZPUMHUXBRQBKHR-UHFFFAOYSA-N 2 0 324.852 3.018 20 10 DGCDRP CCCOc1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(O)c1 ZINC000289709708 432972675 /nfs/dbraw/zinc/97/26/75/432972675.db2.gz OXBAWVWIRRZDJT-SJPCQFCGSA-N 2 0 318.461 3.238 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)c1O ZINC000366951250 434532083 /nfs/dbraw/zinc/53/20/83/434532083.db2.gz IORJFEINDLJRTE-UHFFFAOYSA-N 2 0 318.461 3.099 20 10 DGCDRP C[C@H](C[NH2+][C@@H](C)c1cc(Br)ccc1O)C[NH+](C)C ZINC000293759969 298778997 /nfs/dbraw/zinc/77/89/97/298778997.db2.gz RZSGMAYRMHFULJ-MNOVXSKESA-N 2 0 315.255 3.003 20 10 DGCDRP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(N(C)C)cc1 ZINC000363792857 332248716 /nfs/dbraw/zinc/24/87/16/332248716.db2.gz OROXUJWLBWYLLU-UHOSZYNNSA-N 2 0 301.478 3.420 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000853239252 620680926 /nfs/dbraw/zinc/68/09/26/620680926.db2.gz CVWNBAXPMOPASN-GOEBONIOSA-N 2 0 318.461 3.173 20 10 DGCDRP COc1ccc(C[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1C ZINC000915678506 620593633 /nfs/dbraw/zinc/59/36/33/620593633.db2.gz PNGGMZQCIGMONF-HOTGVXAUSA-N 2 0 304.478 3.461 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000858179552 621161964 /nfs/dbraw/zinc/16/19/64/621161964.db2.gz NWTPWPKHXGRDBL-SJLPKXTDSA-N 2 0 317.521 3.454 20 10 DGCDRP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000858245035 621167900 /nfs/dbraw/zinc/16/79/00/621167900.db2.gz BADONDJGYYXMJF-NSHDSACASA-N 2 0 300.805 3.006 20 10 DGCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c1 ZINC000754735776 621529474 /nfs/dbraw/zinc/52/94/74/621529474.db2.gz BJVSNLFNXFONRT-QGZVFWFLSA-N 2 0 302.462 3.173 20 10 DGCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c1 ZINC000754735773 621529498 /nfs/dbraw/zinc/52/94/98/621529498.db2.gz BJVSNLFNXFONRT-KRWDZBQOSA-N 2 0 302.462 3.173 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000757640488 621730628 /nfs/dbraw/zinc/73/06/28/621730628.db2.gz XEZKOFIBLNMOGC-OCCSQVGLSA-N 2 0 306.425 3.401 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000763607977 622154853 /nfs/dbraw/zinc/15/48/53/622154853.db2.gz VDCZXCLNLPSWGR-SFHVURJKSA-N 2 0 303.494 3.449 20 10 DGCDRP C[NH+](C)CCCC1CC[NH+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000766382894 622325661 /nfs/dbraw/zinc/32/56/61/622325661.db2.gz SBAOWKNSIBBJOE-UHFFFAOYSA-N 2 0 316.489 3.435 20 10 DGCDRP CCOc1ccc(O)c(C[NH+]2CCC(C[NH+](CC)CC)CC2)c1 ZINC000768303331 622449386 /nfs/dbraw/zinc/44/93/86/622449386.db2.gz LZOLCESGEPXFDW-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000768467069 622458798 /nfs/dbraw/zinc/45/87/98/622458798.db2.gz WYQSJCPGWJGSBB-HNNXBMFYSA-N 2 0 302.462 3.045 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c(O)c1 ZINC000768925261 622485645 /nfs/dbraw/zinc/48/56/45/622485645.db2.gz AQXNTLCFCLKKOI-UHFFFAOYSA-N 2 0 320.477 3.343 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)o1 ZINC000771824182 622799622 /nfs/dbraw/zinc/79/96/22/622799622.db2.gz TZZJMHCGFRJPEH-INIZCTEOSA-N 2 0 313.445 3.191 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(c4ccccc4)CC3)cc2)CC1 ZINC000771848361 622803939 /nfs/dbraw/zinc/80/39/39/622803939.db2.gz QHIUWPGNRLWKPU-UHFFFAOYSA-N 2 0 321.468 3.217 20 10 DGCDRP CCOc1ccc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)c(O)c1 ZINC000873232794 623085663 /nfs/dbraw/zinc/08/56/63/623085663.db2.gz MOWIHFRNSGWSTQ-GOSISDBHSA-N 2 0 318.461 3.193 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(N2CCCCCC2)cc1 ZINC000873257425 623093957 /nfs/dbraw/zinc/09/39/57/623093957.db2.gz HGFRNBMXBSEUNO-JFIYKMOQSA-N 2 0 301.478 3.455 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]4CCC[C@@H]43)cc2)CC1 ZINC000775660244 623307121 /nfs/dbraw/zinc/30/71/21/623307121.db2.gz BAGCJBDZDROWFW-QUCCMNQESA-N 2 0 313.489 3.203 20 10 DGCDRP Cc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(O)c1 ZINC000877190150 623822656 /nfs/dbraw/zinc/82/26/56/623822656.db2.gz XIOSAQSYPRZERD-WBVHZDCISA-N 2 0 302.462 3.443 20 10 DGCDRP C[C@@H]([NH2+]Cc1cc(F)cc(F)c1[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000883085166 625921533 /nfs/dbraw/zinc/92/15/33/625921533.db2.gz KGOKKKSHFVCPSP-CHWSQXEVSA-N 2 0 324.415 3.413 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[N@H+](C)[C@H]4CCC[C@H]43)ccc21 ZINC000796726885 626076601 /nfs/dbraw/zinc/07/66/01/626076601.db2.gz GIUFSKXTQIACGC-NSHGMRRFSA-N 2 0 313.489 3.031 20 10 DGCDRP Cc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)s1 ZINC000883284054 626636427 /nfs/dbraw/zinc/63/64/27/626636427.db2.gz CTLLMOGIPFYOJC-UHFFFAOYSA-N 2 0 315.486 3.098 20 10 DGCDRP CC[C@H]1CC[C@H](C)[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809768607 626950503 /nfs/dbraw/zinc/95/05/03/626950503.db2.gz QCIQLRMUEAZOCL-WMZOPIPTSA-N 2 0 301.478 3.201 20 10 DGCDRP CC[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000814299889 627557765 /nfs/dbraw/zinc/55/77/65/627557765.db2.gz DWVXWPBKJYRESC-UAPYVXQJSA-N 2 0 315.505 3.497 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C2CCCC2)cc1 ZINC000925512035 627744951 /nfs/dbraw/zinc/74/49/51/627744951.db2.gz YQVYUAMUFUTSMA-RBUKOAKNSA-N 2 0 301.478 3.011 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cc(Cl)ccc1O ZINC000925777875 627794022 /nfs/dbraw/zinc/79/40/22/627794022.db2.gz RGYSPTAYRLMUKL-ZWNOBZJWSA-N 2 0 318.795 3.331 20 10 DGCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc4ccccc4c3O)CC[C@@H]21 ZINC000816521238 627801138 /nfs/dbraw/zinc/80/11/38/627801138.db2.gz KLUPJGIADMOLFN-LPHOPBHVSA-N 2 0 310.441 3.462 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)C1C[NH2+]C1 ZINC000817932733 627966077 /nfs/dbraw/zinc/96/60/77/627966077.db2.gz XKSUHXQOGNIFPY-ZIAGYGMSSA-N 2 0 321.896 3.274 20 10 DGCDRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(N2CCCCC2)cc1 ZINC000817941297 627968482 /nfs/dbraw/zinc/96/84/82/627968482.db2.gz RPGUEVZOFGBRNC-MRXNPFEDSA-N 2 0 301.478 3.327 20 10 DGCDRP CC[NH2+]CCC[NH2+][C@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000817943383 627970079 /nfs/dbraw/zinc/97/00/79/627970079.db2.gz MJBDORJLRXMUNA-CYBMUJFWSA-N 2 0 304.356 3.451 20 10 DGCDRP CC(C)[NH2+]CCC[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817954157 627973233 /nfs/dbraw/zinc/97/32/33/627973233.db2.gz VLGLAGBZNOOHSW-NSHDSACASA-N 2 0 315.255 3.193 20 10 DGCDRP CC[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817955401 627973894 /nfs/dbraw/zinc/97/38/94/627973894.db2.gz XPOFPIHWZMRAGO-BXUZGUMPSA-N 2 0 316.367 3.451 20 10 DGCDRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cc(Br)ccc1O ZINC000817969932 627978650 /nfs/dbraw/zinc/97/86/50/627978650.db2.gz IIRDXIYOESZZKS-DLOVCJGASA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cc(Br)ccc1O ZINC000817969934 627979054 /nfs/dbraw/zinc/97/90/54/627979054.db2.gz IIRDXIYOESZZKS-WCQGTBRESA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc2c(cc1O)CCCC2 ZINC000817979530 627981655 /nfs/dbraw/zinc/98/16/55/627981655.db2.gz BQRGSTYEFBBFFS-RHSMWYFYSA-N 2 0 302.462 3.454 20 10 DGCDRP C[C@@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(N2CCCCC2)cc1 ZINC000817983648 627983287 /nfs/dbraw/zinc/98/32/87/627983287.db2.gz HIAGZEWEUSQQFH-MRXNPFEDSA-N 2 0 301.478 3.470 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(N(C)C)cc1 ZINC000817985205 627983525 /nfs/dbraw/zinc/98/35/25/627983525.db2.gz HCAZQOXKPRKMNF-FAJBIJEISA-N 2 0 301.478 3.181 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cc(Cl)ccc1O ZINC000817985297 627983678 /nfs/dbraw/zinc/98/36/78/627983678.db2.gz BYIGQUJTXMWZDJ-NCZKRNLISA-N 2 0 308.853 3.474 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000835043666 629833780 /nfs/dbraw/zinc/83/37/80/629833780.db2.gz BAMXOSZWFXAHGO-AATRIKPKSA-N 2 0 301.478 3.087 20 10 DGCDRP CN(C)c1ccc(/C=C/CN2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000835049255 629835701 /nfs/dbraw/zinc/83/57/01/629835701.db2.gz PIUQKFIJCGGTAM-FZMUQLTDSA-N 2 0 301.478 3.182 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000840891149 630373162 /nfs/dbraw/zinc/37/31/62/630373162.db2.gz GRAYEKYDRQMHJW-QGZVFWFLSA-N 2 0 317.521 3.454 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000840916230 630378299 /nfs/dbraw/zinc/37/82/99/630378299.db2.gz HZNZKGKOIQEKBD-GOSISDBHSA-N 2 0 315.505 3.225 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000841088741 630406606 /nfs/dbraw/zinc/40/66/06/630406606.db2.gz AUHKVHQUVGBFBJ-SFHVURJKSA-N 2 0 313.489 3.441 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)c1O ZINC000843046035 630608243 /nfs/dbraw/zinc/60/82/43/630608243.db2.gz SVEAFAOLWJJPQA-CZUORRHYSA-N 2 0 308.853 3.318 20 10 DGCDRP C[NH2+]CCC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000843057122 630609649 /nfs/dbraw/zinc/60/96/49/630609649.db2.gz CFJVWQDSNAYCOC-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC000843058029 630609848 /nfs/dbraw/zinc/60/98/48/630609848.db2.gz LMVDYHYGRKWAIU-YZGWKJHDSA-N 2 0 313.489 3.236 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2CCC([NH3+])CC2)c(C(F)(F)F)c1 ZINC000843104242 630614175 /nfs/dbraw/zinc/61/41/75/630614175.db2.gz INFFHUAGBRLVGR-UHFFFAOYSA-N 2 0 315.383 3.131 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c1O ZINC000843125244 630616645 /nfs/dbraw/zinc/61/66/45/630616645.db2.gz OXOOBJMCVOLCEY-UONOGXRCSA-N 2 0 308.853 3.176 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1O ZINC000843127252 630616959 /nfs/dbraw/zinc/61/69/59/630616959.db2.gz PBTIIIGFNADPBC-HZPDHXFCSA-N 2 0 318.461 3.003 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CCC2CC[NH2+]CC2)cc1 ZINC000844221088 630712724 /nfs/dbraw/zinc/71/27/24/630712724.db2.gz UCMOCUWDRNEZFE-UHFFFAOYSA-N 2 0 303.494 3.354 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2[O-])[C@@H]1CC[NH3+] ZINC000844902102 630970555 /nfs/dbraw/zinc/97/05/55/630970555.db2.gz NKKKRONGSYQLHW-QMTHXVAHSA-N 2 0 300.805 3.134 20 10 DGCDRP C[NH2+]Cc1ccccc1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000844904292 630973294 /nfs/dbraw/zinc/97/32/94/630973294.db2.gz GXUIZYUBGSVJRL-VOTSOKGWSA-N 2 0 309.457 3.275 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000844907812 630975778 /nfs/dbraw/zinc/97/57/78/630975778.db2.gz OBTAAQWFUYEWGP-ONEGZZNKSA-N 2 0 313.420 3.153 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c1O ZINC000846138715 631211455 /nfs/dbraw/zinc/21/14/55/631211455.db2.gz MXRDPCZAXAORPH-CQSZACIVSA-N 2 0 314.429 3.313 20 10 DGCDRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cccc(OC)c2O)CC1 ZINC000846143666 631211767 /nfs/dbraw/zinc/21/17/67/631211767.db2.gz FOGBYJSMHAWNPU-CQSZACIVSA-N 2 0 306.450 3.173 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)c1O ZINC000846166099 631212970 /nfs/dbraw/zinc/21/29/70/631212970.db2.gz SENLVUPPUOGSDF-LSDHHAIUSA-N 2 0 306.450 3.316 20 10 DGCDRP CCc1cccc(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c1O ZINC000848896660 631777600 /nfs/dbraw/zinc/77/76/00/631777600.db2.gz GHJXPKGPMHNWAA-UHFFFAOYSA-N 2 0 316.420 3.445 20 10 DGCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000849350836 631901611 /nfs/dbraw/zinc/90/16/11/631901611.db2.gz YAUWGDOERRGRPQ-CQSZACIVSA-N 2 0 308.853 3.257 20 10 DGCDRP COc1cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000850339313 632118506 /nfs/dbraw/zinc/11/85/06/632118506.db2.gz PNEVNCNUBBLTID-OTVXOJSOSA-N 2 0 320.477 3.128 20 10 DGCDRP CCC[NH+]1CCC([NH2+]Cc2cc(Cl)cc(OC)c2O)CC1 ZINC000228677140 658001807 /nfs/dbraw/zinc/00/18/07/658001807.db2.gz YONQFIVQPUXYRQ-UHFFFAOYSA-N 2 0 312.841 3.018 20 10 DGCDRP CC[C@@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157714756 659094081 /nfs/dbraw/zinc/09/40/81/659094081.db2.gz XFGLFFUEDXRNIC-IEBWSBKVSA-N 2 0 301.478 3.278 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH2+]C1CCCCCCC1 ZINC000084846350 1176170214 /nfs/dbraw/zinc/17/02/14/1176170214.db2.gz CMUPVBBXTHOYFH-UHFFFAOYSA-N 2 0 301.478 3.299 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@@H]2C1 ZINC001333893543 1178691736 /nfs/dbraw/zinc/69/17/36/1178691736.db2.gz YXQHTUTXEIEHOA-NSHGMRRFSA-N 2 0 315.505 3.223 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3cc4c(cc3O)CCC4)C[C@H]2C1 ZINC001334723857 1178786568 /nfs/dbraw/zinc/78/65/68/1178786568.db2.gz HSICFGCSBPCZPY-ZHALLVOQSA-N 2 0 314.473 3.043 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]3C3CCC3)cc2)CC1 ZINC001560985792 1189415100 /nfs/dbraw/zinc/41/51/00/1189415100.db2.gz LPORJOHKFAEXIH-VQTJNVASSA-N 2 0 313.489 3.107 20 10 DGCDRP CCC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)CCC[NH+](C)C ZINC001621314027 1193829738 /nfs/dbraw/zinc/82/97/38/1193829738.db2.gz STZIYJBCRRZYQA-CLFYSBASSA-N 2 0 303.494 3.430 20 10 DGCDRP C[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)C[NH+]1CCCCC1 ZINC001656896037 1196081341 /nfs/dbraw/zinc/08/13/41/1196081341.db2.gz BLRWEPKXXYPJSM-LKGOPFMKSA-N 2 0 315.505 3.477 20 10 DGCDRP COc1cc(C)c(C[NH+]2CCC(CCC[NH+](C)C)CC2)c(O)c1 ZINC001657323432 1196130174 /nfs/dbraw/zinc/13/01/74/1196130174.db2.gz GAMHWGUHZZXTIF-UHFFFAOYSA-N 2 0 320.477 3.263 20 10 DGCDRP Cc1ccc(C[NH+]2C[C@@]34C[N@@H+](C)C[C@]3(C2)CCCC4)c(O)c1 ZINC001665936734 1197218110 /nfs/dbraw/zinc/21/81/10/1197218110.db2.gz FCSXAEWCSLSTLD-KDURUIRLSA-N 2 0 300.446 3.008 20 10 DGCDRP COc1ccc(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c(O)c1 ZINC001203630796 1084565683 /nfs/dbraw/zinc/56/56/83/1084565683.db2.gz VNLDBCBVAQSCRN-KRWDZBQOSA-N 2 0 318.461 3.241 20 10 DGCDRP COc1cccc(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c1O ZINC001203596008 1090764256 /nfs/dbraw/zinc/76/42/56/1090764256.db2.gz YIUOVXJAWOMHQY-KRWDZBQOSA-N 2 0 318.461 3.241 20 10 DGCDRP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001203935323 1090843149 /nfs/dbraw/zinc/84/31/49/1090843149.db2.gz DKRWVLLEISQAAR-UHFFFAOYSA-N 2 0 303.494 3.449 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C[C@@H]1C[NH3+] ZINC001205319349 1091183554 /nfs/dbraw/zinc/18/35/54/1091183554.db2.gz ZGMARCAKMSEVSN-QAPCUYQASA-N 2 0 310.441 3.476 20 10 DGCDRP CC(C)c1ccc(O)c(C[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)c1 ZINC001205406666 1091214533 /nfs/dbraw/zinc/21/45/33/1091214533.db2.gz SNIQTLFKVKRRNM-MRXNPFEDSA-N 2 0 320.477 3.106 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c(Cl)c1 ZINC001205570001 1091257943 /nfs/dbraw/zinc/25/79/43/1091257943.db2.gz CEUIHEJUJZKPOB-MRXNPFEDSA-N 2 0 313.848 3.059 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c1O ZINC001205571600 1091259703 /nfs/dbraw/zinc/25/97/03/1091259703.db2.gz VVPQUQBRJRFYEV-GOSISDBHSA-N 2 0 308.441 3.343 20 10 DGCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001205581360 1091264260 /nfs/dbraw/zinc/26/42/60/1091264260.db2.gz SSURKYSXDIJREW-CQSZACIVSA-N 2 0 320.330 3.064 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)cc(C[NH+](C)C)c1O ZINC001139258053 1091502853 /nfs/dbraw/zinc/50/28/53/1091502853.db2.gz KVIFUGSSTRYAFP-RDJZCZTQSA-N 2 0 318.461 3.227 20 10 DGCDRP CCC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](C)CC ZINC001139404561 1091550453 /nfs/dbraw/zinc/55/04/53/1091550453.db2.gz OPNLBKKIANDYRN-KRWDZBQOSA-N 2 0 303.494 3.449 20 10 DGCDRP CC(C)C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139412102 1091552052 /nfs/dbraw/zinc/55/20/52/1091552052.db2.gz DYKKMXKHNIBJIR-UHFFFAOYSA-N 2 0 315.505 3.306 20 10 DGCDRP C[C@@H]1C[NH2+]CCN(Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001206286778 1091564120 /nfs/dbraw/zinc/56/41/20/1091564120.db2.gz URMKUOKWVCWPCK-GFCCVEGCSA-N 2 0 310.869 3.384 20 10 DGCDRP COc1ccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)c([O-])c1Cl ZINC001206327463 1091581515 /nfs/dbraw/zinc/58/15/15/1091581515.db2.gz WRKOMLUZJWSVMK-MRXNPFEDSA-N 2 0 312.841 3.005 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)c(Cl)c1 ZINC001206556862 1091668798 /nfs/dbraw/zinc/66/87/98/1091668798.db2.gz YNGBLRQXZGBTAG-QGZVFWFLSA-N 2 0 309.885 3.357 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@@H+]3C[C@@H](C[NH3+])CC[C@@H]3C)c2c1 ZINC001206805713 1091748081 /nfs/dbraw/zinc/74/80/81/1091748081.db2.gz CRQVZALISDXYQH-UONOGXRCSA-N 2 0 314.429 3.113 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC001140300068 1091819119 /nfs/dbraw/zinc/81/91/19/1091819119.db2.gz LKYNVJOTIUDBDS-UHFFFAOYSA-N 2 0 301.478 3.205 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C)C[C@H]3C)cc2)CC1 ZINC001140303833 1091820472 /nfs/dbraw/zinc/82/04/72/1091820472.db2.gz BKPBKGOCKRYNQJ-ZWKOTPCHSA-N 2 0 315.505 3.449 20 10 DGCDRP CC[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140305551 1091820958 /nfs/dbraw/zinc/82/09/58/1091820958.db2.gz BWABOIUBRZYYBJ-SFHVURJKSA-N 2 0 315.505 3.451 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CCC[C@]3(CCC[NH+](C)C3)C2)c(O)c1 ZINC001276806129 1094992442 /nfs/dbraw/zinc/99/24/42/1094992442.db2.gz HFDBVPVOCJCUMA-IBGZPJMESA-N 2 0 318.461 3.017 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001337785086 1095094555 /nfs/dbraw/zinc/09/45/55/1095094555.db2.gz JMAYVYPTIRABPG-BZUAXINKSA-N 2 0 320.477 3.195 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@@]3(CCC[NH+](C)C3)C2)c(O)c1 ZINC001276814242 1095111900 /nfs/dbraw/zinc/11/19/00/1095111900.db2.gz FOZOZQONDAWVGO-LJQANCHMSA-N 2 0 318.461 3.099 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@@]23CCC[NH2+]CC3)ccc1N(C)C ZINC001222314798 1095545366 /nfs/dbraw/zinc/54/53/66/1095545366.db2.gz IOGUWEQPFVZEQY-LJQANCHMSA-N 2 0 301.478 3.169 20 10 DGCDRP C[N@@H+]1CCC2(C1)CC[NH+](Cc1c(O)ccc(F)c1Cl)CC2 ZINC001276837119 1095749879 /nfs/dbraw/zinc/74/98/79/1095749879.db2.gz GGWHXBHAUMLJHG-UHFFFAOYSA-N 2 0 312.816 3.102 20 10 DGCDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001117956110 1095910391 /nfs/dbraw/zinc/91/03/91/1095910391.db2.gz MYBVIGXNKZMVEQ-QAQDUYKDSA-N 2 0 301.478 3.142 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)c1O ZINC001206317074 1098709646 /nfs/dbraw/zinc/70/96/46/1098709646.db2.gz CGVDMQHPKPNXFI-INIZCTEOSA-N 2 0 312.841 3.005 20 10 DGCDRP C[N@H+]1C[C@@H]2C[NH+](Cc3cccc(-c4ccccc4)c3O)C[C@@H]2C1 ZINC001234996682 1098739978 /nfs/dbraw/zinc/73/99/78/1098739978.db2.gz MFXCUZHYVNVVRX-HDICACEKSA-N 2 0 308.425 3.053 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)c2ccccc21 ZINC001235030038 1098759110 /nfs/dbraw/zinc/75/91/10/1098759110.db2.gz DUJLPLOUITYHMP-FQEVSTJZSA-N 2 0 309.457 3.091 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCC[C@]4(CCC[NH2+]4)CC3)ccc21 ZINC001235042336 1098769807 /nfs/dbraw/zinc/76/98/07/1098769807.db2.gz ALQVYVFNNMYFMR-HXUWFJFHSA-N 2 0 313.489 3.177 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)c2ccccc21 ZINC001235091968 1098795085 /nfs/dbraw/zinc/79/50/85/1098795085.db2.gz GOWZUKDGOBPHNA-UHFFFAOYSA-N 2 0 323.484 3.481 20 10 DGCDRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001206326978 1098805395 /nfs/dbraw/zinc/80/53/95/1098805395.db2.gz RBUIFZKFOFOFJA-OAHLLOKOSA-N 2 0 300.805 3.136 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCCCC23CC[NH2+]CC3)cc1Cl ZINC001235190554 1098868116 /nfs/dbraw/zinc/86/81/16/1098868116.db2.gz VTFVJXHCPYRZRH-UHFFFAOYSA-N 2 0 308.853 3.462 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c(O)c1 ZINC001235238668 1098912032 /nfs/dbraw/zinc/91/20/32/1098912032.db2.gz GKGUZEYVHWZNFQ-GOSISDBHSA-N 2 0 302.462 3.363 20 10 DGCDRP Cc1cccc(C[N@@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c1O ZINC001235251506 1098925172 /nfs/dbraw/zinc/92/51/72/1098925172.db2.gz UEGXAPBJUONHOB-TZIWHRDSSA-N 2 0 322.452 3.422 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1CCC[C@]12C[NH2+]C[C@@H]2c1ccccc1 ZINC001235255004 1098927163 /nfs/dbraw/zinc/92/71/63/1098927163.db2.gz TUJSFBQUTHLNKQ-TZIWHRDSSA-N 2 0 322.452 3.422 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c2ccccc21 ZINC001235270907 1098940526 /nfs/dbraw/zinc/94/05/26/1098940526.db2.gz NTBUSHNVBBLLEZ-VQIMIIECSA-N 2 0 309.457 3.090 20 10 DGCDRP CC(C)(C)c1cc(O)c(C[N@@H+]2CC[C@@H](C3C[NH2+]C3)C2)cc1Cl ZINC001235340812 1098964286 /nfs/dbraw/zinc/96/42/86/1098964286.db2.gz MNNHSWGFNXRZQY-GFCCVEGCSA-N 2 0 322.880 3.384 20 10 DGCDRP Cc1ccc(C)c(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1O ZINC001235428673 1099023195 /nfs/dbraw/zinc/02/31/95/1099023195.db2.gz OSGWSZSAGPOJDG-SJORKVTESA-N 2 0 302.462 3.221 20 10 DGCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@H]1c1ccccc1)C[NH2+]CCO2 ZINC001235675256 1099118853 /nfs/dbraw/zinc/11/88/53/1099118853.db2.gz SYQHCFJLXYMQTF-SFHVURJKSA-N 2 0 324.424 3.211 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC(C3CC[NH2+]CC3)CC2)c(O)c1 ZINC001235701398 1099135739 /nfs/dbraw/zinc/13/57/39/1099135739.db2.gz AWGSIABBAMDLLH-UHFFFAOYSA-N 2 0 318.461 3.003 20 10 DGCDRP COc1ccc2c(c1)c1c(n2C)CC[N@@H+](CCCCCC[NH3+])C1 ZINC001235839128 1099203243 /nfs/dbraw/zinc/20/32/43/1099203243.db2.gz KIVRRBNGVLAWMN-UHFFFAOYSA-N 2 0 315.461 3.064 20 10 DGCDRP Cc1ccc(O)c(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236375390 1099564189 /nfs/dbraw/zinc/56/41/89/1099564189.db2.gz JVENNAACJIZAFK-INIZCTEOSA-N 2 0 302.462 3.445 20 10 DGCDRP CC[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236933928 1099882786 /nfs/dbraw/zinc/88/27/86/1099882786.db2.gz AXKDKRHIGYWXGV-QGZVFWFLSA-N 2 0 319.468 3.342 20 10 DGCDRP C[C@@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236932424 1099883094 /nfs/dbraw/zinc/88/30/94/1099883094.db2.gz OPSSRIRJWITXHX-MRXNPFEDSA-N 2 0 319.468 3.200 20 10 DGCDRP Cc1cccc(O)c1C[NH+]1CCC(CC2CC[NH2+]CC2)CC1 ZINC001236963186 1099894507 /nfs/dbraw/zinc/89/45/07/1099894507.db2.gz VMBBZMBEZPHFSH-UHFFFAOYSA-N 2 0 302.462 3.302 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CC[C@H]3[NH3+])CC2)cc1 ZINC001237355922 1100093355 /nfs/dbraw/zinc/09/33/55/1100093355.db2.gz FEZRQEVSOVFXEZ-GOSISDBHSA-N 2 0 301.478 3.236 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201947407 1102767296 /nfs/dbraw/zinc/76/72/96/1102767296.db2.gz XUVGCJNACXVNIA-YJBOKZPZSA-N 2 0 314.473 3.364 20 10 DGCDRP Cc1ccc(C[C@@H](C)[NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001246171803 1104419190 /nfs/dbraw/zinc/41/91/90/1104419190.db2.gz DXQHAVWEGMOQDO-GOSISDBHSA-N 2 0 323.484 3.125 20 10 DGCDRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1C ZINC001246174308 1104420911 /nfs/dbraw/zinc/42/09/11/1104420911.db2.gz OHAKAKMESFOLER-RYRKJORJSA-N 2 0 301.478 3.011 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246311605 1104483778 /nfs/dbraw/zinc/48/37/78/1104483778.db2.gz QDBGZKZUKCHNON-QGZVFWFLSA-N 2 0 301.478 3.297 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@@H]2CC[NH2+][C@H](C(C)(C)C)C2)cc1 ZINC001246901875 1104728594 /nfs/dbraw/zinc/72/85/94/1104728594.db2.gz PMJIIQJEUOCMFD-MSOLQXFVSA-N 2 0 303.494 3.351 20 10 DGCDRP CCCC[C@H]1C[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)CC[NH2+]1 ZINC001246902305 1104728766 /nfs/dbraw/zinc/72/87/66/1104728766.db2.gz RBNMWMLQLUHKLB-PKOBYXMFSA-N 2 0 303.494 3.495 20 10 DGCDRP CC[C@@H]1CC([N@H+](C)Cc2ccc(N(C)C)cc2)C[C@@H](CC)[NH2+]1 ZINC001246901097 1104729131 /nfs/dbraw/zinc/72/91/31/1104729131.db2.gz KMARENHPUWCUSS-IAGOWNOFSA-N 2 0 303.494 3.494 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@]3(CCC[NH+](C)C3)C2)cc1 ZINC001275833253 1104925855 /nfs/dbraw/zinc/92/58/55/1104925855.db2.gz DXJJRBAKUMSLCC-IBGZPJMESA-N 2 0 301.478 3.060 20 10 DGCDRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001275959463 1104968523 /nfs/dbraw/zinc/96/85/23/1104968523.db2.gz AZNVQLDQUAIGFZ-FQEVSTJZSA-N 2 0 313.489 3.205 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC[C@@]3(CCC[N@@H+](C)C3)C2)c1O ZINC001275965332 1104969995 /nfs/dbraw/zinc/96/99/95/1104969995.db2.gz BIULXYLBPXVHPC-LJQANCHMSA-N 2 0 302.462 3.317 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC(C)(C)C3)cc2)CC1 ZINC001258273047 1106705676 /nfs/dbraw/zinc/70/56/76/1106705676.db2.gz GYGMUMFYLHEJRV-SFHVURJKSA-N 2 0 315.505 3.497 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC(C)(C)C3)cc2)CC1 ZINC001324394804 1108273730 /nfs/dbraw/zinc/27/37/30/1108273730.db2.gz HIKXYORLHFCZBM-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP CCc1cccc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@@H](C)C2)c1O ZINC001308917669 1111493286 /nfs/dbraw/zinc/49/32/86/1111493286.db2.gz DMWWBGSVTKOPPF-HNNXBMFYSA-N 2 0 311.429 3.060 20 10 DGCDRP CCCOc1ccc(C[NH2+]C[C@@H]2C[NH+]3CCC2CC3)cc1C ZINC001308965024 1111501662 /nfs/dbraw/zinc/50/16/62/1111501662.db2.gz BJFFNCKPHNEHSQ-GOSISDBHSA-N 2 0 302.462 3.215 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CCC)C2)c(O)c1 ZINC000093742339 431917074 /nfs/dbraw/zinc/91/70/74/431917074.db2.gz BQSPBLJIZBMYDX-INIZCTEOSA-N 2 0 320.477 3.345 20 10 DGCDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)c2ccccc2O)[C@H](C)C1 ZINC000183515060 432298749 /nfs/dbraw/zinc/29/87/49/432298749.db2.gz KVLBRBOPCKJWIC-SOLBZPMBSA-N 2 0 320.477 3.180 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccccc1O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272183385 432457358 /nfs/dbraw/zinc/45/73/58/432457358.db2.gz KNSVTZPQIHCRBO-VQIMIIECSA-N 2 0 310.441 3.392 20 10 DGCDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000263674598 432565238 /nfs/dbraw/zinc/56/52/38/432565238.db2.gz KSDMMNFNQWPBTP-INIZCTEOSA-N 2 0 310.441 3.491 20 10 DGCDRP Cc1nccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000178698590 432768707 /nfs/dbraw/zinc/76/87/07/432768707.db2.gz LPAXRYYTNDUZHG-CABCVRRESA-N 2 0 300.450 3.244 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)c1 ZINC000276592019 432821004 /nfs/dbraw/zinc/82/10/04/432821004.db2.gz AAKJWZJORPYEEL-CQSZACIVSA-N 2 0 306.450 3.173 20 10 DGCDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000296954268 432942197 /nfs/dbraw/zinc/94/21/97/432942197.db2.gz QWOXWCUVQFUNJB-WBVHZDCISA-N 2 0 302.462 3.337 20 10 DGCDRP CCOc1cccc(C[NH2+]CCCCC[NH+]2CCCC2)c1O ZINC000292940371 433604648 /nfs/dbraw/zinc/60/46/48/433604648.db2.gz HVFJQTAMUXHQHJ-UHFFFAOYSA-N 2 0 306.450 3.147 20 10 DGCDRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000295828949 434441632 /nfs/dbraw/zinc/44/16/32/434441632.db2.gz DUXTXSUYVVCXKO-DOTOQJQBSA-N 2 0 302.462 3.481 20 10 DGCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000296048934 434491572 /nfs/dbraw/zinc/49/15/72/434491572.db2.gz UZKALJKLAVBEEU-DJXYKJKZSA-N 2 0 301.478 3.419 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000296048939 434492209 /nfs/dbraw/zinc/49/22/09/434492209.db2.gz UZKALJKLAVBEEU-NMACRGETSA-N 2 0 301.478 3.419 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](CC)C[C@H]2C)cc1F ZINC000742385872 574995342 /nfs/dbraw/zinc/99/53/42/574995342.db2.gz ZJQUHXCEACBORD-CRAIPNDOSA-N 2 0 321.484 3.492 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853093533 620668069 /nfs/dbraw/zinc/66/80/69/620668069.db2.gz MJKDPFCXKUAYNK-MRXNPFEDSA-N 2 0 318.461 3.003 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1CCCN1C)c1ccc(N2CCCCC2)cc1 ZINC000154507232 620682821 /nfs/dbraw/zinc/68/28/21/620682821.db2.gz UEEFAXXTFZTOBU-VQIMIIECSA-N 2 0 301.478 3.422 20 10 DGCDRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1O ZINC000902500671 619643652 /nfs/dbraw/zinc/64/36/52/619643652.db2.gz GRWDYFUUZNVUPR-JNAXZKDPSA-N 2 0 324.424 3.299 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000841086256 620223540 /nfs/dbraw/zinc/22/35/40/620223540.db2.gz GRTMPRZDJRSMQZ-LPHOPBHVSA-N 2 0 301.478 3.025 20 10 DGCDRP c1cc2c(cc1C[NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)CCCO2 ZINC000922268369 621015380 /nfs/dbraw/zinc/01/53/80/621015380.db2.gz FCNKFSIOFDZRMF-SFHVURJKSA-N 2 0 314.473 3.223 20 10 DGCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cc4c(cc3O)CCC4)C2)CC1 ZINC000755780074 621592983 /nfs/dbraw/zinc/59/29/83/621592983.db2.gz MHZPNYNZIJGVEN-SFHVURJKSA-N 2 0 314.473 3.045 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CC[C@@H]2CCC[NH+]2C)cc1 ZINC000767359219 622393088 /nfs/dbraw/zinc/39/30/88/622393088.db2.gz GEFXFXQZFIXNRD-SFHVURJKSA-N 2 0 303.494 3.449 20 10 DGCDRP CCOc1ccc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c(O)c1 ZINC000769483182 622532469 /nfs/dbraw/zinc/53/24/69/622532469.db2.gz NPJMSJCKLSFAPY-MRXNPFEDSA-N 2 0 306.450 3.097 20 10 DGCDRP CCN(C)c1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000773732238 623064771 /nfs/dbraw/zinc/06/47/71/623064771.db2.gz ZQEJGHCYKLIWKG-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]([NH3+])Cc2ccccc2)c1 ZINC000873235698 623086709 /nfs/dbraw/zinc/08/67/09/623086709.db2.gz SDRFBTYJRFSWBD-ZBFHGGJFSA-N 2 0 314.429 3.012 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c2c1c(F)ccc2O ZINC000873263695 623097023 /nfs/dbraw/zinc/09/70/23/623097023.db2.gz KBPUHFMBMOKQLK-VVSAWPALSA-N 2 0 304.409 3.200 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c2c1c(F)ccc2O ZINC000873263780 623097259 /nfs/dbraw/zinc/09/72/59/623097259.db2.gz KBPUHFMBMOKQLK-ZHZXCYKASA-N 2 0 304.409 3.200 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000876810520 623712165 /nfs/dbraw/zinc/71/21/65/623712165.db2.gz ANJPUINYTUSPRM-CRAIPNDOSA-N 2 0 300.446 3.149 20 10 DGCDRP Cc1cccc(O)c1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000877486783 623907879 /nfs/dbraw/zinc/90/78/79/623907879.db2.gz NKIUIXWPQIMGNR-SFHVURJKSA-N 2 0 310.441 3.312 20 10 DGCDRP CC1(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000785507538 624678981 /nfs/dbraw/zinc/67/89/81/624678981.db2.gz CVVKPSAIXCWOLU-UHFFFAOYSA-N 2 0 313.489 3.108 20 10 DGCDRP Cc1sccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883283664 626636160 /nfs/dbraw/zinc/63/61/60/626636160.db2.gz NOXIPTCNGRZPBV-UHFFFAOYSA-N 2 0 315.486 3.098 20 10 DGCDRP CSC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC[NH+](C)CC1 ZINC000810253226 626992860 /nfs/dbraw/zinc/99/28/60/626992860.db2.gz ONNRCWCSWZFCBD-HNNXBMFYSA-N 2 0 321.534 3.231 20 10 DGCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000925784220 627794708 /nfs/dbraw/zinc/79/47/08/627794708.db2.gz IFRALTFEQQYBRU-SUNKGSAMSA-N 2 0 316.367 3.307 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc2ccccc2c1O ZINC000925787016 627795503 /nfs/dbraw/zinc/79/55/03/627795503.db2.gz YRKGHOPMSWGIAE-GXTWGEPZSA-N 2 0 320.383 3.441 20 10 DGCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc4ccccc4c3O)CC[C@H]21 ZINC000816521239 627801436 /nfs/dbraw/zinc/80/14/36/627801436.db2.gz KLUPJGIADMOLFN-QFBILLFUSA-N 2 0 310.441 3.462 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H](Cc1ccccc1)[C@H](C)[NH3+] ZINC000817894841 627954344 /nfs/dbraw/zinc/95/43/44/627954344.db2.gz QRVZSFSHBSGROH-OXJNMPFZSA-N 2 0 311.473 3.109 20 10 DGCDRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817898590 627956333 /nfs/dbraw/zinc/95/63/33/627956333.db2.gz JNDGDXOZNSQFKH-DYESRHJHSA-N 2 0 323.484 3.335 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CC[NH2+]CC[C@H]3C)cc2)CC1 ZINC000817902384 627956951 /nfs/dbraw/zinc/95/69/51/627956951.db2.gz PAXUKAJZPJKRNC-XLIONFOSSA-N 2 0 315.505 3.401 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)cc1F ZINC000817903189 627957395 /nfs/dbraw/zinc/95/73/95/627957395.db2.gz JOEXHFAMTHSZCH-RHSMWYFYSA-N 2 0 307.457 3.150 20 10 DGCDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]C1CC[NH2+]CC1 ZINC000817937536 627966626 /nfs/dbraw/zinc/96/66/26/627966626.db2.gz XLXOFIIFIBFESK-IBGZPJMESA-N 2 0 310.441 3.408 20 10 DGCDRP CC[C@@H]([NH2+]CC1([NH3+])CCC1)c1ccc(C(F)(F)F)cc1O ZINC000817964603 627976889 /nfs/dbraw/zinc/97/68/89/627976889.db2.gz FOVBLDOXZXQNCL-GFCCVEGCSA-N 2 0 302.340 3.333 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000817971194 627980029 /nfs/dbraw/zinc/98/00/29/627980029.db2.gz KKEHYUWFIWEFMY-BXWFABGCSA-N 2 0 301.478 3.326 20 10 DGCDRP CC[N@@H+]1CCC[C@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835035245 629830294 /nfs/dbraw/zinc/83/02/94/629830294.db2.gz FADIEOGVTHEURB-LZCIBIBXSA-N 2 0 301.478 3.087 20 10 DGCDRP CC[NH+]1CCC(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835039062 629831407 /nfs/dbraw/zinc/83/14/07/629831407.db2.gz WFYZWIABRWCXCA-AATRIKPKSA-N 2 0 301.478 3.087 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000835044130 629833589 /nfs/dbraw/zinc/83/35/89/629833589.db2.gz WWKPLOHTMDHXRN-WAQVGJNASA-N 2 0 301.478 3.228 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cc1F ZINC000841032236 630399126 /nfs/dbraw/zinc/39/91/26/630399126.db2.gz AEQVSWBACUPVFD-ZBFHGGJFSA-N 2 0 307.457 3.150 20 10 DGCDRP CCCN(CCC)c1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000841064652 630403624 /nfs/dbraw/zinc/40/36/24/630403624.db2.gz RZOQSUQLHPACPZ-APWZRJJASA-N 2 0 303.494 3.401 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000841086754 630406261 /nfs/dbraw/zinc/40/62/61/630406261.db2.gz KZXAOOBNPVDJOF-SFHVURJKSA-N 2 0 314.429 3.361 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c1O ZINC000843044196 630607797 /nfs/dbraw/zinc/60/77/97/630607797.db2.gz AAIDTKXVHYXBJM-MRXNPFEDSA-N 2 0 308.853 3.318 20 10 DGCDRP CCCN(CCC)c1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)cc1 ZINC000843051709 630608905 /nfs/dbraw/zinc/60/89/05/630608905.db2.gz KSAYTYBGHVUEKG-VQIMIIECSA-N 2 0 303.494 3.482 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1O ZINC000843127253 630616992 /nfs/dbraw/zinc/61/69/92/630616992.db2.gz PBTIIIGFNADPBC-JKSUJKDBSA-N 2 0 318.461 3.003 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cc1F ZINC000843127461 630617272 /nfs/dbraw/zinc/61/72/72/630617272.db2.gz REZKLNYHIVVWPN-IRXDYDNUSA-N 2 0 319.468 3.103 20 10 DGCDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000843129970 630617482 /nfs/dbraw/zinc/61/74/82/630617482.db2.gz VUJTWOPRHYYCRJ-HUUCEWRRSA-N 2 0 314.429 3.187 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c1O ZINC000846137379 631211439 /nfs/dbraw/zinc/21/14/39/631211439.db2.gz ORNYAWQAKRKLLZ-GFCCVEGCSA-N 2 0 306.450 3.361 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1O ZINC000846140368 631211523 /nfs/dbraw/zinc/21/15/23/631211523.db2.gz PKGMKHAJJDLPHR-XHSDSOJGSA-N 2 0 320.477 3.419 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c1O ZINC000846155974 631212492 /nfs/dbraw/zinc/21/24/92/631212492.db2.gz JLEDUOVQPXTYOO-CVEARBPZSA-N 2 0 320.477 3.419 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)c1O ZINC000846166098 631212948 /nfs/dbraw/zinc/21/29/48/631212948.db2.gz SENLVUPPUOGSDF-HUUCEWRRSA-N 2 0 306.450 3.316 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CCC[C@H]([NH3+])C3)cc2)CC1 ZINC000848717975 631733447 /nfs/dbraw/zinc/73/34/47/631733447.db2.gz DUXCKLHLJRMUTH-ROUUACIJSA-N 2 0 301.478 3.282 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c1O ZINC000848889387 631773205 /nfs/dbraw/zinc/77/32/05/631773205.db2.gz JIEQAMGYPBGSLF-INIZCTEOSA-N 2 0 302.462 3.118 20 10 DGCDRP Cc1cc(O)c(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1C ZINC000850420076 632147077 /nfs/dbraw/zinc/14/70/77/632147077.db2.gz LKXUUSWEQQPJFB-UHFFFAOYSA-N 2 0 302.462 3.221 20 10 DGCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000850581160 632202339 /nfs/dbraw/zinc/20/23/39/632202339.db2.gz DJSNWTHJYHUUCH-OAHLLOKOSA-N 2 0 302.462 3.473 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000164408998 658934360 /nfs/dbraw/zinc/93/43/60/658934360.db2.gz URYFBCPKPLKMLP-KRWDZBQOSA-N 2 0 302.462 3.317 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000192872411 662113652 /nfs/dbraw/zinc/11/36/52/662113652.db2.gz PBBMCDCJHNLBLE-GJZGRUSLSA-N 2 0 306.450 3.316 20 10 DGCDRP CC[C@H](C)C[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001620812736 1192107353 /nfs/dbraw/zinc/10/73/53/1192107353.db2.gz QUDHYHBSMWROIW-IRXDYDNUSA-N 2 0 303.494 3.353 20 10 DGCDRP Nc1ccc(C[NH+]2CCC(c3ncc4n3CCCC4)CC2)cc1 ZINC001356083538 1181138912 /nfs/dbraw/zinc/13/89/12/1181138912.db2.gz RREHKXDSTPVBEY-UHFFFAOYSA-N 2 0 310.445 3.181 20 10 DGCDRP CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001474013217 1183850206 /nfs/dbraw/zinc/85/02/06/1183850206.db2.gz DPFPNOOJXKZFGC-MJGOQNOKSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[NH+](CC)CC[C@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001474305077 1183901296 /nfs/dbraw/zinc/90/12/96/1183901296.db2.gz FLTAULBRDRIGNG-IJDCCNJMSA-N 2 0 303.494 3.476 20 10 DGCDRP C[N@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(Cl)cc2O)C1 ZINC001474348765 1183907395 /nfs/dbraw/zinc/90/73/95/1183907395.db2.gz LCHBWOKKQWLMML-AWEZNQCLSA-N 2 0 308.853 3.209 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@@H]3C3CCC3)cc2)CC1 ZINC001560985791 1189415271 /nfs/dbraw/zinc/41/52/71/1189415271.db2.gz LPORJOHKFAEXIH-UXHICEINSA-N 2 0 313.489 3.107 20 10 DGCDRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3ccc(N4CCCCC4)cc3)[C@@H]2C1 ZINC001621108431 1193803370 /nfs/dbraw/zinc/80/33/70/1193803370.db2.gz OVMKARWJIQQMTL-DFQSSKMNSA-N 2 0 313.489 3.107 20 10 DGCDRP CC(C)CCCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001650213947 1195360554 /nfs/dbraw/zinc/36/05/54/1195360554.db2.gz YUUZDVRQZNYBFE-UHFFFAOYSA-N 2 0 303.494 3.354 20 10 DGCDRP CC[N@H+](CCC[NH+]1CCCC1)Cc1c(C)cc(OC)cc1O ZINC001658016007 1196202934 /nfs/dbraw/zinc/20/29/34/1196202934.db2.gz YABJAOLJRCOWRM-UHFFFAOYSA-N 2 0 306.450 3.017 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccc(Cl)cc3O)C[C@H]2C1 ZINC001660892234 1196539343 /nfs/dbraw/zinc/53/93/43/1196539343.db2.gz HYPKSQGEPBRNOZ-JGGQBBKZSA-N 2 0 308.853 3.208 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCC[C@@]4(CCC[NH2+]C4)C3)ccc21 ZINC000323049623 1081768114 /nfs/dbraw/zinc/76/81/14/1081768114.db2.gz QHYHLEFSRKECDH-HXUWFJFHSA-N 2 0 313.489 3.035 20 10 DGCDRP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001648815021 1081928361 /nfs/dbraw/zinc/92/83/61/1081928361.db2.gz YRPBFFCZGFEMEF-IAGOWNOFSA-N 2 0 316.489 3.469 20 10 DGCDRP C[NH+](C)C1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001168294993 1087284256 /nfs/dbraw/zinc/28/42/56/1087284256.db2.gz MTRKCWBHMKUFOI-UHFFFAOYSA-N 2 0 301.478 3.249 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168389100 1087548382 /nfs/dbraw/zinc/54/83/82/1087548382.db2.gz KCSYKVUNQWEPLI-UHFFFAOYSA-N 2 0 315.505 3.449 20 10 DGCDRP COc1cc(C[NH2+]CC[C@H](C)[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC001203270065 1090710223 /nfs/dbraw/zinc/71/02/23/1090710223.db2.gz GNXWTZZPZMMFGF-ZDUSSCGKSA-N 2 0 308.466 3.128 20 10 DGCDRP CCC1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001203490921 1090743103 /nfs/dbraw/zinc/74/31/03/1090743103.db2.gz DWVXWPBKJYRESC-UHFFFAOYSA-N 2 0 315.505 3.497 20 10 DGCDRP COc1cccc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c1O ZINC001203596566 1090764034 /nfs/dbraw/zinc/76/40/34/1090764034.db2.gz IYJNWZUFSNTLRL-IRXDYDNUSA-N 2 0 318.461 3.240 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c2ccccc21 ZINC001204240257 1090931316 /nfs/dbraw/zinc/93/13/16/1090931316.db2.gz MKAGDAKDNDQVJA-DYESRHJHSA-N 2 0 323.484 3.289 20 10 DGCDRP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001205266710 1091157261 /nfs/dbraw/zinc/15/72/61/1091157261.db2.gz WMQXPFSEHKSZME-LJQANCHMSA-N 2 0 301.478 3.380 20 10 DGCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001205581356 1091264551 /nfs/dbraw/zinc/26/45/51/1091264551.db2.gz SSURKYSXDIJREW-AWEZNQCLSA-N 2 0 320.330 3.064 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)CC[C@@H]1C[NH3+] ZINC001205602671 1091273778 /nfs/dbraw/zinc/27/37/78/1091273778.db2.gz LGIUPIHPFNXFKC-FUHWJXTLSA-N 2 0 301.478 3.094 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)CC[C@H]1C[NH3+] ZINC001205625961 1091286595 /nfs/dbraw/zinc/28/65/95/1091286595.db2.gz DAOWPOLOGIBUBR-CABCVRRESA-N 2 0 304.478 3.497 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H]2C)c(OC)c1 ZINC001205901327 1091400486 /nfs/dbraw/zinc/40/04/86/1091400486.db2.gz CMBSGPATONBLJS-JKSUJKDBSA-N 2 0 319.493 3.101 20 10 DGCDRP C[C@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001205922850 1091415341 /nfs/dbraw/zinc/41/53/41/1091415341.db2.gz BVRVIHKIIUFMDC-UONOGXRCSA-N 2 0 316.445 3.136 20 10 DGCDRP C[C@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001205922848 1091415414 /nfs/dbraw/zinc/41/54/14/1091415414.db2.gz BVRVIHKIIUFMDC-KBPBESRZSA-N 2 0 316.445 3.136 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@](C)(F)CC2)cc(C[NH+](C)C)c1O ZINC001139253507 1091501716 /nfs/dbraw/zinc/50/17/16/1091501716.db2.gz WHIAKSJGEQCUAJ-SFHVURJKSA-N 2 0 324.440 3.177 20 10 DGCDRP CCCC[N@H+](CCC)Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139257617 1091502118 /nfs/dbraw/zinc/50/21/18/1091502118.db2.gz ZLABAWRIMZEQNQ-UHFFFAOYSA-N 2 0 308.466 3.475 20 10 DGCDRP CCC[N@@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)CC(C)C ZINC001139259550 1091503522 /nfs/dbraw/zinc/50/35/22/1091503522.db2.gz VQCLMNPHLCXOAI-UHFFFAOYSA-N 2 0 308.466 3.330 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@H]2C(C)C)cc(C[NH+](C)C)c1O ZINC001139259066 1091503641 /nfs/dbraw/zinc/50/36/41/1091503641.db2.gz GYOPNSVWZZVLDY-INIZCTEOSA-N 2 0 306.450 3.083 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCC[C@@](C)(C[NH3+])CC3)ccc21 ZINC001206304557 1091570756 /nfs/dbraw/zinc/57/07/56/1091570756.db2.gz MMLQKPKEEYNFDG-LJQANCHMSA-N 2 0 301.478 3.020 20 10 DGCDRP Cc1ccc(C)c(C[N@H+]2CC[C@@H](Oc3ccncc3C)C2)c1O ZINC001140185034 1091795122 /nfs/dbraw/zinc/79/51/22/1091795122.db2.gz OPHGXQKUZBNVEJ-MRXNPFEDSA-N 2 0 312.413 3.366 20 10 DGCDRP CCN(CC)c1ccc(CN2CCC([N@H+](C)CC)CC2)c(O)c1 ZINC001140857091 1092033645 /nfs/dbraw/zinc/03/36/45/1092033645.db2.gz LQRPTNXGAIDFGG-UHFFFAOYSA-N 2 0 319.493 3.155 20 10 DGCDRP Oc1cccc2c1C[N@H+](C[C@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001208951865 1092608043 /nfs/dbraw/zinc/60/80/43/1092608043.db2.gz FIWMQGGDVFJRJP-SFHVURJKSA-N 2 0 322.452 3.272 20 10 DGCDRP Nc1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC001120262938 1094397159 /nfs/dbraw/zinc/39/71/59/1094397159.db2.gz GMNHGQLOYKIZSU-UHFFFAOYSA-N 2 0 301.478 3.357 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c2ccccc21 ZINC001222141999 1095453182 /nfs/dbraw/zinc/45/31/82/1095453182.db2.gz UUXDUEBYLZTQTE-OAQYLSRUSA-N 2 0 323.484 3.481 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222160284 1095466239 /nfs/dbraw/zinc/46/62/39/1095466239.db2.gz DSDNUALITGUMKR-FQEVSTJZSA-N 2 0 315.505 3.498 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001222265157 1095519342 /nfs/dbraw/zinc/51/93/42/1095519342.db2.gz PEUMGMLCTWSODX-HXUWFJFHSA-N 2 0 313.489 3.252 20 10 DGCDRP [NH3+]CC1(F)CC[NH+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001222548580 1095661667 /nfs/dbraw/zinc/66/16/67/1095661667.db2.gz SORJTGWTCAQWBI-UHFFFAOYSA-N 2 0 314.404 3.322 20 10 DGCDRP C[C@@H]1CC2(C[N@@H+]1Cc1ccc(N3CCCC3)cc1)CC[NH2+]CC2 ZINC001118076067 1095930021 /nfs/dbraw/zinc/93/00/21/1095930021.db2.gz KLGWROQUTMWZNT-QGZVFWFLSA-N 2 0 313.489 3.251 20 10 DGCDRP C[C@H]1CC2(C[N@@H+]1Cc1ccc(N3CCCC3)cc1)CC[NH2+]CC2 ZINC001118076066 1095930129 /nfs/dbraw/zinc/93/01/29/1095930129.db2.gz KLGWROQUTMWZNT-KRWDZBQOSA-N 2 0 313.489 3.251 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322553629 1096729366 /nfs/dbraw/zinc/72/93/66/1096729366.db2.gz BPUNGLOXQYPGPE-SDKNFDLMSA-N 2 0 300.446 3.464 20 10 DGCDRP C[NH+]1CCC2(CC[N@H+](Cc3ccc4ccccc4c3O)C2)CC1 ZINC001231881303 1097878038 /nfs/dbraw/zinc/87/80/38/1097878038.db2.gz UWDBPMMDZYRARA-UHFFFAOYSA-N 2 0 310.441 3.463 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@@H](C)C2)cc1 ZINC001175775501 1098167712 /nfs/dbraw/zinc/16/77/12/1098167712.db2.gz RITQHWIUPWWUFS-KRWDZBQOSA-N 2 0 324.472 3.248 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc1Cl ZINC001235041192 1098769189 /nfs/dbraw/zinc/76/91/89/1098769189.db2.gz YASNYIAPXWMDPF-QGZVFWFLSA-N 2 0 308.853 3.462 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCC[C@H]2C2CC[NH2+]CC2)ccc1N(C)C ZINC001235152136 1098837740 /nfs/dbraw/zinc/83/77/40/1098837740.db2.gz CRWWLXLIJBPGFX-FQEVSTJZSA-N 2 0 315.505 3.415 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1 ZINC001235158123 1098843717 /nfs/dbraw/zinc/84/37/17/1098843717.db2.gz USUSHCBESAIEFJ-LJQANCHMSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@H](C3C[NH2+]C3)C2)cc1 ZINC001235342936 1098967502 /nfs/dbraw/zinc/96/75/02/1098967502.db2.gz YCAAKLDDPNCGHH-SFHVURJKSA-N 2 0 309.457 3.135 20 10 DGCDRP Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1O ZINC001235420615 1099012261 /nfs/dbraw/zinc/01/22/61/1099012261.db2.gz ACUVUDXPKXIJRE-LSDHHAIUSA-N 2 0 306.425 3.051 20 10 DGCDRP CCC[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235693580 1099132519 /nfs/dbraw/zinc/13/25/19/1099132519.db2.gz DGIBEWOPGXQRRJ-GOSISDBHSA-N 2 0 301.478 3.251 20 10 DGCDRP C[N@H+](C/C=C/c1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235963148 1099293653 /nfs/dbraw/zinc/29/36/53/1099293653.db2.gz RFGAEQRPPMARNL-VMPITWQZSA-N 2 0 321.468 3.241 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001235976793 1099307392 /nfs/dbraw/zinc/30/73/92/1099307392.db2.gz DSNVNGMSAJLJHN-UHFFFAOYSA-N 2 0 322.452 3.338 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CC3(C2)CCC[NH2+]CC3)c2ccccc21 ZINC001236008872 1099331684 /nfs/dbraw/zinc/33/16/84/1099331684.db2.gz MZMQHXUWDQMKEX-UHFFFAOYSA-N 2 0 323.484 3.481 20 10 DGCDRP C[NH2+]C1CCC([N@H+](C)Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001236214876 1099470198 /nfs/dbraw/zinc/47/01/98/1099470198.db2.gz JBSPNOWMTXYLDR-UHFFFAOYSA-N 2 0 316.367 3.373 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)C2(C)CC[NH2+]CC2)c2ccccc21 ZINC001236224188 1099481968 /nfs/dbraw/zinc/48/19/68/1099481968.db2.gz RVFQYCQTUJKSQB-UHFFFAOYSA-N 2 0 311.473 3.480 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)C[NH2+]C2 ZINC001236276712 1099514533 /nfs/dbraw/zinc/51/45/33/1099514533.db2.gz MDTXEMPQOQQTCH-UHFFFAOYSA-N 2 0 309.457 3.378 20 10 DGCDRP Cc1ccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c(O)c1 ZINC001236377250 1099563125 /nfs/dbraw/zinc/56/31/25/1099563125.db2.gz ZZMZRTOJQNCFIJ-INIZCTEOSA-N 2 0 302.462 3.445 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)cc1 ZINC001236598627 1099695440 /nfs/dbraw/zinc/69/54/40/1099695440.db2.gz LYGTWJVRXQPKEN-GOSISDBHSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236940070 1099882155 /nfs/dbraw/zinc/88/21/55/1099882155.db2.gz XAAPELUGLMLUBY-HOTGVXAUSA-N 2 0 319.468 3.055 20 10 DGCDRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236940072 1099883292 /nfs/dbraw/zinc/88/32/92/1099883292.db2.gz XAAPELUGLMLUBY-HZPDHXFCSA-N 2 0 319.468 3.055 20 10 DGCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3c([O-])ccc(Cl)c3Cl)C[C@@H]2C1 ZINC001237079283 1099958104 /nfs/dbraw/zinc/95/81/04/1099958104.db2.gz JQFQNPLFLALSTC-MNOVXSKESA-N 2 0 315.244 3.083 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)c1 ZINC001237418594 1100120892 /nfs/dbraw/zinc/12/08/92/1100120892.db2.gz XPKLHXSQEYNDQU-WMLDXEAASA-N 2 0 302.462 3.264 20 10 DGCDRP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1C ZINC001201557884 1102650067 /nfs/dbraw/zinc/65/00/67/1102650067.db2.gz NHBZWSAKPTWQDY-SFHVURJKSA-N 2 0 304.478 3.461 20 10 DGCDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001201557093 1102651262 /nfs/dbraw/zinc/65/12/62/1102651262.db2.gz DIEPLQPSLGCNKU-GOSISDBHSA-N 2 0 316.489 3.469 20 10 DGCDRP COc1cc(O)c(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)cc1Cl ZINC001206563450 1103788676 /nfs/dbraw/zinc/78/86/76/1103788676.db2.gz CVAALRCPTBMBGZ-INIZCTEOSA-N 2 0 312.841 3.005 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](Cc3ccccc3)C2)cc1 ZINC001246314438 1104483736 /nfs/dbraw/zinc/48/37/36/1104483736.db2.gz XNCQSUNNSJXKHD-UXHICEINSA-N 2 0 323.484 3.206 20 10 DGCDRP Cc1cc(C)c(C[NH2+][C@H]2CC[NH2+][C@H](Cc3ccccc3)C2)c(O)c1 ZINC001246345249 1104500340 /nfs/dbraw/zinc/50/03/40/1104500340.db2.gz VWKMSCFEZJGYKQ-RBUKOAKNSA-N 2 0 324.468 3.462 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC001246517957 1104574396 /nfs/dbraw/zinc/57/43/96/1104574396.db2.gz BZCJRQMOJAWCIC-RDTXWAMCSA-N 2 0 302.462 3.364 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@H]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001246900260 1104728703 /nfs/dbraw/zinc/72/87/03/1104728703.db2.gz HEUPKTYLZGBIJG-SFHVURJKSA-N 2 0 301.478 3.107 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[NH2+][C@@H]1CC2CCN(CC2)C1 ZINC001254837185 1106146399 /nfs/dbraw/zinc/14/63/99/1106146399.db2.gz SHKVRQCXYLADOY-LJQANCHMSA-N 2 0 313.489 3.251 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC001320876917 1107171861 /nfs/dbraw/zinc/17/18/61/1107171861.db2.gz UAFNTGMATNLLCN-APWZRJJASA-N 2 0 303.494 3.305 20 10 DGCDRP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001320905419 1107184423 /nfs/dbraw/zinc/18/44/23/1107184423.db2.gz HWNUVBKJSFLIBH-GOSISDBHSA-N 2 0 301.478 3.203 20 10 DGCDRP C[NH+](C)CCC1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001319815703 1108647604 /nfs/dbraw/zinc/64/76/04/1108647604.db2.gz LYBYVGCBVJSTLJ-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP C[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308237745 1111402767 /nfs/dbraw/zinc/40/27/67/1111402767.db2.gz QQZRPIYWKRBMBS-MJGOQNOKSA-N 2 0 315.505 3.354 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c1 ZINC001308569780 1111445317 /nfs/dbraw/zinc/44/53/17/1111445317.db2.gz IWOJJBHKNMLHHI-SJLPKXTDSA-N 2 0 302.462 3.432 20 10 DGCDRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(Br)cc1O ZINC000273575661 130139326 /nfs/dbraw/zinc/13/93/26/130139326.db2.gz LRWPMCPARYPFGX-LLVKDONJSA-N 2 0 315.255 3.147 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]C2CC[NH+](C3CCC3)CC2)c1O ZINC000273721462 130157771 /nfs/dbraw/zinc/15/77/71/130157771.db2.gz IMEGLKRGRHCMJD-UHFFFAOYSA-N 2 0 324.852 3.161 20 10 DGCDRP CCCOc1ccc(C[NH2+]Cc2ccc3c[nH+]cn3c2)c(O)c1 ZINC000297486326 132018612 /nfs/dbraw/zinc/01/86/12/132018612.db2.gz KBGNWVDZVXWTEM-UHFFFAOYSA-N 2 0 311.385 3.119 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(O)c1 ZINC000093597913 431915599 /nfs/dbraw/zinc/91/55/99/431915599.db2.gz UVEPABHFFXGBBC-MRXNPFEDSA-N 2 0 318.461 3.099 20 10 DGCDRP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000125463688 431926812 /nfs/dbraw/zinc/92/68/12/431926812.db2.gz RSNBYTLEIBIGOF-GOSISDBHSA-N 2 0 301.478 3.060 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)cc2)CC1 ZINC000157493315 432622774 /nfs/dbraw/zinc/62/27/74/432622774.db2.gz NUGQZINKDMDWMR-IEBWSBKVSA-N 2 0 315.505 3.495 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)CC1CC[NH2+]CC1 ZINC000178978095 432791987 /nfs/dbraw/zinc/79/19/87/432791987.db2.gz AWLCXDHLBRPRBO-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c(O)c1 ZINC000290401512 433045648 /nfs/dbraw/zinc/04/56/48/433045648.db2.gz JJUAJSPHJCFYOK-QAPCUYQASA-N 2 0 318.461 3.097 20 10 DGCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3c(O)cccc3Cl)C2)CC1 ZINC000290478008 433063838 /nfs/dbraw/zinc/06/38/38/433063838.db2.gz NXMUFDOSQZALIW-AWEZNQCLSA-N 2 0 308.853 3.209 20 10 DGCDRP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)c1ccc(Br)cc1O ZINC000293714134 433842535 /nfs/dbraw/zinc/84/25/35/433842535.db2.gz PBZZJOZPAABSEJ-WDEREUQCSA-N 2 0 315.255 3.003 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(-n3ccnc3)nc2)c(O)c1 ZINC000363861504 434167629 /nfs/dbraw/zinc/16/76/29/434167629.db2.gz WUYTXDXSEVWMEU-AWEZNQCLSA-N 2 0 308.385 3.132 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000370675772 434617684 /nfs/dbraw/zinc/61/76/84/434617684.db2.gz FBZQVDYKSJHZAK-IEZWGBDMSA-N 2 0 301.478 3.420 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cc(OC)ccc2O)CC1 ZINC000185563810 521550022 /nfs/dbraw/zinc/55/00/22/521550022.db2.gz KCJPTROESCMFQX-CQSZACIVSA-N 2 0 306.450 3.173 20 10 DGCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000743387618 575048189 /nfs/dbraw/zinc/04/81/89/575048189.db2.gz LLIOISBWRRHVOJ-HNNXBMFYSA-N 2 0 302.462 3.045 20 10 DGCDRP C[NH+]1CCC(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000729682806 575260625 /nfs/dbraw/zinc/26/06/25/575260625.db2.gz OVGAWJXRBDLDDW-UHFFFAOYSA-N 2 0 310.441 3.491 20 10 DGCDRP Oc1cccc(Cl)c1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093306 620667610 /nfs/dbraw/zinc/66/76/10/620667610.db2.gz IMIYNOUNYJMKMZ-CQSZACIVSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853241518 620681617 /nfs/dbraw/zinc/68/16/17/620681617.db2.gz WKFIPNZQQOOZBV-NVXWUHKLSA-N 2 0 302.462 3.473 20 10 DGCDRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)c1cc(Br)ccc1O ZINC000854222820 620785741 /nfs/dbraw/zinc/78/57/41/620785741.db2.gz LDWMXQFOWQYPRC-SNVBAGLBSA-N 2 0 313.239 3.077 20 10 DGCDRP COc1cc(C)cc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)c1O ZINC000894384326 618299415 /nfs/dbraw/zinc/29/94/15/618299415.db2.gz JNFZSUVZNBWFOC-UHFFFAOYSA-N 2 0 314.429 3.061 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CC[C@@H](C)[NH+]2CCCCC2)c1O ZINC000894445932 618335955 /nfs/dbraw/zinc/33/59/55/618335955.db2.gz QXBCKVSYLASNOI-OAHLLOKOSA-N 2 0 306.450 3.063 20 10 DGCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CCC(C)(C)[NH3+])c1O ZINC000925738073 618590751 /nfs/dbraw/zinc/59/07/51/618590751.db2.gz MXQWZMNQWFZYOD-JTQLQIEISA-N 2 0 315.255 3.241 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000925780798 618618089 /nfs/dbraw/zinc/61/80/89/618618089.db2.gz GZLCINGRXBCCJU-IUODEOHRSA-N 2 0 324.415 3.166 20 10 DGCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(N(C)C)cc1 ZINC000925782693 618618820 /nfs/dbraw/zinc/61/88/20/618618820.db2.gz MOZOFVJXCUVAFM-GOEBONIOSA-N 2 0 311.420 3.038 20 10 DGCDRP COc1cc(C)cc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)c1O ZINC000895454891 618787742 /nfs/dbraw/zinc/78/77/42/618787742.db2.gz PHIAGMFLLNCEHW-UHFFFAOYSA-N 2 0 306.450 3.062 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c(C(F)(F)F)c1 ZINC000841057303 619249122 /nfs/dbraw/zinc/24/91/22/619249122.db2.gz IYDSSUUDBAEDGS-QWHCGFSZSA-N 2 0 315.383 3.131 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c(C(F)(F)F)c1 ZINC000841057304 619249150 /nfs/dbraw/zinc/24/91/50/619249150.db2.gz IYDSSUUDBAEDGS-STQMWFEESA-N 2 0 315.383 3.131 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)cc1F ZINC000903083883 619713129 /nfs/dbraw/zinc/71/31/29/619713129.db2.gz PUNDKRDBNHHCHC-ZXFUBFMLSA-N 2 0 317.452 3.139 20 10 DGCDRP CCC1([NH3+])CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000903946832 619843920 /nfs/dbraw/zinc/84/39/20/619843920.db2.gz CKAFSNQJJGIAHL-UHFFFAOYSA-N 2 0 301.478 3.380 20 10 DGCDRP COc1ccc(N2CC[C@H]([NH2+]C[C@@H]([NH3+])CCC(C)(C)C)C2)cc1 ZINC000904376543 619918324 /nfs/dbraw/zinc/91/83/24/619918324.db2.gz BCXOGKRXTIEEDJ-HOTGVXAUSA-N 2 0 319.493 3.017 20 10 DGCDRP Cc1cccc(C[NH+]2CCC(C[NH3+])(c3ccccc3)CC2)c1O ZINC000904459529 619923817 /nfs/dbraw/zinc/92/38/17/619923817.db2.gz UJTLBWUCMBVSGZ-UHFFFAOYSA-N 2 0 310.441 3.193 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)cc1F ZINC000922846954 621108165 /nfs/dbraw/zinc/10/81/65/621108165.db2.gz IDSHEJBVSPHPMJ-UHFFFAOYSA-N 2 0 319.468 3.388 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2c1c(F)ccc2O ZINC000756402617 621635521 /nfs/dbraw/zinc/63/55/21/621635521.db2.gz VXDCMCHNEQGYNF-XUJVJEKNSA-N 2 0 304.409 3.154 20 10 DGCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC000756450211 621639638 /nfs/dbraw/zinc/63/96/38/621639638.db2.gz RCEJVFWOIBZPOC-GUTXKFCHSA-N 2 0 306.425 3.401 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]CCC2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756546845 621646686 /nfs/dbraw/zinc/64/66/86/621646686.db2.gz SHIRRNZRLKLTCP-WFASDCNBSA-N 2 0 306.425 3.401 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000763607976 622154965 /nfs/dbraw/zinc/15/49/65/622154965.db2.gz VDCZXCLNLPSWGR-GOSISDBHSA-N 2 0 303.494 3.449 20 10 DGCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@H](C[NH+]3CCCC3)C1)CCCC2 ZINC000768446962 622457111 /nfs/dbraw/zinc/45/71/11/622457111.db2.gz PRTKPRRZNFRBHA-MRXNPFEDSA-N 2 0 314.473 3.189 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(O)c1 ZINC000769498107 622534143 /nfs/dbraw/zinc/53/41/43/622534143.db2.gz GGQSIANSDCMKSL-MRXNPFEDSA-N 2 0 318.461 3.099 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC(C)(C)C3)cc2)CC1 ZINC000771866840 622805741 /nfs/dbraw/zinc/80/57/41/622805741.db2.gz BVLHVLVGBKYIMO-QGZVFWFLSA-N 2 0 301.478 3.107 20 10 DGCDRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000873251803 623092083 /nfs/dbraw/zinc/09/20/83/623092083.db2.gz OJOUVRNPXAJZSF-SCTDSRPQSA-N 2 0 310.441 3.393 20 10 DGCDRP C[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775632832 623299478 /nfs/dbraw/zinc/29/94/78/623299478.db2.gz ACDOOMDGHHMCHJ-UHFFFAOYSA-N 2 0 309.457 3.070 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@H+](C3CC3)C3CCCC3)cc2)CC1 ZINC000775649885 623303145 /nfs/dbraw/zinc/30/31/45/623303145.db2.gz URKZHUIEIRCVAX-UHFFFAOYSA-N 2 0 313.489 3.345 20 10 DGCDRP CC(C)CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775648708 623303792 /nfs/dbraw/zinc/30/37/92/623303792.db2.gz IKLMKXGWZUDPDL-UHFFFAOYSA-N 2 0 315.505 3.449 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775663847 623308965 /nfs/dbraw/zinc/30/89/65/623308965.db2.gz FHCTYSUPFBYFAJ-QGZVFWFLSA-N 2 0 301.478 3.060 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3C3CCC3)cc2)CC1 ZINC000775669575 623310073 /nfs/dbraw/zinc/31/00/73/623310073.db2.gz LVFUASFCLXQFNG-HXUWFJFHSA-N 2 0 313.489 3.203 20 10 DGCDRP C[C@@H]([N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(C)CC1 ZINC000775736379 623322359 /nfs/dbraw/zinc/32/23/59/623322359.db2.gz RWJGKAXFIIKAPG-MRXNPFEDSA-N 2 0 301.478 3.059 20 10 DGCDRP Cc1cscc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000785520575 624681287 /nfs/dbraw/zinc/68/12/87/624681287.db2.gz ALMLRKKJBJUHLN-UHFFFAOYSA-N 2 0 315.486 3.098 20 10 DGCDRP CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809768606 626949834 /nfs/dbraw/zinc/94/98/34/626949834.db2.gz QCIQLRMUEAZOCL-SJLPKXTDSA-N 2 0 301.478 3.201 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1O ZINC000809767951 626950078 /nfs/dbraw/zinc/95/00/78/626950078.db2.gz YXBTYOWFAHCKMS-BBRMVZONSA-N 2 0 308.853 3.270 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@@H](C)[C@@H]3C)cc2F)CC1 ZINC000813858591 627516756 /nfs/dbraw/zinc/51/67/56/627516756.db2.gz ASTNSTOIYXMANF-RVKKMQEKSA-N 2 0 319.468 3.102 20 10 DGCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815057583 627620826 /nfs/dbraw/zinc/62/08/26/627620826.db2.gz UWKHDVOAGLHFAI-SFHVURJKSA-N 2 0 303.494 3.225 20 10 DGCDRP Cc1ccc([C@@H](C)N2CCc3sc(C[NH3+])nc3C2)c(O)c1C ZINC000925751548 627787745 /nfs/dbraw/zinc/78/77/45/627787745.db2.gz NSTXAYMUJVGMKQ-GFCCVEGCSA-N 2 0 317.458 3.044 20 10 DGCDRP Oc1c(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)ccc2ccccc21 ZINC000816514975 627800327 /nfs/dbraw/zinc/80/03/27/627800327.db2.gz LVUYWXOXJMILHD-INIZCTEOSA-N 2 0 310.441 3.463 20 10 DGCDRP CC(=O)c1cc(Cl)cc(CN2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)c1O ZINC000817880392 627952799 /nfs/dbraw/zinc/95/27/99/627952799.db2.gz RNAHNRIXWXZKJN-MJVIPROJSA-N 2 0 324.852 3.053 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817945798 627970476 /nfs/dbraw/zinc/97/04/76/627970476.db2.gz MIFOOHYKRPMRNM-FZMZJTMJSA-N 2 0 316.367 3.451 20 10 DGCDRP [NH3+][C@H](C[NH2+][C@H](CCc1ccccc1)c1ccccc1O)C1CC1 ZINC000817965337 627977857 /nfs/dbraw/zinc/97/78/57/627977857.db2.gz OQWWYBPTDNICTF-RTBURBONSA-N 2 0 310.441 3.393 20 10 DGCDRP [NH3+][C@H](C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O)C1CC1 ZINC000817965334 627977895 /nfs/dbraw/zinc/97/78/95/627977895.db2.gz OQWWYBPTDNICTF-MOPGFXCFSA-N 2 0 310.441 3.393 20 10 DGCDRP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(N2CCCCC2)cc1 ZINC000817969085 627978493 /nfs/dbraw/zinc/97/84/93/627978493.db2.gz QZRWJUPJVPJBPP-AEFFLSMTSA-N 2 0 301.478 3.470 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cc(Br)ccc1O ZINC000817969933 627978972 /nfs/dbraw/zinc/97/89/72/627978972.db2.gz IIRDXIYOESZZKS-MVWJERBFSA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c2c1c(F)ccc2O ZINC000817974812 627981034 /nfs/dbraw/zinc/98/10/34/627981034.db2.gz FRZJFALGFNGZEX-BHPKHCPMSA-N 2 0 306.425 3.434 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C34CCC(CC3)CC4)cc2)CC1 ZINC000824935670 628708733 /nfs/dbraw/zinc/70/87/33/628708733.db2.gz LCPOYCGAKKKDJF-UHFFFAOYSA-N 2 0 313.489 3.251 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC000835030457 629829702 /nfs/dbraw/zinc/82/97/02/629829702.db2.gz YEHVCRBYEANRCM-JBJGNSMKSA-N 2 0 313.489 3.182 20 10 DGCDRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835034564 629830592 /nfs/dbraw/zinc/83/05/92/629830592.db2.gz BLNSVELDHAVOJA-OOFWQKGWSA-N 2 0 301.478 3.087 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000840894430 630373922 /nfs/dbraw/zinc/37/39/22/630373922.db2.gz RLOWDUFFPRRYIV-DLBZAZTESA-N 2 0 317.521 3.312 20 10 DGCDRP Cc1cc(O)c(CN2CC[C@H](C[NH+]3CCCC3)C2)c(Cl)c1 ZINC000840918238 630378154 /nfs/dbraw/zinc/37/81/54/630378154.db2.gz QJQXAHMNLQNQGP-CQSZACIVSA-N 2 0 308.853 3.272 20 10 DGCDRP CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000841005050 630394183 /nfs/dbraw/zinc/39/41/83/630394183.db2.gz DDURHFPVERAAJD-SJLPKXTDSA-N 2 0 303.494 3.351 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000841071760 630404283 /nfs/dbraw/zinc/40/42/83/630404283.db2.gz AQAJGALQSQJFNI-GOSISDBHSA-N 2 0 301.478 3.299 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1F ZINC000841072316 630404542 /nfs/dbraw/zinc/40/45/42/630404542.db2.gz ILFMEIMWCLYCQO-MRXNPFEDSA-N 2 0 307.457 3.294 20 10 DGCDRP C[NH2+]CCC[N@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000841104369 630408698 /nfs/dbraw/zinc/40/86/98/630408698.db2.gz PQFPMQZBBUMBNY-UHFFFAOYSA-N 2 0 314.429 3.013 20 10 DGCDRP CCN(CC)c1ccc(CN2CCC[C@H](C[NH2+]C)C2)cc1F ZINC000843044153 630607884 /nfs/dbraw/zinc/60/78/84/630607884.db2.gz FNHXIQXGRQXBLP-MRXNPFEDSA-N 2 0 307.457 3.103 20 10 DGCDRP [NH3+]CC[C@H]1CCCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000843122465 630615710 /nfs/dbraw/zinc/61/57/10/630615710.db2.gz CYZDNLAKZGGNMX-GOSISDBHSA-N 2 0 301.478 3.380 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000843128334 630617198 /nfs/dbraw/zinc/61/71/98/630617198.db2.gz WFYGAQISFCBMNT-LJQANCHMSA-N 2 0 315.505 3.354 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2)c2c1c(F)ccc2O ZINC000843344080 630648172 /nfs/dbraw/zinc/64/81/72/630648172.db2.gz PPXZWBMDYRJPLI-IAQYHMDHSA-N 2 0 300.377 3.328 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1O ZINC000848891547 631774078 /nfs/dbraw/zinc/77/40/78/631774078.db2.gz ZYOWWLUIFSRUNE-QFBILLFUSA-N 2 0 314.473 3.403 20 10 DGCDRP Oc1cccc(Cl)c1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000849350843 631901558 /nfs/dbraw/zinc/90/15/58/631901558.db2.gz YQRTXLQFKPYZDK-AWEZNQCLSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C ZINC000172957374 659367383 /nfs/dbraw/zinc/36/73/83/659367383.db2.gz FWUIZHJTIIIWRH-QGZVFWFLSA-N 2 0 302.462 3.317 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H](C[NH3+])C3)cc2)CC1 ZINC001576735249 1191865854 /nfs/dbraw/zinc/86/58/54/1191865854.db2.gz YIZJFTOBKLYJJM-QZTJIDSGSA-N 2 0 301.478 3.140 20 10 DGCDRP Cc1cc(O)c(C[NH2+][C@@H]2[C@@H]3CCC[NH2+][C@H]3C2(C)C)cc1Cl ZINC001579637974 1191983885 /nfs/dbraw/zinc/98/38/85/1191983885.db2.gz LIPXYWIRYSDGOU-DAXOMENPSA-N 2 0 308.853 3.220 20 10 DGCDRP CCC(C)(C)[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001621003733 1192779304 /nfs/dbraw/zinc/77/93/04/1192779304.db2.gz VNCDDWKYFCKVAW-MRXNPFEDSA-N 2 0 303.494 3.353 20 10 DGCDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC001461365887 1182800118 /nfs/dbraw/zinc/80/01/18/1182800118.db2.gz UEPIKBJZJSRQHS-KRWDZBQOSA-N 2 0 321.484 3.349 20 10 DGCDRP CC[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560476518 1189332392 /nfs/dbraw/zinc/33/23/92/1189332392.db2.gz LNIVZTDEYDWPFW-MOPGFXCFSA-N 2 0 315.505 3.354 20 10 DGCDRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560571048 1189343479 /nfs/dbraw/zinc/34/34/79/1189343479.db2.gz FMUYHFLPWSMUGX-LPHOPBHVSA-N 2 0 315.505 3.353 20 10 DGCDRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc(Cl)cc3O)C2)CC1 ZINC001560789033 1189382150 /nfs/dbraw/zinc/38/21/50/1189382150.db2.gz LDXIHHHNDMQORD-UHFFFAOYSA-N 2 0 308.853 3.353 20 10 DGCDRP C[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)C[NH+]1CCCCC1 ZINC001656896038 1196081204 /nfs/dbraw/zinc/08/12/04/1196081204.db2.gz BLRWEPKXXYPJSM-ZEVQVBBLSA-N 2 0 315.505 3.477 20 10 DGCDRP C[C@H]([NH2+]Cc1cc(F)ccc1O)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001658822072 1196304328 /nfs/dbraw/zinc/30/43/28/1196304328.db2.gz GYUGWCIURQFMGR-KBPBESRZSA-N 2 0 306.425 3.274 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCCC1 ZINC001662705208 1196741727 /nfs/dbraw/zinc/74/17/27/1196741727.db2.gz ARAKLLZJYNOJPL-KRWDZBQOSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001167841342 1084179561 /nfs/dbraw/zinc/17/95/61/1084179561.db2.gz KRXZBRUWJLUZOK-OAHLLOKOSA-N 2 0 320.477 3.357 20 10 DGCDRP Cc1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)[nH+]c1C ZINC001156656504 1089628096 /nfs/dbraw/zinc/62/80/96/1089628096.db2.gz WVPFVLCQPYJPCD-UHFFFAOYSA-N 2 0 310.445 3.062 20 10 DGCDRP Cc1ccc(C[N@H+]2C[C@@H]3C[NH+](Cc4ccccc4O)C[C@@H]3C2)cc1 ZINC001203552009 1090754004 /nfs/dbraw/zinc/75/40/04/1090754004.db2.gz WUSJAUKOCFKKES-BGYRXZFFSA-N 2 0 322.452 3.264 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC3(C[NH+](C)C3)CC2)cc1 ZINC001203942405 1090845807 /nfs/dbraw/zinc/84/58/07/1090845807.db2.gz PGSIRKSDHSJHSY-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP CC(C)(C)C1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001205164973 1091116347 /nfs/dbraw/zinc/11/63/47/1091116347.db2.gz YVNDMRFSNLOEHX-UHFFFAOYSA-N 2 0 315.505 3.354 20 10 DGCDRP CC1(C)C=Cc2c(O)c(C[N@@H+]3CCC[C@@](C)([NH3+])CC3)ccc2O1 ZINC001205296893 1091170617 /nfs/dbraw/zinc/17/06/17/1091170617.db2.gz WCKUOWCDMXRIFL-LJQANCHMSA-N 2 0 316.445 3.280 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c(O)c1 ZINC001205627407 1091286579 /nfs/dbraw/zinc/28/65/79/1091286579.db2.gz PIDHDNYEJWLQKQ-HZPDHXFCSA-N 2 0 319.493 3.045 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)cc(C[NH+](C)C)c1O ZINC001139256268 1091501875 /nfs/dbraw/zinc/50/18/75/1091501875.db2.gz XQHFRXTVWKBAQT-CVEARBPZSA-N 2 0 318.461 3.084 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)c(O)c1 ZINC001206554160 1091667300 /nfs/dbraw/zinc/66/73/00/1091667300.db2.gz BDWMPMSSGCPJKV-LJQANCHMSA-N 2 0 319.493 3.189 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@H](C[NH3+])CC[C@H]2C)c(OC)c1 ZINC001206769774 1091733934 /nfs/dbraw/zinc/73/39/34/1091733934.db2.gz QGFPXQXBFULJOR-CVEARBPZSA-N 2 0 319.493 3.101 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@](C)(F)C3)cc2)CC1 ZINC001140301885 1091818923 /nfs/dbraw/zinc/81/89/23/1091818923.db2.gz CFEBMLMCGJAHAM-IBGZPJMESA-N 2 0 319.468 3.153 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H](C)CC34CC4)cc2)CC1 ZINC001140305516 1091820592 /nfs/dbraw/zinc/82/05/92/1091820592.db2.gz AIHMNYDEHBSXFL-QGZVFWFLSA-N 2 0 313.489 3.203 20 10 DGCDRP Cc1cc(N2CC[NH+](Cc3c(O)cccc3Cl)CC2)cc[nH+]1 ZINC001140342705 1091835124 /nfs/dbraw/zinc/83/51/24/1091835124.db2.gz VHCSORVBMKCZGO-UHFFFAOYSA-N 2 0 317.820 3.071 20 10 DGCDRP Cc1ccc(O)c(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001140620987 1091934076 /nfs/dbraw/zinc/93/40/76/1091934076.db2.gz JXUDCWDMLTUINE-WOJBJXKFSA-N 2 0 322.452 3.264 20 10 DGCDRP C[NH+]1CCC2(C[NH+](Cc3cccc(C(C)(C)C)c3O)C2)CC1 ZINC001143112478 1092616355 /nfs/dbraw/zinc/61/63/55/1092616355.db2.gz SEIXTGMHSGSMLZ-UHFFFAOYSA-N 2 0 302.462 3.217 20 10 DGCDRP CN1CCC[C@H]2C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116418 1092617841 /nfs/dbraw/zinc/61/78/41/1092617841.db2.gz ANFDCINLQIZNDO-YOEHRIQHSA-N 2 0 302.462 3.216 20 10 DGCDRP CN1CCC[C@@H]2C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116416 1092618824 /nfs/dbraw/zinc/61/88/24/1092618824.db2.gz ANFDCINLQIZNDO-RHSMWYFYSA-N 2 0 302.462 3.216 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c(O)c1 ZINC001222155268 1095463098 /nfs/dbraw/zinc/46/30/98/1095463098.db2.gz YZRCFFKVNHHCID-LJQANCHMSA-N 2 0 302.462 3.265 20 10 DGCDRP Cc1cccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1O ZINC001222168121 1095474368 /nfs/dbraw/zinc/47/43/68/1095474368.db2.gz VCNDIVMJMTZIEB-LJQANCHMSA-N 2 0 302.462 3.446 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC001118242850 1095965759 /nfs/dbraw/zinc/96/57/59/1095965759.db2.gz LFADTAATQPBKKR-RTBURBONSA-N 2 0 313.489 3.108 20 10 DGCDRP Cc1cccc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c1O ZINC001231593183 1097786959 /nfs/dbraw/zinc/78/69/59/1097786959.db2.gz QHZYODCCLHMJHX-UHFFFAOYSA-N 2 0 302.462 3.254 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC001177333393 1098518210 /nfs/dbraw/zinc/51/82/10/1098518210.db2.gz BAWQOVZOFWHTMP-UHFFFAOYSA-N 2 0 315.505 3.497 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c1O ZINC001235041004 1098768568 /nfs/dbraw/zinc/76/85/68/1098768568.db2.gz WCGUKSWZWDZREK-KRWDZBQOSA-N 2 0 308.853 3.462 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC3(CC[NH2+]CC3)CC2)c1O ZINC001235133167 1098831194 /nfs/dbraw/zinc/83/11/94/1098831194.db2.gz NYUFWVCSQIBGGZ-UHFFFAOYSA-N 2 0 308.853 3.320 20 10 DGCDRP Cc1cc(C)c(C[N@@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c(O)c1 ZINC001235156188 1098842944 /nfs/dbraw/zinc/84/29/44/1098842944.db2.gz FKVROBRJFDTPRS-GOSISDBHSA-N 2 0 302.462 3.363 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001235363825 1098980699 /nfs/dbraw/zinc/98/06/99/1098980699.db2.gz KFEWILNDOSPVRY-TZIWHRDSSA-N 2 0 322.452 3.145 20 10 DGCDRP Cc1cc(F)cc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1O ZINC001235420609 1099013971 /nfs/dbraw/zinc/01/39/71/1099013971.db2.gz ACUVUDXPKXIJRE-GJZGRUSLSA-N 2 0 306.425 3.051 20 10 DGCDRP C[N@H+](CCC[NH3+])Cc1c(O)ccc2cc(Br)ccc21 ZINC001235435594 1099033934 /nfs/dbraw/zinc/03/39/34/1099033934.db2.gz RIGZYXRNABFTKA-UHFFFAOYSA-N 2 0 323.234 3.089 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC001235889041 1099235307 /nfs/dbraw/zinc/23/53/07/1099235307.db2.gz VEMRAWDQMQIPHV-GOSISDBHSA-N 2 0 321.896 3.370 20 10 DGCDRP Cc1ccc(C[N@@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)c(O)c1 ZINC001235973589 1099302367 /nfs/dbraw/zinc/30/23/67/1099302367.db2.gz NJMKFRDQEPCWRE-UHFFFAOYSA-N 2 0 322.452 3.338 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001236308706 1099527548 /nfs/dbraw/zinc/52/75/48/1099527548.db2.gz XETIXRWPLSXVKL-RTBURBONSA-N 2 0 313.489 3.108 20 10 DGCDRP CC[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236942048 1099881562 /nfs/dbraw/zinc/88/15/62/1099881562.db2.gz IULPFZXYZLICHY-MRXNPFEDSA-N 2 0 319.468 3.200 20 10 DGCDRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236940075 1099882305 /nfs/dbraw/zinc/88/23/05/1099882305.db2.gz XAAPELUGLMLUBY-IYBDPMFKSA-N 2 0 319.468 3.055 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@@H]1C ZINC001236938245 1099883241 /nfs/dbraw/zinc/88/32/41/1099883241.db2.gz IMRINUWJJJFHBK-HZPDHXFCSA-N 2 0 319.468 3.198 20 10 DGCDRP C[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@@H]1CCc2ccccc21 ZINC001237257590 1100050149 /nfs/dbraw/zinc/05/01/49/1100050149.db2.gz HOYLWSGVCVIIOF-OAQYLSRUSA-N 2 0 321.468 3.216 20 10 DGCDRP Cc1cccc(O)c1C[NH+]1CCC([NH+]2CCC(F)CC2)CC1 ZINC001237487141 1100139923 /nfs/dbraw/zinc/13/99/23/1100139923.db2.gz GTLYCPISORGUJB-UHFFFAOYSA-N 2 0 306.425 3.099 20 10 DGCDRP Cc1cc(Cl)cc(C[N@H+]2CCC3(C2)CC[NH+](C)CC3)c1O ZINC001237686732 1100215407 /nfs/dbraw/zinc/21/54/07/1100215407.db2.gz MJFAYXYVPGAQQF-UHFFFAOYSA-N 2 0 308.853 3.272 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c1O ZINC001205780969 1101352987 /nfs/dbraw/zinc/35/29/87/1101352987.db2.gz ULOUVDCBPKGLHX-ZDUSSCGKSA-N 2 0 312.404 3.106 20 10 DGCDRP Cc1cc(O)c(C[NH+]2C[C@@H]3CC[N@H+](C)CC[C@@H]3C2)cc1Cl ZINC001276371999 1103688879 /nfs/dbraw/zinc/68/88/79/1103688879.db2.gz DPOKLIOLPCYWRY-OKILXGFUSA-N 2 0 308.853 3.128 20 10 DGCDRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccc3ccccc3c1O)C2 ZINC001276374323 1103697090 /nfs/dbraw/zinc/69/70/90/1103697090.db2.gz WFQJOTGXGGFWIU-HXUWFJFHSA-N 2 0 310.441 3.463 20 10 DGCDRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001206566141 1103849475 /nfs/dbraw/zinc/84/94/75/1103849475.db2.gz XOOXVERMGWWXTQ-OAHLLOKOSA-N 2 0 316.367 3.362 20 10 DGCDRP CC(C)CCC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246175091 1104420824 /nfs/dbraw/zinc/42/08/24/1104420824.db2.gz SFVUXHUIKXLCCA-QGZVFWFLSA-N 2 0 303.494 3.401 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC001246523391 1104577910 /nfs/dbraw/zinc/57/79/10/1104577910.db2.gz GXGKQTUPBQBBHR-SUNYJGFJSA-N 2 0 302.462 3.363 20 10 DGCDRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001319797781 1108638481 /nfs/dbraw/zinc/63/84/81/1108638481.db2.gz RZCAXXTUMILDPA-HOTGVXAUSA-N 2 0 319.468 3.055 20 10 DGCDRP CCCOc1ccc(C[N@H+](C)C2CC[NH+](CCC)CC2)c(O)c1 ZINC000092165735 193169743 /nfs/dbraw/zinc/16/97/43/193169743.db2.gz PECVGKQVORKVNT-UHFFFAOYSA-N 2 0 320.477 3.487 20 10 DGCDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000177974451 228336391 /nfs/dbraw/zinc/33/63/91/228336391.db2.gz JPAVXLSUMFIYAD-MDZRGWNJSA-N 2 0 301.478 3.105 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(O)c1 ZINC000093597915 431915910 /nfs/dbraw/zinc/91/59/10/431915910.db2.gz UVEPABHFFXGBBC-INIZCTEOSA-N 2 0 318.461 3.099 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c(O)c1 ZINC000252799281 432388030 /nfs/dbraw/zinc/38/80/30/432388030.db2.gz AKBBALXAMRFFSH-MAUKXSAKSA-N 2 0 318.461 3.097 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC000186142546 432561439 /nfs/dbraw/zinc/56/14/39/432561439.db2.gz IZIKNLMRWCXNOZ-HOTGVXAUSA-N 2 0 320.477 3.419 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]CCC[NH+]2CCCCC2)c1O ZINC000228669965 432718990 /nfs/dbraw/zinc/71/89/90/432718990.db2.gz REUIGOYYMFRSDX-UHFFFAOYSA-N 2 0 312.841 3.020 20 10 DGCDRP CC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(C)cc1O ZINC000280233413 433020111 /nfs/dbraw/zinc/02/01/11/433020111.db2.gz VKSXAKOCNDAMPZ-SJLPKXTDSA-N 2 0 320.477 3.242 20 10 DGCDRP CCCN(c1ccc(C[NH3+])cc1)C1CCN(c2cc[nH+]cc2)CC1 ZINC000298068875 433046712 /nfs/dbraw/zinc/04/67/12/433046712.db2.gz KUHLLCKMHRBBMS-UHFFFAOYSA-N 2 0 324.472 3.426 20 10 DGCDRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(N(C)C)cc1 ZINC000296118637 434515417 /nfs/dbraw/zinc/51/54/17/434515417.db2.gz ZZISIFJCXOFLKG-DQXYTYHJSA-N 2 0 301.478 3.419 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(N(C)C)cc1 ZINC000363792856 332248595 /nfs/dbraw/zinc/24/85/95/332248595.db2.gz OROXUJWLBWYLLU-QRQLOZEOSA-N 2 0 301.478 3.420 20 10 DGCDRP Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)CC2 ZINC000853240601 620680921 /nfs/dbraw/zinc/68/09/21/620680921.db2.gz OWJMWKLOHPFNQG-NVXWUHKLSA-N 2 0 300.446 3.091 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853239392 620681110 /nfs/dbraw/zinc/68/11/10/620681110.db2.gz GODGBDYLXRZOSR-HOCLYGCPSA-N 2 0 318.461 3.173 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c1O ZINC000894180756 618725208 /nfs/dbraw/zinc/72/52/08/618725208.db2.gz PXBASOIOENSFLX-INIZCTEOSA-N 2 0 320.477 3.453 20 10 DGCDRP COc1cc(C)cc(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)c1O ZINC000896950009 618992534 /nfs/dbraw/zinc/99/25/34/618992534.db2.gz AWHFFOLVNGHTDP-UHFFFAOYSA-N 2 0 318.461 3.206 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c(C(F)(F)F)c1 ZINC000841057302 619249161 /nfs/dbraw/zinc/24/91/61/619249161.db2.gz IYDSSUUDBAEDGS-OLZOCXBDSA-N 2 0 315.383 3.131 20 10 DGCDRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000902486962 619646525 /nfs/dbraw/zinc/64/65/25/619646525.db2.gz FUNCGPWFLVISSS-DZKIICNBSA-N 2 0 305.441 3.204 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@H]1C[NH3+] ZINC000904412073 619920349 /nfs/dbraw/zinc/92/03/49/619920349.db2.gz PEZOXMNYTGUUFV-AEFFLSMTSA-N 2 0 301.478 3.094 20 10 DGCDRP Cc1ccc(O)c(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000904473434 619924613 /nfs/dbraw/zinc/92/46/13/619924613.db2.gz ISSWHBAVPVDONK-YLJYHZDGSA-N 2 0 324.424 3.046 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)c1O ZINC000841086266 620226696 /nfs/dbraw/zinc/22/66/96/620226696.db2.gz GWMRLOOMHJDTEW-XJKSGUPXSA-N 2 0 308.853 3.318 20 10 DGCDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921688740 620934298 /nfs/dbraw/zinc/93/42/98/620934298.db2.gz DICHBQVDQZKRBJ-QGZVFWFLSA-N 2 0 302.462 3.222 20 10 DGCDRP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)CC1(C)C ZINC000858094770 621152064 /nfs/dbraw/zinc/15/20/64/621152064.db2.gz RVDKFTJZHQNULA-QGZVFWFLSA-N 2 0 301.478 3.249 20 10 DGCDRP C[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)CC1CC[NH+](C)CC1 ZINC000103462125 621378513 /nfs/dbraw/zinc/37/85/13/621378513.db2.gz FGBPADWUHXCQRT-UHFFFAOYSA-N 2 0 320.477 3.169 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(O)cc1C ZINC000768445679 622457080 /nfs/dbraw/zinc/45/70/80/622457080.db2.gz IBNWETGDVBBHRC-KRWDZBQOSA-N 2 0 318.461 3.160 20 10 DGCDRP CCOc1ccc(O)c(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)c1 ZINC000769469587 622530110 /nfs/dbraw/zinc/53/01/10/622530110.db2.gz AOIRVRAZZOMTDU-GDBMZVCRSA-N 2 0 306.450 3.096 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)cc1 ZINC000773757076 623068725 /nfs/dbraw/zinc/06/87/25/623068725.db2.gz YIFRJURBCFGZNN-VQIMIIECSA-N 2 0 303.494 3.447 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC000773766311 623070476 /nfs/dbraw/zinc/07/04/76/623070476.db2.gz RPJPIWSXUTVAEO-HKUYNNGSSA-N 2 0 301.478 3.059 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)c1 ZINC000873232179 623084587 /nfs/dbraw/zinc/08/45/87/623084587.db2.gz BEODVYNJTMNTJH-SFHVURJKSA-N 2 0 318.461 3.193 20 10 DGCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000873265955 623097924 /nfs/dbraw/zinc/09/79/24/623097924.db2.gz YGLOYONHFORDCN-XYVMCAHJSA-N 2 0 301.478 3.324 20 10 DGCDRP C[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)C1CC[NH2+]CC1 ZINC000873268887 623098575 /nfs/dbraw/zinc/09/85/75/623098575.db2.gz IYJWZVAIWHAVEN-KGLIPLIRSA-N 2 0 302.462 3.310 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3c3ccc[nH]3)cc2)CC1 ZINC000775630584 623299986 /nfs/dbraw/zinc/29/99/86/623299986.db2.gz MHSAWJHTKRBFJB-FQEVSTJZSA-N 2 0 324.472 3.104 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]4CCC[C@H]43)cc2)CC1 ZINC000775660246 623307004 /nfs/dbraw/zinc/30/70/04/623307004.db2.gz BAGCJBDZDROWFW-UYAOXDASSA-N 2 0 313.489 3.203 20 10 DGCDRP Cc1cccc(O)c1C[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000877045306 623775708 /nfs/dbraw/zinc/77/57/08/623775708.db2.gz VIWDIIXMYPSNMY-UHFFFAOYSA-N 2 0 302.393 3.191 20 10 DGCDRP C[N@@H+]1CC[C@H]([NH2+]CCCSc2nccs2)[C@@H]2CCC[C@H]21 ZINC000796772781 626080998 /nfs/dbraw/zinc/08/09/98/626080998.db2.gz VUMDGBSGUJPVKT-MELADBBJSA-N 2 0 311.520 3.088 20 10 DGCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1O ZINC000808675595 626848243 /nfs/dbraw/zinc/84/82/43/626848243.db2.gz MNJPYPMPXMDGQZ-STQMWFEESA-N 2 0 308.853 3.489 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N(C)C)c(C)c2)C[C@@H]1C ZINC000815057647 627620361 /nfs/dbraw/zinc/62/03/61/627620361.db2.gz WHZDQAACGPYWBQ-FUHWJXTLSA-N 2 0 303.494 3.366 20 10 DGCDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817947190 627970341 /nfs/dbraw/zinc/97/03/41/627970341.db2.gz MKBZCNHCTBEGND-GRDNDAEWSA-N 2 0 302.462 3.310 20 10 DGCDRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1cc2c(cc1O)CCCC2 ZINC000817960152 627976322 /nfs/dbraw/zinc/97/63/22/627976322.db2.gz KYZSKWOMZHTCOU-XCRHUMRWSA-N 2 0 302.462 3.439 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000817963814 627976924 /nfs/dbraw/zinc/97/69/24/627976924.db2.gz VRECOSXHLSEVFL-CHWSQXEVSA-N 2 0 300.402 3.271 20 10 DGCDRP CC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1cc(Br)ccc1O ZINC000817977887 627981946 /nfs/dbraw/zinc/98/19/46/627981946.db2.gz RCNHNYAHBCUSQA-ZWNOBZJWSA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1cc(F)ccc1O ZINC000817984332 627983482 /nfs/dbraw/zinc/98/34/82/627983482.db2.gz QOKNRUGBVUPFTQ-JIWOQCETSA-N 2 0 318.436 3.336 20 10 DGCDRP C[C@@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1ccccc1O ZINC000817984778 627983774 /nfs/dbraw/zinc/98/37/74/627983774.db2.gz ZSDJUDOIGJTBQJ-IGMKFADOSA-N 2 0 300.446 3.196 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(N(C)C)cc1 ZINC000817985206 627983793 /nfs/dbraw/zinc/98/37/93/627983793.db2.gz HCAZQOXKPRKMNF-MTNOOBJLSA-N 2 0 301.478 3.181 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1Cl ZINC000824933040 628708918 /nfs/dbraw/zinc/70/89/18/628708918.db2.gz ATLPQPPEKUDHKR-BBRMVZONSA-N 2 0 308.853 3.270 20 10 DGCDRP Cc1cc(O)c(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1Cl ZINC000825320377 628748759 /nfs/dbraw/zinc/74/87/59/628748759.db2.gz KCFXXPLBFMBQEQ-GOOCMWNKSA-N 2 0 308.853 3.459 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000835025046 629827899 /nfs/dbraw/zinc/82/78/99/629827899.db2.gz GBFSXYOKKARYRF-AATRIKPKSA-N 2 0 301.478 3.039 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000835030454 629829767 /nfs/dbraw/zinc/82/97/67/629829767.db2.gz YEHVCRBYEANRCM-FTKDCLMVSA-N 2 0 313.489 3.182 20 10 DGCDRP C[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)C[NH+]1CCCC1 ZINC000835034831 629830515 /nfs/dbraw/zinc/83/05/15/629830515.db2.gz FKLFJUZNUATPEZ-LXXRFIIISA-N 2 0 301.478 3.087 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCCC23CC[NH+](C)CC3)cc1 ZINC000835045395 629833986 /nfs/dbraw/zinc/83/39/86/629833986.db2.gz LNDBQJDXJCTMEB-GQCTYLIASA-N 2 0 313.489 3.326 20 10 DGCDRP CN(C)c1ccc(/C=C\CN(C)CCC[NH+]2CCCC2)cc1 ZINC000835050405 629836543 /nfs/dbraw/zinc/83/65/43/629836543.db2.gz ARPUYSPRGDOXJI-VURMDHGXSA-N 2 0 301.478 3.184 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1F ZINC000841057554 630403187 /nfs/dbraw/zinc/40/31/87/630403187.db2.gz PIRWDGUCZSRKAR-GOSISDBHSA-N 2 0 307.457 3.151 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cc1 ZINC000841084225 630406020 /nfs/dbraw/zinc/40/60/20/630406020.db2.gz XQEMBNHDCHITNT-BSWVIFLNSA-N 2 0 301.478 3.121 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)cc1F ZINC000841090666 630406686 /nfs/dbraw/zinc/40/66/86/630406686.db2.gz MJDKUNBTCMCNGJ-RDTXWAMCSA-N 2 0 307.457 3.089 20 10 DGCDRP COc1ccc(C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cc1C ZINC000842766360 630574112 /nfs/dbraw/zinc/57/41/12/630574112.db2.gz RLQQWHLVJDMDMC-UXHICEINSA-N 2 0 324.468 3.439 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3CCC(F)CC3)cc2)CC1 ZINC000842780931 630575592 /nfs/dbraw/zinc/57/55/92/630575592.db2.gz ZIGBEMFBZYGLTE-UHFFFAOYSA-N 2 0 319.468 3.056 20 10 DGCDRP CCCN(CCC)c1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)cc1 ZINC000843051704 630609011 /nfs/dbraw/zinc/60/90/11/630609011.db2.gz KSAYTYBGHVUEKG-APWZRJJASA-N 2 0 303.494 3.482 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@]1(C)CC[NH2+]C1 ZINC000843059466 630609843 /nfs/dbraw/zinc/60/98/43/630609843.db2.gz MJEKQJDJYMJBLS-LJQANCHMSA-N 2 0 301.478 3.108 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000843116861 630615251 /nfs/dbraw/zinc/61/52/51/630615251.db2.gz MWLAJRPAXKMLPY-HXUWFJFHSA-N 2 0 313.489 3.252 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)cc1 ZINC000843127015 630616597 /nfs/dbraw/zinc/61/65/97/630616597.db2.gz NXFXOVWBEVWKFW-LLHWWHOWSA-N 2 0 313.489 3.087 20 10 DGCDRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000843127311 630617092 /nfs/dbraw/zinc/61/70/92/630617092.db2.gz DVYPPXWZPDAMKE-UHFFFAOYSA-N 2 0 309.457 3.425 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC000843128305 630617165 /nfs/dbraw/zinc/61/71/65/630617165.db2.gz VTJBZUUKOKGGME-HZPDHXFCSA-N 2 0 318.461 3.003 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC000843128308 630617291 /nfs/dbraw/zinc/61/72/91/630617291.db2.gz VTJBZUUKOKGGME-JKSUJKDBSA-N 2 0 318.461 3.003 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cc2c(cc1O)CCCC2 ZINC000848557805 631691956 /nfs/dbraw/zinc/69/19/56/631691956.db2.gz LBLUUKXTESTRIN-CPUCHLNUSA-N 2 0 302.462 3.262 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)cc1F ZINC000849349533 631900825 /nfs/dbraw/zinc/90/08/25/631900825.db2.gz CDHXNRYSFGLNTF-KRWDZBQOSA-N 2 0 319.468 3.103 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000849350075 631900920 /nfs/dbraw/zinc/90/09/20/631900920.db2.gz JRVDBVLXLCWIPP-GOSISDBHSA-N 2 0 315.505 3.273 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)cc1C ZINC000849350744 631902039 /nfs/dbraw/zinc/90/20/39/631902039.db2.gz UTUZQWDLBBWDLE-QGZVFWFLSA-N 2 0 302.462 3.221 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4ccccc43)cc2)CC1 ZINC000850373770 632130380 /nfs/dbraw/zinc/13/03/80/632130380.db2.gz QAIHHVZLAPKLEB-OAQYLSRUSA-N 2 0 321.468 3.216 20 10 DGCDRP CCOc1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c(O)c1 ZINC000850420364 632146565 /nfs/dbraw/zinc/14/65/65/632146565.db2.gz NFGOVYRUUWQBKI-UHFFFAOYSA-N 2 0 318.461 3.003 20 10 DGCDRP Oc1cccc(Cl)c1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850421183 632147438 /nfs/dbraw/zinc/14/74/38/632147438.db2.gz WGMGCISWAKXXCV-UHFFFAOYSA-N 2 0 308.853 3.257 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000246894778 655552955 /nfs/dbraw/zinc/55/29/55/655552955.db2.gz UECOEFAOGXPMQS-FXAWDEMLSA-N 2 0 313.489 3.201 20 10 DGCDRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000068722633 655598488 /nfs/dbraw/zinc/59/84/88/655598488.db2.gz UGKDTUOAGZMADX-SFHVURJKSA-N 2 0 301.478 3.108 20 10 DGCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c1O ZINC000317473389 656619947 /nfs/dbraw/zinc/61/99/47/656619947.db2.gz CRFLJXRCKQXYSG-OAHLLOKOSA-N 2 0 324.852 3.018 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000092066055 657289280 /nfs/dbraw/zinc/28/92/80/657289280.db2.gz UECOEFAOGXPMQS-YLJYHZDGSA-N 2 0 313.489 3.201 20 10 DGCDRP CCOc1cccc(C[N@H+](CCC[NH3+])Cc2ccccc2)c1O ZINC000303985627 657583137 /nfs/dbraw/zinc/58/31/37/657583137.db2.gz HTPMKAUNGFEQNJ-UHFFFAOYSA-N 2 0 314.429 3.142 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C ZINC000172957381 659367522 /nfs/dbraw/zinc/36/75/22/659367522.db2.gz FWUIZHJTIIIWRH-KRWDZBQOSA-N 2 0 302.462 3.317 20 10 DGCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000179932002 659946500 /nfs/dbraw/zinc/94/65/00/659946500.db2.gz VUIODEJLJMDHSD-UHFFFAOYSA-N 2 0 308.441 3.475 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H](C[NH3+])C3)cc2)CC1 ZINC001576735251 1191866626 /nfs/dbraw/zinc/86/66/26/1191866626.db2.gz YIZJFTOBKLYJJM-ZWKOTPCHSA-N 2 0 301.478 3.140 20 10 DGCDRP COc1cc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])c(O)c(C(C)(C)C)c1 ZINC001579152678 1191967806 /nfs/dbraw/zinc/96/78/06/1191967806.db2.gz AAJFETRPQHBMJS-GUYCJALGSA-N 2 0 320.477 3.305 20 10 DGCDRP Cc1ccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(O)c1 ZINC001579696724 1191987833 /nfs/dbraw/zinc/98/78/33/1191987833.db2.gz BPVYAXKWNSFKGK-FXAWDEMLSA-N 2 0 324.424 3.046 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(O)c1 ZINC001621118662 1192646725 /nfs/dbraw/zinc/64/67/25/1192646725.db2.gz SUIBWKDJPSRWOK-MRXNPFEDSA-N 2 0 318.461 3.017 20 10 DGCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC001332422438 1178442507 /nfs/dbraw/zinc/44/25/07/1178442507.db2.gz WBAVKAPIYWNFEP-XWESNNAXSA-N 2 0 300.446 3.371 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001349326514 1179893392 /nfs/dbraw/zinc/89/33/92/1179893392.db2.gz ZNLBTCRZPFBACY-UHFFFAOYSA-N 2 0 301.478 3.027 20 10 DGCDRP c1cc(N2CCCC2)ccc1CN1CCC([NH2+]CC2CC2)CC1 ZINC001349319699 1179893484 /nfs/dbraw/zinc/89/34/84/1179893484.db2.gz PDDQZGVPDUVTIA-UHFFFAOYSA-N 2 0 313.489 3.251 20 10 DGCDRP CCOCc1cc(C[NH2+]CCC2CC[NH+](C)CC2)ccc1OC ZINC001200244043 1180480806 /nfs/dbraw/zinc/48/08/06/1180480806.db2.gz PLAFYUSHVIIDEE-UHFFFAOYSA-N 2 0 320.477 3.053 20 10 DGCDRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560571050 1189343234 /nfs/dbraw/zinc/34/32/34/1189343234.db2.gz FMUYHFLPWSMUGX-VQIMIIECSA-N 2 0 315.505 3.353 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC4(C3)CCCC4)cc2)CC1 ZINC001665542151 1197150102 /nfs/dbraw/zinc/15/01/02/1197150102.db2.gz FOHXBJBYDMXQNQ-UHFFFAOYSA-N 2 0 313.489 3.251 20 10 DGCDRP CC[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304579 1082124552 /nfs/dbraw/zinc/12/45/52/1082124552.db2.gz VPPXEEFFRRMMEY-GOSISDBHSA-N 2 0 301.478 3.203 20 10 DGCDRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001183533939 1083974116 /nfs/dbraw/zinc/97/41/16/1083974116.db2.gz NWMVEXMATYORIP-UWVAXJGDSA-N 2 0 315.505 3.353 20 10 DGCDRP N[C@H](c1ccccc1O)[C@H]([NH2+][C@H]1C[C@H]2C[C@H]2C1)c1ccccc1O ZINC001167915119 1084654889 /nfs/dbraw/zinc/65/48/89/1084654889.db2.gz ZQWDATIECIIJAA-DIJDKNKZSA-N 2 0 324.424 3.227 20 10 DGCDRP Oc1cccc2c1C[N@@H+](C1C[C@H]3CC[C@@H](C1)[NH+]3CC1CC1)CC2 ZINC001168001948 1086107937 /nfs/dbraw/zinc/10/79/37/1086107937.db2.gz AMAQVUHNMFBAKA-JWTNVVGKSA-N 2 0 312.457 3.156 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c2ccccc21 ZINC001204235220 1090931862 /nfs/dbraw/zinc/93/18/62/1090931862.db2.gz KPBSAHJZLRJNCW-AEFFLSMTSA-N 2 0 323.484 3.289 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c1O ZINC001204741930 1091026982 /nfs/dbraw/zinc/02/69/82/1091026982.db2.gz FVWDEHRACRGONV-UHFFFAOYSA-N 2 0 308.853 3.320 20 10 DGCDRP C[C@]1([NH3+])CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001205266709 1091157404 /nfs/dbraw/zinc/15/74/04/1091157404.db2.gz WMQXPFSEHKSZME-IBGZPJMESA-N 2 0 301.478 3.380 20 10 DGCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001205591422 1091270751 /nfs/dbraw/zinc/27/07/51/1091270751.db2.gz MNQJAQKCTYXGIG-AWEZNQCLSA-N 2 0 320.330 3.064 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)cc1 ZINC001205603495 1091275694 /nfs/dbraw/zinc/27/56/94/1091275694.db2.gz PGWXXDJFFQEEAE-SJLPKXTDSA-N 2 0 303.494 3.340 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@H]1C[NH3+] ZINC001205616825 1091282629 /nfs/dbraw/zinc/28/26/29/1091282629.db2.gz HBWSTUWBUBEBGY-MJGOQNOKSA-N 2 0 315.505 3.484 20 10 DGCDRP C[C@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCC[C@@H]1C[NH3+] ZINC001206012512 1091449469 /nfs/dbraw/zinc/44/94/69/1091449469.db2.gz MAFGOEPVORPYPQ-LSDHHAIUSA-N 2 0 304.478 3.497 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)cc(C[NH+](C)C)c1O ZINC001139258052 1091501426 /nfs/dbraw/zinc/50/14/26/1091501426.db2.gz KVIFUGSSTRYAFP-NVXWUHKLSA-N 2 0 318.461 3.227 20 10 DGCDRP CCC[N@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)[C@H](C)CC ZINC001139253073 1091501749 /nfs/dbraw/zinc/50/17/49/1091501749.db2.gz KOVQZLMBJXFSEE-CQSZACIVSA-N 2 0 308.466 3.473 20 10 DGCDRP C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139404591 1091550142 /nfs/dbraw/zinc/55/01/42/1091550142.db2.gz PVWSUUJEDUMCHU-IRXDYDNUSA-N 2 0 301.478 3.201 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC001139408066 1091551776 /nfs/dbraw/zinc/55/17/76/1091551776.db2.gz JHDGNYRVFGIJKE-MSOLQXFVSA-N 2 0 315.505 3.306 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](C)C1 ZINC001139409912 1091552216 /nfs/dbraw/zinc/55/22/16/1091552216.db2.gz UZMWGBNKBAFOHV-IAGOWNOFSA-N 2 0 301.478 3.059 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]4CCC[C@H]4C3)cc2)CC1 ZINC001139408985 1091552415 /nfs/dbraw/zinc/55/24/15/1091552415.db2.gz RQRYOECKTSJOIX-MOPGFXCFSA-N 2 0 313.489 3.060 20 10 DGCDRP COc1cc(O)c(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)c(Cl)c1 ZINC001206325768 1091581570 /nfs/dbraw/zinc/58/15/70/1091581570.db2.gz JKGGSCVUPCNRQI-INIZCTEOSA-N 2 0 312.841 3.005 20 10 DGCDRP COc1ccc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)c([O-])c1Cl ZINC001206327461 1091581770 /nfs/dbraw/zinc/58/17/70/1091581770.db2.gz WRKOMLUZJWSVMK-INIZCTEOSA-N 2 0 312.841 3.005 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCCC[C@](C)(C[NH3+])C3)ccc21 ZINC001206550044 1091665434 /nfs/dbraw/zinc/66/54/34/1091665434.db2.gz UBDLLLCWEYQXCV-LJQANCHMSA-N 2 0 301.478 3.020 20 10 DGCDRP CC(C)[N@H+](Cc1ccc2c(c1)CCCN2C)[C@H]1CCC[NH2+]CC1 ZINC001206591590 1091681610 /nfs/dbraw/zinc/68/16/10/1091681610.db2.gz TWAOLKNSVUFVAN-IBGZPJMESA-N 2 0 315.505 3.422 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)c(OC)c1 ZINC001206616796 1091689722 /nfs/dbraw/zinc/68/97/22/1091689722.db2.gz QHLBPWKIEFRXER-MRXNPFEDSA-N 2 0 319.493 3.102 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C)CC3)cc2)CC1 ZINC001140301950 1091817909 /nfs/dbraw/zinc/81/79/09/1091817909.db2.gz FHTKEXJKVMDNIH-GOSISDBHSA-N 2 0 315.505 3.451 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C)[C@H]3C)cc2)CC1 ZINC001140304029 1091820389 /nfs/dbraw/zinc/82/03/89/1091820389.db2.gz FBAMUINLKJBCNZ-ZWKOTPCHSA-N 2 0 315.505 3.449 20 10 DGCDRP Cc1c(O)ccc(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c1O ZINC001140746235 1091983726 /nfs/dbraw/zinc/98/37/26/1091983726.db2.gz WRMKDIOQESNRFY-KRWDZBQOSA-N 2 0 318.461 3.247 20 10 DGCDRP Cc1c(C[NH+]2CCC3(CC[N@H+](C)C3)CC2)c2ccccc2n1C ZINC001276557265 1092204160 /nfs/dbraw/zinc/20/41/60/1092204160.db2.gz WYJGZMMZVBGTLT-UHFFFAOYSA-N 2 0 311.473 3.404 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])c1O ZINC000404315962 1094253884 /nfs/dbraw/zinc/25/38/84/1094253884.db2.gz OEYNQWIIOGITND-BXUZGUMPSA-N 2 0 312.841 3.004 20 10 DGCDRP CCc1cccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)c1O ZINC001336888809 1094774148 /nfs/dbraw/zinc/77/41/48/1094774148.db2.gz MKOHYARODVEMEL-SZMVWBNQSA-N 2 0 302.462 3.117 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001116588336 1095609032 /nfs/dbraw/zinc/60/90/32/1095609032.db2.gz CTMRUIDLZNSIHS-JKSUJKDBSA-N 2 0 320.477 3.197 20 10 DGCDRP Cc1cc(C)c(C[N@@H+]2C[C@@H](c3ccccc3)C3(C[NH2+]C3)C2)c(O)c1 ZINC001222608465 1095689447 /nfs/dbraw/zinc/68/94/47/1095689447.db2.gz AFSJOOPVRJKXSF-IBGZPJMESA-N 2 0 322.452 3.198 20 10 DGCDRP Cc1cccc(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c1O ZINC001231591956 1097787036 /nfs/dbraw/zinc/78/70/36/1097787036.db2.gz DDFITOOVZJNTST-WOJBJXKFSA-N 2 0 322.452 3.264 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@H](C)C2)cc1 ZINC001175775502 1098168040 /nfs/dbraw/zinc/16/80/40/1098168040.db2.gz RITQHWIUPWWUFS-QGZVFWFLSA-N 2 0 324.472 3.248 20 10 DGCDRP C[NH+]1CCC2(C[NH+](Cc3cc(C(C)(C)C)ccc3O)C2)CC1 ZINC001233286610 1098276336 /nfs/dbraw/zinc/27/63/36/1098276336.db2.gz ATUHFYBWGJPMTA-UHFFFAOYSA-N 2 0 302.462 3.217 20 10 DGCDRP C[N@@H+](Cc1ccc(C(F)(F)F)cc1O)CC1CC[NH+](C)CC1 ZINC001233454449 1098340776 /nfs/dbraw/zinc/34/07/76/1098340776.db2.gz VKQZKAWRXKFHMQ-UHFFFAOYSA-N 2 0 316.367 3.185 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c2ccccc21 ZINC001235270898 1098939094 /nfs/dbraw/zinc/93/90/94/1098939094.db2.gz NTBUSHNVBBLLEZ-APWZRJJASA-N 2 0 309.457 3.090 20 10 DGCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c1 ZINC001235351199 1098973327 /nfs/dbraw/zinc/97/33/27/1098973327.db2.gz ONTGTXJLVHKCSG-TZIWHRDSSA-N 2 0 322.452 3.280 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@H]3F)c1 ZINC001235400224 1098995806 /nfs/dbraw/zinc/99/58/06/1098995806.db2.gz CRIYVJBBLBAXAM-IEBWSBKVSA-N 2 0 320.452 3.213 20 10 DGCDRP Cc1c(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@@H]3F)c2ccccc2n1C ZINC001235404187 1099001360 /nfs/dbraw/zinc/00/13/60/1099001360.db2.gz MZSIYVBRFDKHEX-RBUKOAKNSA-N 2 0 315.436 3.010 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@H]3F)cc1 ZINC001235403690 1099002926 /nfs/dbraw/zinc/00/29/26/1099002926.db2.gz LVFIAPALVAMNIJ-MOPGFXCFSA-N 2 0 319.468 3.056 20 10 DGCDRP Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1O ZINC001235420612 1099012310 /nfs/dbraw/zinc/01/23/10/1099012310.db2.gz ACUVUDXPKXIJRE-HUUCEWRRSA-N 2 0 306.425 3.051 20 10 DGCDRP Cc1ccc(C)c(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1O ZINC001235428669 1099022849 /nfs/dbraw/zinc/02/28/49/1099022849.db2.gz OSGWSZSAGPOJDG-IRXDYDNUSA-N 2 0 302.462 3.221 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)cc1 ZINC001235928616 1099265342 /nfs/dbraw/zinc/26/53/42/1099265342.db2.gz BCWLVAGFOVWCQI-RTBURBONSA-N 2 0 309.457 3.135 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)cc1 ZINC001235928610 1099265456 /nfs/dbraw/zinc/26/54/56/1099265456.db2.gz BCWLVAGFOVWCQI-MOPGFXCFSA-N 2 0 309.457 3.135 20 10 DGCDRP c1ccc([C@H]2CC[N@H+]2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235949502 1099284350 /nfs/dbraw/zinc/28/43/50/1099284350.db2.gz MUYGZVHETMJYGI-HXUWFJFHSA-N 2 0 307.441 3.043 20 10 DGCDRP CCC[N@H+](Cc1ccc2c(c1)CCCN2C)C1CC[NH2+]CC1 ZINC001236182473 1099453558 /nfs/dbraw/zinc/45/35/58/1099453558.db2.gz POBRFDRRHMSTJY-UHFFFAOYSA-N 2 0 301.478 3.033 20 10 DGCDRP Cc1cc(O)c(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)cc1Cl ZINC001236600394 1099697161 /nfs/dbraw/zinc/69/71/61/1099697161.db2.gz HUKNEFDNFGNNMO-CYBMUJFWSA-N 2 0 308.853 3.318 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c2ccccc21 ZINC001236817505 1099806084 /nfs/dbraw/zinc/80/60/84/1099806084.db2.gz CCFCBWGYYRBTCI-SNRMKQJTSA-N 2 0 309.457 3.075 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c2ccccc21 ZINC001236817502 1099807163 /nfs/dbraw/zinc/80/71/63/1099807163.db2.gz CCFCBWGYYRBTCI-KFKAGJAMSA-N 2 0 309.457 3.075 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc1 ZINC001237379615 1100098012 /nfs/dbraw/zinc/09/80/12/1100098012.db2.gz CCGBSAIEODQGSC-MJGOQNOKSA-N 2 0 301.478 3.107 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC001237386756 1100103366 /nfs/dbraw/zinc/10/33/66/1100103366.db2.gz AFZKSIAWZYIISU-ICSRJNTNSA-N 2 0 313.489 3.251 20 10 DGCDRP C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001199227747 1102086744 /nfs/dbraw/zinc/08/67/44/1102086744.db2.gz LBCQBZUXRMSAQE-FUHWJXTLSA-N 2 0 301.478 3.107 20 10 DGCDRP C[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC001201930471 1102752807 /nfs/dbraw/zinc/75/28/07/1102752807.db2.gz ZNBCGHAQQWOERU-SFHVURJKSA-N 2 0 323.484 3.332 20 10 DGCDRP CC[C@H](C[C@@H](C)CC)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246171813 1104419307 /nfs/dbraw/zinc/41/93/07/1104419307.db2.gz DYLWRJOWJSHUPT-FUHWJXTLSA-N 2 0 303.494 3.401 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](Cc3ccccc3)C2)cc1 ZINC001246314436 1104484294 /nfs/dbraw/zinc/48/42/94/1104484294.db2.gz XNCQSUNNSJXKHD-PMACEKPBSA-N 2 0 323.484 3.206 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC001246517956 1104574102 /nfs/dbraw/zinc/57/41/02/1104574102.db2.gz BZCJRQMOJAWCIC-KSSFIOAISA-N 2 0 302.462 3.364 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246523388 1104577452 /nfs/dbraw/zinc/57/74/52/1104577452.db2.gz GXGKQTUPBQBBHR-LBTNJELSSA-N 2 0 302.462 3.363 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H]1CCC2(C[NH2+]C2)C1 ZINC001246524130 1104578023 /nfs/dbraw/zinc/57/80/23/1104578023.db2.gz JSJXMIVYPLQFAZ-KBXCAEBGSA-N 2 0 314.473 3.364 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246527668 1104578240 /nfs/dbraw/zinc/57/82/40/1104578240.db2.gz UCFAFCPBNPSSPC-YGTYGHESSA-N 2 0 314.473 3.220 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CC[NH2+][C@@H](C(C)C)C1 ZINC001246924389 1104740527 /nfs/dbraw/zinc/74/05/27/1104740527.db2.gz MFFVBEOUGYFTRE-RTBURBONSA-N 2 0 303.494 3.351 20 10 DGCDRP CN(C)c1ccc(CN2CCC[C@@]3(CC[N@H+](C)C3)C2)c(Cl)c1 ZINC001276156037 1105033366 /nfs/dbraw/zinc/03/33/66/1105033366.db2.gz MLCJFBKRVPMWII-SFHVURJKSA-N 2 0 321.896 3.324 20 10 DGCDRP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001255944377 1106346233 /nfs/dbraw/zinc/34/62/33/1106346233.db2.gz VMAPFWBJMZAMDL-QGZVFWFLSA-N 2 0 303.494 3.497 20 10 DGCDRP CC(C)[NH+]1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000393544600 1109032093 /nfs/dbraw/zinc/03/20/93/1109032093.db2.gz IVONKWJQALPKKH-UHFFFAOYSA-N 2 0 301.478 3.249 20 10 DGCDRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](C)C1 ZINC001308269408 1111407590 /nfs/dbraw/zinc/40/75/90/1111407590.db2.gz QWYSNUVFQGYKMK-FUHIMQAGSA-N 2 0 315.505 3.353 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)cc1F ZINC001308553122 1111443296 /nfs/dbraw/zinc/44/32/96/1111443296.db2.gz HETCWGRLVYBSND-JFIYKMOQSA-N 2 0 319.468 3.102 20 10 DGCDRP CC(C)[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308920129 1111493515 /nfs/dbraw/zinc/49/35/15/1111493515.db2.gz ZWKMLGMQTHXQRB-WOJBJXKFSA-N 2 0 315.505 3.353 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@@H]4CCCC[C@H]34)cc2)CC1 ZINC001308917674 1111493663 /nfs/dbraw/zinc/49/36/63/1111493663.db2.gz DQCISVMTJPDPRJ-YSIASYRMSA-N 2 0 313.489 3.107 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)CC1CC[NH+](C)CC1 ZINC000093088684 193202485 /nfs/dbraw/zinc/20/24/85/193202485.db2.gz NNUJKLLHVBUZCX-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000093563587 193268790 /nfs/dbraw/zinc/26/87/90/193268790.db2.gz OVXSOFGSFCSXOO-LJQANCHMSA-N 2 0 301.478 3.203 20 10 DGCDRP CCCOc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c(O)c1 ZINC000278463882 130693793 /nfs/dbraw/zinc/69/37/93/130693793.db2.gz FRXAJQAXCFGGJQ-UHFFFAOYSA-N 2 0 318.461 3.145 20 10 DGCDRP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(N(C)C)cc1 ZINC000269013671 432151622 /nfs/dbraw/zinc/15/16/22/432151622.db2.gz ODMCAZKFAUPANT-HNNXBMFYSA-N 2 0 301.478 3.420 20 10 DGCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3c(O)cccc3Cl)C2)CC1 ZINC000290478020 277032880 /nfs/dbraw/zinc/03/28/80/277032880.db2.gz NXMUFDOSQZALIW-CQSZACIVSA-N 2 0 308.853 3.209 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)[C@H](C)C1 ZINC000173362635 432274027 /nfs/dbraw/zinc/27/40/27/432274027.db2.gz WLFCGFDGJAFYMB-VQIMIIECSA-N 2 0 301.478 3.107 20 10 DGCDRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(F)ccc1O ZINC000184937545 432448064 /nfs/dbraw/zinc/44/80/64/432448064.db2.gz UPRZLPSCNWYCCS-CYBMUJFWSA-N 2 0 302.393 3.444 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc2c(cc1O)CCCC2 ZINC000184997681 432453753 /nfs/dbraw/zinc/45/37/53/432453753.db2.gz VMYULVXJILNGIL-LSDHHAIUSA-N 2 0 314.473 3.406 20 10 DGCDRP C[C@H]([NH2+]Cc1ccccc1O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272183382 432457392 /nfs/dbraw/zinc/45/73/92/432457392.db2.gz KNSVTZPQIHCRBO-QFBILLFUSA-N 2 0 310.441 3.392 20 10 DGCDRP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cc(OC)ccc2O)CC1 ZINC000192844578 432420772 /nfs/dbraw/zinc/42/07/72/432420772.db2.gz QYDXLUMOFNZFCD-AWEZNQCLSA-N 2 0 306.450 3.316 20 10 DGCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000743387620 575048449 /nfs/dbraw/zinc/04/84/49/575048449.db2.gz LLIOISBWRRHVOJ-OAHLLOKOSA-N 2 0 302.462 3.045 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc(F)ccc1O ZINC000853240020 620680951 /nfs/dbraw/zinc/68/09/51/620680951.db2.gz LOZBBPQQJBDKKR-UKRRQHHQSA-N 2 0 306.425 3.304 20 10 DGCDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000854230453 620786325 /nfs/dbraw/zinc/78/63/25/620786325.db2.gz QJNPUFVTOIJRHB-ZWNOBZJWSA-N 2 0 315.255 3.179 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000925780799 618618133 /nfs/dbraw/zinc/61/81/33/618618133.db2.gz GZLCINGRXBCCJU-SWLSCSKDSA-N 2 0 324.415 3.166 20 10 DGCDRP CC1([NH+]2CCC2)CCC([NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000927037277 619259696 /nfs/dbraw/zinc/25/96/96/619259696.db2.gz MLLXXJFBPLSHOR-KOHRHEQBSA-N 2 0 300.446 3.376 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)ccc1N(C)C ZINC000923365137 621178842 /nfs/dbraw/zinc/17/88/42/621178842.db2.gz UALFGMBVYOKIOP-MJGOQNOKSA-N 2 0 301.478 3.025 20 10 DGCDRP Cc1cc(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)ccc1N(C)C ZINC000923382320 621180469 /nfs/dbraw/zinc/18/04/69/621180469.db2.gz BVIWJLIWHFDXHA-MRXNPFEDSA-N 2 0 301.478 3.025 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)c2c1c(F)ccc2O ZINC000858490664 621197571 /nfs/dbraw/zinc/19/75/71/621197571.db2.gz LKSKNMYGRZHIGH-UMVBOHGHSA-N 2 0 306.425 3.401 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000839182847 621343670 /nfs/dbraw/zinc/34/36/70/621343670.db2.gz QPFDCHTUEQSOOH-MJICGBHWSA-N 2 0 301.478 3.087 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000839182848 621343801 /nfs/dbraw/zinc/34/38/01/621343801.db2.gz QPFDCHTUEQSOOH-SUZKBHRPSA-N 2 0 301.478 3.087 20 10 DGCDRP CCOCc1cc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)ccc1OC ZINC000839183262 621344801 /nfs/dbraw/zinc/34/48/01/621344801.db2.gz VOPSRTYRDBWUHE-INIZCTEOSA-N 2 0 320.477 3.053 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2c1c(F)ccc2O ZINC000756402610 621635429 /nfs/dbraw/zinc/63/54/29/621635429.db2.gz VXDCMCHNEQGYNF-JMSVASOKSA-N 2 0 304.409 3.154 20 10 DGCDRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)C[NH+]1CCCC1 ZINC000756422846 621637661 /nfs/dbraw/zinc/63/76/61/621637661.db2.gz MQEIWGAAAJPSOM-UMVBOHGHSA-N 2 0 306.425 3.401 20 10 DGCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC000756450212 621639578 /nfs/dbraw/zinc/63/95/78/621639578.db2.gz RCEJVFWOIBZPOC-GZBFAFLISA-N 2 0 306.425 3.401 20 10 DGCDRP C[C@@H](c1cccnc1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000757892320 621745353 /nfs/dbraw/zinc/74/53/53/621745353.db2.gz RPGJZQQFAGZEAJ-KRWDZBQOSA-N 2 0 324.472 3.026 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1F ZINC000769328356 622518381 /nfs/dbraw/zinc/51/83/81/622518381.db2.gz GKPOLLJJQWKJJE-UHFFFAOYSA-N 2 0 321.484 3.446 20 10 DGCDRP CC[C@H](C)C[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000771828741 622800203 /nfs/dbraw/zinc/80/02/03/622800203.db2.gz BPVPLFGAPMYBAV-HNNXBMFYSA-N 2 0 307.457 3.103 20 10 DGCDRP CCC1([NH+](C)C)CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000872669255 622950215 /nfs/dbraw/zinc/95/02/15/622950215.db2.gz DGOZOJDHYWQHCT-UHFFFAOYSA-N 2 0 313.445 3.247 20 10 DGCDRP CCC1([NH+](C)C)CC[NH+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000872668392 622950239 /nfs/dbraw/zinc/95/02/39/622950239.db2.gz GPGXEKPQXCDXLM-UHFFFAOYSA-N 2 0 302.462 3.187 20 10 DGCDRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc2c(cc1O)CCCC2 ZINC000873239802 623087461 /nfs/dbraw/zinc/08/74/61/623087461.db2.gz CXXOKEXCFHYNRS-CKEIUWERSA-N 2 0 302.462 3.439 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000873257410 623093382 /nfs/dbraw/zinc/09/33/82/623093382.db2.gz UTXUJTDITMFRRX-OFQRWUPVSA-N 2 0 305.441 3.204 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(N2CCCCCC2)cc1 ZINC000873257424 623093721 /nfs/dbraw/zinc/09/37/21/623093721.db2.gz HGFRNBMXBSEUNO-BQFCYCMXSA-N 2 0 301.478 3.455 20 10 DGCDRP C[N@H+](Cc1cccs1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775643473 623301746 /nfs/dbraw/zinc/30/17/46/623301746.db2.gz YRWHEFYVQOROAJ-UHFFFAOYSA-N 2 0 315.486 3.132 20 10 DGCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC000775652943 623304624 /nfs/dbraw/zinc/30/46/24/623304624.db2.gz WMXXZQIRNOVTDF-UHFFFAOYSA-N 2 0 301.478 3.203 20 10 DGCDRP CC(C)C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775689319 623314477 /nfs/dbraw/zinc/31/44/77/623314477.db2.gz CRXWFEJGXNNIDD-IBGZPJMESA-N 2 0 315.505 3.306 20 10 DGCDRP C[C@H]1CC[C@H](C)[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775702752 623315814 /nfs/dbraw/zinc/31/58/14/623315814.db2.gz WLTHQWKBLWLTPL-IRXDYDNUSA-N 2 0 301.478 3.059 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000796694289 626074142 /nfs/dbraw/zinc/07/41/42/626074142.db2.gz KZNPKPNRUFKILB-XUVXKRRUSA-N 2 0 315.505 3.495 20 10 DGCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1O ZINC000808675592 626848050 /nfs/dbraw/zinc/84/80/50/626848050.db2.gz MNJPYPMPXMDGQZ-CHWSQXEVSA-N 2 0 308.853 3.489 20 10 DGCDRP CCC1([NH+]2CCC2)CC[NH+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000884475219 626886122 /nfs/dbraw/zinc/88/61/22/626886122.db2.gz BQIXHFHLAFEUIW-UHFFFAOYSA-N 2 0 314.473 3.331 20 10 DGCDRP CSC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC[NH+](C)CC1 ZINC000810252892 626993487 /nfs/dbraw/zinc/99/34/87/626993487.db2.gz WFHAFVHXYYPDEE-HNNXBMFYSA-N 2 0 322.518 3.487 20 10 DGCDRP CC[C@@H]([NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1)c1ccccc1O ZINC000925886914 627812257 /nfs/dbraw/zinc/81/22/57/627812257.db2.gz MYZPQHYAZANMTR-POAQFYNOSA-N 2 0 310.441 3.492 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1 ZINC000816641727 627818360 /nfs/dbraw/zinc/81/83/60/627818360.db2.gz CZYSSJHCWPUTLK-HXUWFJFHSA-N 2 0 315.505 3.451 20 10 DGCDRP C[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccc4ccccc4c3O)C2)C1 ZINC000816642073 627818560 /nfs/dbraw/zinc/81/85/60/627818560.db2.gz OQHMNSMIXZPZOH-FQEVSTJZSA-N 2 0 310.441 3.463 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](Cc1ccccc1)[C@@H](C)[NH3+] ZINC000817894843 627954474 /nfs/dbraw/zinc/95/44/74/627954474.db2.gz QRVZSFSHBSGROH-UZLBHIALSA-N 2 0 311.473 3.109 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817946475 627970814 /nfs/dbraw/zinc/97/08/14/627970814.db2.gz XYSLWWIVSZKJLV-IRXDYDNUSA-N 2 0 301.478 3.327 20 10 DGCDRP C[C@H]([NH2+]CCc1ccc(N)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000817957250 627974040 /nfs/dbraw/zinc/97/40/40/627974040.db2.gz KEGYKEIEVKDNGW-FXAWDEMLSA-N 2 0 323.484 3.312 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]([NH3+])C(C)C)c1ccc(C(F)(F)F)cc1O ZINC000817957528 627974860 /nfs/dbraw/zinc/97/48/60/627974860.db2.gz CNMDXVMRPLRFFN-STQMWFEESA-N 2 0 304.356 3.435 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000817970465 627978575 /nfs/dbraw/zinc/97/85/75/627978575.db2.gz WHNOJOHECDPVTQ-LEWSCRJBSA-N 2 0 316.367 3.450 20 10 DGCDRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)cc1 ZINC000817969090 627978597 /nfs/dbraw/zinc/97/85/97/627978597.db2.gz RJPHSDINXZIRCQ-FUHWJXTLSA-N 2 0 301.478 3.470 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccc(Br)cc1O ZINC000817970430 627978993 /nfs/dbraw/zinc/97/89/93/627978993.db2.gz VDZGTFXEUCMYKY-ZMLRMANQSA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000817971197 627979881 /nfs/dbraw/zinc/97/98/81/627979881.db2.gz KKEHYUWFIWEFMY-TXPKVOOTSA-N 2 0 301.478 3.326 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cc(Cl)ccc1O ZINC000817985294 627983409 /nfs/dbraw/zinc/98/34/09/627983409.db2.gz BYIGQUJTXMWZDJ-DMEJVMROSA-N 2 0 308.853 3.474 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(N2CCCCC2)cc1 ZINC000817982476 627983841 /nfs/dbraw/zinc/98/38/41/627983841.db2.gz SSPHEXLSWUWDTO-LZLYRXPVSA-N 2 0 301.478 3.455 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000817987536 627984340 /nfs/dbraw/zinc/98/43/40/627984340.db2.gz UCMQDCTWTFDFDN-VIBAHUMZSA-N 2 0 314.473 3.310 20 10 DGCDRP Cc1cc(O)c(CN2CC[C@H](C[NH+]3CCCC3)C2)cc1Cl ZINC000824854943 628700836 /nfs/dbraw/zinc/70/08/36/628700836.db2.gz DRIOFFQUEOJCLE-CQSZACIVSA-N 2 0 308.853 3.272 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC000825182798 628735393 /nfs/dbraw/zinc/73/53/93/628735393.db2.gz AGHUKHHGUDUEJV-MRXNPFEDSA-N 2 0 301.478 3.107 20 10 DGCDRP C[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)C[NH+]1CCCC1 ZINC000835034828 629830493 /nfs/dbraw/zinc/83/04/93/629830493.db2.gz FKLFJUZNUATPEZ-DKRLNXSXSA-N 2 0 301.478 3.087 20 10 DGCDRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841030948 630397922 /nfs/dbraw/zinc/39/79/22/630397922.db2.gz PYDDWVPPLYRDNJ-MJGOQNOKSA-N 2 0 301.478 3.284 20 10 DGCDRP CC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC[NH2+]CC1 ZINC000841054877 630403099 /nfs/dbraw/zinc/40/30/99/630403099.db2.gz PKRNOMJNMSYUKM-UHFFFAOYSA-N 2 0 301.478 3.156 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)c(C(F)(F)F)c1 ZINC000841058753 630403173 /nfs/dbraw/zinc/40/31/73/630403173.db2.gz UAJUBADHVMBKNZ-ZDUSSCGKSA-N 2 0 315.383 3.003 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@]1(C)C[NH3+] ZINC000841088118 630406927 /nfs/dbraw/zinc/40/69/27/630406927.db2.gz YACITSBXMKSJQM-VQIMIIECSA-N 2 0 301.478 3.094 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000843043656 630607442 /nfs/dbraw/zinc/60/74/42/630607442.db2.gz ATECCGBFYCKNLD-SGSXCFNPSA-N 2 0 313.489 3.230 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC(CC[NH2+]C)CC2)cc1 ZINC000843057868 630609408 /nfs/dbraw/zinc/60/94/08/630609408.db2.gz WCIYGMMKQZVDRU-UHFFFAOYSA-N 2 0 303.494 3.354 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000843127011 630616543 /nfs/dbraw/zinc/61/65/43/630616543.db2.gz NXFXOVWBEVWKFW-GNAXCBTBSA-N 2 0 313.489 3.087 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126646 630616726 /nfs/dbraw/zinc/61/67/26/630616726.db2.gz MNOKTBBZQMJAGH-MJGOQNOKSA-N 2 0 315.505 3.273 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CC[C@@H]2CCC[NH2+]C2)cc1 ZINC000844220677 630712734 /nfs/dbraw/zinc/71/27/34/630712734.db2.gz JLGYFPINFAURMF-KRWDZBQOSA-N 2 0 303.494 3.354 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c1O ZINC000846138983 631211452 /nfs/dbraw/zinc/21/14/52/631211452.db2.gz ZGYYTEDKRLFDEV-CABCVRRESA-N 2 0 306.450 3.316 20 10 DGCDRP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(OC)c2O)CC1 ZINC000846142011 631211650 /nfs/dbraw/zinc/21/16/50/631211650.db2.gz QMKQEIGVILKLEX-AWEZNQCLSA-N 2 0 306.450 3.316 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c1O ZINC000846146981 631212053 /nfs/dbraw/zinc/21/20/53/631212053.db2.gz UFFSPYBKHAEHAW-CABCVRRESA-N 2 0 306.450 3.173 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)c1O ZINC000846150549 631212380 /nfs/dbraw/zinc/21/23/80/631212380.db2.gz RHOMSUINENZHIZ-AWEZNQCLSA-N 2 0 318.461 3.458 20 10 DGCDRP CCc1cccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c1O ZINC000848898053 631777641 /nfs/dbraw/zinc/77/76/41/631777641.db2.gz PHECIWLUJIZYCO-UHFFFAOYSA-N 2 0 302.462 3.451 20 10 DGCDRP CCc1cccc(C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)c1O ZINC000848919923 631787890 /nfs/dbraw/zinc/78/78/90/631787890.db2.gz VULUMQFDPYAUBR-UXHICEINSA-N 2 0 324.468 3.390 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000850584077 632202406 /nfs/dbraw/zinc/20/24/06/632202406.db2.gz QGKZQSSAMCPIEX-AWEZNQCLSA-N 2 0 318.461 3.173 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000164537782 658937621 /nfs/dbraw/zinc/93/76/21/658937621.db2.gz OFYVKLGKVSSKBW-APWZRJJASA-N 2 0 314.473 3.458 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000179569341 659932919 /nfs/dbraw/zinc/93/29/19/659932919.db2.gz ZYSXGRYISJEKCD-KRWDZBQOSA-N 2 0 302.462 3.480 20 10 DGCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cc3c(cc2O)CCCC3)C1 ZINC000245538316 662235584 /nfs/dbraw/zinc/23/55/84/662235584.db2.gz JUGXUYLLKPDOGL-PKOBYXMFSA-N 2 0 314.473 3.187 20 10 DGCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2c(O)ccc3ccccc32)C1 ZINC000246197267 662250317 /nfs/dbraw/zinc/25/03/17/662250317.db2.gz AKRPREMIDIUEGI-LPHOPBHVSA-N 2 0 310.441 3.462 20 10 DGCDRP C[NH+](C)CC1(C[NH2+]Cc2ccc(N3CCCC3)cc2)CCCC1 ZINC001620895926 1192560819 /nfs/dbraw/zinc/56/08/19/1192560819.db2.gz TWVALDXCVPFSCJ-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC001332422436 1178442307 /nfs/dbraw/zinc/44/23/07/1178442307.db2.gz WBAVKAPIYWNFEP-QRCPMIHRSA-N 2 0 300.446 3.371 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(O)c1 ZINC001461935528 1182881926 /nfs/dbraw/zinc/88/19/26/1182881926.db2.gz OBDSJRSXAVZZQW-INIZCTEOSA-N 2 0 318.461 3.160 20 10 DGCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001473965238 1183840328 /nfs/dbraw/zinc/84/03/28/1183840328.db2.gz XRNIPOMWRLMOPT-SFHVURJKSA-N 2 0 301.478 3.108 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@H]3CC=CCC3)cc2)CC1 ZINC001560559491 1189341791 /nfs/dbraw/zinc/34/17/91/1189341791.db2.gz ZEWNCMGJMQUIRP-SFHVURJKSA-N 2 0 313.489 3.274 20 10 DGCDRP C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001656636289 1196056391 /nfs/dbraw/zinc/05/63/91/1196056391.db2.gz QVFXCOZYLSTFOO-QFBILLFUSA-N 2 0 301.478 3.107 20 10 DGCDRP C[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)C[NH+]1CCCCC1 ZINC001656896035 1196081106 /nfs/dbraw/zinc/08/11/06/1196081106.db2.gz BLRWEPKXXYPJSM-DVBCCOPCSA-N 2 0 315.505 3.477 20 10 DGCDRP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC001660262031 1196463679 /nfs/dbraw/zinc/46/36/79/1196463679.db2.gz LJOPOFAODBZLNG-LBPRGKRZSA-N 2 0 314.857 3.264 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC[C@@H]3C=CCC3)cc2)CC1 ZINC001663193940 1196809437 /nfs/dbraw/zinc/80/94/37/1196809437.db2.gz UQNKFUPVUHMFDG-GOSISDBHSA-N 2 0 313.489 3.274 20 10 DGCDRP CN1CCCc2cc(C[N@H+](C[C@@H]3CCC[NH2+]C3)C3CC3)ccc21 ZINC000323675879 1197691696 /nfs/dbraw/zinc/69/16/96/1197691696.db2.gz GGCQBQCYEMSTQJ-QGZVFWFLSA-N 2 0 313.489 3.033 20 10 DGCDRP Cc1cc(C)[nH+]c(NCc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001156651893 1089624885 /nfs/dbraw/zinc/62/48/85/1089624885.db2.gz SKIVKIWKCWDVTP-UHFFFAOYSA-N 2 0 310.445 3.062 20 10 DGCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@H]2C1 ZINC001138222302 1091120362 /nfs/dbraw/zinc/12/03/62/1091120362.db2.gz QVFWLKSLYOESHH-RTBURBONSA-N 2 0 313.489 3.060 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCC[C@H]1C[NH3+] ZINC001205992045 1091439582 /nfs/dbraw/zinc/43/95/82/1091439582.db2.gz CYLFGVZSNZFTEO-MJGOQNOKSA-N 2 0 315.505 3.484 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCC[C@@H]1C[NH3+] ZINC001205992044 1091439668 /nfs/dbraw/zinc/43/96/68/1091439668.db2.gz CYLFGVZSNZFTEO-IEBWSBKVSA-N 2 0 315.505 3.484 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCC[C@H]1C[NH3+] ZINC001206022800 1091455509 /nfs/dbraw/zinc/45/55/09/1091455509.db2.gz CUVSZEXGRMWJPI-CABCVRRESA-N 2 0 304.478 3.497 20 10 DGCDRP COc1cc(C[N@@H+]2CCCC[C@](C)(F)C2)cc(C[NH+](C)C)c1O ZINC001139254081 1091502162 /nfs/dbraw/zinc/50/21/62/1091502162.db2.gz CWRGCZOKBHLAJE-SFHVURJKSA-N 2 0 324.440 3.177 20 10 DGCDRP CCC[N@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)[C@@H](C)CC ZINC001139253072 1091502741 /nfs/dbraw/zinc/50/27/41/1091502741.db2.gz KOVQZLMBJXFSEE-AWEZNQCLSA-N 2 0 308.466 3.473 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)cc(C[NH+](C)C)c1O ZINC001139257218 1091502837 /nfs/dbraw/zinc/50/28/37/1091502837.db2.gz UYALSHPBQZTSIZ-KBPBESRZSA-N 2 0 306.450 3.083 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCCC[C@@](C)(C[NH3+])C3)ccc21 ZINC001206550043 1091665508 /nfs/dbraw/zinc/66/55/08/1091665508.db2.gz UBDLLLCWEYQXCV-IBGZPJMESA-N 2 0 301.478 3.020 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@](C)(F)C3)cc2)CC1 ZINC001140301886 1091817986 /nfs/dbraw/zinc/81/79/86/1091817986.db2.gz CFEBMLMCGJAHAM-LJQANCHMSA-N 2 0 319.468 3.153 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(F)(F)CC3)cc2)CC1 ZINC001140299844 1091819075 /nfs/dbraw/zinc/81/90/75/1091819075.db2.gz HDTXHVODCQJHEX-UHFFFAOYSA-N 2 0 323.431 3.060 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H](C)C[C@H]3CF)cc2)CC1 ZINC001140302546 1091820353 /nfs/dbraw/zinc/82/03/53/1091820353.db2.gz UBAUBEHAABFCLG-LPHOPBHVSA-N 2 0 319.468 3.008 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169143171 1092559537 /nfs/dbraw/zinc/55/95/37/1092559537.db2.gz YSKDZHZCLOARRS-ACDBMABISA-N 2 0 313.489 3.344 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c1O ZINC001222147980 1095457381 /nfs/dbraw/zinc/45/73/81/1095457381.db2.gz GWYLROWKVUTWQE-LJQANCHMSA-N 2 0 302.462 3.265 20 10 DGCDRP CC(C)CC[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC001338987205 1095459280 /nfs/dbraw/zinc/45/92/80/1095459280.db2.gz CZGJBCQLDNPRTR-UHFFFAOYSA-N 2 0 315.505 3.354 20 10 DGCDRP Cc1cc(C[NH+]2CCC3(C[NH2+]C3)CC2)c(C)n1-c1ccccc1 ZINC001222202626 1095491921 /nfs/dbraw/zinc/49/19/21/1095491921.db2.gz ASJZSDSLZUSXBF-UHFFFAOYSA-N 2 0 309.457 3.280 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCC[C@@]34CCC[NH2+]CC4)ccc21 ZINC001222315421 1095545581 /nfs/dbraw/zinc/54/55/81/1095545581.db2.gz NMMVFKHNESJNPQ-HXUWFJFHSA-N 2 0 313.489 3.177 20 10 DGCDRP CC(C)(C)c1cccc(CN2CC[C@]3(C2)CCCC[NH2+]3)c1O ZINC001222426320 1095607289 /nfs/dbraw/zinc/60/72/89/1095607289.db2.gz APPFBPDBZVRNCX-IBGZPJMESA-N 2 0 302.462 3.408 20 10 DGCDRP COc1cc(C)cc(C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1O ZINC001119510044 1096216070 /nfs/dbraw/zinc/21/60/70/1096216070.db2.gz MFPKZJRYSXGYQN-INIZCTEOSA-N 2 0 308.466 3.165 20 10 DGCDRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001172358227 1097124118 /nfs/dbraw/zinc/12/41/18/1097124118.db2.gz GNUFUVNKJVLXPI-LMMKCTJWSA-N 2 0 315.505 3.353 20 10 DGCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]2C1 ZINC001233284943 1098274378 /nfs/dbraw/zinc/27/43/78/1098274378.db2.gz NEMDHIZPBVSASQ-ZBFHGGJFSA-N 2 0 302.462 3.073 20 10 DGCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]2C1 ZINC001233287215 1098276878 /nfs/dbraw/zinc/27/68/78/1098276878.db2.gz BURHHYRJHNXDBQ-IYBDPMFKSA-N 2 0 302.462 3.073 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)c2ccccc21 ZINC001234991347 1098736093 /nfs/dbraw/zinc/73/60/93/1098736093.db2.gz FFWLPYSGGZLZEP-OAQYLSRUSA-N 2 0 323.484 3.481 20 10 DGCDRP CC[NH+]1C[C@H]2C[NH+](Cc3cccc(-c4ccccc4)c3O)C[C@@H]2C1 ZINC001234998292 1098741033 /nfs/dbraw/zinc/74/10/33/1098741033.db2.gz DTOCLMHYDWFBAB-OALUTQOASA-N 2 0 322.452 3.443 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@H]3F)c(O)c1 ZINC001235405915 1099001839 /nfs/dbraw/zinc/00/18/39/1099001839.db2.gz POTZZHBJIAWTES-MJGOQNOKSA-N 2 0 320.452 3.213 20 10 DGCDRP C[NH+]1CCC2(C[NH+](Cc3ccc(C(C)(C)C)cc3O)C2)CC1 ZINC001235677407 1099119603 /nfs/dbraw/zinc/11/96/03/1099119603.db2.gz DMCWNDMDIQWWFW-UHFFFAOYSA-N 2 0 302.462 3.217 20 10 DGCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001235680094 1099124752 /nfs/dbraw/zinc/12/47/52/1099124752.db2.gz HUKPELDRHUNEPI-CALCHBBNSA-N 2 0 316.489 3.463 20 10 DGCDRP CCC[C@@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235693930 1099132528 /nfs/dbraw/zinc/13/25/28/1099132528.db2.gz KFEDDTRWIUYSBM-MRXNPFEDSA-N 2 0 304.434 3.029 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)cc1Cl ZINC001235886649 1099233113 /nfs/dbraw/zinc/23/31/13/1099233113.db2.gz AARYKIUQPMSOTL-MRXNPFEDSA-N 2 0 308.853 3.318 20 10 DGCDRP Cc1ccc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc1C ZINC001236242240 1099496707 /nfs/dbraw/zinc/49/67/07/1099496707.db2.gz ZAVVWVHZSGALIE-UHFFFAOYSA-N 2 0 323.484 3.345 20 10 DGCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1CC2(C1)CC[NH2+]CC2 ZINC001236276724 1099514839 /nfs/dbraw/zinc/51/48/39/1099514839.db2.gz MLCDSABKSITXMA-UHFFFAOYSA-N 2 0 315.505 3.354 20 10 DGCDRP Cc1cccc(C[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)c1O ZINC001236300426 1099524233 /nfs/dbraw/zinc/52/42/33/1099524233.db2.gz BHBKGFDPZOREMV-UHFFFAOYSA-N 2 0 310.441 3.455 20 10 DGCDRP CC[N@@H+](Cc1ccc(N(C)C)c2ccccc12)C[C@@H]1CC[NH2+]C1 ZINC001236408967 1099582406 /nfs/dbraw/zinc/58/24/06/1099582406.db2.gz QRIPZGIAFKDOCY-MRXNPFEDSA-N 2 0 311.473 3.337 20 10 DGCDRP C[C@H]1CCCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236940376 1099881323 /nfs/dbraw/zinc/88/13/23/1099881323.db2.gz PDHXNTSMWKYQKM-INIZCTEOSA-N 2 0 319.468 3.342 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@H]1C ZINC001236938243 1099882715 /nfs/dbraw/zinc/88/27/15/1099882715.db2.gz IMRINUWJJJFHBK-CVEARBPZSA-N 2 0 319.468 3.198 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)c(O)c1 ZINC001237415418 1100119718 /nfs/dbraw/zinc/11/97/18/1100119718.db2.gz NMAGKGIEZPMSEI-YOEHRIQHSA-N 2 0 302.462 3.264 20 10 DGCDRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC001325624831 1103085787 /nfs/dbraw/zinc/08/57/87/1103085787.db2.gz GDFMCLLOUUXXTM-OAHLLOKOSA-N 2 0 314.429 3.059 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC3(CC[N@@H+](C)C3)CC2)cc1Cl ZINC001276372541 1103688734 /nfs/dbraw/zinc/68/87/34/1103688734.db2.gz XMIBUAXTRMXYMU-UHFFFAOYSA-N 2 0 308.853 3.272 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CC(C)(C)C1 ZINC001246172961 1104420810 /nfs/dbraw/zinc/42/08/10/1104420810.db2.gz JBZAHMKSKODDGH-FUHWJXTLSA-N 2 0 315.505 3.401 20 10 DGCDRP CC1(C)CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001246174460 1104421084 /nfs/dbraw/zinc/42/10/84/1104421084.db2.gz QJCOZFJWAJWOEG-QGZVFWFLSA-N 2 0 301.478 3.155 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001246902748 1104728822 /nfs/dbraw/zinc/72/88/22/1104728822.db2.gz UHNRDLXRYGCILO-MOPGFXCFSA-N 2 0 301.478 3.107 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)C2CCC3(CC[NH2+]C3)CC2)cc1 ZINC001246900257 1104729347 /nfs/dbraw/zinc/72/93/47/1104729347.db2.gz HECGVZDSYIAKHF-UHFFFAOYSA-N 2 0 301.478 3.107 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246917394 1104737157 /nfs/dbraw/zinc/73/71/57/1104737157.db2.gz CQWYGHVUNNOFQJ-LJQANCHMSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246924023 1104738058 /nfs/dbraw/zinc/73/80/58/1104738058.db2.gz LKOQGSCZAIANCX-VQTJNVASSA-N 2 0 315.505 3.497 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)cc1 ZINC001275833780 1104926356 /nfs/dbraw/zinc/92/63/56/1104926356.db2.gz QUFBSWDOZAUQSD-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC001322147860 1107544015 /nfs/dbraw/zinc/54/40/15/1107544015.db2.gz CAAWLBNVSFMPGC-UHFFFAOYSA-N 2 0 313.489 3.251 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)C3(C)C)cc2)CC1 ZINC001323454181 1107979765 /nfs/dbraw/zinc/97/97/65/1107979765.db2.gz ZSJMQEBQTRQEAQ-UHFFFAOYSA-N 2 0 301.478 3.059 20 10 DGCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OC)c(COCC)c2)C1 ZINC001308224018 1111400823 /nfs/dbraw/zinc/40/08/23/1111400823.db2.gz CDJIULLMKRFRLE-KRWDZBQOSA-N 2 0 320.477 3.053 20 10 DGCDRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](C)C1 ZINC001308269412 1111408574 /nfs/dbraw/zinc/40/85/74/1111408574.db2.gz QWYSNUVFQGYKMK-MBOZVWFJSA-N 2 0 315.505 3.353 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c1 ZINC001308569774 1111445511 /nfs/dbraw/zinc/44/55/11/1111445511.db2.gz IWOJJBHKNMLHHI-AEFFLSMTSA-N 2 0 302.462 3.432 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1O ZINC000093683568 431917462 /nfs/dbraw/zinc/91/74/62/431917462.db2.gz IQMUSDSWOFYZLF-INIZCTEOSA-N 2 0 318.461 3.099 20 10 DGCDRP CCOc1ccc(O)c(C[NH+]2CCC(CCC[NH+](C)C)CC2)c1 ZINC000093688678 431917647 /nfs/dbraw/zinc/91/76/47/431917647.db2.gz MIHNJQDDPQWVBH-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)[C@H](C)C1 ZINC000173362621 432274366 /nfs/dbraw/zinc/27/43/66/432274366.db2.gz WLFCGFDGJAFYMB-APWZRJJASA-N 2 0 301.478 3.107 20 10 DGCDRP C[C@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccc(N(C)C)cc1 ZINC000152756633 432352796 /nfs/dbraw/zinc/35/27/96/432352796.db2.gz DIGVFHRHOHOXMK-HNNXBMFYSA-N 2 0 312.461 3.179 20 10 DGCDRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(F)ccc1O ZINC000184937503 432447478 /nfs/dbraw/zinc/44/74/78/432447478.db2.gz UPRZLPSCNWYCCS-ZDUSSCGKSA-N 2 0 302.393 3.444 20 10 DGCDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000263674599 432565193 /nfs/dbraw/zinc/56/51/93/432565193.db2.gz KSDMMNFNQWPBTP-MRXNPFEDSA-N 2 0 310.441 3.491 20 10 DGCDRP Cc1nccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000178698609 432767931 /nfs/dbraw/zinc/76/79/31/432767931.db2.gz LPAXRYYTNDUZHG-HUUCEWRRSA-N 2 0 300.450 3.244 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000280166354 433008364 /nfs/dbraw/zinc/00/83/64/433008364.db2.gz QYTYHOOKYAHHSD-DOTOQJQBSA-N 2 0 308.466 3.098 20 10 DGCDRP CCOc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c(O)c1 ZINC000853093589 620668088 /nfs/dbraw/zinc/66/80/88/620668088.db2.gz OQDZWKARBGWDDH-MRXNPFEDSA-N 2 0 318.461 3.003 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093795 620667775 /nfs/dbraw/zinc/66/77/75/620667775.db2.gz RJJBDHJJTLUURJ-CQSZACIVSA-N 2 0 308.853 3.257 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N(C)C)cc2C)[C@H](C)C1 ZINC000840918002 618529991 /nfs/dbraw/zinc/52/99/91/618529991.db2.gz XTOUBNMTDXREJJ-VQIMIIECSA-N 2 0 303.494 3.223 20 10 DGCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c1O ZINC000925776483 618616022 /nfs/dbraw/zinc/61/60/22/618616022.db2.gz KRXCGBZOZSSTRF-MNOVXSKESA-N 2 0 318.795 3.249 20 10 DGCDRP COc1cc(C)cc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c1O ZINC000894324650 618764542 /nfs/dbraw/zinc/76/45/42/618764542.db2.gz AHJCSPZFVKXZIX-UHFFFAOYSA-N 2 0 318.461 3.206 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000841086257 620225336 /nfs/dbraw/zinc/22/53/36/620225336.db2.gz GRTMPRZDJRSMQZ-QFBILLFUSA-N 2 0 301.478 3.025 20 10 DGCDRP COc1ccc(C[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1C ZINC000915678507 620593479 /nfs/dbraw/zinc/59/34/79/620593479.db2.gz PNGGMZQCIGMONF-HZPDHXFCSA-N 2 0 304.478 3.461 20 10 DGCDRP CCCN(CCC)c1ccc(C[NH2+]CCN2CCCC2)cc1 ZINC000920957147 620829363 /nfs/dbraw/zinc/82/93/63/620829363.db2.gz KTQBKXPRHIOVOJ-UHFFFAOYSA-N 2 0 303.494 3.498 20 10 DGCDRP COc1cccc(C[NH2+]C2CCC(C)([NH+]3CCCC3)CC2)c1O ZINC000922509518 621048896 /nfs/dbraw/zinc/04/88/96/621048896.db2.gz OSOUJYVZDHMSRJ-UHFFFAOYSA-N 2 0 318.461 3.288 20 10 DGCDRP CCOCc1cc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)ccc1OC ZINC000839183263 621344243 /nfs/dbraw/zinc/34/42/43/621344243.db2.gz VOPSRTYRDBWUHE-MRXNPFEDSA-N 2 0 320.477 3.053 20 10 DGCDRP COc1cc(C)cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1O ZINC000754731800 621528984 /nfs/dbraw/zinc/52/89/84/621528984.db2.gz HIYQXQGTWKWDEY-UHFFFAOYSA-N 2 0 320.477 3.261 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c1 ZINC000755777273 621593264 /nfs/dbraw/zinc/59/32/64/621593264.db2.gz BFLJSLDFVRAUCD-KRWDZBQOSA-N 2 0 302.462 3.173 20 10 DGCDRP C[C@H]([NH2+]CCOCCC[NH3+])c1ccc(N2CCCCCC2)cc1 ZINC000863547018 621682950 /nfs/dbraw/zinc/68/29/50/621682950.db2.gz NSBKRWSYSYZVAY-KRWDZBQOSA-N 2 0 319.493 3.083 20 10 DGCDRP CCc1cccc(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)c1O ZINC000864050651 621732320 /nfs/dbraw/zinc/73/23/20/621732320.db2.gz MQXWNIYCBZXESM-UHFFFAOYSA-N 2 0 302.462 3.405 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000757675119 621732824 /nfs/dbraw/zinc/73/28/24/621732824.db2.gz ZYBJTKDQRPVOJV-UKRRQHHQSA-N 2 0 324.440 3.028 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)c1O ZINC000866516978 622131275 /nfs/dbraw/zinc/13/12/75/622131275.db2.gz FRYJTFLTISMZGY-VNSJNIRKSA-N 2 0 306.450 3.314 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000766029458 622300863 /nfs/dbraw/zinc/30/08/63/622300863.db2.gz KRAHSJNGVRQXNC-UHFFFAOYSA-N 2 0 303.494 3.414 20 10 DGCDRP CC1CC([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)C1 ZINC000768239425 622447260 /nfs/dbraw/zinc/44/72/60/622447260.db2.gz ZFAZOQKTRQIVQY-UHFFFAOYSA-N 2 0 313.489 3.107 20 10 DGCDRP CCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)c(O)c1 ZINC000769470748 622530899 /nfs/dbraw/zinc/53/08/99/622530899.db2.gz OTNBYTGUMINLNU-HOCLYGCPSA-N 2 0 306.450 3.096 20 10 DGCDRP CCOCc1cc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)ccc1OC ZINC000872251472 622866776 /nfs/dbraw/zinc/86/67/76/622866776.db2.gz JKEYNDCUBUCJMA-QGZVFWFLSA-N 2 0 320.477 3.100 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000773753962 623067298 /nfs/dbraw/zinc/06/72/98/623067298.db2.gz NVVAZFBOMWLDBI-GOSISDBHSA-N 2 0 301.478 3.060 20 10 DGCDRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(N(C)C)cc1 ZINC000873238360 623086717 /nfs/dbraw/zinc/08/67/17/623086717.db2.gz XQPCPSRAQCVKCI-OAHLLOKOSA-N 2 0 309.457 3.249 20 10 DGCDRP C[C@@H]([NH2+]CC[C@@H]([NH3+])Cc1ccccc1)c1cc(F)ccc1O ZINC000873236237 623087055 /nfs/dbraw/zinc/08/70/55/623087055.db2.gz ZLPYQHQCUPWAQV-CZUORRHYSA-N 2 0 302.393 3.142 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc2c(cc1O)CCCC2 ZINC000873263813 623096697 /nfs/dbraw/zinc/09/66/97/623096697.db2.gz KKAKNBHUFPJTMD-KJWYOANISA-N 2 0 314.473 3.452 20 10 DGCDRP CC(C)C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC000775653871 623304804 /nfs/dbraw/zinc/30/48/04/623304804.db2.gz DYXOSHDTWCLBDU-UHFFFAOYSA-N 2 0 303.494 3.305 20 10 DGCDRP CC(C)[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775652577 623305103 /nfs/dbraw/zinc/30/51/03/623305103.db2.gz NFRIEHWVLJZWLI-LJQANCHMSA-N 2 0 301.478 3.059 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3C[C@H]4CCCC[C@@H]4C3)cc2)CC1 ZINC000775698745 623316331 /nfs/dbraw/zinc/31/63/31/623316331.db2.gz RZHCMPBSEYFECL-RTBURBONSA-N 2 0 313.489 3.060 20 10 DGCDRP CSCC[C@H](C)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775715117 623318785 /nfs/dbraw/zinc/31/87/85/623318785.db2.gz WMYZXYSIRGDCTH-INIZCTEOSA-N 2 0 321.534 3.012 20 10 DGCDRP C[C@H]([N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(C)CC1 ZINC000775736378 623322112 /nfs/dbraw/zinc/32/21/12/623322112.db2.gz RWJGKAXFIIKAPG-INIZCTEOSA-N 2 0 301.478 3.059 20 10 DGCDRP CCC1([NH+]2CCC2)CC[NH+](Cc2cc(C)c(C)cc2O)CC1 ZINC000884475898 626886193 /nfs/dbraw/zinc/88/61/93/626886193.db2.gz VZHAHYWYUZSZCP-UHFFFAOYSA-N 2 0 302.462 3.459 20 10 DGCDRP CC[C@H](CSC)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809767048 626949208 /nfs/dbraw/zinc/94/92/08/626949208.db2.gz FSJSJKQZYGHCAA-QGZVFWFLSA-N 2 0 321.534 3.012 20 10 DGCDRP CSC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CC[NH+](C)CC1 ZINC000810252145 626992355 /nfs/dbraw/zinc/99/23/55/626992355.db2.gz KBHSDMWRGQLEHL-CQSZACIVSA-N 2 0 308.491 3.179 20 10 DGCDRP CSC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CC[NH+](C)CC1 ZINC000810252894 626993445 /nfs/dbraw/zinc/99/34/45/626993445.db2.gz WFHAFVHXYYPDEE-OAHLLOKOSA-N 2 0 322.518 3.487 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)c2c1c(F)ccc2O ZINC000925846011 627804651 /nfs/dbraw/zinc/80/46/51/627804651.db2.gz MXUXDABOVUUCQB-VPSJLMRDSA-N 2 0 304.409 3.201 20 10 DGCDRP CC(=O)c1cc(Cl)cc(CN2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)c1O ZINC000817880393 627952421 /nfs/dbraw/zinc/95/24/21/627952421.db2.gz RNAHNRIXWXZKJN-SUNKGSAMSA-N 2 0 324.852 3.053 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)cc1F ZINC000817903188 627957124 /nfs/dbraw/zinc/95/71/24/627957124.db2.gz JOEXHFAMTHSZCH-PBHICJAKSA-N 2 0 307.457 3.150 20 10 DGCDRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(N2CCCCC2)cc1 ZINC000817941296 627968314 /nfs/dbraw/zinc/96/83/14/627968314.db2.gz RPGUEVZOFGBRNC-INIZCTEOSA-N 2 0 301.478 3.327 20 10 DGCDRP CC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(N(C)C)cc1 ZINC000817948428 627971270 /nfs/dbraw/zinc/97/12/70/627971270.db2.gz JRBSUJQSPWROOA-FQEVSTJZSA-N 2 0 311.473 3.495 20 10 DGCDRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817954821 627973300 /nfs/dbraw/zinc/97/33/00/627973300.db2.gz KVEJTMZFZXCNLH-CVEARBPZSA-N 2 0 319.468 3.466 20 10 DGCDRP CC[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817965378 627977547 /nfs/dbraw/zinc/97/75/47/627977547.db2.gz PVDCGRABTMDXCS-CHWSQXEVSA-N 2 0 302.340 3.189 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)c1O ZINC000818431787 628022681 /nfs/dbraw/zinc/02/26/81/628022681.db2.gz TVWNUPURBKUSJF-GFCCVEGCSA-N 2 0 324.852 3.018 20 10 DGCDRP Cc1cc(O)c(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1Cl ZINC000825884783 628806832 /nfs/dbraw/zinc/80/68/32/628806832.db2.gz AENPRNOEVMGOBW-YIONKMFJSA-N 2 0 308.853 3.411 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C\c2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000835026114 629827376 /nfs/dbraw/zinc/82/73/76/629827376.db2.gz QMDXNSFXYFLSPS-NCPUXXIWSA-N 2 0 315.505 3.428 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC000835029124 629829072 /nfs/dbraw/zinc/82/90/72/629829072.db2.gz UYMNLQLMRQXDQJ-WAYWQWQTSA-N 2 0 301.478 3.039 20 10 DGCDRP CCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 ZINC000840894677 630373864 /nfs/dbraw/zinc/37/38/64/630373864.db2.gz RWTVMYJUEQVJQD-KRWDZBQOSA-N 2 0 317.521 3.456 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000840894432 630373941 /nfs/dbraw/zinc/37/39/41/630373941.db2.gz RLOWDUFFPRRYIV-IRXDYDNUSA-N 2 0 317.521 3.312 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000840917894 630378204 /nfs/dbraw/zinc/37/82/04/630378204.db2.gz UZBVNRYOTIMIJH-SFHVURJKSA-N 2 0 315.505 3.369 20 10 DGCDRP CC(C)[C@@H]([NH3+])C[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000841030924 630398066 /nfs/dbraw/zinc/39/80/66/630398066.db2.gz PCUMFOAYXNHLQR-SFHVURJKSA-N 2 0 314.429 3.044 20 10 DGCDRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841030947 630398348 /nfs/dbraw/zinc/39/83/48/630398348.db2.gz PYDDWVPPLYRDNJ-IEBWSBKVSA-N 2 0 301.478 3.284 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cc1F ZINC000841032231 630399238 /nfs/dbraw/zinc/39/92/38/630399238.db2.gz AEQVSWBACUPVFD-GDBMZVCRSA-N 2 0 307.457 3.150 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000841032999 630399399 /nfs/dbraw/zinc/39/93/99/630399399.db2.gz ILHMIPBSORROTL-ONEGZZNKSA-N 2 0 309.457 3.057 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c(C(F)(F)F)c1 ZINC000841057301 630403208 /nfs/dbraw/zinc/40/32/08/630403208.db2.gz IYDSSUUDBAEDGS-CHWSQXEVSA-N 2 0 315.383 3.131 20 10 DGCDRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841070305 630404167 /nfs/dbraw/zinc/40/41/67/630404167.db2.gz NBMITKTWFWNASP-GOSISDBHSA-N 2 0 301.478 3.155 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1F ZINC000841088035 630406683 /nfs/dbraw/zinc/40/66/83/630406683.db2.gz XJKHWUWTNAHAES-GOSISDBHSA-N 2 0 315.436 3.462 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000843046955 630608070 /nfs/dbraw/zinc/60/80/70/630608070.db2.gz IRXMZJZFBKNAOG-JJTKIYQPSA-N 2 0 301.478 3.248 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)c1O ZINC000843046036 630608293 /nfs/dbraw/zinc/60/82/93/630608293.db2.gz SVEAFAOLWJJPQA-XJKSGUPXSA-N 2 0 308.853 3.318 20 10 DGCDRP CC[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@H]1[NH3+] ZINC000843053695 630608880 /nfs/dbraw/zinc/60/88/80/630608880.db2.gz RERHFNABBUBCHQ-IEBWSBKVSA-N 2 0 301.478 3.236 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC000843117388 630615959 /nfs/dbraw/zinc/61/59/59/630615959.db2.gz PCQQJIAXSKEFPG-LJQANCHMSA-N 2 0 301.478 3.108 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000843128911 630616882 /nfs/dbraw/zinc/61/68/82/630616882.db2.gz ZDPDUVIWOIPORG-KDURUIRLSA-N 2 0 313.489 3.108 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC000843128301 630617224 /nfs/dbraw/zinc/61/72/24/630617224.db2.gz VTJBZUUKOKGGME-HOTGVXAUSA-N 2 0 318.461 3.003 20 10 DGCDRP CN(C)c1ccc(C[NH2+]CCCCCC[NH3+])c(C(F)(F)F)c1 ZINC000843129823 630617731 /nfs/dbraw/zinc/61/77/31/630617731.db2.gz RSZHCOXKIDZYIH-UHFFFAOYSA-N 2 0 317.399 3.380 20 10 DGCDRP C[N@H+](CC[C@H]1CCC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000844220476 630712669 /nfs/dbraw/zinc/71/26/69/630712669.db2.gz DWDRANFOJIHLDP-GOSISDBHSA-N 2 0 315.505 3.498 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000844905408 630972984 /nfs/dbraw/zinc/97/29/84/630972984.db2.gz YZUIHTWTXLWIGB-UHFFFAOYSA-N 2 0 315.436 3.420 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c1O ZINC000846138985 631211333 /nfs/dbraw/zinc/21/13/33/631211333.db2.gz ZGYYTEDKRLFDEV-HUUCEWRRSA-N 2 0 306.450 3.316 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cccc(OC)c2O)CC1 ZINC000846144482 631211906 /nfs/dbraw/zinc/21/19/06/631211906.db2.gz GUGKEIJKTWEOMA-CQSZACIVSA-N 2 0 306.450 3.173 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c1O ZINC000848912764 631784475 /nfs/dbraw/zinc/78/44/75/631784475.db2.gz VOOWWQUJXXOKBH-KRWDZBQOSA-N 2 0 302.462 3.118 20 10 DGCDRP COc1cc(C[NH2+]CC2=CC[N@H+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850239975 632090628 /nfs/dbraw/zinc/09/06/28/632090628.db2.gz WVLKQRIICYKLSV-UHFFFAOYSA-N 2 0 318.461 3.050 20 10 DGCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000850581158 632202201 /nfs/dbraw/zinc/20/22/01/632202201.db2.gz DJSNWTHJYHUUCH-HNNXBMFYSA-N 2 0 302.462 3.473 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c(O)c1 ZINC000850585391 632203138 /nfs/dbraw/zinc/20/31/38/632203138.db2.gz WRGJKGPRUMNXEM-OAHLLOKOSA-N 2 0 302.462 3.473 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cc2c(cc1O)CCCC2 ZINC000185404193 660221482 /nfs/dbraw/zinc/22/14/82/660221482.db2.gz IHJHDYDQWAYAPQ-HUUCEWRRSA-N 2 0 302.462 3.263 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000248531603 662352025 /nfs/dbraw/zinc/35/20/25/662352025.db2.gz PBBMCDCJHNLBLE-HUUCEWRRSA-N 2 0 306.450 3.316 20 10 DGCDRP CN(C)c1ccc([C@H](N)C[NH2+]Cc2ccc3[nH]ccc3c2)cc1 ZINC001578424775 1191942828 /nfs/dbraw/zinc/94/28/28/1191942828.db2.gz VGNTZLWHAZDCJK-GOSISDBHSA-N 2 0 308.429 3.024 20 10 DGCDRP COc1cc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)c(O)c(C(C)(C)C)c1 ZINC001579152731 1191968010 /nfs/dbraw/zinc/96/80/10/1191968010.db2.gz FCHARAFHHQQUSC-LJQANCHMSA-N 2 0 320.477 3.178 20 10 DGCDRP Cc1cc(C[N@@H+](C)CC(C)(C)C[NH3+])ccc1N1CCCCC1 ZINC001579592968 1191980937 /nfs/dbraw/zinc/98/09/37/1191980937.db2.gz OVOQNPVGQAAIBJ-UHFFFAOYSA-N 2 0 303.494 3.402 20 10 DGCDRP CC(C)[NH+]1CCC(CC[NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC001621022644 1192892366 /nfs/dbraw/zinc/89/23/66/1192892366.db2.gz FSPYBHFDBMNJHG-UHFFFAOYSA-N 2 0 302.462 3.222 20 10 DGCDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001341569512 1179029952 /nfs/dbraw/zinc/02/99/52/1179029952.db2.gz PUJKOSAJJVWIOA-SFHVURJKSA-N 2 0 301.478 3.060 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC3(C)C)cc2)CC1 ZINC001461269682 1182789353 /nfs/dbraw/zinc/78/93/53/1182789353.db2.gz SDUKHJPNLKPBQE-SFHVURJKSA-N 2 0 301.478 3.107 20 10 DGCDRP CCC(C)(C)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001461675615 1182840436 /nfs/dbraw/zinc/84/04/36/1182840436.db2.gz JANSFFNHOFCQFK-UHFFFAOYSA-N 2 0 303.494 3.354 20 10 DGCDRP CSC1(C[NH2+]Cc2cc(C(C)C)ccc2O)CC[NH+](C)CC1 ZINC001462295182 1182934762 /nfs/dbraw/zinc/93/47/62/1182934762.db2.gz BERGFASGJSZFLD-UHFFFAOYSA-N 2 0 322.518 3.433 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4CCC[C@H]34)cc2)CC1 ZINC001560987743 1189416595 /nfs/dbraw/zinc/41/65/95/1189416595.db2.gz WJMNXNXHZTZUSB-YSIASYRMSA-N 2 0 313.489 3.107 20 10 DGCDRP Cc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C)c1 ZINC001655320677 1195903140 /nfs/dbraw/zinc/90/31/40/1195903140.db2.gz VXWLYICPBJZDFZ-UHFFFAOYSA-N 2 0 323.484 3.345 20 10 DGCDRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001657156660 1196112316 /nfs/dbraw/zinc/11/23/16/1196112316.db2.gz FIZGAIBLPOCEFV-YRWFTTLQSA-N 2 0 315.505 3.353 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3CCCCCC3)cc2)CC1 ZINC001657370948 1196134784 /nfs/dbraw/zinc/13/47/84/1196134784.db2.gz GOAMBCGHJXCWIT-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP C[C@H](CC1CCC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001658380416 1196249668 /nfs/dbraw/zinc/24/96/68/1196249668.db2.gz JBGHNADXEAGHAF-MRXNPFEDSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC001659369624 1196375929 /nfs/dbraw/zinc/37/59/29/1196375929.db2.gz MKWAHYYDLZHIDO-UHFFFAOYSA-N 2 0 303.494 3.273 20 10 DGCDRP COc1ccc(O)c(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC001659420804 1196381958 /nfs/dbraw/zinc/38/19/58/1196381958.db2.gz PWPGXIOAUWZQCG-LSDHHAIUSA-N 2 0 318.461 3.143 20 10 DGCDRP Cc1ccc(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c(O)c1 ZINC001659520890 1196390615 /nfs/dbraw/zinc/39/06/15/1196390615.db2.gz YMYLXGAPAQQMAF-MOPGFXCFSA-N 2 0 310.441 3.136 20 10 DGCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCC1 ZINC001660588227 1196501375 /nfs/dbraw/zinc/50/13/75/1196501375.db2.gz PZDWCGDMZISVBS-LJQANCHMSA-N 2 0 301.478 3.107 20 10 DGCDRP CC1CC[NH+](CCC[NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC001660797453 1196525516 /nfs/dbraw/zinc/52/55/16/1196525516.db2.gz DUELJCWSKQAZBB-GQCTYLIASA-N 2 0 315.505 3.477 20 10 DGCDRP CC[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304580 1082124476 /nfs/dbraw/zinc/12/44/76/1082124476.db2.gz VPPXEEFFRRMMEY-SFHVURJKSA-N 2 0 301.478 3.203 20 10 DGCDRP C[C@H]([NH3+])c1ccc(N(CC[NH3+])C23CC4CC(CC(C4)C2)C3)cc1 ZINC001170626654 1082965821 /nfs/dbraw/zinc/96/58/21/1082965821.db2.gz IOXAOMJYTSNTSM-KMYSJOAASA-N 2 0 313.489 3.440 20 10 DGCDRP C[N@H+](Cc1ccccc1O)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994802 1086059920 /nfs/dbraw/zinc/05/99/20/1086059920.db2.gz PULTZWNUCMTAHJ-JWTNVVGKSA-N 2 0 300.446 3.229 20 10 DGCDRP Cc1c[nH+]c(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc1C ZINC001156659008 1089631070 /nfs/dbraw/zinc/63/10/70/1089631070.db2.gz IOUKNRDVPARFFH-UHFFFAOYSA-N 2 0 310.445 3.062 20 10 DGCDRP CC(C)c1ccc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c(O)c1 ZINC001204741743 1091027600 /nfs/dbraw/zinc/02/76/00/1091027600.db2.gz AFYGYRMALOUYRE-UHFFFAOYSA-N 2 0 302.462 3.481 20 10 DGCDRP C[NH+]1CC2(C1)CC[NH+](Cc1ccc(N3CCCCC3)cc1)CC2 ZINC001138220423 1091120284 /nfs/dbraw/zinc/12/02/84/1091120284.db2.gz BXCDWXCQXWIKSU-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@@](C)([NH3+])CC3)c2c1 ZINC001205289616 1091167294 /nfs/dbraw/zinc/16/72/94/1091167294.db2.gz ZQVRPNAJUBHQJG-LJQANCHMSA-N 2 0 314.429 3.257 20 10 DGCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cc3ccccc3cc2O)CC1 ZINC001205581530 1091266157 /nfs/dbraw/zinc/26/61/57/1091266157.db2.gz VGWJJFKXEGOQEC-SFHVURJKSA-N 2 0 302.393 3.198 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)cc1 ZINC001205603494 1091276282 /nfs/dbraw/zinc/27/62/82/1091276282.db2.gz PGWXXDJFFQEEAE-FUHWJXTLSA-N 2 0 303.494 3.340 20 10 DGCDRP COc1cc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)cc(C[NH+](C)C)c1O ZINC001139256306 1091501239 /nfs/dbraw/zinc/50/12/39/1091501239.db2.gz YFHJBPPCYVOYHY-IYBDPMFKSA-N 2 0 318.461 3.084 20 10 DGCDRP CCC(CC)[N@H+](CC)Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139258040 1091502073 /nfs/dbraw/zinc/50/20/73/1091502073.db2.gz KJPNGFWBANRRHL-UHFFFAOYSA-N 2 0 308.466 3.473 20 10 DGCDRP C[C@H]1C[NH2+]CCC[N@@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001206263389 1091556957 /nfs/dbraw/zinc/55/69/57/1091556957.db2.gz WGVYCGIWCSKNGB-AWEZNQCLSA-N 2 0 314.404 3.382 20 10 DGCDRP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC001206362728 1091600274 /nfs/dbraw/zinc/60/02/74/1091600274.db2.gz QDWPORNOAQJADO-GOSISDBHSA-N 2 0 302.393 3.198 20 10 DGCDRP COc1cc(O)c(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)c(Cl)c1 ZINC001206572863 1091672818 /nfs/dbraw/zinc/67/28/18/1091672818.db2.gz GIJAFGVFLFPNRT-MRXNPFEDSA-N 2 0 312.841 3.005 20 10 DGCDRP Cc1nccn1-c1ccccc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001140027100 1091743314 /nfs/dbraw/zinc/74/33/14/1091743314.db2.gz YIHKMFSBWZNDTC-UHFFFAOYSA-N 2 0 319.408 3.445 20 10 DGCDRP Oc1ccc(F)cc1C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001140055754 1091752855 /nfs/dbraw/zinc/75/28/55/1091752855.db2.gz SNABLNUXPCGIEY-KRWDZBQOSA-N 2 0 306.425 3.372 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C)C[C@@H]3C)cc2)CC1 ZINC001140303828 1091820059 /nfs/dbraw/zinc/82/00/59/1091820059.db2.gz BKPBKGOCKRYNQJ-MSOLQXFVSA-N 2 0 315.505 3.449 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)C[C@H]3CC3(C)C)cc2)CC1 ZINC001140305752 1091820095 /nfs/dbraw/zinc/82/00/95/1091820095.db2.gz HGPCMIOTQHMEJS-GOSISDBHSA-N 2 0 315.505 3.306 20 10 DGCDRP CCC1CC[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC1 ZINC001140302756 1091820884 /nfs/dbraw/zinc/82/08/84/1091820884.db2.gz ZOLCOVPAVVKVTI-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)c(Cl)c1 ZINC001140924034 1092065790 /nfs/dbraw/zinc/06/57/90/1092065790.db2.gz BBINNMRUFVOLEO-UHFFFAOYSA-N 2 0 321.896 3.324 20 10 DGCDRP Cc1ccc(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001140951014 1092078120 /nfs/dbraw/zinc/07/81/20/1092078120.db2.gz SZYXGBCLZJJSEX-WOJBJXKFSA-N 2 0 322.452 3.264 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)cc1F ZINC001119990897 1094338118 /nfs/dbraw/zinc/33/81/18/1094338118.db2.gz YTAVELKVBXGJPE-BBWFWOEESA-N 2 0 319.468 3.054 20 10 DGCDRP Cc1cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)ccc1N(C)C ZINC001139673875 1095030382 /nfs/dbraw/zinc/03/03/82/1095030382.db2.gz LYSYUHPDVFPTNO-UHFFFAOYSA-N 2 0 315.505 3.369 20 10 DGCDRP CC(C)c1ccc(C[N@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c(O)c1 ZINC001276814083 1095108521 /nfs/dbraw/zinc/10/85/21/1095108521.db2.gz DGGYWGGRMNLPIA-CALCHBBNSA-N 2 0 302.462 3.289 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222172012 1095476609 /nfs/dbraw/zinc/47/66/09/1095476609.db2.gz HGFGPDFUEWQSAI-LJQANCHMSA-N 2 0 302.462 3.446 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001116588334 1095609076 /nfs/dbraw/zinc/60/90/76/1095609076.db2.gz CTMRUIDLZNSIHS-HZPDHXFCSA-N 2 0 320.477 3.197 20 10 DGCDRP CC[NH+]1C[C@H]2C[NH+](Cc3cc(C)n(-c4ccccc4)c3C)C[C@@H]2C1 ZINC001137858957 1095770672 /nfs/dbraw/zinc/77/06/72/1095770672.db2.gz BSDFJHXTBZRNMR-PMACEKPBSA-N 2 0 323.484 3.478 20 10 DGCDRP Cc1cc(F)cc(C[NH+]2CCC3(CCC[N@@H+](C)C3)CC2)c1O ZINC001277519515 1097751906 /nfs/dbraw/zinc/75/19/06/1097751906.db2.gz ZRYUVZUFSWKMIQ-UHFFFAOYSA-N 2 0 306.425 3.148 20 10 DGCDRP Cc1ccc(O)c(C[NH+]2CCC3(CC2)C[NH2+]Cc2ccccc23)c1 ZINC001235094966 1098798940 /nfs/dbraw/zinc/79/89/40/1098798940.db2.gz SDDYTECAMFLTCX-UHFFFAOYSA-N 2 0 322.452 3.338 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c(O)c1 ZINC001235239282 1098911785 /nfs/dbraw/zinc/91/17/85/1098911785.db2.gz UXXVAEDUFBPIHJ-SFHVURJKSA-N 2 0 318.461 3.145 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c(O)c1 ZINC001235238669 1098912026 /nfs/dbraw/zinc/91/20/26/1098912026.db2.gz GKGUZEYVHWZNFQ-SFHVURJKSA-N 2 0 302.462 3.363 20 10 DGCDRP CCc1ccc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c(O)c1 ZINC001235241123 1098914450 /nfs/dbraw/zinc/91/44/50/1098914450.db2.gz YOBGIQLWJGMJIA-GOSISDBHSA-N 2 0 302.462 3.309 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c2ccccc21 ZINC001235270900 1098940480 /nfs/dbraw/zinc/94/04/80/1098940480.db2.gz NTBUSHNVBBLLEZ-LPHOPBHVSA-N 2 0 309.457 3.090 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001235375208 1098985489 /nfs/dbraw/zinc/98/54/89/1098985489.db2.gz LTDZYLDROLNFBP-CTNGQTDRSA-N 2 0 322.452 3.280 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)ccc1N(C)C ZINC001235421691 1099013655 /nfs/dbraw/zinc/01/36/55/1099013655.db2.gz BXSRGNLZTFLFSK-OALUTQOASA-N 2 0 315.505 3.273 20 10 DGCDRP CC[NH+]1C[C@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001235680123 1099124461 /nfs/dbraw/zinc/12/44/61/1099124461.db2.gz ILZRRLTUAJLAFS-HOTGVXAUSA-N 2 0 302.462 3.073 20 10 DGCDRP Oc1cc(Cl)ccc1C[NH+]1CCC(C2CC[NH2+]CC2)CC1 ZINC001235702921 1099135770 /nfs/dbraw/zinc/13/57/70/1099135770.db2.gz XCCSMUAAKCZKIF-UHFFFAOYSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(CN2CCCC3(C[NH2+]C3)C2)cc1 ZINC001235711149 1099140180 /nfs/dbraw/zinc/14/01/80/1099140180.db2.gz KPROLNXIVMFHIE-UHFFFAOYSA-N 2 0 309.457 3.280 20 10 DGCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1ccc(C(F)(F)F)cc1O ZINC001235718305 1099146301 /nfs/dbraw/zinc/14/63/01/1099146301.db2.gz XJHSSUXFLHTIMD-UHFFFAOYSA-N 2 0 316.367 3.233 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)C[C@H]2CCC[NH2+]C2)c2ccccc21 ZINC001235950400 1099283772 /nfs/dbraw/zinc/28/37/72/1099283772.db2.gz DWLYMMOFTUQHRS-INIZCTEOSA-N 2 0 311.473 3.337 20 10 DGCDRP Oc1cc2c(cc1C[NH+]1CCCCCCCC1)C[NH2+]CCO2 ZINC001236306896 1099527266 /nfs/dbraw/zinc/52/72/66/1099527266.db2.gz GBCICRZULCQZHZ-UHFFFAOYSA-N 2 0 304.434 3.030 20 10 DGCDRP COc1cc(C)c(CN([C@@H]2CC[NH2+]C2)C2CCCCC2)c(O)c1 ZINC001236662666 1099730444 /nfs/dbraw/zinc/73/04/44/1099730444.db2.gz LKTIZSAPKQFYFT-MRXNPFEDSA-N 2 0 318.461 3.206 20 10 DGCDRP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001236820360 1099806229 /nfs/dbraw/zinc/80/62/29/1099806229.db2.gz RDQXDHZHGYSXJF-DBVUQKKJSA-N 2 0 309.457 3.263 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3ccc(C(C)C)cc3O)C[C@H]2C1 ZINC001237054503 1099947548 /nfs/dbraw/zinc/94/75/48/1099947548.db2.gz ARDYDGIPYPMJPA-QZTJIDSGSA-N 2 0 302.462 3.289 20 10 DGCDRP CN(CCC[NH+]1CCCC1)Cc1cc(C(F)(F)F)ccc1O ZINC001237140160 1099990219 /nfs/dbraw/zinc/99/02/19/1099990219.db2.gz WWKVOKOMBQFBSR-UHFFFAOYSA-N 2 0 316.367 3.329 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)c(O)c1 ZINC001237415417 1100119678 /nfs/dbraw/zinc/11/96/78/1100119678.db2.gz NMAGKGIEZPMSEI-WMLDXEAASA-N 2 0 302.462 3.264 20 10 DGCDRP Cc1cccc(O)c1C[NH+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001237488497 1100141739 /nfs/dbraw/zinc/14/17/39/1100141739.db2.gz ZBHSZYCPLGVKMK-RTBURBONSA-N 2 0 322.452 3.264 20 10 DGCDRP CCC[N@H+]1C[C@H]2CN(Cc3cc(Cl)cc(C)c3O)C[C@H]2C1 ZINC001237690351 1100214181 /nfs/dbraw/zinc/21/41/81/1100214181.db2.gz WIMQTPBLQNMTBX-GASCZTMLSA-N 2 0 308.853 3.128 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCSC(C)(C)C)cc2)CC1 ZINC001201594245 1102664156 /nfs/dbraw/zinc/66/41/56/1102664156.db2.gz FAASIGNWFCIAEV-UHFFFAOYSA-N 2 0 321.534 3.060 20 10 DGCDRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC001325743092 1103114304 /nfs/dbraw/zinc/11/43/04/1103114304.db2.gz JKGGQSGIGYSEPU-CABCVRRESA-N 2 0 307.457 3.322 20 10 DGCDRP Cc1ccc(C[C@H](C)[NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001246171805 1104418939 /nfs/dbraw/zinc/41/89/39/1104418939.db2.gz DXQHAVWEGMOQDO-SFHVURJKSA-N 2 0 323.484 3.125 20 10 DGCDRP CCCC[C@@H]1C[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)CC[NH2+]1 ZINC001246902303 1104728103 /nfs/dbraw/zinc/72/81/03/1104728103.db2.gz RBNMWMLQLUHKLB-IEBWSBKVSA-N 2 0 303.494 3.495 20 10 DGCDRP CC[C@H]1CC([N@H+](C)Cc2ccc(N(C)C)cc2)C[C@H](CC)[NH2+]1 ZINC001246901098 1104728840 /nfs/dbraw/zinc/72/88/40/1104728840.db2.gz KMARENHPUWCUSS-IRXDYDNUSA-N 2 0 303.494 3.494 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@H]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001246902749 1104729217 /nfs/dbraw/zinc/72/92/17/1104729217.db2.gz UHNRDLXRYGCILO-OALUTQOASA-N 2 0 301.478 3.107 20 10 DGCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(N(C)C)c(C)c3)(C1)CCC2 ZINC001275361223 1104736179 /nfs/dbraw/zinc/73/61/79/1104736179.db2.gz QCYROJKOTRPLEF-RBUKOAKNSA-N 2 0 301.478 3.215 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CC[NH2+][C@H](C(C)C)C1 ZINC001246924383 1104739213 /nfs/dbraw/zinc/73/92/13/1104739213.db2.gz MFFVBEOUGYFTRE-MOPGFXCFSA-N 2 0 303.494 3.351 20 10 DGCDRP CC[N@H+](Cc1ccccc1O)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256862229 1106499877 /nfs/dbraw/zinc/49/98/77/1106499877.db2.gz KNLPHGDNMNFYIN-UHFFFAOYSA-N 2 0 311.429 3.278 20 10 DGCDRP C[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccc(N4CCCC4)cc3)C2)C1 ZINC001261244934 1107370808 /nfs/dbraw/zinc/37/08/08/1107370808.db2.gz JHDQBKQTTZRSOM-HXUWFJFHSA-N 2 0 313.489 3.205 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000093564088 193269683 /nfs/dbraw/zinc/26/96/83/193269683.db2.gz XJSUAPRBOBQQAX-KRWDZBQOSA-N 2 0 318.461 3.241 20 10 DGCDRP CCOc1cccc(C[N@H+](CC)CCC[NH+]2CCCC2)c1O ZINC000289444426 131387136 /nfs/dbraw/zinc/38/71/36/131387136.db2.gz MGALZHGWFXCBKB-UHFFFAOYSA-N 2 0 306.450 3.099 20 10 DGCDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000124163457 431885077 /nfs/dbraw/zinc/88/50/77/431885077.db2.gz GZIIOLNVNWKHGR-SFHVURJKSA-N 2 0 301.478 3.108 20 10 DGCDRP COCC[N@H+](C)CCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185008721 432455813 /nfs/dbraw/zinc/45/58/13/432455813.db2.gz NWSRJKDGIGHPDV-OAHLLOKOSA-N 2 0 316.445 3.164 20 10 DGCDRP C[C@H]([NH2+]Cc1ccccc1O)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272183378 432458322 /nfs/dbraw/zinc/45/83/22/432458322.db2.gz KNSVTZPQIHCRBO-LPHOPBHVSA-N 2 0 310.441 3.392 20 10 DGCDRP Cn1ccnc1[C@@H]1CCC[N@H+](Cc2c([O-])ccc(Cl)c2F)C1 ZINC000373228797 433137342 /nfs/dbraw/zinc/13/73/42/433137342.db2.gz NDMJGQZWMGCKMN-LLVKDONJSA-N 2 0 323.799 3.298 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423085840 434207143 /nfs/dbraw/zinc/20/71/43/434207143.db2.gz LOUACBYTVMNRKL-KZNAEPCWSA-N 2 0 311.473 3.497 20 10 DGCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2c(O)ccc3ccncc32)C1 ZINC000743390695 575049351 /nfs/dbraw/zinc/04/93/51/575049351.db2.gz UXHXSQQJRSACNW-OAHLLOKOSA-N 2 0 313.445 3.104 20 10 DGCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)cc1 ZINC000925779997 618617769 /nfs/dbraw/zinc/61/77/69/618617769.db2.gz DDGXGXMXQBJNHJ-HIFRSBDPSA-N 2 0 311.420 3.038 20 10 DGCDRP C[C@@]1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCC[NH2+]C1 ZINC000841056049 619249103 /nfs/dbraw/zinc/24/91/03/619249103.db2.gz AYRMEZHVVFSHMP-LJQANCHMSA-N 2 0 301.478 3.156 20 10 DGCDRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1O ZINC000902500669 619643644 /nfs/dbraw/zinc/64/36/44/619643644.db2.gz GRWDYFUUZNVUPR-GZRFBZBPSA-N 2 0 324.424 3.299 20 10 DGCDRP COc1ccc(N2CC[C@@H]([NH2+]C[C@@H]([NH3+])CCC(C)(C)C)C2)cc1 ZINC000904376545 619918279 /nfs/dbraw/zinc/91/82/79/619918279.db2.gz BCXOGKRXTIEEDJ-JKSUJKDBSA-N 2 0 319.493 3.017 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000841086255 620220993 /nfs/dbraw/zinc/22/09/93/620220993.db2.gz GRTMPRZDJRSMQZ-APWZRJJASA-N 2 0 301.478 3.025 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000858100267 621152778 /nfs/dbraw/zinc/15/27/78/621152778.db2.gz ASVBPFQGIUDRQR-KRWDZBQOSA-N 2 0 303.494 3.495 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000756422733 621637770 /nfs/dbraw/zinc/63/77/70/621637770.db2.gz NLWKZURQECCJSI-XHSDSOJGSA-N 2 0 320.477 3.419 20 10 DGCDRP CC[NH+]1CCC(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756534668 621645996 /nfs/dbraw/zinc/64/59/96/621645996.db2.gz MFWRXWQTFWGWIN-IUODEOHRSA-N 2 0 306.425 3.401 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]CCC2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756546841 621646509 /nfs/dbraw/zinc/64/65/09/621646509.db2.gz SHIRRNZRLKLTCP-IUODEOHRSA-N 2 0 306.425 3.401 20 10 DGCDRP COc1cccc(C[NH2+]CCC2CC[NH+](C(C)C)CC2)c1O ZINC000865717087 621982571 /nfs/dbraw/zinc/98/25/71/621982571.db2.gz NTWFFSLKHYCPLY-UHFFFAOYSA-N 2 0 306.450 3.001 20 10 DGCDRP CCOc1cccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)c1O ZINC000769470049 622530620 /nfs/dbraw/zinc/53/06/20/622530620.db2.gz JIDRSGLZVGVYHW-GOEBONIOSA-N 2 0 306.450 3.096 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(O)c1 ZINC000769498105 622534119 /nfs/dbraw/zinc/53/41/19/622534119.db2.gz GGQSIANSDCMKSL-INIZCTEOSA-N 2 0 318.461 3.099 20 10 DGCDRP Oc1ccccc1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000770509581 622640410 /nfs/dbraw/zinc/64/04/10/622640410.db2.gz PDQONEDRKBWMQV-UHFFFAOYSA-N 2 0 302.462 3.480 20 10 DGCDRP CCC(CC)(CC)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771841541 622801185 /nfs/dbraw/zinc/80/11/85/622801185.db2.gz JDCRWMVYSYTCCH-UHFFFAOYSA-N 2 0 303.494 3.497 20 10 DGCDRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(F)ccc1O ZINC000873234819 623086113 /nfs/dbraw/zinc/08/61/13/623086113.db2.gz FZIUZSDGNFUWQS-LBPRGKRZSA-N 2 0 300.377 3.028 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]([NH3+])Cc2ccccc2)c1 ZINC000873235695 623086520 /nfs/dbraw/zinc/08/65/20/623086520.db2.gz SDRFBTYJRFSWBD-GDBMZVCRSA-N 2 0 314.429 3.012 20 10 DGCDRP C[C@H]1CCC[C@@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775649397 623303124 /nfs/dbraw/zinc/30/31/24/623303124.db2.gz QXLBPWLPOXOHJF-FXAWDEMLSA-N 2 0 315.505 3.449 20 10 DGCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C1CC1)C1CC1 ZINC000775668445 623309422 /nfs/dbraw/zinc/30/94/22/623309422.db2.gz ZVFNMUXJXPSOID-UHFFFAOYSA-N 2 0 313.489 3.059 20 10 DGCDRP C[C@@H]1CC[C@H](C)C[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775702750 623315633 /nfs/dbraw/zinc/31/56/33/623315633.db2.gz WLTHQWKBLWLTPL-DLBZAZTESA-N 2 0 301.478 3.059 20 10 DGCDRP CSCC[C@@H](C)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775715118 623318600 /nfs/dbraw/zinc/31/86/00/623318600.db2.gz WMYZXYSIRGDCTH-MRXNPFEDSA-N 2 0 321.534 3.012 20 10 DGCDRP CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775998183 623362418 /nfs/dbraw/zinc/36/24/18/623362418.db2.gz DSLQLOWRMGPSCY-VQIMIIECSA-N 2 0 301.478 3.059 20 10 DGCDRP Cc1cccc(C[NH2+]CC2(c3ccccc3)CC[NH+](C)CC2)c1O ZINC000877717561 624004367 /nfs/dbraw/zinc/00/43/67/624004367.db2.gz LGFRGHWEQSSFLK-UHFFFAOYSA-N 2 0 324.468 3.454 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000796772265 626081127 /nfs/dbraw/zinc/08/11/27/626081127.db2.gz PQWIAKNWJBEUHB-OTWHNJEPSA-N 2 0 301.478 3.023 20 10 DGCDRP CCOc1ccc(O)c(C[N@H+](CC)CCC[NH+]2CCCC2)c1 ZINC000809749866 626946490 /nfs/dbraw/zinc/94/64/90/626946490.db2.gz LHPIWXSFTXOQLU-UHFFFAOYSA-N 2 0 306.450 3.099 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000809767351 626948702 /nfs/dbraw/zinc/94/87/02/626948702.db2.gz INHYXCFYTYQDRW-AZUAARDMSA-N 2 0 315.505 3.449 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@H](C)[C@@H]3C)cc2F)CC1 ZINC000813858589 627516640 /nfs/dbraw/zinc/51/66/40/627516640.db2.gz ASTNSTOIYXMANF-RLFYNMQTSA-N 2 0 319.468 3.102 20 10 DGCDRP CN(C)c1ccc(C[NH2+]CCCCC[NH+]2CCCC2)cc1F ZINC000815151009 627638229 /nfs/dbraw/zinc/63/82/29/627638229.db2.gz IRCKQYOXYFJACJ-UHFFFAOYSA-N 2 0 307.457 3.247 20 10 DGCDRP Cc1cc(C)c([C@@H](C)N2CCc3sc(C[NH3+])nc3C2)c(O)c1 ZINC000925751779 627787642 /nfs/dbraw/zinc/78/76/42/627787642.db2.gz PSSWPURZMKHWKR-GFCCVEGCSA-N 2 0 317.458 3.044 20 10 DGCDRP Cc1cc(C)c([C@H](C)N2CCc3sc(C[NH3+])nc3C2)c(O)c1 ZINC000925751782 627787826 /nfs/dbraw/zinc/78/78/26/627787826.db2.gz PSSWPURZMKHWKR-LBPRGKRZSA-N 2 0 317.458 3.044 20 10 DGCDRP C[C@@H]([NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1)c1cc(F)ccc1O ZINC000925886989 627812543 /nfs/dbraw/zinc/81/25/43/627812543.db2.gz PAKCTARGHJVIJM-NRXGSXMXSA-N 2 0 314.404 3.241 20 10 DGCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@@](C[NH3+])(c3ccccc3)C2)c1 ZINC000925886905 627812638 /nfs/dbraw/zinc/81/26/38/627812638.db2.gz MPZDNHQSXJNLAM-MDYRTPRTSA-N 2 0 310.441 3.410 20 10 DGCDRP CCC[N@H+](CCC[NH+](C)C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816610833 627814616 /nfs/dbraw/zinc/81/46/16/627814616.db2.gz ANQJRHGSWUUXHS-UHFFFAOYSA-N 2 0 302.821 3.348 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)C1C[NH2+]C1 ZINC000817932730 627965444 /nfs/dbraw/zinc/96/54/44/627965444.db2.gz XKSUHXQOGNIFPY-KBPBESRZSA-N 2 0 321.896 3.274 20 10 DGCDRP CC(C)[NH2+]CCC[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000817954277 627973407 /nfs/dbraw/zinc/97/34/07/627973407.db2.gz WYXAGUGGOUGTHZ-NSHDSACASA-N 2 0 315.255 3.193 20 10 DGCDRP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000817959989 627976184 /nfs/dbraw/zinc/97/61/84/627976184.db2.gz JSNPXTUMYFPWOR-JTQLQIEISA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817965392 627977884 /nfs/dbraw/zinc/97/78/84/627977884.db2.gz TULLQYZTONAHLP-AWEZNQCLSA-N 2 0 302.462 3.311 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817965381 627977957 /nfs/dbraw/zinc/97/79/57/627977957.db2.gz PVDCGRABTMDXCS-QWHCGFSZSA-N 2 0 302.340 3.189 20 10 DGCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000817970850 627980073 /nfs/dbraw/zinc/98/00/73/627980073.db2.gz GFQRNIGTUZQDSL-JFIYKMOQSA-N 2 0 301.478 3.468 20 10 DGCDRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000817976239 627980597 /nfs/dbraw/zinc/98/05/97/627980597.db2.gz IRWSESSRMOUQMG-GHMZBOCLSA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c2c1c(F)ccc2O ZINC000817985090 627983459 /nfs/dbraw/zinc/98/34/59/627983459.db2.gz ABZXAGCRHJYLSG-HVNMYJMUSA-N 2 0 304.409 3.057 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000817984835 627983575 /nfs/dbraw/zinc/98/35/75/627983575.db2.gz ASAYBCAGRJAFQQ-LEUOFYLZSA-N 2 0 301.478 3.181 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2c1c(F)ccc2O ZINC000817984883 627983612 /nfs/dbraw/zinc/98/36/12/627983612.db2.gz BITYIFDGAIQULH-MBNYWOFBSA-N 2 0 304.409 3.344 20 10 DGCDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000817987219 627984488 /nfs/dbraw/zinc/98/44/88/627984488.db2.gz YHZSZBASKUJOGD-WMZOPIPTSA-N 2 0 301.478 3.468 20 10 DGCDRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000817987218 627984620 /nfs/dbraw/zinc/98/46/20/627984620.db2.gz YHZSZBASKUJOGD-SJLPKXTDSA-N 2 0 301.478 3.468 20 10 DGCDRP Cc1csc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000824750480 628689559 /nfs/dbraw/zinc/68/95/59/628689559.db2.gz KZUKGEQXZZKXAY-UHFFFAOYSA-N 2 0 315.486 3.098 20 10 DGCDRP Cc1cc(O)c(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1Cl ZINC000825716229 628789739 /nfs/dbraw/zinc/78/97/39/628789739.db2.gz QVIGSYKOKKGONU-UHFFFAOYSA-N 2 0 308.853 3.318 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2c1c(F)ccc2O ZINC000834891802 629799173 /nfs/dbraw/zinc/79/91/73/629799173.db2.gz JLWKUFLMGFCRAN-JBMNRGHBSA-N 2 0 304.409 3.294 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC(CC[NH+](C)C)CC2)cc1 ZINC000835027413 629829208 /nfs/dbraw/zinc/82/92/08/629829208.db2.gz LXWSTTWNOKMYSZ-WAYWQWQTSA-N 2 0 315.505 3.430 20 10 DGCDRP CCC[NH+]1CCC(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835036170 629830290 /nfs/dbraw/zinc/83/02/90/629830290.db2.gz AVTGDESHJRJAFN-WAYWQWQTSA-N 2 0 315.505 3.477 20 10 DGCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835034565 629830725 /nfs/dbraw/zinc/83/07/25/629830725.db2.gz BLNSVELDHAVOJA-QWNKOJSDSA-N 2 0 301.478 3.087 20 10 DGCDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835038584 629831145 /nfs/dbraw/zinc/83/11/45/629831145.db2.gz UBTQVEJJWAEVGR-XZXOBPBMSA-N 2 0 315.505 3.476 20 10 DGCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840917968 630378326 /nfs/dbraw/zinc/37/83/26/630378326.db2.gz XMBSRJGEJGQVJK-QGZVFWFLSA-N 2 0 303.494 3.225 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1O ZINC000841028924 630398513 /nfs/dbraw/zinc/39/85/13/630398513.db2.gz IHZAQFPGPXNCFO-NSHDSACASA-N 2 0 320.820 3.364 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1F ZINC000841057555 630403238 /nfs/dbraw/zinc/40/32/38/630403238.db2.gz PIRWDGUCZSRKAR-SFHVURJKSA-N 2 0 307.457 3.151 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]CC2(C)C)cc1F ZINC000841072123 630404201 /nfs/dbraw/zinc/40/42/01/630404201.db2.gz HFEUTGKLBDTRGQ-KRWDZBQOSA-N 2 0 307.457 3.150 20 10 DGCDRP Cc1ccc(O)c(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1 ZINC000842767215 630573705 /nfs/dbraw/zinc/57/37/05/630573705.db2.gz YYEWLOJXQIXIKK-MOPGFXCFSA-N 2 0 310.441 3.136 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccccc1O ZINC000842922002 630593545 /nfs/dbraw/zinc/59/35/45/630593545.db2.gz ULWUNGSJXZFXSK-SUMDDJOVSA-N 2 0 310.441 3.388 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)c1O ZINC000843046034 630608324 /nfs/dbraw/zinc/60/83/24/630608324.db2.gz SVEAFAOLWJJPQA-CJNGLKHVSA-N 2 0 308.853 3.318 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)cc1 ZINC000843057392 630609606 /nfs/dbraw/zinc/60/96/06/630609606.db2.gz CXGVBKWHQQDRJB-YTQUADARSA-N 2 0 301.478 3.092 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@]1(C)CC[NH2+]C1 ZINC000843059465 630609896 /nfs/dbraw/zinc/60/98/96/630609896.db2.gz MJEKQJDJYMJBLS-IBGZPJMESA-N 2 0 301.478 3.108 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000843116858 630615207 /nfs/dbraw/zinc/61/52/07/630615207.db2.gz MWLAJRPAXKMLPY-FQEVSTJZSA-N 2 0 313.489 3.252 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000843123696 630615770 /nfs/dbraw/zinc/61/57/70/630615770.db2.gz NRRQBBDVHAHOKX-IBGZPJMESA-N 2 0 301.478 3.108 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1 ZINC000843125222 630616604 /nfs/dbraw/zinc/61/66/04/630616604.db2.gz OKYAZNJCUAGJPP-KGJVCODVSA-N 2 0 313.489 3.087 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cc1C ZINC000843128283 630617114 /nfs/dbraw/zinc/61/71/14/630617114.db2.gz VQNBZNBQIBCDCR-IAGOWNOFSA-N 2 0 302.462 3.221 20 10 DGCDRP Cc1cc(Cl)cc(C[NH2+]Cc2ccc(C[NH3+])cc2F)c1O ZINC000844904734 630973270 /nfs/dbraw/zinc/97/32/70/630973270.db2.gz PDLFYYGXMYLFCG-UHFFFAOYSA-N 2 0 308.784 3.242 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)c1O ZINC000846143236 631211852 /nfs/dbraw/zinc/21/18/52/631211852.db2.gz CWAYKMOVKWXOHJ-HUUCEWRRSA-N 2 0 306.450 3.172 20 10 DGCDRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc(F)ccc1O ZINC000850582828 632202047 /nfs/dbraw/zinc/20/20/47/632202047.db2.gz LMMXXFFVXLJVBJ-CYBMUJFWSA-N 2 0 306.425 3.304 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c(O)c1 ZINC000850585388 632203041 /nfs/dbraw/zinc/20/30/41/632203041.db2.gz WRGJKGPRUMNXEM-HNNXBMFYSA-N 2 0 302.462 3.473 20 10 DGCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cc3c(cc2O)CCCC3)C1 ZINC000160453810 655636239 /nfs/dbraw/zinc/63/62/39/655636239.db2.gz JUGXUYLLKPDOGL-MJGOQNOKSA-N 2 0 314.473 3.187 20 10 DGCDRP C[N@H+](CCC[NH2+]Cc1ccc2c(c1)CCO2)Cc1ccccc1 ZINC000237089755 657090711 /nfs/dbraw/zinc/09/07/11/657090711.db2.gz YSOLHAVCSOZJOP-UHFFFAOYSA-N 2 0 310.441 3.233 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC000093089309 662344026 /nfs/dbraw/zinc/34/40/26/662344026.db2.gz KBPFARQPLVEFCP-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP Cc1cc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)ccc1N1CCCCC1 ZINC001579598290 1191981815 /nfs/dbraw/zinc/98/18/15/1191981815.db2.gz NKRYDZIENSQIGM-QGZVFWFLSA-N 2 0 301.478 3.156 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)c1 ZINC001356057023 1181132733 /nfs/dbraw/zinc/13/27/33/1181132733.db2.gz LCIQFEAHTVFNBO-BQFCYCMXSA-N 2 0 302.462 3.171 20 10 DGCDRP CCOCc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)ccc1OC ZINC001461065775 1182763215 /nfs/dbraw/zinc/76/32/15/1182763215.db2.gz VRFVFYVLSYKOPE-MRXNPFEDSA-N 2 0 320.477 3.053 20 10 DGCDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC001461365888 1182799429 /nfs/dbraw/zinc/79/94/29/1182799429.db2.gz UEPIKBJZJSRQHS-QGZVFWFLSA-N 2 0 321.484 3.349 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]Cc2ccc3c[nH+]cn3c2)cc1 ZINC001474173994 1183877362 /nfs/dbraw/zinc/87/73/62/1183877362.db2.gz HJIPDRZUIVDLHF-ONEGZZNKSA-N 2 0 306.413 3.203 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC001652181232 1195558945 /nfs/dbraw/zinc/55/89/45/1195558945.db2.gz GSFNYALUCNNLST-QGZVFWFLSA-N 2 0 303.494 3.415 20 10 DGCDRP C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001657156658 1196112340 /nfs/dbraw/zinc/11/23/40/1196112340.db2.gz FIZGAIBLPOCEFV-IAGOWNOFSA-N 2 0 315.505 3.353 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3(C)CCCC3)cc2)CC1 ZINC001657182241 1196115725 /nfs/dbraw/zinc/11/57/25/1196115725.db2.gz VDQSCRXQYFLZQG-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP CCC[C@@H](C)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001658508047 1196266787 /nfs/dbraw/zinc/26/67/87/1196266787.db2.gz UKAMJYSTRAKLBS-QGZVFWFLSA-N 2 0 303.494 3.354 20 10 DGCDRP COc1ccc(O)c(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC001659420802 1196381382 /nfs/dbraw/zinc/38/13/82/1196381382.db2.gz PWPGXIOAUWZQCG-GJZGRUSLSA-N 2 0 318.461 3.143 20 10 DGCDRP CC1CC[NH+](CCC[NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC001660797454 1196525488 /nfs/dbraw/zinc/52/54/88/1196525488.db2.gz DUELJCWSKQAZBB-XQRVVYSFSA-N 2 0 315.505 3.477 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC001664566595 1197014851 /nfs/dbraw/zinc/01/48/51/1197014851.db2.gz MRHLPKIUNHTFTA-UHFFFAOYSA-N 2 0 303.494 3.273 20 10 DGCDRP Cc1cc(N2CC[NH+](Cc3cc(Cl)ccc3O)CC2)cc[nH+]1 ZINC001203665611 1090776326 /nfs/dbraw/zinc/77/63/26/1090776326.db2.gz PHUBXHPSCPPJJX-UHFFFAOYSA-N 2 0 317.820 3.071 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC3(C[NH+](C)C3)CC2)c2ccccc21 ZINC001204239933 1090931368 /nfs/dbraw/zinc/93/13/68/1090931368.db2.gz FSGWTSKQVVTQBM-UHFFFAOYSA-N 2 0 323.484 3.433 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c(Cl)c1 ZINC001204735436 1091025628 /nfs/dbraw/zinc/02/56/28/1091025628.db2.gz VBMIVEKERZZAAT-UHFFFAOYSA-N 2 0 321.896 3.372 20 10 DGCDRP C[C@]1([NH3+])CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001205287713 1091166024 /nfs/dbraw/zinc/16/60/24/1091166024.db2.gz BBTOGILWCZQKOX-AWEZNQCLSA-N 2 0 302.340 3.114 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C[C@@H]1C[NH3+] ZINC001205296194 1091169793 /nfs/dbraw/zinc/16/97/93/1091169793.db2.gz IRBFHQLHAHWXCU-RDJZCZTQSA-N 2 0 311.473 3.323 20 10 DGCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001205558099 1091251294 /nfs/dbraw/zinc/25/12/94/1091251294.db2.gz BTUUBOHMXRPGGY-LJQANCHMSA-N 2 0 319.468 3.330 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c(O)c1 ZINC001205627408 1091285910 /nfs/dbraw/zinc/28/59/10/1091285910.db2.gz PIDHDNYEJWLQKQ-JKSUJKDBSA-N 2 0 319.493 3.045 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c1 ZINC001205786772 1091348332 /nfs/dbraw/zinc/34/83/32/1091348332.db2.gz BGCCMPUNSYBVFW-CQSZACIVSA-N 2 0 312.404 3.106 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2O)CCC[C@@H]1C[NH3+] ZINC001206026841 1091457684 /nfs/dbraw/zinc/45/76/84/1091457684.db2.gz UIDLYTIBRZSFHV-VXGBXAGGSA-N 2 0 316.367 3.218 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)cc(C[NH+](C)C)c1O ZINC001139256270 1091502031 /nfs/dbraw/zinc/50/20/31/1091502031.db2.gz XQHFRXTVWKBAQT-HZPDHXFCSA-N 2 0 318.461 3.084 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)cc(C[NH+](C)C)c1O ZINC001139257220 1091502534 /nfs/dbraw/zinc/50/25/34/1091502534.db2.gz UYALSHPBQZTSIZ-KGLIPLIRSA-N 2 0 306.450 3.083 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3CC4CCC(CC4)C3)cc2)CC1 ZINC001139410899 1091551033 /nfs/dbraw/zinc/55/10/33/1091551033.db2.gz KYWXKQNCJDYHDY-UHFFFAOYSA-N 2 0 313.489 3.060 20 10 DGCDRP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001206362731 1091600251 /nfs/dbraw/zinc/60/02/51/1091600251.db2.gz QEBOKJSCROCIJU-SFHVURJKSA-N 2 0 302.393 3.198 20 10 DGCDRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001206541888 1091662373 /nfs/dbraw/zinc/66/23/73/1091662373.db2.gz MPZUGKFFDSHOED-IBGZPJMESA-N 2 0 301.478 3.238 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)c(O)c1 ZINC001140854783 1092031504 /nfs/dbraw/zinc/03/15/04/1092031504.db2.gz AMHIQTDCMXAJHR-UHFFFAOYSA-N 2 0 319.493 3.012 20 10 DGCDRP CC[N@H+](CCC[NH+]1CCCCC1)Cc1ccc(N(C)C)cc1 ZINC001209452690 1092780453 /nfs/dbraw/zinc/78/04/53/1092780453.db2.gz RSJIAXUAUUYIRJ-UHFFFAOYSA-N 2 0 303.494 3.451 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])c1O ZINC000404315964 1094254209 /nfs/dbraw/zinc/25/42/09/1094254209.db2.gz OEYNQWIIOGITND-FZMZJTMJSA-N 2 0 312.841 3.004 20 10 DGCDRP CCc1cccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)c1O ZINC001336888806 1094774293 /nfs/dbraw/zinc/77/42/93/1094774293.db2.gz MKOHYARODVEMEL-CGTJXYLNSA-N 2 0 302.462 3.117 20 10 DGCDRP CCN(CC)c1ccc(CN2CCC[C@@]23CCC[NH2+]C3)cc1 ZINC001222237473 1095505042 /nfs/dbraw/zinc/50/50/42/1095505042.db2.gz KUBGJSSYSCUXQC-LJQANCHMSA-N 2 0 301.478 3.251 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(F)(C[NH3+])CC2)c2ccccc21 ZINC001222533389 1095655798 /nfs/dbraw/zinc/65/57/98/1095655798.db2.gz WSBJIRMOBSHGRO-UHFFFAOYSA-N 2 0 315.436 3.169 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3C[NH2+]CC[C@H]32)c2ccccc21 ZINC001222620265 1095695006 /nfs/dbraw/zinc/69/50/06/1095695006.db2.gz JZUXGXPOOUBCQV-HNAYVOBHSA-N 2 0 309.457 3.090 20 10 DGCDRP CN(C)c1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c2ccccc21 ZINC001222623116 1095697983 /nfs/dbraw/zinc/69/79/83/1095697983.db2.gz AHZDDAQYBQGTEU-CALCHBBNSA-N 2 0 323.484 3.337 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)c(Cl)c1 ZINC001206311851 1098664288 /nfs/dbraw/zinc/66/42/88/1098664288.db2.gz VXVKUOTVPSRGTG-KRWDZBQOSA-N 2 0 309.885 3.357 20 10 DGCDRP Oc1cc(Cl)ccc1C[N@@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235157982 1098843866 /nfs/dbraw/zinc/84/38/66/1098843866.db2.gz SWASZJGZKQUGQT-INIZCTEOSA-N 2 0 308.853 3.400 20 10 DGCDRP Oc1cccc(Cl)c1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235228467 1098901752 /nfs/dbraw/zinc/90/17/52/1098901752.db2.gz MUDVZOXDYRPXCW-INIZCTEOSA-N 2 0 308.853 3.400 20 10 DGCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c1 ZINC001235251424 1098924730 /nfs/dbraw/zinc/92/47/30/1098924730.db2.gz RUMVPXBXQBJRKU-TZIWHRDSSA-N 2 0 322.452 3.422 20 10 DGCDRP Cc1ccc(C)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1O ZINC001235428663 1099021804 /nfs/dbraw/zinc/02/18/04/1099021804.db2.gz OSGWSZSAGPOJDG-IAGOWNOFSA-N 2 0 302.462 3.221 20 10 DGCDRP Cc1cc(C[NH+]2CCC(C3CC[NH2+]CC3)CC2)ccc1N(C)C ZINC001235702955 1099135817 /nfs/dbraw/zinc/13/58/17/1099135817.db2.gz YNYFNWXWISEGNA-UHFFFAOYSA-N 2 0 315.505 3.273 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001235868917 1099227434 /nfs/dbraw/zinc/22/74/34/1099227434.db2.gz WRFXXROJOIWPCC-ICSRJNTNSA-N 2 0 313.489 3.251 20 10 DGCDRP CC(C)(C)c1cccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1O ZINC001236321108 1099534010 /nfs/dbraw/zinc/53/40/10/1099534010.db2.gz WERVNPUBIZQTGJ-GASCZTMLSA-N 2 0 302.462 3.121 20 10 DGCDRP COc1cc(C)c(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c(O)c1 ZINC001236459556 1099623508 /nfs/dbraw/zinc/62/35/08/1099623508.db2.gz UXHBMEYJCDJYOB-UHFFFAOYSA-N 2 0 320.477 3.309 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)cc1 ZINC001236818143 1099805068 /nfs/dbraw/zinc/80/50/68/1099805068.db2.gz GLLCHMVSBBEHQO-IHPCNDPISA-N 2 0 309.457 3.263 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N(CC)CC)cc1O)C[C@H]1CC[NH2+]C1 ZINC001236834887 1099821690 /nfs/dbraw/zinc/82/16/90/1099821690.db2.gz JJESCNFCOHPFDM-INIZCTEOSA-N 2 0 319.493 3.060 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N(CC)CC)cc1)C[C@H]1CC[NH2+]C1 ZINC001236835376 1099821787 /nfs/dbraw/zinc/82/17/87/1099821787.db2.gz MKADTBBCCGSOCJ-SFHVURJKSA-N 2 0 303.494 3.354 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3cc4ccccc4cc3O)C[C@H]2C1 ZINC001236838274 1099824461 /nfs/dbraw/zinc/82/44/61/1099824461.db2.gz XOYKICZOUOMNDT-RTBURBONSA-N 2 0 310.441 3.319 20 10 DGCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)CC(C)(C)C ZINC001236939521 1099881486 /nfs/dbraw/zinc/88/14/86/1099881486.db2.gz RVZMSRFIZDYFDE-UHFFFAOYSA-N 2 0 307.457 3.055 20 10 DGCDRP CCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236932491 1099882695 /nfs/dbraw/zinc/88/26/95/1099882695.db2.gz PNMNYEQKMDCDNM-UHFFFAOYSA-N 2 0 319.468 3.200 20 10 DGCDRP CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236941529 1099883366 /nfs/dbraw/zinc/88/33/66/1099883366.db2.gz CHQXFCNTWYQXLN-IBGZPJMESA-N 2 0 319.468 3.198 20 10 DGCDRP COc1ccc(C[NH+]2CCC(CC3CC[NH2+]CC3)CC2)c(O)c1 ZINC001236949394 1099889242 /nfs/dbraw/zinc/88/92/42/1099889242.db2.gz VHMADBRREUFUPA-UHFFFAOYSA-N 2 0 318.461 3.003 20 10 DGCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)[C@@H]1CC[NH3+] ZINC001326465726 1103328076 /nfs/dbraw/zinc/32/80/76/1103328076.db2.gz WIIKHYJAHVXZDP-QFBILLFUSA-N 2 0 301.478 3.236 20 10 DGCDRP C[N@@H+]1CCCC2(CC[NH+](Cc3ccc(Cl)cc3O)CC2)C1 ZINC001275267397 1104697617 /nfs/dbraw/zinc/69/76/17/1104697617.db2.gz MZWRVOQCJJOHFD-UHFFFAOYSA-N 2 0 308.853 3.353 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@H]2CC[NH2+][C@H](C(C)(C)C)C2)cc1 ZINC001246901891 1104728569 /nfs/dbraw/zinc/72/85/69/1104728569.db2.gz PMJIIQJEUOCMFD-ROUUACIJSA-N 2 0 303.494 3.351 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@]3(CCC[NH+](C)C3)C2)ccc1N(C)C ZINC001275360699 1104736370 /nfs/dbraw/zinc/73/63/70/1104736370.db2.gz HHAWHTYDILOTGQ-FQEVSTJZSA-N 2 0 315.505 3.369 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCCC3)cc2)[C@@H](C)C1 ZINC001319717060 1108608118 /nfs/dbraw/zinc/60/81/18/1108608118.db2.gz KGKAYNOIMZDCOT-PXNSSMCTSA-N 2 0 315.505 3.449 20 10 DGCDRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000273540851 130134010 /nfs/dbraw/zinc/13/40/10/130134010.db2.gz YEEQBFZEOOFPII-AWEZNQCLSA-N 2 0 300.446 3.184 20 10 DGCDRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000177974491 228336092 /nfs/dbraw/zinc/33/60/92/228336092.db2.gz JPAVXLSUMFIYAD-JTDSTZFVSA-N 2 0 301.478 3.105 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1O ZINC000183428135 432292895 /nfs/dbraw/zinc/29/28/95/432292895.db2.gz XJEJRAHCZRJRKO-OAHLLOKOSA-N 2 0 314.429 3.183 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2c([O-])ccc(Cl)c2F)C[C@@H]1n1ccnc1 ZINC000191442906 432265645 /nfs/dbraw/zinc/26/56/45/432265645.db2.gz SJPKRNAHUGEQES-RISCZKNCSA-N 2 0 323.799 3.464 20 10 DGCDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000296954262 432942307 /nfs/dbraw/zinc/94/23/07/432942307.db2.gz QWOXWCUVQFUNJB-RDJZCZTQSA-N 2 0 302.462 3.337 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)c(O)c1 ZINC000290400439 433046142 /nfs/dbraw/zinc/04/61/42/433046142.db2.gz JJUAJSPHJCFYOK-CRAIPNDOSA-N 2 0 318.461 3.097 20 10 DGCDRP C[C@@H](C[NH2+][C@@H](C)c1cc(Br)ccc1O)C[NH+](C)C ZINC000293759971 433857127 /nfs/dbraw/zinc/85/71/27/433857127.db2.gz RZSGMAYRMHFULJ-QWRGUYRKSA-N 2 0 315.255 3.003 20 10 DGCDRP [O-]c1cc(F)c(Cl)cc1CN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000295436023 434359106 /nfs/dbraw/zinc/35/91/06/434359106.db2.gz UDWAKAXUSWELQK-GFCCVEGCSA-N 2 0 312.816 3.102 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc1F ZINC000740003897 574917841 /nfs/dbraw/zinc/91/78/41/574917841.db2.gz ASJXOEBTNIMMLX-MRXNPFEDSA-N 2 0 321.484 3.493 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c(O)c1 ZINC000853239281 620680908 /nfs/dbraw/zinc/68/09/08/620680908.db2.gz DHWZJFUJTWHIMY-DOTOQJQBSA-N 2 0 302.462 3.473 20 10 DGCDRP COc1ccc(N2CC[C@H]([NH2+][C@H]3C[C@H]([NH3+])c4ccccc43)C2)cc1 ZINC000854217186 620785101 /nfs/dbraw/zinc/78/51/01/620785101.db2.gz KKDCPIPQSGMKDN-GKCIPKSASA-N 2 0 323.440 3.008 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000925780800 618618113 /nfs/dbraw/zinc/61/81/13/618618113.db2.gz GZLCINGRXBCCJU-WFASDCNBSA-N 2 0 324.415 3.166 20 10 DGCDRP CCOc1cccc(C[N@H+](C)CCCC[NH+]2CCCCC2)c1O ZINC000895684164 618818526 /nfs/dbraw/zinc/81/85/26/618818526.db2.gz AKGFTLFKYGXOKR-UHFFFAOYSA-N 2 0 320.477 3.489 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000841004141 619148436 /nfs/dbraw/zinc/14/84/36/619148436.db2.gz MQZJWIZUXTXGJJ-FUHWJXTLSA-N 2 0 303.494 3.353 20 10 DGCDRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1O ZINC000902500675 619643883 /nfs/dbraw/zinc/64/38/83/619643883.db2.gz GRWDYFUUZNVUPR-VHFSOBRXSA-N 2 0 324.424 3.299 20 10 DGCDRP CN(C)c1ccc(C[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CC2)cc1 ZINC000903880586 619827741 /nfs/dbraw/zinc/82/77/41/619827741.db2.gz UVPCFVIOPDLTRX-AYHJJNSGSA-N 2 0 313.489 3.248 20 10 DGCDRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000903973487 619847725 /nfs/dbraw/zinc/84/77/25/619847725.db2.gz FKVYMCZNDCYNOH-SJLPKXTDSA-N 2 0 301.478 3.012 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C[C@]2(C)CCC[NH2+]C2)C2CC2)cc1 ZINC000904307722 619911638 /nfs/dbraw/zinc/91/16/38/619911638.db2.gz VIHKIERGRDEDFK-LJQANCHMSA-N 2 0 301.478 3.107 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)/C=C/Cl)cc2)CC1 ZINC000922649175 621073477 /nfs/dbraw/zinc/07/34/77/621073477.db2.gz ULDUFTZSYVHSRV-CMDGGOBGSA-N 2 0 307.869 3.059 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)c1 ZINC000922848111 621108410 /nfs/dbraw/zinc/10/84/10/621108410.db2.gz NKMOATLAXKEPPJ-UHFFFAOYSA-N 2 0 318.461 3.288 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2c1c(F)ccc2O ZINC000756402612 621635487 /nfs/dbraw/zinc/63/54/87/621635487.db2.gz VXDCMCHNEQGYNF-LALPHHSUSA-N 2 0 304.409 3.154 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+]CC3(C)CCC3)cc2F)CC1 ZINC000766215429 622312822 /nfs/dbraw/zinc/31/28/22/622312822.db2.gz ZAECEIOFHMUEJZ-UHFFFAOYSA-N 2 0 319.468 3.247 20 10 DGCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2c(O)cccc2OC)CC1 ZINC000768304493 622449262 /nfs/dbraw/zinc/44/92/62/622449262.db2.gz YOXUWMILMHYHQR-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@@H](C[NH+]3CCCC3)C1)CCCC2 ZINC000768446961 622456703 /nfs/dbraw/zinc/45/67/03/622456703.db2.gz PRTKPRRZNFRBHA-INIZCTEOSA-N 2 0 314.473 3.189 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CCC[NH+](C)C1 ZINC000768546297 622463799 /nfs/dbraw/zinc/46/37/99/622463799.db2.gz IIHHNFLCIZKFQL-IBGZPJMESA-N 2 0 315.505 3.451 20 10 DGCDRP CCOc1cccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)c1O ZINC000769470046 622530464 /nfs/dbraw/zinc/53/04/64/622530464.db2.gz JIDRSGLZVGVYHW-GDBMZVCRSA-N 2 0 306.450 3.096 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)o1 ZINC000771824183 622799734 /nfs/dbraw/zinc/79/97/34/622799734.db2.gz TZZJMHCGFRJPEH-MRXNPFEDSA-N 2 0 313.445 3.191 20 10 DGCDRP CC[C@@H](C)C[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000771828742 622800750 /nfs/dbraw/zinc/80/07/50/622800750.db2.gz BPVPLFGAPMYBAV-OAHLLOKOSA-N 2 0 307.457 3.103 20 10 DGCDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000872251242 622867333 /nfs/dbraw/zinc/86/73/33/622867333.db2.gz ISEKJOOIPHQTIF-QGZVFWFLSA-N 2 0 301.478 3.155 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC000773766314 623070975 /nfs/dbraw/zinc/07/09/75/623070975.db2.gz RPJPIWSXUTVAEO-PKOBYXMFSA-N 2 0 301.478 3.059 20 10 DGCDRP C[C@H]([NH2+]CC[C@H]([NH3+])Cc1ccccc1)c1cc(F)ccc1O ZINC000873236235 623086875 /nfs/dbraw/zinc/08/68/75/623086875.db2.gz ZLPYQHQCUPWAQV-BBRMVZONSA-N 2 0 302.393 3.142 20 10 DGCDRP CC1CCC([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775644401 623301889 /nfs/dbraw/zinc/30/18/89/623301889.db2.gz LFQKCSCFPZYRLW-UHFFFAOYSA-N 2 0 315.505 3.449 20 10 DGCDRP CC(C)C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775689320 623314572 /nfs/dbraw/zinc/31/45/72/623314572.db2.gz CRXWFEJGXNNIDD-LJQANCHMSA-N 2 0 315.505 3.306 20 10 DGCDRP Cc1cccc(O)c1C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000877007159 623765126 /nfs/dbraw/zinc/76/51/26/623765126.db2.gz FJRMEDLTVZJEMI-LJQANCHMSA-N 2 0 324.468 3.355 20 10 DGCDRP C[N@@H+]1CC[C@H]([NH2+]CCCSc2nccs2)[C@H]2CCC[C@H]21 ZINC000796772779 626081173 /nfs/dbraw/zinc/08/11/73/626081173.db2.gz VUMDGBSGUJPVKT-HZSPNIEDSA-N 2 0 311.520 3.088 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1O ZINC000809767952 626950144 /nfs/dbraw/zinc/95/01/44/626950144.db2.gz YXBTYOWFAHCKMS-CJNGLKHVSA-N 2 0 308.853 3.270 20 10 DGCDRP CSC1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CC[NH+](C)CC1 ZINC000810252051 626992248 /nfs/dbraw/zinc/99/22/48/626992248.db2.gz HBALBVOBXKTMCY-LBPRGKRZSA-N 2 0 312.454 3.009 20 10 DGCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC(C)(C)C ZINC000812795506 627421723 /nfs/dbraw/zinc/42/17/23/627421723.db2.gz ZSVUOLMLYSNPJG-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP Cc1cc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)ccc1N(C)C ZINC000815054066 627619859 /nfs/dbraw/zinc/61/98/59/627619859.db2.gz FXDHSKIVYHPQKP-GOSISDBHSA-N 2 0 303.494 3.367 20 10 DGCDRP Cc1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)ccc1N(C)C ZINC000815055115 627619927 /nfs/dbraw/zinc/61/99/27/627619927.db2.gz WESBEOGFZZHADI-IBGZPJMESA-N 2 0 315.505 3.369 20 10 DGCDRP CC[C@@H]([NH2+]CCC(C)(C)[NH3+])c1cc(Br)ccc1O ZINC000925739586 627784822 /nfs/dbraw/zinc/78/48/22/627784822.db2.gz ZPJSHHWOEFKTFI-GFCCVEGCSA-N 2 0 315.255 3.323 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cc(Cl)ccc1O ZINC000925777874 627794000 /nfs/dbraw/zinc/79/40/00/627794000.db2.gz RGYSPTAYRLMUKL-MFKMUULPSA-N 2 0 318.795 3.331 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)c2c1c(F)ccc2O ZINC000925846006 627805230 /nfs/dbraw/zinc/80/52/30/627805230.db2.gz MXUXDABOVUUCQB-VBVJRUAFSA-N 2 0 304.409 3.201 20 10 DGCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@](C[NH3+])(c3ccccc3)C2)c1 ZINC000925886906 627812264 /nfs/dbraw/zinc/81/22/64/627812264.db2.gz MPZDNHQSXJNLAM-RIFZZMRRSA-N 2 0 310.441 3.410 20 10 DGCDRP C[N@@H+]1CCC[C@]2(CC[NH+](Cc3c(O)ccc4ccccc43)C2)C1 ZINC000816642238 627817850 /nfs/dbraw/zinc/81/78/50/627817850.db2.gz ULGJZPMZZLYIGS-FQEVSTJZSA-N 2 0 310.441 3.463 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC000816641726 627818297 /nfs/dbraw/zinc/81/82/97/627818297.db2.gz CZYSSJHCWPUTLK-FQEVSTJZSA-N 2 0 315.505 3.451 20 10 DGCDRP CC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(N(C)C)cc1 ZINC000817948429 627971936 /nfs/dbraw/zinc/97/19/36/627971936.db2.gz JRBSUJQSPWROOA-HXUWFJFHSA-N 2 0 311.473 3.495 20 10 DGCDRP CC(C)[NH2+]CCC[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000817954155 627973058 /nfs/dbraw/zinc/97/30/58/627973058.db2.gz VLGLAGBZNOOHSW-LLVKDONJSA-N 2 0 315.255 3.193 20 10 DGCDRP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817960000 627976192 /nfs/dbraw/zinc/97/61/92/627976192.db2.gz JXVBDONKVKLLHS-JTQLQIEISA-N 2 0 315.255 3.323 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000817984834 627983267 /nfs/dbraw/zinc/98/32/67/627983267.db2.gz ASAYBCAGRJAFQQ-DZOHQFGASA-N 2 0 301.478 3.181 20 10 DGCDRP CCC[N@H+](Cc1ccnn1-c1cc[nH+]cc1)Cc1ccccc1O ZINC000824649980 628679696 /nfs/dbraw/zinc/67/96/96/628679696.db2.gz KXFDWHCQYUMTAE-UHFFFAOYSA-N 2 0 322.412 3.385 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc1Cl ZINC000825935507 628811848 /nfs/dbraw/zinc/81/18/48/628811848.db2.gz WIDBZDOGJUHZRH-CJNGLKHVSA-N 2 0 308.853 3.270 20 10 DGCDRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000834514391 629719838 /nfs/dbraw/zinc/71/98/38/629719838.db2.gz VNTAHDLHLWMFMZ-HLLBOEOZSA-N 2 0 302.462 3.337 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000835041280 629832098 /nfs/dbraw/zinc/83/20/98/629832098.db2.gz AARVGOLTIBHCBW-LOTUCHTNSA-N 2 0 313.489 3.371 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000840895495 630374692 /nfs/dbraw/zinc/37/46/92/630374692.db2.gz YUQZXTAIXZYMOS-XKGZKEIXSA-N 2 0 315.505 3.208 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000840917893 630378112 /nfs/dbraw/zinc/37/81/12/630378112.db2.gz UZBVNRYOTIMIJH-GOSISDBHSA-N 2 0 315.505 3.369 20 10 DGCDRP CCOc1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)c(O)c1 ZINC000841087838 630406640 /nfs/dbraw/zinc/40/66/40/630406640.db2.gz VTHGNVLWEUUAQX-GOSISDBHSA-N 2 0 314.429 3.361 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1C[NH3+] ZINC000841100274 630407883 /nfs/dbraw/zinc/40/78/83/630407883.db2.gz AQYPQJARHGPTTP-SJLPKXTDSA-N 2 0 301.478 3.094 20 10 DGCDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843112574 630615088 /nfs/dbraw/zinc/61/50/88/630615088.db2.gz HVNHKEGGMFDGPB-QGZVFWFLSA-N 2 0 301.478 3.238 20 10 DGCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126110 630616367 /nfs/dbraw/zinc/61/63/67/630616367.db2.gz GOBXQBFZQUKBRU-UONOGXRCSA-N 2 0 308.853 3.257 20 10 DGCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126043 630616686 /nfs/dbraw/zinc/61/66/86/630616686.db2.gz FFULDVJIRJXCNT-KBPBESRZSA-N 2 0 308.853 3.257 20 10 DGCDRP COc1ccc(N2CCC[N@H+](CCCCCCC[NH3+])CC2)cc1 ZINC000844222098 630713038 /nfs/dbraw/zinc/71/30/38/630713038.db2.gz UGRWXDNJFYGCCE-UHFFFAOYSA-N 2 0 319.493 3.117 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)ccc1O ZINC000844922715 630982706 /nfs/dbraw/zinc/98/27/06/630982706.db2.gz CYEQLHLTXMZUMQ-JTQLQIEISA-N 2 0 308.784 3.494 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)ccc1O ZINC000844922716 630982837 /nfs/dbraw/zinc/98/28/37/630982837.db2.gz CYEQLHLTXMZUMQ-SNVBAGLBSA-N 2 0 308.784 3.494 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c1O ZINC000846138713 631211449 /nfs/dbraw/zinc/21/14/49/631211449.db2.gz MXRDPCZAXAORPH-AWEZNQCLSA-N 2 0 314.429 3.313 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1O ZINC000846142712 631211687 /nfs/dbraw/zinc/21/16/87/631211687.db2.gz CCCWKOMFITVRIE-CZUORRHYSA-N 2 0 308.466 3.418 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000849350504 631900645 /nfs/dbraw/zinc/90/06/45/631900645.db2.gz OQDIMGZSTFRRFT-CQSZACIVSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000164537662 658937501 /nfs/dbraw/zinc/93/75/01/658937501.db2.gz OFYVKLGKVSSKBW-VQIMIIECSA-N 2 0 314.473 3.458 20 10 DGCDRP C[C@@H]1C[C@H](C[N@H+](C)Cc2ccc(N3CCCC3)cc2)CC[NH2+]1 ZINC001576597020 1191852053 /nfs/dbraw/zinc/85/20/53/1191852053.db2.gz CRJNNKMACDDRAZ-SJLPKXTDSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1cc(O)c(C[NH2+][C@@H]2[C@H]3CCC[NH2+][C@H]3C2(C)C)cc1Cl ZINC001579637973 1191983880 /nfs/dbraw/zinc/98/38/80/1191983880.db2.gz LIPXYWIRYSDGOU-APHBMKBZSA-N 2 0 308.853 3.220 20 10 DGCDRP CC[C@H](C)C[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001620812734 1192107416 /nfs/dbraw/zinc/10/74/16/1192107416.db2.gz QUDHYHBSMWROIW-DLBZAZTESA-N 2 0 303.494 3.353 20 10 DGCDRP C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001620904387 1192569934 /nfs/dbraw/zinc/56/99/34/1192569934.db2.gz BSHAVQHJACQGGG-PKOBYXMFSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001620904384 1192570312 /nfs/dbraw/zinc/57/03/12/1192570312.db2.gz BSHAVQHJACQGGG-HKUYNNGSSA-N 2 0 315.505 3.497 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(O)c1 ZINC001621118661 1192644865 /nfs/dbraw/zinc/64/48/65/1192644865.db2.gz SUIBWKDJPSRWOK-INIZCTEOSA-N 2 0 318.461 3.017 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@@H]2C1 ZINC001333893541 1178691770 /nfs/dbraw/zinc/69/17/70/1178691770.db2.gz YXQHTUTXEIEHOA-NLWGTHIKSA-N 2 0 315.505 3.223 20 10 DGCDRP CC(C)(C[NH3+])C1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001345160663 1179535605 /nfs/dbraw/zinc/53/56/05/1179535605.db2.gz XLRVRMIJDIFXAE-UHFFFAOYSA-N 2 0 315.505 3.484 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001356083630 1181138139 /nfs/dbraw/zinc/13/81/39/1181138139.db2.gz WDQSPBQNEHCUQT-GOSISDBHSA-N 2 0 301.478 3.357 20 10 DGCDRP C[C@@H](CC[NH2+]Cc1ccc2c(c1)CCCO2)[NH+]1CCCCC1 ZINC001461428914 1182812537 /nfs/dbraw/zinc/81/25/37/1182812537.db2.gz AKRXAKOJDLSNPB-INIZCTEOSA-N 2 0 302.462 3.366 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]34C[C@@H]3CCCC4)cc2)CC1 ZINC001461758326 1182851576 /nfs/dbraw/zinc/85/15/76/1182851576.db2.gz YAVSOXOVPITKMM-AZUAARDMSA-N 2 0 313.489 3.108 20 10 DGCDRP CCc1ccccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001474015995 1183852028 /nfs/dbraw/zinc/85/20/28/1183852028.db2.gz JIBSXNOTVVNVKE-UHFFFAOYSA-N 2 0 323.484 3.291 20 10 DGCDRP C[N@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(Cl)cc2O)C1 ZINC001474348766 1183907611 /nfs/dbraw/zinc/90/76/11/1183907611.db2.gz LCHBWOKKQWLMML-CQSZACIVSA-N 2 0 308.853 3.209 20 10 DGCDRP CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560258078 1189300092 /nfs/dbraw/zinc/30/00/92/1189300092.db2.gz SRWNBCFHWKOTJN-ICSRJNTNSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(C)cc(OC)cc2O)C[C@H]1C ZINC001560636405 1189352989 /nfs/dbraw/zinc/35/29/89/1189352989.db2.gz FNPHRTZWYQRNFJ-HUUCEWRRSA-N 2 0 306.450 3.014 20 10 DGCDRP COc1cc(C)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c(O)c1 ZINC001621169892 1193812329 /nfs/dbraw/zinc/81/23/29/1193812329.db2.gz XDLADPYJBRSHHO-UHFFFAOYSA-N 2 0 320.477 3.261 20 10 DGCDRP C[C@@H](CC1CCC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001658380415 1196249320 /nfs/dbraw/zinc/24/93/20/1196249320.db2.gz JBGHNADXEAGHAF-INIZCTEOSA-N 2 0 301.478 3.107 20 10 DGCDRP COc1ccc(O)c(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC001659420801 1196381739 /nfs/dbraw/zinc/38/17/39/1196381739.db2.gz PWPGXIOAUWZQCG-CABCVRRESA-N 2 0 318.461 3.143 20 10 DGCDRP CC(C)c1ccc(O)c(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC001659602793 1196399034 /nfs/dbraw/zinc/39/90/34/1196399034.db2.gz YQUWUCAANROGBQ-UHFFFAOYSA-N 2 0 302.462 3.480 20 10 DGCDRP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC001660262029 1196463388 /nfs/dbraw/zinc/46/33/88/1196463388.db2.gz LJOPOFAODBZLNG-GFCCVEGCSA-N 2 0 314.857 3.264 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3(C4CC4)CCC3)cc2)CC1 ZINC001662013490 1196674713 /nfs/dbraw/zinc/67/47/13/1196674713.db2.gz KVYCTIKPHRHDJH-UHFFFAOYSA-N 2 0 313.489 3.108 20 10 DGCDRP CC[NH+]1CCC(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)CC1 ZINC001664147867 1196975005 /nfs/dbraw/zinc/97/50/05/1196975005.db2.gz UGBGEQLPZVCTHG-UHFFFAOYSA-N 2 0 315.505 3.449 20 10 DGCDRP CN1CCCc2cc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)ccc21 ZINC000321621342 1197685445 /nfs/dbraw/zinc/68/54/45/1197685445.db2.gz MYYWNLYWMXYQKH-LJQANCHMSA-N 2 0 313.489 3.033 20 10 DGCDRP CC[N@H+](CCC1CC[NH+](C)CC1)Cc1ccc(N(C)C)cc1 ZINC001207486664 1083527794 /nfs/dbraw/zinc/52/77/94/1083527794.db2.gz AAGAOTFROKLYEW-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP Nc1cccc(N2CCCC3=C[C@H]4C[C@H](C[N@@H+]5CCCC[C@H]45)[C@@H]32)[nH+]1 ZINC001155630225 1089192753 /nfs/dbraw/zinc/19/27/53/1089192753.db2.gz UEPOIBWBWZYDBE-TVKQPGBESA-N 2 0 324.472 3.063 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001203560832 1090756592 /nfs/dbraw/zinc/75/65/92/1090756592.db2.gz HDZOMLYEMDZSAV-QUCCMNQESA-N 2 0 322.452 3.346 20 10 DGCDRP [NH3+]CC1CC[NH+](Cc2cc(-c3ccc(F)cc3)ccc2O)CC1 ZINC001205053065 1091091740 /nfs/dbraw/zinc/09/17/40/1091091740.db2.gz IQLGKOSVFTZYEO-UHFFFAOYSA-N 2 0 314.404 3.369 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C[C@H]1C[NH3+] ZINC001205319347 1091184319 /nfs/dbraw/zinc/18/43/19/1091184319.db2.gz ZGMARCAKMSEVSN-CRAIPNDOSA-N 2 0 310.441 3.476 20 10 DGCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC001205570158 1091260385 /nfs/dbraw/zinc/26/03/85/1091260385.db2.gz GKLZJGZSFFLTSR-SFHVURJKSA-N 2 0 302.393 3.198 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)CC[C@@H]1C[NH3+] ZINC001205637049 1091290674 /nfs/dbraw/zinc/29/06/74/1091290674.db2.gz GHHNFOVOIVFIKK-LSDHHAIUSA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC[C@H]1C[NH3+] ZINC001205638614 1091291732 /nfs/dbraw/zinc/29/17/32/1091291732.db2.gz PYMHIKXTIDKSDM-RYUDHWBXSA-N 2 0 316.367 3.218 20 10 DGCDRP C[C@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001205903495 1091402332 /nfs/dbraw/zinc/40/23/32/1091402332.db2.gz PQYCXAYHRRMMIU-WMZOPIPTSA-N 2 0 301.478 3.236 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2O)CCC[C@H]1C[NH3+] ZINC001206025409 1091457252 /nfs/dbraw/zinc/45/72/52/1091457252.db2.gz NWIHWQLIGWCXSJ-NEPJUHHUSA-N 2 0 316.367 3.218 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2O)CCC[C@H]1C[NH3+] ZINC001206025412 1091457598 /nfs/dbraw/zinc/45/75/98/1091457598.db2.gz NWIHWQLIGWCXSJ-RYUDHWBXSA-N 2 0 316.367 3.218 20 10 DGCDRP COc1cc(C[NH+]2[C@@H](C)CCC[C@@H]2C)cc(C[NH+](C)C)c1O ZINC001139253508 1091502245 /nfs/dbraw/zinc/50/22/45/1091502245.db2.gz WJJUEANVJJQPAE-KBPBESRZSA-N 2 0 306.450 3.225 20 10 DGCDRP C[N@H+](CCc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139404708 1091549965 /nfs/dbraw/zinc/54/99/65/1091549965.db2.gz WTNHKUOEEXJNCV-UHFFFAOYSA-N 2 0 323.484 3.113 20 10 DGCDRP COc1cc(N(C)C)ccc1C[N@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206598471 1091684293 /nfs/dbraw/zinc/68/42/93/1091684293.db2.gz KJNMCGFLOKYOED-KRWDZBQOSA-N 2 0 319.493 3.114 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C)C[C@H]3C)cc2)CC1 ZINC001140303830 1091820313 /nfs/dbraw/zinc/82/03/13/1091820313.db2.gz BKPBKGOCKRYNQJ-QZTJIDSGSA-N 2 0 315.505 3.449 20 10 DGCDRP Oc1ccc(F)cc1C[N@@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222167776 1095473540 /nfs/dbraw/zinc/47/35/40/1095473540.db2.gz QWCKVDBDFLYMCY-GOSISDBHSA-N 2 0 306.425 3.277 20 10 DGCDRP Cc1c(O)ccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1O ZINC001222168272 1095476343 /nfs/dbraw/zinc/47/63/43/1095476343.db2.gz ZHYHODATRMLFHW-IBGZPJMESA-N 2 0 318.461 3.152 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001222265155 1095520125 /nfs/dbraw/zinc/52/01/25/1095520125.db2.gz PEUMGMLCTWSODX-FQEVSTJZSA-N 2 0 313.489 3.252 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCC2)cc1)C[C@H]1CCC[NH+](C)C1 ZINC001116437345 1095550456 /nfs/dbraw/zinc/55/04/56/1095550456.db2.gz ZRKHXRMDJBAXID-SFHVURJKSA-N 2 0 301.478 3.060 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC001118016084 1095922683 /nfs/dbraw/zinc/92/26/83/1095922683.db2.gz TURIBAFLHHTUCO-QUCCMNQESA-N 2 0 313.489 3.251 20 10 DGCDRP C[NH+]1CC2(C1)CC[NH+](Cc1cc(C(C)(C)C)ccc1O)CC2 ZINC001233287184 1098276923 /nfs/dbraw/zinc/27/69/23/1098276923.db2.gz ZYEBZQLBZJZJJF-UHFFFAOYSA-N 2 0 302.462 3.217 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001235030863 1098759792 /nfs/dbraw/zinc/75/97/92/1098759792.db2.gz HBTPWWLRHLOYNM-FQEVSTJZSA-N 2 0 309.457 3.280 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)ccc1N(C)C ZINC001235044810 1098772451 /nfs/dbraw/zinc/77/24/51/1098772451.db2.gz KVVLLEIYCUYNKA-IBGZPJMESA-N 2 0 301.478 3.169 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCCC23CC[NH2+]CC3)c1 ZINC001235143882 1098832924 /nfs/dbraw/zinc/83/29/24/1098832924.db2.gz FZUDUHCCJKXOND-UHFFFAOYSA-N 2 0 302.462 3.408 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)ccc1N(C)C ZINC001235152138 1098837844 /nfs/dbraw/zinc/83/78/44/1098837844.db2.gz CRWWLXLIJBPGFX-HXUWFJFHSA-N 2 0 315.505 3.415 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH+]1CCC2(CCCC2)CC1 ZINC001235155046 1098843007 /nfs/dbraw/zinc/84/30/07/1098843007.db2.gz KYQPBQWHODIANA-UHFFFAOYSA-N 2 0 313.489 3.252 20 10 DGCDRP Cc1ccc(C[N@@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c(O)c1 ZINC001235379229 1098988273 /nfs/dbraw/zinc/98/82/73/1098988273.db2.gz BSUCNAYEAHHRGZ-CTNGQTDRSA-N 2 0 322.452 3.280 20 10 DGCDRP Cc1cc(C)c(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235426367 1099020466 /nfs/dbraw/zinc/02/04/66/1099020466.db2.gz KQGZKXIHJILPPY-DLBZAZTESA-N 2 0 302.462 3.221 20 10 DGCDRP Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235432909 1099030404 /nfs/dbraw/zinc/03/04/04/1099030404.db2.gz ZILYUHLFPOIYSI-UONOGXRCSA-N 2 0 308.853 3.257 20 10 DGCDRP CCN(CC)c1ccc(CN(CC)C2CC[NH2+]CC2)c(OC)c1 ZINC001235761668 1099169145 /nfs/dbraw/zinc/16/91/45/1099169145.db2.gz OHGFZOZQUKCJNP-UHFFFAOYSA-N 2 0 319.493 3.115 20 10 DGCDRP CCN(Cc1c(O)ccc(Cl)c1Cl)C1CC[NH2+]CC1 ZINC001235764517 1099170606 /nfs/dbraw/zinc/17/06/06/1099170606.db2.gz HYDMEXJMGKSTGJ-UHFFFAOYSA-N 2 0 303.233 3.273 20 10 DGCDRP Cc1c(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c2ccccc2n1C ZINC001235883296 1099232045 /nfs/dbraw/zinc/23/20/45/1099232045.db2.gz CLIRTZYZKILUNS-LJQANCHMSA-N 2 0 311.473 3.451 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)c2ccccc21 ZINC001235950401 1099282917 /nfs/dbraw/zinc/28/29/17/1099282917.db2.gz DWLYMMOFTUQHRS-MRXNPFEDSA-N 2 0 311.473 3.337 20 10 DGCDRP CCN(Cc1ccc(N2CCCCC2)cc1)[C@H]1CCC[NH2+]C1 ZINC001236003950 1099325623 /nfs/dbraw/zinc/32/56/23/1099325623.db2.gz BXVSENIBZOUBSS-IBGZPJMESA-N 2 0 301.478 3.251 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CC3(C2)CCC[NH2+]CC3)cc1 ZINC001236007391 1099328749 /nfs/dbraw/zinc/32/87/49/1099328749.db2.gz AKTAEPSVMPWDNT-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)Cc2ccc3c(c2)CC[NH2+]C3)cc1 ZINC001236190889 1099456130 /nfs/dbraw/zinc/45/61/30/1099456130.db2.gz ZRICKLGKKQFRQJ-UHFFFAOYSA-N 2 0 309.457 3.030 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)Cc2ccc3c(c2)C[NH2+]CC3)cc1 ZINC001236189770 1099456976 /nfs/dbraw/zinc/45/69/76/1099456976.db2.gz NDFCTECERXRQPX-UHFFFAOYSA-N 2 0 309.457 3.030 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@H+](C)[C@H]3CCCC[C@@H]3[NH3+])c2c1 ZINC001236215807 1099471772 /nfs/dbraw/zinc/47/17/72/1099471772.db2.gz IKEPUHHERFETQG-ROUUACIJSA-N 2 0 314.429 3.256 20 10 DGCDRP Oc1ccc(-c2ccc(F)cc2)cc1C[NH+]1CCC[NH2+]CCC1 ZINC001236239948 1099492947 /nfs/dbraw/zinc/49/29/47/1099492947.db2.gz HPKFWPSTDSDDSN-UHFFFAOYSA-N 2 0 314.404 3.384 20 10 DGCDRP Cc1cccc(O)c1C[N@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236304034 1099525468 /nfs/dbraw/zinc/52/54/68/1099525468.db2.gz GKIBRCMIDANWCE-UHFFFAOYSA-N 2 0 310.441 3.455 20 10 DGCDRP Oc1ccc(F)cc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374158 1099559798 /nfs/dbraw/zinc/55/97/98/1099559798.db2.gz PHZXREKKXCVAOK-AWEZNQCLSA-N 2 0 306.425 3.276 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N(CC)CC)cc1O)C[C@@H]1CC[NH2+]C1 ZINC001236834888 1099821421 /nfs/dbraw/zinc/82/14/21/1099821421.db2.gz JJESCNFCOHPFDM-MRXNPFEDSA-N 2 0 319.493 3.060 20 10 DGCDRP CCOc1ccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c(O)c1 ZINC001237041045 1099939088 /nfs/dbraw/zinc/93/90/88/1099939088.db2.gz BAEXQNBVRQHMKP-UHFFFAOYSA-N 2 0 320.477 3.343 20 10 DGCDRP Oc1cc(Cl)c(F)cc1CN(C1CCC1)[C@H]1CCC[NH2+]C1 ZINC001237159286 1100007685 /nfs/dbraw/zinc/00/76/85/1100007685.db2.gz ABEYPOYPHWBHCN-ZDUSSCGKSA-N 2 0 312.816 3.291 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)c2ccccc21 ZINC001237384422 1100102790 /nfs/dbraw/zinc/10/27/90/1100102790.db2.gz WRJGEBHPUWNRHG-PXNSSMCTSA-N 2 0 323.484 3.480 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C1=CC[C@H]([NH+]2CCCC2)CC1 ZINC001242694477 1102289376 /nfs/dbraw/zinc/28/93/76/1102289376.db2.gz WBIFZLVZQKUUGK-IBGZPJMESA-N 2 0 311.473 3.128 20 10 DGCDRP C[C@@H]1C[C@H](C)[N@H+](Cc2ccc(N3CCCC3)cc2)C[C@@H]1C[NH3+] ZINC001325701910 1103105822 /nfs/dbraw/zinc/10/58/22/1103105822.db2.gz CLIDHIRRIKLNHK-RYRKJORJSA-N 2 0 301.478 3.092 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001329036528 1104132777 /nfs/dbraw/zinc/13/27/77/1104132777.db2.gz MXPBULWWQCUDOJ-LJIZCISZSA-N 2 0 300.446 3.227 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246527665 1104577474 /nfs/dbraw/zinc/57/74/74/1104577474.db2.gz UCFAFCPBNPSSPC-NXEZDXNNSA-N 2 0 314.473 3.220 20 10 DGCDRP C[C@@H]1CC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H](C)C1 ZINC001258152228 1106681810 /nfs/dbraw/zinc/68/18/10/1106681810.db2.gz UDJYCEYDZUHCFH-IRXDYDNUSA-N 2 0 315.505 3.353 20 10 DGCDRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](C)C1 ZINC001308269410 1111408658 /nfs/dbraw/zinc/40/86/58/1111408658.db2.gz QWYSNUVFQGYKMK-HLIPFELVSA-N 2 0 315.505 3.353 20 10 DGCDRP CC(C)C[N@H+](C)CCCNCc1cc(F)c(N(C)C)cc1F ZINC001308456728 1111430949 /nfs/dbraw/zinc/43/09/49/1111430949.db2.gz HUZIODHNMQOLGW-UHFFFAOYSA-N 2 0 313.436 3.098 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c1 ZINC001308569777 1111445698 /nfs/dbraw/zinc/44/56/98/1111445698.db2.gz IWOJJBHKNMLHHI-FUHWJXTLSA-N 2 0 302.462 3.432 20 10 DGCDRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cc(F)ccc1O ZINC000185207143 299290213 /nfs/dbraw/zinc/29/02/13/299290213.db2.gz DFKKSPCJDHUVNU-KFWWJZLASA-N 2 0 324.440 3.071 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423085839 237822846 /nfs/dbraw/zinc/82/28/46/237822846.db2.gz LOUACBYTVMNRKL-FGTMMUONSA-N 2 0 311.473 3.497 20 10 DGCDRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000125463477 431926535 /nfs/dbraw/zinc/92/65/35/431926535.db2.gz RSNBYTLEIBIGOF-SFHVURJKSA-N 2 0 301.478 3.060 20 10 DGCDRP CCC[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCCN3C)CC1 ZINC000126657569 431955222 /nfs/dbraw/zinc/95/52/22/431955222.db2.gz UCNDHOMFQUOGKS-UHFFFAOYSA-N 2 0 301.478 3.033 20 10 DGCDRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1O ZINC000183428197 432292927 /nfs/dbraw/zinc/29/29/27/432292927.db2.gz JEXOARGVIMXXMW-HNNXBMFYSA-N 2 0 314.429 3.183 20 10 DGCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000185059834 432462803 /nfs/dbraw/zinc/46/28/03/432462803.db2.gz GWDWINPSXOSFOZ-LSDHHAIUSA-N 2 0 302.462 3.263 20 10 DGCDRP Cc1cc(Br)cc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])c1O ZINC000817977870 620897607 /nfs/dbraw/zinc/89/76/07/620897607.db2.gz QWDZLAWUDXIJAQ-GHMZBOCLSA-N 2 0 315.255 3.241 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc(F)ccc1O ZINC000853240022 620680864 /nfs/dbraw/zinc/68/08/64/620680864.db2.gz LOZBBPQQJBDKKR-ZFWWWQNUSA-N 2 0 306.425 3.304 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c(O)c1 ZINC000853239282 620681034 /nfs/dbraw/zinc/68/10/34/620681034.db2.gz DHWZJFUJTWHIMY-NVXWUHKLSA-N 2 0 302.462 3.473 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853239393 620681058 /nfs/dbraw/zinc/68/10/58/620681058.db2.gz GODGBDYLXRZOSR-ZBFHGGJFSA-N 2 0 318.461 3.173 20 10 DGCDRP Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)CC2 ZINC000853240603 620681118 /nfs/dbraw/zinc/68/11/18/620681118.db2.gz OWJMWKLOHPFNQG-WBVHZDCISA-N 2 0 300.446 3.091 20 10 DGCDRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000902485471 619645809 /nfs/dbraw/zinc/64/58/09/619645809.db2.gz KXSJGXPNFIDHCY-LNLFQRSKSA-N 2 0 310.441 3.393 20 10 DGCDRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000902485472 619645956 /nfs/dbraw/zinc/64/59/56/619645956.db2.gz KXSJGXPNFIDHCY-ZHALLVOQSA-N 2 0 310.441 3.393 20 10 DGCDRP Cc1cccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1O ZINC000904476948 619924766 /nfs/dbraw/zinc/92/47/66/619924766.db2.gz VCDQDULWOXLYMF-YLJYHZDGSA-N 2 0 324.424 3.046 20 10 DGCDRP C[NH+](C)CC1CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921921274 620969007 /nfs/dbraw/zinc/96/90/07/620969007.db2.gz VTISIBIRGHARKQ-UHFFFAOYSA-N 2 0 302.462 3.222 20 10 DGCDRP CN(C)c1cc(F)c(C[NH2+]C(C)(C)CCC[NH+](C)C)cc1F ZINC000858172428 621161142 /nfs/dbraw/zinc/16/11/42/621161142.db2.gz UIYXYRSRLUNIGO-UHFFFAOYSA-N 2 0 313.436 3.241 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c1 ZINC000755777275 621592992 /nfs/dbraw/zinc/59/29/92/621592992.db2.gz BFLJSLDFVRAUCD-QGZVFWFLSA-N 2 0 302.462 3.173 20 10 DGCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cc4c(cc3O)CCC4)C2)CC1 ZINC000755780073 621593251 /nfs/dbraw/zinc/59/32/51/621593251.db2.gz MHZPNYNZIJGVEN-GOSISDBHSA-N 2 0 314.473 3.045 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000757675081 621732943 /nfs/dbraw/zinc/73/29/43/621732943.db2.gz ZORGPCDFOIIVGR-ZDUSSCGKSA-N 2 0 314.857 3.055 20 10 DGCDRP CN(C)c1ccc(C[N@H+](CC[C@H]2CCC[NH+]2C)C2CC2)cc1 ZINC000759846395 621895702 /nfs/dbraw/zinc/89/57/02/621895702.db2.gz UCUMPRZESRGLQU-GOSISDBHSA-N 2 0 301.478 3.201 20 10 DGCDRP COc1cccc(O)c1C[NH2+]CCC1CC[NH+](C(C)C)CC1 ZINC000865716614 621982246 /nfs/dbraw/zinc/98/22/46/621982246.db2.gz BGJZZLGUHRCZFY-UHFFFAOYSA-N 2 0 306.450 3.001 20 10 DGCDRP CCOc1cccc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)c1O ZINC000865766033 621992065 /nfs/dbraw/zinc/99/20/65/621992065.db2.gz YGODGAOSCZGELN-UHFFFAOYSA-N 2 0 306.450 3.143 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)c1 ZINC000866518051 622131364 /nfs/dbraw/zinc/13/13/64/622131364.db2.gz RSJDPPAOCLPBCR-WRSVWVKZSA-N 2 0 306.450 3.314 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c(O)c1 ZINC000768304133 622449697 /nfs/dbraw/zinc/44/96/97/622449697.db2.gz SMJGFZSNZHQQSE-UHFFFAOYSA-N 2 0 318.461 3.099 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)cc1C ZINC000872644860 622947508 /nfs/dbraw/zinc/94/75/08/622947508.db2.gz LIQMGALMIPIARG-UHFFFAOYSA-N 2 0 302.462 3.459 20 10 DGCDRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(N(C)C)cc1 ZINC000873238359 623086568 /nfs/dbraw/zinc/08/65/68/623086568.db2.gz XQPCPSRAQCVKCI-HNNXBMFYSA-N 2 0 309.457 3.249 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(N2CCCCCC2)cc1 ZINC000873253918 623093068 /nfs/dbraw/zinc/09/30/68/623093068.db2.gz HGFRNBMXBSEUNO-NUJGCVRESA-N 2 0 301.478 3.455 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC(C)C ZINC000775653478 623304467 /nfs/dbraw/zinc/30/44/67/623304467.db2.gz ICORADILXSDZOX-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775708870 623317289 /nfs/dbraw/zinc/31/72/89/623317289.db2.gz PIJJXCCBOLAPTF-AEFFLSMTSA-N 2 0 301.478 3.059 20 10 DGCDRP Cc1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c(O)c1 ZINC000876811577 623714209 /nfs/dbraw/zinc/71/42/09/623714209.db2.gz LIILZWLXWIVCGA-YJBOKZPZSA-N 2 0 300.446 3.149 20 10 DGCDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc(Cl)ccc1O)CC2 ZINC000877683960 623991193 /nfs/dbraw/zinc/99/11/93/623991193.db2.gz DPEZSRDDXUUSJU-UHFFFAOYSA-N 2 0 308.853 3.353 20 10 DGCDRP COc1ccc(O)c(C[NH2+]CCC2CC[NH+](C(C)C)CC2)c1 ZINC000877697457 623994974 /nfs/dbraw/zinc/99/49/74/623994974.db2.gz NEUPOUYDUYKDBH-UHFFFAOYSA-N 2 0 306.450 3.001 20 10 DGCDRP C[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000783266083 624333105 /nfs/dbraw/zinc/33/31/05/624333105.db2.gz NEBHHIUZQXTYQE-UZLBHIALSA-N 2 0 313.489 3.107 20 10 DGCDRP COc1cccc(O)c1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000809739122 626944046 /nfs/dbraw/zinc/94/40/46/626944046.db2.gz YCVZXYQEINPFDC-UHFFFAOYSA-N 2 0 314.429 3.094 20 10 DGCDRP CSC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CC[NH+](C)CC1 ZINC000810252144 626992270 /nfs/dbraw/zinc/99/22/70/626992270.db2.gz KBHSDMWRGQLEHL-AWEZNQCLSA-N 2 0 308.491 3.179 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N(C)C)c(C)c2)C[C@H]1C ZINC000815057648 627620697 /nfs/dbraw/zinc/62/06/97/627620697.db2.gz WHZDQAACGPYWBQ-SJLPKXTDSA-N 2 0 303.494 3.366 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1 ZINC000815145338 627636654 /nfs/dbraw/zinc/63/66/54/627636654.db2.gz RUCZZNZJJSYSJX-LJQANCHMSA-N 2 0 301.478 3.060 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C2CCCC2)cc1 ZINC000925512034 627745143 /nfs/dbraw/zinc/74/51/43/627745143.db2.gz YQVYUAMUFUTSMA-OALUTQOASA-N 2 0 301.478 3.011 20 10 DGCDRP CC[C@H]([NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1)c1ccccc1O ZINC000925886915 627812489 /nfs/dbraw/zinc/81/24/89/627812489.db2.gz MYZPQHYAZANMTR-XKGZKEIXSA-N 2 0 310.441 3.492 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000817894299 627954203 /nfs/dbraw/zinc/95/42/03/627954203.db2.gz LEIRYSHWIKUNEA-IPMKNSEASA-N 2 0 301.478 3.071 20 10 DGCDRP c1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc2c1OCC2 ZINC000817902542 627956869 /nfs/dbraw/zinc/95/68/69/627956869.db2.gz TWERPXGPEIBYOY-FGTMMUONSA-N 2 0 300.446 3.022 20 10 DGCDRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817937200 627966862 /nfs/dbraw/zinc/96/68/62/627966862.db2.gz VBWUHDCCTCXXKV-AWEZNQCLSA-N 2 0 305.441 3.219 20 10 DGCDRP CC[C@@H]([NH2+]C[C@@H]([NH3+])C(C)C)c1cc(Br)ccc1O ZINC000817957363 627974116 /nfs/dbraw/zinc/97/41/16/627974116.db2.gz BESQYXXRPJHMBM-CHWSQXEVSA-N 2 0 315.255 3.179 20 10 DGCDRP CC[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817965379 627977595 /nfs/dbraw/zinc/97/75/95/627977595.db2.gz PVDCGRABTMDXCS-OLZOCXBDSA-N 2 0 302.340 3.189 20 10 DGCDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000817976243 627980917 /nfs/dbraw/zinc/98/09/17/627980917.db2.gz IRWSESSRMOUQMG-QWRGUYRKSA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(N2CCCCC2)cc1 ZINC000817982474 627983813 /nfs/dbraw/zinc/98/38/13/627983813.db2.gz SSPHEXLSWUWDTO-BQFCYCMXSA-N 2 0 301.478 3.455 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000827949765 629007040 /nfs/dbraw/zinc/00/70/40/629007040.db2.gz NSDBDBNFYNAFEO-SFHVURJKSA-N 2 0 315.505 3.273 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2c1c(F)ccc2O ZINC000834891805 629799261 /nfs/dbraw/zinc/79/92/61/629799261.db2.gz JLWKUFLMGFCRAN-ZWOWXGAWSA-N 2 0 304.409 3.294 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2c1c(F)ccc2O ZINC000834891804 629799401 /nfs/dbraw/zinc/79/94/01/629799401.db2.gz JLWKUFLMGFCRAN-JXODSGKVSA-N 2 0 304.409 3.294 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC000835029122 629829358 /nfs/dbraw/zinc/82/93/58/629829358.db2.gz UYMNLQLMRQXDQJ-AATRIKPKSA-N 2 0 301.478 3.039 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000835038862 629831076 /nfs/dbraw/zinc/83/10/76/629831076.db2.gz UQZYDYJYHNWCRS-SNAWJCMRSA-N 2 0 301.478 3.087 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000840895493 630374302 /nfs/dbraw/zinc/37/43/02/630374302.db2.gz YUQZXTAIXZYMOS-ILZDJORESA-N 2 0 315.505 3.208 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000840910783 630376582 /nfs/dbraw/zinc/37/65/82/630376582.db2.gz RVTSLNSROLDMLB-UHFFFAOYSA-N 2 0 315.505 3.369 20 10 DGCDRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc(N)cc3)CC2)C1 ZINC000841034703 630399913 /nfs/dbraw/zinc/39/99/13/630399913.db2.gz JSPJGNAWCJJUHM-OXJNMPFZSA-N 2 0 315.505 3.444 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC[NH2+]1 ZINC000841064095 630403600 /nfs/dbraw/zinc/40/36/00/630403600.db2.gz XWHDGOOFQMVIOA-WCQYABFASA-N 2 0 315.383 3.002 20 10 DGCDRP CN(C)c1ccc(C[NH2+]CCC[NH2+]C2CC2)c(C(F)(F)F)c1 ZINC000841090789 630406672 /nfs/dbraw/zinc/40/66/72/630406672.db2.gz QSSHSMPZGLLURG-UHFFFAOYSA-N 2 0 315.383 3.003 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841753183 630462380 /nfs/dbraw/zinc/46/23/80/630462380.db2.gz KXCGXXMJSUOODM-CYBMUJFWSA-N 2 0 314.857 3.055 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841758050 630462838 /nfs/dbraw/zinc/46/28/38/630462838.db2.gz KBQQCFLOGYQXNT-TZMCWYRMSA-N 2 0 314.857 3.053 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841758047 630462956 /nfs/dbraw/zinc/46/29/56/630462956.db2.gz KBQQCFLOGYQXNT-OCCSQVGLSA-N 2 0 314.857 3.053 20 10 DGCDRP [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000843045346 630607654 /nfs/dbraw/zinc/60/76/54/630607654.db2.gz NUUXCWMCAZCCRE-RISCZKNCSA-N 2 0 312.816 3.149 20 10 DGCDRP CCCN(CCC)c1ccc(C[N@H+](C)C2CC[NH2+]CC2)cc1 ZINC000843046137 630608056 /nfs/dbraw/zinc/60/80/56/630608056.db2.gz OGOYDGQGZZPAQT-UHFFFAOYSA-N 2 0 303.494 3.497 20 10 DGCDRP CC[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1[NH3+] ZINC000843053694 630609054 /nfs/dbraw/zinc/60/90/54/630609054.db2.gz RERHFNABBUBCHQ-HKUYNNGSSA-N 2 0 301.478 3.236 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CCC[NH2+]C1 ZINC000843059924 630609931 /nfs/dbraw/zinc/60/99/31/630609931.db2.gz USRHHCHMNYRGSA-SFHVURJKSA-N 2 0 301.478 3.108 20 10 DGCDRP CCOc1ccc(O)c(C[N@H+](CCC[NH3+])CC2CCCC2)c1 ZINC000843124049 630615817 /nfs/dbraw/zinc/61/58/17/630615817.db2.gz ULQMJLXEGILTEF-UHFFFAOYSA-N 2 0 306.450 3.132 20 10 DGCDRP CCOc1ccc(C[N@H+](CCC[NH3+])CC2CCCC2)c(O)c1 ZINC000843123855 630615899 /nfs/dbraw/zinc/61/58/99/630615899.db2.gz QNRUHYZBWOVERC-UHFFFAOYSA-N 2 0 306.450 3.132 20 10 DGCDRP [NH3+]CC[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000843122466 630616034 /nfs/dbraw/zinc/61/60/34/630616034.db2.gz CYZDNLAKZGGNMX-SFHVURJKSA-N 2 0 301.478 3.380 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c1O ZINC000843125245 630616611 /nfs/dbraw/zinc/61/66/11/630616611.db2.gz OXOOBJMCVOLCEY-ZIAGYGMSSA-N 2 0 308.853 3.176 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2)c2c1c(F)ccc2O ZINC000843344079 630648343 /nfs/dbraw/zinc/64/83/43/630648343.db2.gz PPXZWBMDYRJPLI-ABAIWWIYSA-N 2 0 300.377 3.328 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(N(C)C)cc1 ZINC000844926414 630988030 /nfs/dbraw/zinc/98/80/30/630988030.db2.gz ZUXGVGJQPTYCJD-CYBMUJFWSA-N 2 0 301.409 3.201 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1O ZINC000846142711 631211679 /nfs/dbraw/zinc/21/16/79/631211679.db2.gz CCCWKOMFITVRIE-CJNGLKHVSA-N 2 0 308.466 3.418 20 10 DGCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000849350543 631901012 /nfs/dbraw/zinc/90/10/12/631901012.db2.gz PUNKVRWSFSMRFX-AWEZNQCLSA-N 2 0 308.853 3.257 20 10 DGCDRP CCOc1cccc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c1O ZINC000849350781 631901320 /nfs/dbraw/zinc/90/13/20/631901320.db2.gz WAZGWZJLRZVVHW-MRXNPFEDSA-N 2 0 318.461 3.003 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000849350757 631901337 /nfs/dbraw/zinc/90/13/37/631901337.db2.gz VFVPLFBLVPUKHQ-IBGZPJMESA-N 2 0 315.505 3.273 20 10 DGCDRP COc1cc(C[NH2+]CCC[NH+]2CCCC2)c(O)c(C(C)(C)C)c1 ZINC000850014048 632028387 /nfs/dbraw/zinc/02/83/87/632028387.db2.gz SHEICCHRDIXTEO-UHFFFAOYSA-N 2 0 320.477 3.274 20 10 DGCDRP Cc1cc(C)cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000850366908 632126998 /nfs/dbraw/zinc/12/69/98/632126998.db2.gz NKUXGSCWCSFPOA-UHFFFAOYSA-N 2 0 323.484 3.345 20 10 DGCDRP CN(C)c1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1F ZINC000850419987 632147129 /nfs/dbraw/zinc/14/71/29/632147129.db2.gz JOTKCKKFGRVIJW-UHFFFAOYSA-N 2 0 319.468 3.103 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)cc1C(C)C ZINC000793743192 661055235 /nfs/dbraw/zinc/05/52/35/661055235.db2.gz HTTUDJNKGCXELA-LJQANCHMSA-N 2 0 302.462 3.352 20 10 DGCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cc3c(cc2O)CCCC3)C1 ZINC000160453690 655636106 /nfs/dbraw/zinc/63/61/06/655636106.db2.gz JUGXUYLLKPDOGL-IEBWSBKVSA-N 2 0 314.473 3.187 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000192872396 658761349 /nfs/dbraw/zinc/76/13/49/658761349.db2.gz PBBMCDCJHNLBLE-CABCVRRESA-N 2 0 306.450 3.316 20 10 DGCDRP CCc1cccc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c1O ZINC001578266229 1191935659 /nfs/dbraw/zinc/93/56/59/1191935659.db2.gz FQDVBZPBCNCKJL-KRWDZBQOSA-N 2 0 302.462 3.166 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]Cc2cccc3c2CC[NH2+]C3)cc1 ZINC001578425835 1191942788 /nfs/dbraw/zinc/94/27/88/1191942788.db2.gz PCDLTLLDFGJWLY-PLNGDYQASA-N 2 0 321.468 3.201 20 10 DGCDRP COc1cc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)c(O)c(C(C)(C)C)c1 ZINC001579152730 1191967814 /nfs/dbraw/zinc/96/78/14/1191967814.db2.gz FCHARAFHHQQUSC-IBGZPJMESA-N 2 0 320.477 3.178 20 10 DGCDRP Cc1cccc(C)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001620871736 1192503772 /nfs/dbraw/zinc/50/37/72/1192503772.db2.gz OFOOSOYEOORWMP-UHFFFAOYSA-N 2 0 323.484 3.345 20 10 DGCDRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc(N)cc2)C1 ZINC001334753948 1178791857 /nfs/dbraw/zinc/79/18/57/1178791857.db2.gz KBWPDRMYWWFJJA-AEFFLSMTSA-N 2 0 301.478 3.355 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)c1 ZINC001356057024 1181132705 /nfs/dbraw/zinc/13/27/05/1181132705.db2.gz LCIQFEAHTVFNBO-JZXOWHBKSA-N 2 0 302.462 3.171 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]CC2(C[NH+](C)C)CCCC2)cc1 ZINC001474106273 1183869139 /nfs/dbraw/zinc/86/91/39/1183869139.db2.gz HYOWEBQEFPMYCH-BQYQJAHWSA-N 2 0 315.505 3.477 20 10 DGCDRP CCCN(CCC[NH+](C)C)Cc1cc(F)c(N(C)C)cc1F ZINC001474503345 1183931975 /nfs/dbraw/zinc/93/19/75/1183931975.db2.gz KJDNTDPSUJFEJX-UHFFFAOYSA-N 2 0 313.436 3.195 20 10 DGCDRP CC(C)C[N@@H+](Cc1cc(F)ccc1O)CC1CC[NH+](C)CC1 ZINC001560979413 1189414741 /nfs/dbraw/zinc/41/47/41/1189414741.db2.gz IDCSRRWQRVYCEL-UHFFFAOYSA-N 2 0 308.441 3.331 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCCC3CCC3)cc2)CC1 ZINC001658308413 1196239014 /nfs/dbraw/zinc/23/90/14/1196239014.db2.gz DHEUXDKYSPUIRD-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCCC1 ZINC001662705209 1196742005 /nfs/dbraw/zinc/74/20/05/1196742005.db2.gz ARAKLLZJYNOJPL-QGZVFWFLSA-N 2 0 315.505 3.497 20 10 DGCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000314945586 1199797473 /nfs/dbraw/zinc/79/74/73/1199797473.db2.gz RPPZQLDYTMVFFG-GOSISDBHSA-N 2 0 301.478 3.107 20 10 DGCDRP C[NH+]1CCN(c2ccc(CNc3cc[nH+]c(C4CC4)c3)cc2)CC1 ZINC001167437606 1082123780 /nfs/dbraw/zinc/12/37/80/1082123780.db2.gz UZIXCKFZJLQAJR-UHFFFAOYSA-N 2 0 322.456 3.323 20 10 DGCDRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001183533937 1083973236 /nfs/dbraw/zinc/97/32/36/1083973236.db2.gz NWMVEXMATYORIP-HLIPFELVSA-N 2 0 315.505 3.353 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)c(O)c1 ZINC001184376026 1084166774 /nfs/dbraw/zinc/16/67/74/1084166774.db2.gz YYAURPUJZDCUTK-UHFFFAOYSA-N 2 0 306.450 3.062 20 10 DGCDRP COc1ccc(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c(O)c1 ZINC001203630797 1084565515 /nfs/dbraw/zinc/56/55/15/1084565515.db2.gz VNLDBCBVAQSCRN-QGZVFWFLSA-N 2 0 318.461 3.241 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168353824 1087305910 /nfs/dbraw/zinc/30/59/10/1087305910.db2.gz VYRMRVGMOFZKOC-UHFFFAOYSA-N 2 0 313.489 3.251 20 10 DGCDRP CC1(C)C=Cc2c(O)c(C[N@@H+]3CCCC[C@@H](C[NH3+])C3)ccc2O1 ZINC001206649828 1088352704 /nfs/dbraw/zinc/35/27/04/1088352704.db2.gz ZQVHKOOORKTEBA-AWEZNQCLSA-N 2 0 316.445 3.137 20 10 DGCDRP CC[NH+](CC)Cc1cc(OC)ccc1N(CCC[NH3+])C(C)C ZINC001164128636 1090350572 /nfs/dbraw/zinc/35/05/72/1090350572.db2.gz AAWZAXLOGIXKGX-UHFFFAOYSA-N 2 0 307.482 3.101 20 10 DGCDRP Oc1ccccc1C[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001203558417 1090613546 /nfs/dbraw/zinc/61/35/46/1090613546.db2.gz HPTLVTVJBJNIOQ-UHFFFAOYSA-N 2 0 322.452 3.490 20 10 DGCDRP COc1cccc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c1O ZINC001203596565 1090764065 /nfs/dbraw/zinc/76/40/65/1090764065.db2.gz IYJNWZUFSNTLRL-DLBZAZTESA-N 2 0 318.461 3.240 20 10 DGCDRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001205016818 1091085438 /nfs/dbraw/zinc/08/54/38/1091085438.db2.gz KULSDXJYTQHRMD-INIZCTEOSA-N 2 0 310.441 3.491 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3c4ccccc4n(C)c3C)C[C@H]2C1 ZINC001138259280 1091127324 /nfs/dbraw/zinc/12/73/24/1091127324.db2.gz DMYFYJUULRSFKX-IAGOWNOFSA-N 2 0 311.473 3.260 20 10 DGCDRP C[C@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001205904957 1091403658 /nfs/dbraw/zinc/40/36/58/1091403658.db2.gz YUAFNBPIKTXGIK-HOTGVXAUSA-N 2 0 311.473 3.465 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCC[C@H]1C[NH3+] ZINC001205992043 1091439236 /nfs/dbraw/zinc/43/92/36/1091439236.db2.gz CYLFGVZSNZFTEO-HKUYNNGSSA-N 2 0 315.505 3.484 20 10 DGCDRP C[C@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2O)CCC[C@H]1C[NH3+] ZINC001206026840 1091457840 /nfs/dbraw/zinc/45/78/40/1091457840.db2.gz UIDLYTIBRZSFHV-RYUDHWBXSA-N 2 0 316.367 3.218 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)cc(C[NH+](C)C)c1O ZINC001139256271 1091501305 /nfs/dbraw/zinc/50/13/05/1091501305.db2.gz XQHFRXTVWKBAQT-JKSUJKDBSA-N 2 0 318.461 3.084 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@H](C)[C@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139255248 1091501568 /nfs/dbraw/zinc/50/15/68/1091501568.db2.gz OMRLRZZXBLQKBE-HUUCEWRRSA-N 2 0 320.477 3.330 20 10 DGCDRP COc1cc(C[N@H+](C)Cc2ccsc2)cc(C[NH+](C)C)c1O ZINC001139258028 1091501911 /nfs/dbraw/zinc/50/19/11/1091501911.db2.gz JVKBXKOVBJQPPG-UHFFFAOYSA-N 2 0 320.458 3.156 20 10 DGCDRP COc1cc(C[N@@H+]2CCCCC[C@@H]2C)cc(C[NH+](C)C)c1O ZINC001139257056 1091502224 /nfs/dbraw/zinc/50/22/24/1091502224.db2.gz QBCLNMYWIJFVBJ-AWEZNQCLSA-N 2 0 306.450 3.227 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC34CCCCC4)cc2)CC1 ZINC001139407931 1091551879 /nfs/dbraw/zinc/55/18/79/1091551879.db2.gz GTDNSSLQGWJVGA-UHFFFAOYSA-N 2 0 313.489 3.347 20 10 DGCDRP Cc1cccc2c1C[N@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001139408347 1091552350 /nfs/dbraw/zinc/55/23/50/1091552350.db2.gz KKJCTHGYTUJLLB-UHFFFAOYSA-N 2 0 321.468 3.263 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCC[C@](C)(C[NH3+])CC3)ccc21 ZINC001206304556 1091572005 /nfs/dbraw/zinc/57/20/05/1091572005.db2.gz MMLQKPKEEYNFDG-IBGZPJMESA-N 2 0 301.478 3.020 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@H](C[NH3+])CC[C@@H]2C)c(OC)c1 ZINC001206769775 1091733271 /nfs/dbraw/zinc/73/32/71/1091733271.db2.gz QGFPXQXBFULJOR-HOTGVXAUSA-N 2 0 319.493 3.101 20 10 DGCDRP C[C@H]1CC[C@H](C[NH3+])C[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001206770072 1091733778 /nfs/dbraw/zinc/73/37/78/1091733778.db2.gz QIJDBNRHYAFBGI-JKSUJKDBSA-N 2 0 311.473 3.465 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@@H+]3C[C@H](C[NH3+])CC[C@@H]3C)c2c1 ZINC001206805711 1091747588 /nfs/dbraw/zinc/74/75/88/1091747588.db2.gz CRQVZALISDXYQH-KBPBESRZSA-N 2 0 314.429 3.113 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)c1O ZINC001140185419 1091794773 /nfs/dbraw/zinc/79/47/73/1091794773.db2.gz VBGJPGCNXKEXJX-UHFFFAOYSA-N 2 0 302.462 3.459 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)CC3CCC3)cc2)CC1 ZINC001140303810 1091819656 /nfs/dbraw/zinc/81/96/56/1091819656.db2.gz BESUIXJLMFNWDU-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP Cc1c(O)ccc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)c1O ZINC001140748857 1091984845 /nfs/dbraw/zinc/98/48/45/1091984845.db2.gz MSFLRXOEEYSGSH-DLBZAZTESA-N 2 0 318.461 3.245 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCC2)cc1)CC1(C)CC[NH+](C)CC1 ZINC001208105803 1092197367 /nfs/dbraw/zinc/19/73/67/1092197367.db2.gz CQTAGHBMGOLFLS-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP Nc1ccc(C[NH+]2CCCC3(CCCC[NH2+]C3)CCC2)cc1 ZINC001222119892 1095443442 /nfs/dbraw/zinc/44/34/42/1095443442.db2.gz OSTWIIZICOLZMJ-UHFFFAOYSA-N 2 0 301.478 3.405 20 10 DGCDRP CC(C)c1ccc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)c(O)c1 ZINC001222277396 1095526348 /nfs/dbraw/zinc/52/63/48/1095526348.db2.gz NJKOPPCVYHZMKI-LJQANCHMSA-N 2 0 302.462 3.481 20 10 DGCDRP Oc1cc(C(F)(F)F)ccc1CN1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222355714 1095569875 /nfs/dbraw/zinc/56/98/75/1095569875.db2.gz UDLVMWFWAVQZBO-OAHLLOKOSA-N 2 0 314.351 3.129 20 10 DGCDRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC001116565796 1095601907 /nfs/dbraw/zinc/60/19/07/1095601907.db2.gz XDISXFBNVGBZRE-UMVBOHGHSA-N 2 0 306.425 3.401 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001116588331 1095608951 /nfs/dbraw/zinc/60/89/51/1095608951.db2.gz CTMRUIDLZNSIHS-CVEARBPZSA-N 2 0 320.477 3.197 20 10 DGCDRP Cc1cc(C[NH+]2CCC(F)(C[NH3+])CC2)c(C)n1-c1ccccc1 ZINC001222532330 1095654261 /nfs/dbraw/zinc/65/42/61/1095654261.db2.gz KNTVYNFHTRSXIT-UHFFFAOYSA-N 2 0 315.436 3.357 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC001118016085 1095923008 /nfs/dbraw/zinc/92/30/08/1095923008.db2.gz TURIBAFLHHTUCO-UYAOXDASSA-N 2 0 313.489 3.251 20 10 DGCDRP CC(C)(C)c1ccc(C[NH+]2CCC3(CCC[NH2+]3)CC2)c(O)c1 ZINC001228555097 1097140647 /nfs/dbraw/zinc/14/06/47/1097140647.db2.gz BVVTUHJMAYVGTH-UHFFFAOYSA-N 2 0 302.462 3.408 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1F ZINC001177823774 1098607960 /nfs/dbraw/zinc/60/79/60/1098607960.db2.gz ZNYQZLLPNFPXHR-QGZVFWFLSA-N 2 0 309.473 3.348 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001234997701 1098740631 /nfs/dbraw/zinc/74/06/31/1098740631.db2.gz DOSZYFMSCPTTAP-LJQANCHMSA-N 2 0 302.462 3.265 20 10 DGCDRP C[C@]1(C[NH3+])CCC[N@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001206326976 1098803791 /nfs/dbraw/zinc/80/37/91/1098803791.db2.gz RBUIFZKFOFOFJA-HNNXBMFYSA-N 2 0 300.805 3.136 20 10 DGCDRP Oc1cc(Cl)ccc1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235229183 1098900930 /nfs/dbraw/zinc/90/09/30/1098900930.db2.gz OYMZAHUGXAQSQZ-MRXNPFEDSA-N 2 0 308.853 3.400 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c1O ZINC001235230252 1098903786 /nfs/dbraw/zinc/90/37/86/1098903786.db2.gz UNSQNRGJIMNMRG-GOSISDBHSA-N 2 0 302.462 3.363 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC001235269184 1098940426 /nfs/dbraw/zinc/94/04/26/1098940426.db2.gz LJSJNLKUUWYQKA-QUCCMNQESA-N 2 0 309.457 3.278 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@@H]3F)c1O ZINC001235408099 1099005421 /nfs/dbraw/zinc/00/54/21/1099005421.db2.gz UAGQBIIKYSABHH-QFBILLFUSA-N 2 0 320.452 3.213 20 10 DGCDRP CCc1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235423901 1099016288 /nfs/dbraw/zinc/01/62/88/1099016288.db2.gz GYGDGBMOFCYVLX-SJORKVTESA-N 2 0 302.462 3.166 20 10 DGCDRP C[NH+](C)CC1CC[NH+](Cc2ccc(C(C)(C)C)cc2O)CC1 ZINC001235681684 1099123943 /nfs/dbraw/zinc/12/39/43/1099123943.db2.gz CGQWKOZUGRGDLR-UHFFFAOYSA-N 2 0 304.478 3.463 20 10 DGCDRP c1ccc2c(c1)CCC[N@@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001235835522 1099201204 /nfs/dbraw/zinc/20/12/04/1099201204.db2.gz WLEPUFAJXAZAHG-UHFFFAOYSA-N 2 0 321.468 3.045 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)CC1CCCCC1 ZINC001235961111 1099294300 /nfs/dbraw/zinc/29/43/00/1099294300.db2.gz ZXDFVPMLWILJLQ-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP Cc1ccc(C[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)c(O)c1 ZINC001236300733 1099522984 /nfs/dbraw/zinc/52/29/84/1099522984.db2.gz XUFWTAOEBNHYME-UHFFFAOYSA-N 2 0 310.441 3.455 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N(CC)CC)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236835375 1099821608 /nfs/dbraw/zinc/82/16/08/1099821608.db2.gz MKADTBBCCGSOCJ-GOSISDBHSA-N 2 0 303.494 3.354 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236835698 1099822608 /nfs/dbraw/zinc/82/26/08/1099822608.db2.gz OYRIUWRVPVQGMT-LJQANCHMSA-N 2 0 315.505 3.498 20 10 DGCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1CCCCC1 ZINC001236931253 1099880467 /nfs/dbraw/zinc/88/04/67/1099880467.db2.gz IEGSLNWOQPYTKX-UHFFFAOYSA-N 2 0 319.468 3.342 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)c1O ZINC001237408160 1100116052 /nfs/dbraw/zinc/11/60/52/1100116052.db2.gz YYZOSOIEPIIHDK-YOEHRIQHSA-N 2 0 302.462 3.264 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)c1 ZINC001237418595 1100121736 /nfs/dbraw/zinc/12/17/36/1100121736.db2.gz XPKLHXSQEYNDQU-YOEHRIQHSA-N 2 0 302.462 3.264 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC001329036526 1104133011 /nfs/dbraw/zinc/13/30/11/1104133011.db2.gz MXPBULWWQCUDOJ-CWVYHPPDSA-N 2 0 300.446 3.227 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246523387 1104578060 /nfs/dbraw/zinc/57/80/60/1104578060.db2.gz GXGKQTUPBQBBHR-IYOUNJFTSA-N 2 0 302.462 3.363 20 10 DGCDRP CCOc1cccc(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)c1O ZINC001275270546 1104698937 /nfs/dbraw/zinc/69/89/37/1104698937.db2.gz KKUIVOMVDBTWEH-UHFFFAOYSA-N 2 0 318.461 3.099 20 10 DGCDRP C[N@@H+]1CCCC2(CC[NH+](Cc3cc(Cl)ccc3O)CC2)C1 ZINC001275275853 1104700298 /nfs/dbraw/zinc/70/02/98/1104700298.db2.gz REIUKGPLRJCXNP-UHFFFAOYSA-N 2 0 308.853 3.353 20 10 DGCDRP Cc1cc(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)ccc1N(C)C ZINC001275361354 1104736217 /nfs/dbraw/zinc/73/62/17/1104736217.db2.gz SUDXAZSCMGXXDF-UHFFFAOYSA-N 2 0 315.505 3.369 20 10 DGCDRP Oc1ccc(F)cc1C[NH+]1CCC2(C[NH+](C3CCCC3)C2)CC1 ZINC001275912561 1104952481 /nfs/dbraw/zinc/95/24/81/1104952481.db2.gz CAFBNGUBBMCTDC-UHFFFAOYSA-N 2 0 318.436 3.372 20 10 DGCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccc(N3CCCC3)cc2)C1 ZINC001261186397 1107355747 /nfs/dbraw/zinc/35/57/47/1107355747.db2.gz FWKYBICKVSEDPM-UYAOXDASSA-N 2 0 313.489 3.203 20 10 DGCDRP CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001319707755 1108602801 /nfs/dbraw/zinc/60/28/01/1108602801.db2.gz XSRWGKHNYBYMFY-WBVHZDCISA-N 2 0 319.468 3.198 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCCC3(C)C)cc2)CC1 ZINC001308313756 1111415057 /nfs/dbraw/zinc/41/50/57/1111415057.db2.gz JKTFMTVOABXLKE-IBGZPJMESA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2O)C1 ZINC000179564242 432063160 /nfs/dbraw/zinc/06/31/60/432063160.db2.gz MVNYOMITPIQXIU-IAGOWNOFSA-N 2 0 302.462 3.479 20 10 DGCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000092066891 193151371 /nfs/dbraw/zinc/15/13/71/193151371.db2.gz IHJVOQNQAQSWPK-QAPCUYQASA-N 2 0 300.446 3.149 20 10 DGCDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000124163264 431884226 /nfs/dbraw/zinc/88/42/26/431884226.db2.gz GZIIOLNVNWKHGR-GOSISDBHSA-N 2 0 301.478 3.108 20 10 DGCDRP CC[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccccc1O ZINC000155412278 432554319 /nfs/dbraw/zinc/55/43/19/432554319.db2.gz NFJQXTGOQOCQQT-JFIYKMOQSA-N 2 0 320.477 3.322 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)c(O)c1 ZINC000290400445 433046241 /nfs/dbraw/zinc/04/62/41/433046241.db2.gz JJUAJSPHJCFYOK-MAUKXSAKSA-N 2 0 318.461 3.097 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000370675774 434618984 /nfs/dbraw/zinc/61/89/84/434618984.db2.gz FBZQVDYKSJHZAK-VDZJLULYSA-N 2 0 301.478 3.420 20 10 DGCDRP Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000131343711 526356814 /nfs/dbraw/zinc/35/68/14/526356814.db2.gz VQNWOJGJEKOSIJ-MRXNPFEDSA-N 2 0 310.441 3.463 20 10 DGCDRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(F)cc(C(C)=O)c2O)C[C@H]1C ZINC000750827078 575754223 /nfs/dbraw/zinc/75/42/23/575754223.db2.gz VJTVNYCWBRCLNJ-WBMJQRKESA-N 2 0 322.424 3.039 20 10 DGCDRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)c1ccc(Br)cc1O ZINC000854224358 620785840 /nfs/dbraw/zinc/78/58/40/620785840.db2.gz VNJFQVPZAWZAOR-SNVBAGLBSA-N 2 0 313.239 3.077 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)c1O ZINC000894179866 618725293 /nfs/dbraw/zinc/72/52/93/618725293.db2.gz HYUKMXIFFCLVKI-HNNXBMFYSA-N 2 0 320.477 3.311 20 10 DGCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC(C)(C)C1 ZINC000839184607 621344361 /nfs/dbraw/zinc/34/43/61/621344361.db2.gz KGMIWOOXTLZGBE-UHFFFAOYSA-N 2 0 301.478 3.059 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2c1c(F)ccc2O ZINC000756416032 621636935 /nfs/dbraw/zinc/63/69/35/621636935.db2.gz GIIFYOKAJFILNV-COMQUAJESA-N 2 0 304.409 3.296 20 10 DGCDRP CC[NH+]1CCC(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756534669 621646058 /nfs/dbraw/zinc/64/60/58/621646058.db2.gz MFWRXWQTFWGWIN-SWLSCSKDSA-N 2 0 306.425 3.401 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCC4(CC4)CC3)cc2)CC1 ZINC000766214202 622312440 /nfs/dbraw/zinc/31/24/40/622312440.db2.gz ZJFAHISYUJHCNI-UHFFFAOYSA-N 2 0 313.489 3.251 20 10 DGCDRP CCOc1cccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1O ZINC000768927216 622485629 /nfs/dbraw/zinc/48/56/29/622485629.db2.gz RIZJDHXPOVFXQF-UHFFFAOYSA-N 2 0 320.477 3.343 20 10 DGCDRP CCOc1ccc(O)c(C[N@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)c1 ZINC000769469589 622530655 /nfs/dbraw/zinc/53/06/55/622530655.db2.gz AOIRVRAZZOMTDU-HOCLYGCPSA-N 2 0 306.450 3.096 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000771934237 622818215 /nfs/dbraw/zinc/81/82/15/622818215.db2.gz YFBFLEXJDIKTLJ-UHFFFAOYSA-N 2 0 311.473 3.446 20 10 DGCDRP CCC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000773145664 622991498 /nfs/dbraw/zinc/99/14/98/622991498.db2.gz KWLFETKJZKOCNO-KRWDZBQOSA-N 2 0 315.505 3.497 20 10 DGCDRP CCCOc1ccc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1C ZINC000873012212 623016444 /nfs/dbraw/zinc/01/64/44/623016444.db2.gz DHZPPOSNTHMXTK-QGZVFWFLSA-N 2 0 302.462 3.358 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc2c(cc1O)CCCC2 ZINC000873239803 623087557 /nfs/dbraw/zinc/08/75/57/623087557.db2.gz CXXOKEXCFHYNRS-ZQIUZPCESA-N 2 0 302.462 3.439 20 10 DGCDRP C[N@H+](Cc1ccsc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775644536 623302249 /nfs/dbraw/zinc/30/22/49/623302249.db2.gz NNVGPJOCZSISOL-UHFFFAOYSA-N 2 0 315.486 3.132 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]4CCC[C@H]43)cc2)CC1 ZINC000775660239 623307543 /nfs/dbraw/zinc/30/75/43/623307543.db2.gz BAGCJBDZDROWFW-AZUAARDMSA-N 2 0 313.489 3.203 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC4(CCCC4)C3)cc2)CC1 ZINC000775690275 623314908 /nfs/dbraw/zinc/31/49/08/623314908.db2.gz OLCHXFMUPQWBHH-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP C[C@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775998996 623362780 /nfs/dbraw/zinc/36/27/80/623362780.db2.gz UFJFFVLXGRDFAG-KRWDZBQOSA-N 2 0 301.478 3.060 20 10 DGCDRP Cc1ccc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)c(O)c1 ZINC000876990030 623761497 /nfs/dbraw/zinc/76/14/97/623761497.db2.gz NVHLMTYMBAUQPA-UHFFFAOYSA-N 2 0 302.462 3.445 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c(O)c1 ZINC000877684778 623991661 /nfs/dbraw/zinc/99/16/61/623991661.db2.gz XJWSXEBTVAFHNF-UHFFFAOYSA-N 2 0 318.461 3.099 20 10 DGCDRP Cc1cccc(O)c1C[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC000877718724 624004220 /nfs/dbraw/zinc/00/42/20/624004220.db2.gz QWURPJQKEDFAAK-UHFFFAOYSA-N 2 0 324.468 3.454 20 10 DGCDRP CC[C@H]1CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000806137154 626701053 /nfs/dbraw/zinc/70/10/53/626701053.db2.gz HIGKSKZEIXDONY-FUHWJXTLSA-N 2 0 319.468 3.246 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)[C@H]3C3CC3)cc2)CC1 ZINC000811513968 627286297 /nfs/dbraw/zinc/28/62/97/627286297.db2.gz XYSSTQNARPQMGT-LJQANCHMSA-N 2 0 313.489 3.059 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000817894293 627954321 /nfs/dbraw/zinc/95/43/21/627954321.db2.gz LEIRYSHWIKUNEA-GBESFXJTSA-N 2 0 301.478 3.071 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000817893605 627954607 /nfs/dbraw/zinc/95/46/07/627954607.db2.gz GHQGAXHROMKICN-HSALFYBXSA-N 2 0 315.505 3.461 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000817897836 627955241 /nfs/dbraw/zinc/95/52/41/627955241.db2.gz CCMLFNBVIGKVIZ-VAMGGRTRSA-N 2 0 313.489 3.297 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1F ZINC000817901166 627956070 /nfs/dbraw/zinc/95/60/70/627956070.db2.gz SVONSIRNCZUOKW-BPQIPLTHSA-N 2 0 319.468 3.292 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C2CCC(C[NH3+])CC2)cc1F ZINC000817903307 627956740 /nfs/dbraw/zinc/95/67/40/627956740.db2.gz MNSCYRKWMRUPCC-UHFFFAOYSA-N 2 0 307.457 3.279 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)ccc21 ZINC000817901767 627956974 /nfs/dbraw/zinc/95/69/74/627956974.db2.gz YHSDSKCOXUXYOW-GBESFXJTSA-N 2 0 313.489 3.079 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CC[NH2+]CC[C@@H]3C)cc2)CC1 ZINC000817902382 627957316 /nfs/dbraw/zinc/95/73/16/627957316.db2.gz PAXUKAJZPJKRNC-FXAWDEMLSA-N 2 0 315.505 3.401 20 10 DGCDRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817937202 627966256 /nfs/dbraw/zinc/96/62/56/627966256.db2.gz VBWUHDCCTCXXKV-CQSZACIVSA-N 2 0 305.441 3.219 20 10 DGCDRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817955564 627974194 /nfs/dbraw/zinc/97/41/94/627974194.db2.gz ZAPWNVLWKIJNIO-DLBZAZTESA-N 2 0 301.478 3.327 20 10 DGCDRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817965672 627977814 /nfs/dbraw/zinc/97/78/14/627977814.db2.gz BQRHIQSZRXCSAI-KUHUBIRLSA-N 2 0 302.462 3.311 20 10 DGCDRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(Br)ccc1O ZINC000817976545 627981815 /nfs/dbraw/zinc/98/18/15/627981815.db2.gz NERKVNTXSSFJTQ-WDEREUQCSA-N 2 0 315.255 3.323 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)cc1Cl ZINC000825725816 628791160 /nfs/dbraw/zinc/79/11/60/628791160.db2.gz ARFMWYHKXXWLAY-OAHLLOKOSA-N 2 0 318.804 3.402 20 10 DGCDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835038580 629831253 /nfs/dbraw/zinc/83/12/53/629831253.db2.gz UBTQVEJJWAEVGR-WSSFADSRSA-N 2 0 315.505 3.476 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000835041279 629832333 /nfs/dbraw/zinc/83/23/33/629832333.db2.gz AARVGOLTIBHCBW-GHDGWMACSA-N 2 0 313.489 3.371 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]C2CCC(C[NH+](C)C)CC2)cc1 ZINC000835042735 629833037 /nfs/dbraw/zinc/83/30/37/629833037.db2.gz XJVCDNIKLIXNJP-WAYWQWQTSA-N 2 0 315.505 3.476 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000835051023 629836983 /nfs/dbraw/zinc/83/69/83/629836983.db2.gz ADYACCMYFZFYSZ-ARJAWSKDSA-N 2 0 313.489 3.230 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]CCCC[N@H+](C)C2CC2)cc1 ZINC000835062862 629841547 /nfs/dbraw/zinc/84/15/47/629841547.db2.gz FTRCPUFPQUNMBH-VOTSOKGWSA-N 2 0 301.478 3.230 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]CCCC[N@H+](C)C2CC2)c1O ZINC000835063302 629841585 /nfs/dbraw/zinc/84/15/85/629841585.db2.gz JSRKPSKOEGIDGZ-UHFFFAOYSA-N 2 0 312.841 3.018 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]CCCC[N@H+](C)C2CC2)cc1 ZINC000835062860 629841852 /nfs/dbraw/zinc/84/18/52/629841852.db2.gz FTRCPUFPQUNMBH-SREVYHEPSA-N 2 0 301.478 3.230 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C3CC3)C3CCC3)cc2)CC1 ZINC000835068915 629842287 /nfs/dbraw/zinc/84/22/87/629842287.db2.gz JDBYHEPLTUIJLP-FQEVSTJZSA-N 2 0 313.489 3.107 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N(C)C)cc2C)C[C@H]1C ZINC000840918611 630378383 /nfs/dbraw/zinc/37/83/83/630378383.db2.gz WPYZFDVNIPAARU-VQIMIIECSA-N 2 0 303.494 3.366 20 10 DGCDRP Cc1cc(O)c(C[NH2+]CC2CC[NH+](C3CC3)CC2)c(Cl)c1 ZINC000840941479 630381525 /nfs/dbraw/zinc/38/15/25/630381525.db2.gz ZDCRLYZYSBXIRI-UHFFFAOYSA-N 2 0 308.853 3.318 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@H]1CCC[NH2+]C1 ZINC000841033490 630399261 /nfs/dbraw/zinc/39/92/61/630399261.db2.gz OZKZBUTVMAWIDA-WMZOPIPTSA-N 2 0 301.478 3.155 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)c(C(F)(F)F)c1 ZINC000841058752 630402948 /nfs/dbraw/zinc/40/29/48/630402948.db2.gz UAJUBADHVMBKNZ-CYBMUJFWSA-N 2 0 315.383 3.003 20 10 DGCDRP CCCN(CCC)c1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000841064655 630403667 /nfs/dbraw/zinc/40/36/67/630403667.db2.gz RZOQSUQLHPACPZ-VQIMIIECSA-N 2 0 303.494 3.401 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC[NH2+]1 ZINC000841064094 630403675 /nfs/dbraw/zinc/40/36/75/630403675.db2.gz XWHDGOOFQMVIOA-DGCLKSJQSA-N 2 0 315.383 3.002 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC[NH2+]1 ZINC000841064096 630403811 /nfs/dbraw/zinc/40/38/11/630403811.db2.gz XWHDGOOFQMVIOA-YPMHNXCESA-N 2 0 315.383 3.002 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000841087459 630405863 /nfs/dbraw/zinc/40/58/63/630405863.db2.gz NWNXDBPYONRKDA-YHTLKTDXSA-N 2 0 313.489 3.230 20 10 DGCDRP CCC[N@H+](Cc1ccc(N(CC)CC)cc1)C1CC[NH2+]CC1 ZINC000843045420 630608139 /nfs/dbraw/zinc/60/81/39/630608139.db2.gz XMLUWZCIKMRVRC-UHFFFAOYSA-N 2 0 303.494 3.497 20 10 DGCDRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000843052161 630609067 /nfs/dbraw/zinc/60/90/67/630609067.db2.gz IRIUQYXCGPZYNF-MRXNPFEDSA-N 2 0 301.478 3.236 20 10 DGCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126046 630616261 /nfs/dbraw/zinc/61/62/61/630616261.db2.gz FFULDVJIRJXCNT-UONOGXRCSA-N 2 0 308.853 3.257 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc1 ZINC000843125731 630616317 /nfs/dbraw/zinc/61/63/17/630616317.db2.gz GKKMLMPQVDXSSV-RBUKOAKNSA-N 2 0 315.505 3.354 20 10 DGCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126111 630616512 /nfs/dbraw/zinc/61/65/12/630616512.db2.gz GOBXQBFZQUKBRU-ZIAGYGMSSA-N 2 0 308.853 3.257 20 10 DGCDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000843129971 630617753 /nfs/dbraw/zinc/61/77/53/630617753.db2.gz VUJTWOPRHYYCRJ-LSDHHAIUSA-N 2 0 314.429 3.187 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1F ZINC000843341225 630647858 /nfs/dbraw/zinc/64/78/58/630647858.db2.gz SOVPXAWLERQCBI-BRWVUGGUSA-N 2 0 319.468 3.150 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2)c2c1c(F)ccc2O ZINC000843344081 630648352 /nfs/dbraw/zinc/64/83/52/630648352.db2.gz PPXZWBMDYRJPLI-NHYWBVRUSA-N 2 0 300.377 3.328 20 10 DGCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1ccc(N2CCCCC2)cc1 ZINC000844220912 630712697 /nfs/dbraw/zinc/71/26/97/630712697.db2.gz PAHKDANCEUQIAT-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(C[NH3+])cc2F)c(Cl)c1 ZINC000844908457 630975506 /nfs/dbraw/zinc/97/55/06/630975506.db2.gz UWLUZNYLDADXNR-UHFFFAOYSA-N 2 0 308.784 3.242 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2F)c2c1c(F)ccc2O ZINC000844923739 630986269 /nfs/dbraw/zinc/98/62/69/630986269.db2.gz JRXYCQUFQDCRJQ-BONVTDFDSA-N 2 0 318.367 3.467 20 10 DGCDRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cccc(OC)c2O)CC1 ZINC000846143665 631211859 /nfs/dbraw/zinc/21/18/59/631211859.db2.gz FOGBYJSMHAWNPU-AWEZNQCLSA-N 2 0 306.450 3.173 20 10 DGCDRP CCc1cccc(CN2CCC([NH+]3CCCCC3)CC2)c1O ZINC000848880706 631768239 /nfs/dbraw/zinc/76/82/39/631768239.db2.gz IZCAMFDEJGOAAP-UHFFFAOYSA-N 2 0 302.462 3.405 20 10 DGCDRP Oc1cccc(Cl)c1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000849350844 631901290 /nfs/dbraw/zinc/90/12/90/631901290.db2.gz YQRTXLQFKPYZDK-CQSZACIVSA-N 2 0 308.853 3.257 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000185471921 660224701 /nfs/dbraw/zinc/22/47/01/660224701.db2.gz KFZVRNIXLPBTBC-SUMWQHHRSA-N 2 0 308.466 3.418 20 10 DGCDRP Cc1cccc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1O ZINC000793239173 661016398 /nfs/dbraw/zinc/01/63/98/661016398.db2.gz DDFITOOVZJNTST-BGYRXZFFSA-N 2 0 322.452 3.264 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@H+](CC3CC3)C3CCC3)cc2)CC1 ZINC000793393561 661029626 /nfs/dbraw/zinc/02/96/26/661029626.db2.gz HVEPSDRLKIPJOB-UHFFFAOYSA-N 2 0 313.489 3.203 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000158005917 661869737 /nfs/dbraw/zinc/86/97/37/661869737.db2.gz OBEOGCUBYCVCNB-VQIMIIECSA-N 2 0 314.473 3.458 20 10 DGCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc4c(cc3O)CCCC4)CC[C@H]21 ZINC000245547881 662236096 /nfs/dbraw/zinc/23/60/96/662236096.db2.gz WSYMHDFXUPCKEP-IEBWSBKVSA-N 2 0 314.473 3.187 20 10 DGCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3c(O)ccc4ccccc43)CC[C@H]21 ZINC000247111378 662300915 /nfs/dbraw/zinc/30/09/15/662300915.db2.gz QQFCNDVOSPAYRZ-QFBILLFUSA-N 2 0 310.441 3.462 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1 ZINC000396445355 685227112 /nfs/dbraw/zinc/22/71/12/685227112.db2.gz DDICVORLIFMLIK-INIZCTEOSA-N 2 0 303.494 3.353 20 10 DGCDRP CCOCc1cc(C[NH2+]CC[C@@H]2CCC[NH2+]CC2)ccc1OC ZINC001578124555 1191926826 /nfs/dbraw/zinc/92/68/26/1191926826.db2.gz GZZBSNHYPREYCC-MRXNPFEDSA-N 2 0 320.477 3.101 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1F ZINC001620964972 1192681791 /nfs/dbraw/zinc/68/17/91/1192681791.db2.gz MYNCFHVVRGSYOZ-INIZCTEOSA-N 2 0 321.484 3.493 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCC[C@@H](C[C@@H]([NH3+])C3CCCC3)C2)cc1 ZINC001356082671 1181138680 /nfs/dbraw/zinc/13/86/80/1181138680.db2.gz BOQVVVNFFKDQEU-QFBILLFUSA-N 2 0 301.478 3.388 20 10 DGCDRP CC(C)C(C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC001461435031 1182814649 /nfs/dbraw/zinc/81/46/49/1182814649.db2.gz OAPVDDCGILYVBE-UHFFFAOYSA-N 2 0 317.521 3.456 20 10 DGCDRP CCc1cccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1O ZINC001474749981 1183972596 /nfs/dbraw/zinc/97/25/96/1183972596.db2.gz UFZFEKBBMFPRTF-UHFFFAOYSA-N 2 0 311.429 3.108 20 10 DGCDRP CCOCc1cc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)ccc1OC ZINC001560358634 1189318136 /nfs/dbraw/zinc/31/81/36/1189318136.db2.gz QWGAGNAZUNBMCN-ZWKOTPCHSA-N 2 0 320.477 3.194 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CCN(c3cc[nH+]cc3)C[C@@H]2C)cc1 ZINC001654837236 1195845575 /nfs/dbraw/zinc/84/55/75/1195845575.db2.gz AXQZAZZUWANPMP-KRWDZBQOSA-N 2 0 324.472 3.248 20 10 DGCDRP COc1cc(C)c(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c(O)c1 ZINC001657636330 1196163558 /nfs/dbraw/zinc/16/35/58/1196163558.db2.gz JOUDGISCSWCMAC-UHFFFAOYSA-N 2 0 306.450 3.014 20 10 DGCDRP C[NH2+]C1CCC([N@H+](C)Cc2ccc3c(c2)CCCN3C)CC1 ZINC000316813513 1199817980 /nfs/dbraw/zinc/81/79/80/1199817980.db2.gz FOJUFTXOBNEDGO-UHFFFAOYSA-N 2 0 301.478 3.031 20 10 DGCDRP Cc1cc[nH+]c(NCc2ccc(N3CC[NH+](C)CC3)cc2)c1C ZINC001167427015 1082097208 /nfs/dbraw/zinc/09/72/08/1082097208.db2.gz UEJUYQXHYIDFCN-UHFFFAOYSA-N 2 0 310.445 3.062 20 10 DGCDRP COc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c1 ZINC001203674882 1090778241 /nfs/dbraw/zinc/77/82/41/1090778241.db2.gz FCEBLVJJKHXHAQ-QGZVFWFLSA-N 2 0 318.461 3.241 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)ccc1N(C)C ZINC001204735164 1091025582 /nfs/dbraw/zinc/02/55/82/1091025582.db2.gz MLOQMVROOJKJSP-UHFFFAOYSA-N 2 0 301.478 3.027 20 10 DGCDRP c1ccc([C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001205340169 1091193556 /nfs/dbraw/zinc/19/35/56/1091193556.db2.gz PRSNNBRQCRVCGP-HXUWFJFHSA-N 2 0 321.468 3.086 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)cc1 ZINC001205546634 1091249574 /nfs/dbraw/zinc/24/95/74/1091249574.db2.gz XOHXRGSSRNDNSA-SFHVURJKSA-N 2 0 307.457 3.186 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)CC[C@H]1C[NH3+] ZINC001205602670 1091274431 /nfs/dbraw/zinc/27/44/31/1091274431.db2.gz LGIUPIHPFNXFKC-AEFFLSMTSA-N 2 0 301.478 3.094 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)cc1 ZINC001205603496 1091275247 /nfs/dbraw/zinc/27/52/47/1091275247.db2.gz PGWXXDJFFQEEAE-WMZOPIPTSA-N 2 0 303.494 3.340 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1C[NH3+] ZINC001205616823 1091281739 /nfs/dbraw/zinc/28/17/39/1091281739.db2.gz HBWSTUWBUBEBGY-IEBWSBKVSA-N 2 0 315.505 3.484 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)CC[C@H]1C[NH3+] ZINC001205626296 1091285567 /nfs/dbraw/zinc/28/55/67/1091285567.db2.gz FNAUXLQFRZFSPD-KBPBESRZSA-N 2 0 309.885 3.213 20 10 DGCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H]1CC1(C)C ZINC001202870057 1091356929 /nfs/dbraw/zinc/35/69/29/1091356929.db2.gz QVLMECRGUKZHQW-MOPGFXCFSA-N 2 0 315.505 3.353 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)cc1 ZINC001205991480 1091439489 /nfs/dbraw/zinc/43/94/89/1091439489.db2.gz BAOLFNIEIWFNHQ-SJLPKXTDSA-N 2 0 303.494 3.340 20 10 DGCDRP C[C@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCC[C@H]1C[NH3+] ZINC001206012509 1091449280 /nfs/dbraw/zinc/44/92/80/1091449280.db2.gz MAFGOEPVORPYPQ-GJZGRUSLSA-N 2 0 304.478 3.497 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)cc(C[NH+](C)C)c1O ZINC001139258051 1091502288 /nfs/dbraw/zinc/50/22/88/1091502288.db2.gz KVIFUGSSTRYAFP-DOTOQJQBSA-N 2 0 318.461 3.227 20 10 DGCDRP COc1cc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)cc(C[NH+](C)C)c1O ZINC001139256303 1091502307 /nfs/dbraw/zinc/50/23/07/1091502307.db2.gz YFHJBPPCYVOYHY-HOTGVXAUSA-N 2 0 318.461 3.084 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](C)C1 ZINC001139409914 1091552119 /nfs/dbraw/zinc/55/21/19/1091552119.db2.gz UZMWGBNKBAFOHV-SJORKVTESA-N 2 0 301.478 3.059 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC(CC[NH3+])CC2)c(OC)c1 ZINC001206499885 1091651333 /nfs/dbraw/zinc/65/13/33/1091651333.db2.gz GQOOIIZQPRKPBG-UHFFFAOYSA-N 2 0 319.493 3.102 20 10 DGCDRP CCc1ccc(C[NH+]2CCC(C[NH3+])(c3ccccc3)CC2)c(O)c1 ZINC001206760317 1091726964 /nfs/dbraw/zinc/72/69/64/1091726964.db2.gz CUTJLRPKCYQJIP-UHFFFAOYSA-N 2 0 324.468 3.447 20 10 DGCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc4c(c3)CCCN4C)(C1)CCC2 ZINC001276578601 1092457723 /nfs/dbraw/zinc/45/77/23/1092457723.db2.gz OPMQTWDZCTYJDN-VQTJNVASSA-N 2 0 313.489 3.223 20 10 DGCDRP C[NH+]1CC2(C1)CC[NH+](Cc1cccc(C(C)(C)C)c1O)CC2 ZINC001143112470 1092616386 /nfs/dbraw/zinc/61/63/86/1092616386.db2.gz RQWIJJXLWDTRQC-UHFFFAOYSA-N 2 0 302.462 3.217 20 10 DGCDRP CN1CCC[C@@H]2C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116415 1092617783 /nfs/dbraw/zinc/61/77/83/1092617783.db2.gz ANFDCINLQIZNDO-PBHICJAKSA-N 2 0 302.462 3.216 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@@H+]3CCCC[C@@H](C[NH3+])C3)c2c1 ZINC001206639903 1092879654 /nfs/dbraw/zinc/87/96/54/1092879654.db2.gz GEPMFMZEWNCQJX-AWEZNQCLSA-N 2 0 314.429 3.115 20 10 DGCDRP COc1cccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1O ZINC001222161567 1095466487 /nfs/dbraw/zinc/46/64/87/1095466487.db2.gz PJNCTYXBTNSWTQ-LJQANCHMSA-N 2 0 318.461 3.147 20 10 DGCDRP COc1ccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c(O)c1 ZINC001222162020 1095469505 /nfs/dbraw/zinc/46/95/05/1095469505.db2.gz WJPCRXCFYYEXMQ-IBGZPJMESA-N 2 0 318.461 3.147 20 10 DGCDRP CC(C)(C)c1ccc(O)c(CN2CCC[C@@]3(CCC[NH2+]3)C2)c1 ZINC001222355735 1095570639 /nfs/dbraw/zinc/57/06/39/1095570639.db2.gz UPRXZFYFQMNFEL-IBGZPJMESA-N 2 0 302.462 3.408 20 10 DGCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322553600 1096729281 /nfs/dbraw/zinc/72/92/81/1096729281.db2.gz BPUNGLOXQYPGPE-IXIBIKRGSA-N 2 0 300.446 3.464 20 10 DGCDRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC001172358231 1097124049 /nfs/dbraw/zinc/12/40/49/1097124049.db2.gz GNUFUVNKJVLXPI-ZIFCJYIRSA-N 2 0 315.505 3.353 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H](N)[C@@H](F)CC2)c2ccccc21 ZINC001206167022 1097193075 /nfs/dbraw/zinc/19/30/75/1097193075.db2.gz WAQLGYHBIAZLGY-ZWKOTPCHSA-N 2 0 315.436 3.167 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3c(O)ccc4ccccc43)C[C@H]2C1 ZINC001231589329 1097785724 /nfs/dbraw/zinc/78/57/24/1097785724.db2.gz GMLNFKGSRNZSGR-IAGOWNOFSA-N 2 0 310.441 3.319 20 10 DGCDRP Cc1cccc(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1O ZINC001231591951 1097786910 /nfs/dbraw/zinc/78/69/10/1097786910.db2.gz DDFITOOVZJNTST-PMACEKPBSA-N 2 0 322.452 3.264 20 10 DGCDRP C[NH+](C)Cc1cc(F)cc(C[N@H+](C)Cc2ccccc2O)c1 ZINC001232149358 1097951318 /nfs/dbraw/zinc/95/13/18/1097951318.db2.gz NHVSSHPMPVFGQF-UHFFFAOYSA-N 2 0 302.393 3.225 20 10 DGCDRP C[N@@H+](Cc1cc(C(C)(C)C)ccc1O)CC1CC[NH+](C)CC1 ZINC001233286343 1098275639 /nfs/dbraw/zinc/27/56/39/1098275639.db2.gz PLORRRHFUBROFR-UHFFFAOYSA-N 2 0 304.478 3.463 20 10 DGCDRP Cc1ccc(C[NH+]2CCC3(CC2)C[NH2+]Cc2ccccc23)c(O)c1 ZINC001235094135 1098795720 /nfs/dbraw/zinc/79/57/20/1098795720.db2.gz LQPTWHKXIAIKQC-UHFFFAOYSA-N 2 0 322.452 3.338 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC3(CC[NH2+]C3)CC2)c2ccccc21 ZINC001235102948 1098802980 /nfs/dbraw/zinc/80/29/80/1098802980.db2.gz AMWYJIQPXKQYQM-UHFFFAOYSA-N 2 0 323.484 3.481 20 10 DGCDRP CC(C)(C)c1cccc(CN2CCCC[C@@]23CC[NH2+]C3)c1O ZINC001235118677 1098819079 /nfs/dbraw/zinc/81/90/79/1098819079.db2.gz GWDXXRDZCCQWJR-IBGZPJMESA-N 2 0 302.462 3.408 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@H]3F)c1 ZINC001235400226 1098995404 /nfs/dbraw/zinc/99/54/04/1098995404.db2.gz CRIYVJBBLBAXAM-MJGOQNOKSA-N 2 0 320.452 3.213 20 10 DGCDRP Cc1ccc(C)c(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1O ZINC001235428660 1099021906 /nfs/dbraw/zinc/02/19/06/1099021906.db2.gz OSGWSZSAGPOJDG-DLBZAZTESA-N 2 0 302.462 3.221 20 10 DGCDRP C[N@H+](CCCc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235670519 1099114688 /nfs/dbraw/zinc/11/46/88/1099114688.db2.gz UCOBLGJAKPWZFZ-UHFFFAOYSA-N 2 0 323.484 3.161 20 10 DGCDRP C[NH2+]CC1CC[NH+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001235680245 1099124193 /nfs/dbraw/zinc/12/41/93/1099124193.db2.gz SHDVMUGPKUXAKC-UHFFFAOYSA-N 2 0 310.441 3.491 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH+]1CCC(C2CC[NH2+]CC2)CC1 ZINC001235702357 1099136644 /nfs/dbraw/zinc/13/66/44/1099136644.db2.gz SWCAZLCMVNUWML-UHFFFAOYSA-N 2 0 308.853 3.257 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001235857426 1099218967 /nfs/dbraw/zinc/21/89/67/1099218967.db2.gz XETIXRWPLSXVKL-MOPGFXCFSA-N 2 0 313.489 3.108 20 10 DGCDRP Cc1cc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)c(C)n1-c1ccccc1 ZINC001235928543 1099265716 /nfs/dbraw/zinc/26/57/16/1099265716.db2.gz AGXYRZQOCFUJAN-HKUYNNGSSA-N 2 0 309.457 3.135 20 10 DGCDRP CC(C)(C)c1cc(O)c(C[N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)cc1Cl ZINC001235936106 1099269634 /nfs/dbraw/zinc/26/96/34/1099269634.db2.gz HTEBVWQSNUPRCT-TZMCWYRMSA-N 2 0 322.880 3.384 20 10 DGCDRP CCc1ccc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235959270 1099292193 /nfs/dbraw/zinc/29/21/93/1099292193.db2.gz FZGVYXCJIDDKJZ-UHFFFAOYSA-N 2 0 323.484 3.291 20 10 DGCDRP C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236071239 1099370500 /nfs/dbraw/zinc/37/05/00/1099370500.db2.gz HLMVPDIAMIJOTR-KRWDZBQOSA-N 2 0 321.468 3.043 20 10 DGCDRP Cc1ccc(O)c(C[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)c1 ZINC001236300793 1099523197 /nfs/dbraw/zinc/52/31/97/1099523197.db2.gz ZWMDDQSSWOIZAZ-UHFFFAOYSA-N 2 0 310.441 3.455 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH+]1CCCCCCCC1 ZINC001236308957 1099526467 /nfs/dbraw/zinc/52/64/67/1099526467.db2.gz YUZALJVZJMTDDM-UHFFFAOYSA-N 2 0 301.478 3.252 20 10 DGCDRP CN(C)c1ccc(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001236458043 1099622182 /nfs/dbraw/zinc/62/21/82/1099622182.db2.gz PVFODRXXIXYXQB-UHFFFAOYSA-N 2 0 303.494 3.353 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)cc1 ZINC001236598630 1099695962 /nfs/dbraw/zinc/69/59/62/1099695962.db2.gz LYGTWJVRXQPKEN-SFHVURJKSA-N 2 0 315.505 3.497 20 10 DGCDRP CC(C)c1ccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c(O)c1 ZINC001236601617 1099697702 /nfs/dbraw/zinc/69/77/02/1099697702.db2.gz NRAYWXZZDCHRIM-OAHLLOKOSA-N 2 0 302.462 3.480 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)CC1CC1 ZINC001236929228 1099880093 /nfs/dbraw/zinc/88/00/93/1099880093.db2.gz BORCDEDGUIOMSA-UHFFFAOYSA-N 2 0 319.468 3.200 20 10 DGCDRP C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236939676 1099882272 /nfs/dbraw/zinc/88/22/72/1099882272.db2.gz UCWBWXHQKIBNIK-JKSUJKDBSA-N 2 0 319.468 3.198 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCCCCCC3)c(F)c2)CC1 ZINC001236938144 1099883165 /nfs/dbraw/zinc/88/31/65/1099883165.db2.gz KDAXSYYNZSDKTQ-UHFFFAOYSA-N 2 0 319.468 3.344 20 10 DGCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(C(C)C)cc3O)C[C@@H]2C1 ZINC001237054502 1099947697 /nfs/dbraw/zinc/94/76/97/1099947697.db2.gz ARDYDGIPYPMJPA-HDICACEKSA-N 2 0 302.462 3.289 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@](C)(C[NH3+])C2)c2ccccc21 ZINC001237059222 1099951431 /nfs/dbraw/zinc/95/14/31/1099951431.db2.gz RULALKAHADYJQR-HXUWFJFHSA-N 2 0 311.473 3.467 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c1O ZINC001205780967 1101353753 /nfs/dbraw/zinc/35/37/53/1101353753.db2.gz ULOUVDCBPKGLHX-CYBMUJFWSA-N 2 0 312.404 3.106 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201947406 1102767417 /nfs/dbraw/zinc/76/74/17/1102767417.db2.gz XUVGCJNACXVNIA-QAPCUYQASA-N 2 0 314.473 3.364 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)C3CCC3)cc2)CC1 ZINC001202435397 1102987282 /nfs/dbraw/zinc/98/72/82/1102987282.db2.gz JLAANZRJZWWRKK-UHFFFAOYSA-N 2 0 315.505 3.354 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H](C)C[NH2+]C)c1ccc(C(F)(F)F)cc1O ZINC001326474175 1103331888 /nfs/dbraw/zinc/33/18/88/1103331888.db2.gz TYYIPEGPXJPJNE-ZWNOBZJWSA-N 2 0 304.356 3.307 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC001327004275 1103497753 /nfs/dbraw/zinc/49/77/53/1103497753.db2.gz JPAGMBLRWWTSTL-LJQANCHMSA-N 2 0 313.489 3.108 20 10 DGCDRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1C ZINC001246174304 1104420800 /nfs/dbraw/zinc/42/08/00/1104420800.db2.gz OHAKAKMESFOLER-JFIYKMOQSA-N 2 0 301.478 3.011 20 10 DGCDRP c1cc(C[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)cc2c1OCC2 ZINC001246199224 1104434480 /nfs/dbraw/zinc/43/44/80/1104434480.db2.gz KWSIEQZSLLRSMD-KRWDZBQOSA-N 2 0 300.446 3.166 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001246312411 1104484061 /nfs/dbraw/zinc/48/40/61/1104484061.db2.gz RGESGXPKAVZXKG-UHFFFAOYSA-N 2 0 301.478 3.155 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC001246517946 1104574627 /nfs/dbraw/zinc/57/46/27/1104574627.db2.gz BZCJRQMOJAWCIC-KBXCAEBGSA-N 2 0 302.462 3.364 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC001246523383 1104578323 /nfs/dbraw/zinc/57/83/23/1104578323.db2.gz GXGKQTUPBQBBHR-DEYYWGMASA-N 2 0 302.462 3.363 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CC[N@H+](C)C3)CC2)cc1 ZINC001275833173 1104926155 /nfs/dbraw/zinc/92/61/55/1104926155.db2.gz ATQZJLSMGCEFRX-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC3(CC[N@H+](C)C3)CC2)c(Cl)c1 ZINC001276156422 1105033087 /nfs/dbraw/zinc/03/30/87/1105033087.db2.gz SDYGAONAXUTIQX-UHFFFAOYSA-N 2 0 321.896 3.324 20 10 DGCDRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(N(C)C)cc1 ZINC001256853762 1106498258 /nfs/dbraw/zinc/49/82/58/1106498258.db2.gz QRRWHDLEXOQTQY-INIZCTEOSA-N 2 0 324.472 3.467 20 10 DGCDRP C[C@H]1CC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H](C)C1 ZINC001258152227 1106681656 /nfs/dbraw/zinc/68/16/56/1106681656.db2.gz UDJYCEYDZUHCFH-IAGOWNOFSA-N 2 0 315.505 3.353 20 10 DGCDRP CC[C@@H]([NH2+]CC[C@H](C)[NH2+]C)c1cc(Br)ccc1O ZINC001261424271 1107427861 /nfs/dbraw/zinc/42/78/61/1107427861.db2.gz QIVAIWKJANNZLA-GXFFZTMASA-N 2 0 315.255 3.193 20 10 DGCDRP C[C@H]1CCCC[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308237743 1111402759 /nfs/dbraw/zinc/40/27/59/1111402759.db2.gz QQZRPIYWKRBMBS-HKUYNNGSSA-N 2 0 315.505 3.354 20 10 DGCDRP COc1cccc(C[NH2+]CCC[N@H+](C)C2CCCCC2)c1O ZINC000069953129 431232889 /nfs/dbraw/zinc/23/28/89/431232889.db2.gz QJGJDFQXXWZSLO-UHFFFAOYSA-N 2 0 306.450 3.145 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000093683801 431918011 /nfs/dbraw/zinc/91/80/11/431918011.db2.gz ITGHMGFQCNJGEB-INIZCTEOSA-N 2 0 318.461 3.099 20 10 DGCDRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N(C)C)cc1 ZINC000152430539 432331575 /nfs/dbraw/zinc/33/15/75/432331575.db2.gz YDUAXUQRACYFKK-KXBFYZLASA-N 2 0 301.478 3.278 20 10 DGCDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000296954257 432942919 /nfs/dbraw/zinc/94/29/19/432942919.db2.gz QWOXWCUVQFUNJB-NVXWUHKLSA-N 2 0 302.462 3.337 20 10 DGCDRP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)c1cc(Br)ccc1O ZINC000293759973 433860067 /nfs/dbraw/zinc/86/00/67/433860067.db2.gz RZSGMAYRMHFULJ-WDEREUQCSA-N 2 0 315.255 3.003 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)cc1F ZINC000740003896 574917964 /nfs/dbraw/zinc/91/79/64/574917964.db2.gz ASJXOEBTNIMMLX-INIZCTEOSA-N 2 0 321.484 3.493 20 10 DGCDRP CCOc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000853093140 620667368 /nfs/dbraw/zinc/66/73/68/620667368.db2.gz DMTUNGDMHHJGOZ-INIZCTEOSA-N 2 0 318.461 3.003 20 10 DGCDRP CC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(C(F)(F)F)cc1O ZINC000902485524 619645839 /nfs/dbraw/zinc/64/58/39/619645839.db2.gz LPTGNVDEPRVTFJ-GAFUQQFSSA-N 2 0 302.340 3.189 20 10 DGCDRP Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])c1O ZINC000817977873 620897323 /nfs/dbraw/zinc/89/73/23/620897323.db2.gz QWDZLAWUDXIJAQ-WDEREUQCSA-N 2 0 315.255 3.241 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)ccc1N(C)C ZINC000923365135 621179048 /nfs/dbraw/zinc/17/90/48/621179048.db2.gz UALFGMBVYOKIOP-HKUYNNGSSA-N 2 0 301.478 3.025 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756639786 621655192 /nfs/dbraw/zinc/65/51/92/621655192.db2.gz FAIHJBLLEOFNCT-UMVBOHGHSA-N 2 0 324.440 3.026 20 10 DGCDRP C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000763646148 622156625 /nfs/dbraw/zinc/15/66/25/622156625.db2.gz JDQUYBFLKUTLNT-QGZVFWFLSA-N 2 0 313.489 3.203 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000122659122 622376908 /nfs/dbraw/zinc/37/69/08/622376908.db2.gz ZVVJACCLXZTXER-UHFFFAOYSA-N 2 0 303.494 3.271 20 10 DGCDRP CCC[N@H+](C)C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506119 622535517 /nfs/dbraw/zinc/53/55/17/622535517.db2.gz ATVQBAWNTNGSMX-INIZCTEOSA-N 2 0 307.457 3.055 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC000770350970 622623274 /nfs/dbraw/zinc/62/32/74/622623274.db2.gz HJPYXURMEHTWAI-ICSRJNTNSA-N 2 0 315.505 3.449 20 10 DGCDRP CCOCc1cc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)ccc1OC ZINC000872251471 622867435 /nfs/dbraw/zinc/86/74/35/622867435.db2.gz JKEYNDCUBUCJMA-KRWDZBQOSA-N 2 0 320.477 3.100 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)cc1 ZINC000773757061 623069048 /nfs/dbraw/zinc/06/90/48/623069048.db2.gz YIFRJURBCFGZNN-APWZRJJASA-N 2 0 303.494 3.447 20 10 DGCDRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(F)ccc1O ZINC000873234816 623085886 /nfs/dbraw/zinc/08/58/86/623085886.db2.gz FZIUZSDGNFUWQS-GFCCVEGCSA-N 2 0 300.377 3.028 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]4CCC[C@@H]43)cc2)CC1 ZINC000775660242 623307502 /nfs/dbraw/zinc/30/75/02/623307502.db2.gz BAGCJBDZDROWFW-ICSRJNTNSA-N 2 0 313.489 3.203 20 10 DGCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](C)C(C)C ZINC000775663386 623308363 /nfs/dbraw/zinc/30/83/63/623308363.db2.gz AELYGXVGXQWWSI-KRWDZBQOSA-N 2 0 303.494 3.305 20 10 DGCDRP CC[C@H](C)C[N@H+](CC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775732575 623321277 /nfs/dbraw/zinc/32/12/77/623321277.db2.gz OYTNKJVBAKRNNM-KRWDZBQOSA-N 2 0 303.494 3.306 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1F ZINC000779986530 623845528 /nfs/dbraw/zinc/84/55/28/623845528.db2.gz PQCLVPWCRULCMY-UHFFFAOYSA-N 2 0 321.484 3.493 20 10 DGCDRP C[C@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000783266080 624333052 /nfs/dbraw/zinc/33/30/52/624333052.db2.gz NEBHHIUZQXTYQE-JXFKEZNVSA-N 2 0 313.489 3.107 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)cc1 ZINC000878868000 624376857 /nfs/dbraw/zinc/37/68/57/624376857.db2.gz ZRPDHHKKAZYSGS-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP CCCN(CCC)c1ccc(C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)cc1 ZINC000787304316 624998462 /nfs/dbraw/zinc/99/84/62/624998462.db2.gz KFIVOTLEUAPUJJ-KDURUIRLSA-N 2 0 315.505 3.306 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000809767352 626949106 /nfs/dbraw/zinc/94/91/06/626949106.db2.gz INHYXCFYTYQDRW-ICSRJNTNSA-N 2 0 315.505 3.449 20 10 DGCDRP CC[C@@H]([NH2+]CCC[NH+](C)C)c1ccc(C(F)(F)F)cc1O ZINC000810208567 626988388 /nfs/dbraw/zinc/98/83/88/626988388.db2.gz WLYMYJQEEYQKNZ-CYBMUJFWSA-N 2 0 304.356 3.403 20 10 DGCDRP Cc1ccccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000107797411 627546033 /nfs/dbraw/zinc/54/60/33/627546033.db2.gz JUNBOBRKOAOOHF-UHFFFAOYSA-N 2 0 309.457 3.037 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)cc1 ZINC000814178503 627547340 /nfs/dbraw/zinc/54/73/40/627547340.db2.gz SKQKYFKBJFETDF-IBGZPJMESA-N 2 0 301.478 3.060 20 10 DGCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815057582 627620774 /nfs/dbraw/zinc/62/07/74/627620774.db2.gz UWKHDVOAGLHFAI-GOSISDBHSA-N 2 0 303.494 3.225 20 10 DGCDRP CCOc1ccc(C[NH2+]CCCCC[NH+]2CCCC2)c(O)c1 ZINC000815151409 627638261 /nfs/dbraw/zinc/63/82/61/627638261.db2.gz NYIYSCXMUZQMGW-UHFFFAOYSA-N 2 0 306.450 3.147 20 10 DGCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cc(Cl)ccc1O ZINC000925777871 627793653 /nfs/dbraw/zinc/79/36/53/627793653.db2.gz RGYSPTAYRLMUKL-GWCFXTLKSA-N 2 0 318.795 3.331 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000925793429 627796636 /nfs/dbraw/zinc/79/66/36/627796636.db2.gz YQYZXMWTMORQJB-NUJGCVRESA-N 2 0 301.478 3.183 20 10 DGCDRP CC[NH2+]CCC[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC000817943424 627969599 /nfs/dbraw/zinc/96/95/99/627969599.db2.gz NDXYFJJXAOJSPN-NSHDSACASA-N 2 0 315.255 3.113 20 10 DGCDRP CC[C@@H]([NH2+]C[C@@H]([NH3+])C(C)C)c1ccc(C(F)(F)F)cc1O ZINC000817957525 627975128 /nfs/dbraw/zinc/97/51/28/627975128.db2.gz CNMDXVMRPLRFFN-CHWSQXEVSA-N 2 0 304.356 3.435 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cc(Br)ccc1O ZINC000817969935 627978888 /nfs/dbraw/zinc/97/88/88/627978888.db2.gz IIRDXIYOESZZKS-ZMLRMANQSA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCC2)cc1 ZINC000817976366 627980901 /nfs/dbraw/zinc/98/09/01/627980901.db2.gz KRVAEWKAZOTSGJ-LPHOPBHVSA-N 2 0 313.489 3.470 20 10 DGCDRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCC2)cc1 ZINC000817976365 627981031 /nfs/dbraw/zinc/98/10/31/627981031.db2.gz KRVAEWKAZOTSGJ-APWZRJJASA-N 2 0 313.489 3.470 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC(CC[NH+](C)C)CC2)cc1 ZINC000835027411 629829048 /nfs/dbraw/zinc/82/90/48/629829048.db2.gz LXWSTTWNOKMYSZ-AATRIKPKSA-N 2 0 315.505 3.430 20 10 DGCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835034566 629830398 /nfs/dbraw/zinc/83/03/98/629830398.db2.gz BLNSVELDHAVOJA-XFHJGTJQSA-N 2 0 301.478 3.087 20 10 DGCDRP CC[NH+]1CCC(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835039065 629830984 /nfs/dbraw/zinc/83/09/84/629830984.db2.gz WFYZWIABRWCXCA-WAYWQWQTSA-N 2 0 301.478 3.087 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000840916231 630378422 /nfs/dbraw/zinc/37/84/22/630378422.db2.gz HZNZKGKOIQEKBD-SFHVURJKSA-N 2 0 315.505 3.225 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c(Cl)c1 ZINC000840920408 630378986 /nfs/dbraw/zinc/37/89/86/630378986.db2.gz GPUNFPSDPNUNJO-XJKSGUPXSA-N 2 0 308.853 3.270 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000840932385 630380112 /nfs/dbraw/zinc/38/01/12/630380112.db2.gz PXGHSDVMIUPFNL-QGZVFWFLSA-N 2 0 303.494 3.271 20 10 DGCDRP C[C@@H]1C[C@@H](C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH2+]1 ZINC000841003263 630394550 /nfs/dbraw/zinc/39/45/50/630394550.db2.gz PDVJFGZHKCAUQH-MJGOQNOKSA-N 2 0 315.505 3.497 20 10 DGCDRP CCOc1ccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c(O)c1 ZINC000841029340 630397785 /nfs/dbraw/zinc/39/77/85/630397785.db2.gz PYFRVIUXORGVQG-ZDUSSCGKSA-N 2 0 300.402 3.100 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000841032997 630399403 /nfs/dbraw/zinc/39/94/03/630399403.db2.gz ILHMIPBSORROTL-ARJAWSKDSA-N 2 0 309.457 3.057 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c1O ZINC000841086053 630405941 /nfs/dbraw/zinc/40/59/41/630405941.db2.gz GCUMAVLJSYCPOA-DOMZBBRYSA-N 2 0 324.852 3.018 20 10 DGCDRP [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000843045345 630607447 /nfs/dbraw/zinc/60/74/47/630607447.db2.gz NUUXCWMCAZCCRE-FZMZJTMJSA-N 2 0 312.816 3.149 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC([C@H](C)[NH3+])CC2)cc1F ZINC000843052926 630608676 /nfs/dbraw/zinc/60/86/76/630608676.db2.gz OZMYFQHVRAYYML-AWEZNQCLSA-N 2 0 307.457 3.231 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000843123699 630616073 /nfs/dbraw/zinc/61/60/73/630616073.db2.gz NSAXQRWZHXONPF-HXUWFJFHSA-N 2 0 313.489 3.252 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126755 630616708 /nfs/dbraw/zinc/61/67/08/630616708.db2.gz MNOKTBBZQMJAGH-PKOBYXMFSA-N 2 0 315.505 3.273 20 10 DGCDRP C[C@H]([NH2+]CCCCCC[NH3+])c1ccc(Br)cc1O ZINC000843342097 630647716 /nfs/dbraw/zinc/64/77/16/630647716.db2.gz NINZAPSFJVKXJF-NSHDSACASA-N 2 0 315.255 3.324 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)cc1 ZINC000844902458 630972875 /nfs/dbraw/zinc/97/28/75/630972875.db2.gz NABXVOOTPUMDRG-HKUYNNGSSA-N 2 0 301.478 3.094 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)c1O ZINC000846167510 631213216 /nfs/dbraw/zinc/21/32/16/631213216.db2.gz ZCMCMRMMYSKBMJ-CQSZACIVSA-N 2 0 306.450 3.173 20 10 DGCDRP CCOc1ccc(O)c(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c1 ZINC000849350286 631900241 /nfs/dbraw/zinc/90/02/41/631900241.db2.gz NATBSVHKRDRUJF-INIZCTEOSA-N 2 0 318.461 3.003 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C3CC3)C3CC3)cc2)CC1 ZINC000850399100 632138945 /nfs/dbraw/zinc/13/89/45/632138945.db2.gz VLCILWRAYTUOMO-UHFFFAOYSA-N 2 0 313.489 3.107 20 10 DGCDRP C[C@]1(C[NH2+]Cc2ccccc2O)CC[N@H+](Cc2ccccc2)C1 ZINC000309702077 656116142 /nfs/dbraw/zinc/11/61/42/656116142.db2.gz GMWKUDZUZGXKLJ-HXUWFJFHSA-N 2 0 310.441 3.394 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000164392142 658930432 /nfs/dbraw/zinc/93/04/32/658930432.db2.gz LOSPKDPJDFBOEZ-CQSZACIVSA-N 2 0 320.477 3.082 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH2+]CC[C@@H]1CCC[NH2+]CC1 ZINC001580887735 1192044136 /nfs/dbraw/zinc/04/41/36/1192044136.db2.gz GKFSWVWBTSHOIN-QGZVFWFLSA-N 2 0 301.478 3.156 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC001332422431 1178442301 /nfs/dbraw/zinc/44/23/01/1178442301.db2.gz WBAVKAPIYWNFEP-NPNMTCQASA-N 2 0 300.446 3.371 20 10 DGCDRP CCc1cccc(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)c1O ZINC001343286647 1179252423 /nfs/dbraw/zinc/25/24/23/1179252423.db2.gz QAVCKPFHRVTHMM-UHFFFAOYSA-N 2 0 302.462 3.451 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)c1 ZINC001356057025 1181133471 /nfs/dbraw/zinc/13/34/71/1181133471.db2.gz LCIQFEAHTVFNBO-LZLYRXPVSA-N 2 0 302.462 3.171 20 10 DGCDRP C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C ZINC001461002475 1182753502 /nfs/dbraw/zinc/75/35/02/1182753502.db2.gz WPPMLXIYQUWLKZ-HLIPFELVSA-N 2 0 315.505 3.353 20 10 DGCDRP CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001474013215 1183849762 /nfs/dbraw/zinc/84/97/62/1183849762.db2.gz DPFPNOOJXKZFGC-HKUYNNGSSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(C)cc(OC)cc2O)C[C@H]1C ZINC001560636403 1189352246 /nfs/dbraw/zinc/35/22/46/1189352246.db2.gz FNPHRTZWYQRNFJ-CABCVRRESA-N 2 0 306.450 3.014 20 10 DGCDRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3ccc(N4CCCCC4)cc3)[C@H]2C1 ZINC001621108432 1193803606 /nfs/dbraw/zinc/80/36/06/1193803606.db2.gz OVMKARWJIQQMTL-IHPCNDPISA-N 2 0 313.489 3.107 20 10 DGCDRP C[C@H](CC(C)(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001656383041 1196034128 /nfs/dbraw/zinc/03/41/28/1196034128.db2.gz QZZFDSUMJOUVME-MRXNPFEDSA-N 2 0 303.494 3.353 20 10 DGCDRP C[C@@H]([NH2+]Cc1cc(F)ccc1O)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001658822074 1196304954 /nfs/dbraw/zinc/30/49/54/1196304954.db2.gz GYUGWCIURQFMGR-KGLIPLIRSA-N 2 0 306.425 3.274 20 10 DGCDRP C[NH+](C)CC1(C[NH2+]Cc2ccc3c(c2)CCCO3)CCCC1 ZINC001662173407 1196690251 /nfs/dbraw/zinc/69/02/51/1196690251.db2.gz JOYYJNCMSYIZIE-UHFFFAOYSA-N 2 0 302.462 3.223 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3(CC4CC4)CC3)cc2)CC1 ZINC001663165011 1196802540 /nfs/dbraw/zinc/80/25/40/1196802540.db2.gz JPJGYYNNPHNUHP-UHFFFAOYSA-N 2 0 313.489 3.108 20 10 DGCDRP COc1cc(C)c(C[NH2+]CC[C@H](C)[NH+]2CCCCC2)c(O)c1 ZINC001664270310 1196985375 /nfs/dbraw/zinc/98/53/75/1196985375.db2.gz QQCNVBXNTAKEFC-HNNXBMFYSA-N 2 0 306.450 3.063 20 10 DGCDRP CCC1([NH+]2CCC2)CC[NH+](Cc2c(C)cc(OC)cc2O)CC1 ZINC001665682903 1197171007 /nfs/dbraw/zinc/17/10/07/1197171007.db2.gz LXWCIJNNXDTJCK-UHFFFAOYSA-N 2 0 318.461 3.160 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)Cc2ccccc21 ZINC001205164956 1091116661 /nfs/dbraw/zinc/11/66/61/1091116661.db2.gz YCGGARDOQRMFDJ-KRWDZBQOSA-N 2 0 321.468 3.216 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)CC[C@@H]1C[NH3+] ZINC001205625964 1091287171 /nfs/dbraw/zinc/28/71/71/1091287171.db2.gz DAOWPOLOGIBUBR-LSDHHAIUSA-N 2 0 304.478 3.497 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c(O)c1 ZINC001205627406 1091287189 /nfs/dbraw/zinc/28/71/89/1091287189.db2.gz PIDHDNYEJWLQKQ-HOTGVXAUSA-N 2 0 319.493 3.045 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)cc1 ZINC001205991479 1091440299 /nfs/dbraw/zinc/44/02/99/1091440299.db2.gz BAOLFNIEIWFNHQ-FUHWJXTLSA-N 2 0 303.494 3.340 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCC[C@@H]1C[NH3+] ZINC001205993489 1091440328 /nfs/dbraw/zinc/44/03/28/1091440328.db2.gz HUGBBOXACYZIFG-SJLPKXTDSA-N 2 0 301.478 3.094 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@H](C)CC2)cc(C[NH+](C)C)c1O ZINC001139254595 1091501505 /nfs/dbraw/zinc/50/15/05/1091501505.db2.gz JBHCVKCUOSIZCV-AWEZNQCLSA-N 2 0 306.450 3.084 20 10 DGCDRP COc1cc(C[N@@H+]2CCC3(CCCC3)C2)cc(C[NH+](C)C)c1O ZINC001139256755 1091502608 /nfs/dbraw/zinc/50/26/08/1091502608.db2.gz JNEYJSZRPOTRIZ-UHFFFAOYSA-N 2 0 318.461 3.229 20 10 DGCDRP CCC[N@@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)CC1CC1 ZINC001139253144 1091502631 /nfs/dbraw/zinc/50/26/31/1091502631.db2.gz NJODECWPZBREFH-UHFFFAOYSA-N 2 0 306.450 3.084 20 10 DGCDRP C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139409911 1091552166 /nfs/dbraw/zinc/55/21/66/1091552166.db2.gz UZMWGBNKBAFOHV-DLBZAZTESA-N 2 0 301.478 3.059 20 10 DGCDRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001206324764 1091579053 /nfs/dbraw/zinc/57/90/53/1091579053.db2.gz DEIXZRGAJIGSSN-HNNXBMFYSA-N 2 0 300.805 3.136 20 10 DGCDRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001206541889 1091662531 /nfs/dbraw/zinc/66/25/31/1091662531.db2.gz MPZUGKFFDSHOED-LJQANCHMSA-N 2 0 301.478 3.238 20 10 DGCDRP [NH3+]C[C@@H]1CCCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001206615545 1091689953 /nfs/dbraw/zinc/68/99/53/1091689953.db2.gz IAPLBNQCSXUPHV-SFHVURJKSA-N 2 0 301.478 3.238 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC001140300449 1091818517 /nfs/dbraw/zinc/81/85/17/1091818517.db2.gz QAJHTTRYOPPHEK-KRWDZBQOSA-N 2 0 301.478 3.060 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@H](F)C3)cc2)CC1 ZINC001140302133 1091820257 /nfs/dbraw/zinc/82/02/57/1091820257.db2.gz KXTYVVQJLGTFEX-GOSISDBHSA-N 2 0 319.468 3.153 20 10 DGCDRP C[N@H+](CCC1CC[NH+](C)CC1)Cc1ccc(N2CCCC2)cc1 ZINC001207483684 1091983061 /nfs/dbraw/zinc/98/30/61/1091983061.db2.gz HGRQFXIAPOJEEP-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)c(Cl)c1 ZINC001140924598 1092065524 /nfs/dbraw/zinc/06/55/24/1092065524.db2.gz RHNCYLWIQXMNLG-UHFFFAOYSA-N 2 0 309.885 3.180 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)c(Cl)c1 ZINC001140925082 1092065600 /nfs/dbraw/zinc/06/56/00/1092065600.db2.gz ZFVFORHVNSSOTM-UHFFFAOYSA-N 2 0 309.885 3.180 20 10 DGCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1CC[NH+](CC)CC1 ZINC001208602528 1092422415 /nfs/dbraw/zinc/42/24/15/1092422415.db2.gz GXWBIVJDLOJRSK-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc(N3CCCC3)cc2)c(F)c1 ZINC001118294315 1095976785 /nfs/dbraw/zinc/97/67/85/1095976785.db2.gz BIFTWBIHQULUDD-UHFFFAOYSA-N 2 0 313.420 3.174 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001119032634 1096123107 /nfs/dbraw/zinc/12/31/07/1096123107.db2.gz YNSBEFSADJTBIL-IBEHDNSVSA-N 2 0 300.446 3.369 20 10 DGCDRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc3c(c2)CCO3)CC1(C)C ZINC001171621051 1096936230 /nfs/dbraw/zinc/93/62/30/1096936230.db2.gz HEKIFJSNDMDBGX-UHFFFAOYSA-N 2 0 302.462 3.363 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)C[C@H]2C1 ZINC001231883573 1097879333 /nfs/dbraw/zinc/87/93/33/1097879333.db2.gz PWSRUNCPMYGSLY-QZTJIDSGSA-N 2 0 310.441 3.319 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC3(CC[NH2+]CC3)CC2)cc1Cl ZINC001235134116 1098829951 /nfs/dbraw/zinc/82/99/51/1098829951.db2.gz ZZYJMYFNAWMZOK-UHFFFAOYSA-N 2 0 308.853 3.320 20 10 DGCDRP CCc1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235423900 1099015981 /nfs/dbraw/zinc/01/59/81/1099015981.db2.gz GYGDGBMOFCYVLX-IRXDYDNUSA-N 2 0 302.462 3.166 20 10 DGCDRP CN1CCC[C@@H]2C[N@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]21 ZINC001235678085 1099119321 /nfs/dbraw/zinc/11/93/21/1099119321.db2.gz ADYPRGVBONWUPI-RHSMWYFYSA-N 2 0 302.462 3.216 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)CCC2CC[NH2+]CC2)c(Cl)c1 ZINC001235716962 1099144394 /nfs/dbraw/zinc/14/43/94/1099144394.db2.gz PFMXQGJHRIXLQB-UHFFFAOYSA-N 2 0 309.885 3.228 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)cc1 ZINC001235928612 1099265245 /nfs/dbraw/zinc/26/52/45/1099265245.db2.gz BCWLVAGFOVWCQI-OALUTQOASA-N 2 0 309.457 3.135 20 10 DGCDRP CN(C)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c2ccccc21 ZINC001235958274 1099289850 /nfs/dbraw/zinc/28/98/50/1099289850.db2.gz CHWWKHOVMUPGRP-CWPLJXCYSA-N 2 0 309.457 3.075 20 10 DGCDRP C[C@H]1C[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)CCC[NH2+]1 ZINC001236100094 1099387978 /nfs/dbraw/zinc/38/79/78/1099387978.db2.gz DDMRJBYCNHHXGD-AWEZNQCLSA-N 2 0 314.404 3.382 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1 ZINC001236321655 1099535795 /nfs/dbraw/zinc/53/57/95/1099535795.db2.gz VBLODGMIWWAFPL-GASCZTMLSA-N 2 0 302.462 3.121 20 10 DGCDRP Cc1cccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1O ZINC001236374487 1099560721 /nfs/dbraw/zinc/56/07/21/1099560721.db2.gz DBQHAXRYOFRJNB-INIZCTEOSA-N 2 0 302.462 3.445 20 10 DGCDRP Cc1cc(C[N@H+](C2CCC2)C2CC[NH2+]CC2)ccc1N(C)C ZINC001236633665 1099715439 /nfs/dbraw/zinc/71/54/39/1099715439.db2.gz JOERTMMDTLVXAK-UHFFFAOYSA-N 2 0 301.478 3.168 20 10 DGCDRP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c(C)n1-c1ccccc1 ZINC001236820363 1099806631 /nfs/dbraw/zinc/80/66/31/1099806631.db2.gz RDQXDHZHGYSXJF-VDGAXYAQSA-N 2 0 309.457 3.263 20 10 DGCDRP C[C@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236932421 1099883454 /nfs/dbraw/zinc/88/34/54/1099883454.db2.gz OPSSRIRJWITXHX-INIZCTEOSA-N 2 0 319.468 3.200 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3ccc(C(C)C)cc3O)C[C@@H]2C1 ZINC001237054504 1099946495 /nfs/dbraw/zinc/94/64/95/1099946495.db2.gz ARDYDGIPYPMJPA-ROUUACIJSA-N 2 0 302.462 3.289 20 10 DGCDRP CC[N@H+](Cc1cc(C(F)(F)F)ccc1O)C1CCN(C)CC1 ZINC001237139733 1099989224 /nfs/dbraw/zinc/98/92/24/1099989224.db2.gz OILOOLRGQYCLBW-UHFFFAOYSA-N 2 0 316.367 3.327 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC001237386761 1100102825 /nfs/dbraw/zinc/10/28/25/1100102825.db2.gz AFZKSIAWZYIISU-UYAOXDASSA-N 2 0 313.489 3.251 20 10 DGCDRP CC[C@H]([NH2+]CC[C@H](C)[NH2+]C)c1ccc(C(F)(F)F)cc1O ZINC001326037080 1103188642 /nfs/dbraw/zinc/18/86/42/1103188642.db2.gz VRKHMTMTANBJCL-GWCFXTLKSA-N 2 0 304.356 3.450 20 10 DGCDRP CC[C@@H]([NH2+]C[C@@H](C)C[NH2+]C)c1ccc(C(F)(F)F)cc1O ZINC001326474173 1103331454 /nfs/dbraw/zinc/33/14/54/1103331454.db2.gz TYYIPEGPXJPJNE-GXFFZTMASA-N 2 0 304.356 3.307 20 10 DGCDRP C[C@H]1CC([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H](C)C1 ZINC001246172265 1104419134 /nfs/dbraw/zinc/41/91/34/1104419134.db2.gz HINDZYWEGGSYAV-HZPDHXFCSA-N 2 0 301.478 3.011 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CC(C)(C)C1 ZINC001246172964 1104420579 /nfs/dbraw/zinc/42/05/79/1104420579.db2.gz JBZAHMKSKODDGH-SJLPKXTDSA-N 2 0 315.505 3.401 20 10 DGCDRP CCCC[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)CC[NH2+]1 ZINC001246902304 1104728211 /nfs/dbraw/zinc/72/82/11/1104728211.db2.gz RBNMWMLQLUHKLB-MJGOQNOKSA-N 2 0 303.494 3.495 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001246902750 1104728617 /nfs/dbraw/zinc/72/86/17/1104728617.db2.gz UHNRDLXRYGCILO-RBUKOAKNSA-N 2 0 301.478 3.107 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001246902751 1104728797 /nfs/dbraw/zinc/72/87/97/1104728797.db2.gz UHNRDLXRYGCILO-RTBURBONSA-N 2 0 301.478 3.107 20 10 DGCDRP C[N@@H+]1CCC2(C1)CC[NH+](Cc1c(O)ccc3ccccc31)CC2 ZINC001276078305 1105009439 /nfs/dbraw/zinc/00/94/39/1105009439.db2.gz MXYZFFMSDSWGEF-UHFFFAOYSA-N 2 0 310.441 3.463 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001256629718 1106456671 /nfs/dbraw/zinc/45/66/71/1106456671.db2.gz QOKVQZIHLCQZCX-DFNIBXOVSA-N 2 0 301.478 3.200 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCC2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001256628271 1106456819 /nfs/dbraw/zinc/45/68/19/1106456819.db2.gz YSKDZHZCLOARRS-YOFSQIOKSA-N 2 0 313.489 3.344 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCCC[C@H]2[C@H](C[NH3+])Cc2ccccc2)cc1 ZINC001262487926 1107719195 /nfs/dbraw/zinc/71/91/95/1107719195.db2.gz KFDJZOQTUDSKQA-FPOVZHCZSA-N 2 0 323.484 3.441 20 10 DGCDRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](C)C1 ZINC001308269414 1111408564 /nfs/dbraw/zinc/40/85/64/1111408564.db2.gz QWYSNUVFQGYKMK-UWVAXJGDSA-N 2 0 315.505 3.353 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000284297115 131067895 /nfs/dbraw/zinc/06/78/95/131067895.db2.gz YKELALAXAUHOJN-JKSUJKDBSA-N 2 0 308.466 3.016 20 10 DGCDRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000271177721 432345635 /nfs/dbraw/zinc/34/56/35/432345635.db2.gz KSSSFMUQZYDWEB-INIZCTEOSA-N 2 0 310.441 3.443 20 10 DGCDRP Cc1ccc(O)c(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000192933483 432430137 /nfs/dbraw/zinc/43/01/37/432430137.db2.gz PEBPHFNYIUOLCV-SFHVURJKSA-N 2 0 310.441 3.312 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)c1 ZINC000184972786 432450822 /nfs/dbraw/zinc/45/08/22/432450822.db2.gz CQPGXPNMJANHNZ-CQSZACIVSA-N 2 0 306.450 3.172 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc2c(cc1O)CCCC2 ZINC000184997658 432453497 /nfs/dbraw/zinc/45/34/97/432453497.db2.gz VMYULVXJILNGIL-CABCVRRESA-N 2 0 314.473 3.406 20 10 DGCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000185059855 432461868 /nfs/dbraw/zinc/46/18/68/432461868.db2.gz GWDWINPSXOSFOZ-GJZGRUSLSA-N 2 0 302.462 3.263 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c1 ZINC000194190397 432531453 /nfs/dbraw/zinc/53/14/53/432531453.db2.gz ACCLFSRANQPSLA-HUUCEWRRSA-N 2 0 306.450 3.173 20 10 DGCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CCC[NH+](C)C)c1O ZINC000186913408 432637128 /nfs/dbraw/zinc/63/71/28/432637128.db2.gz ZRSDTFJRLLLZSD-NSHDSACASA-N 2 0 315.255 3.065 20 10 DGCDRP CN(C)c1ccc(C[NH2+]CCCC[NH+](C)C)c(C(F)(F)F)c1 ZINC000279868485 432997789 /nfs/dbraw/zinc/99/77/89/432997789.db2.gz JJZQYTFOTCIDHE-UHFFFAOYSA-N 2 0 317.399 3.203 20 10 DGCDRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000295828952 434440508 /nfs/dbraw/zinc/44/05/08/434440508.db2.gz DUXTXSUYVVCXKO-NVXWUHKLSA-N 2 0 302.462 3.481 20 10 DGCDRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000177974461 546125203 /nfs/dbraw/zinc/12/52/03/546125203.db2.gz JPAVXLSUMFIYAD-GJYPPUQNSA-N 2 0 301.478 3.105 20 10 DGCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000743393382 575049253 /nfs/dbraw/zinc/04/92/53/575049253.db2.gz POWXQBOPHKAMDT-OAHLLOKOSA-N 2 0 302.462 3.045 20 10 DGCDRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(F)cc(C(C)=O)c2O)C[C@@H]1C ZINC000750827076 575754158 /nfs/dbraw/zinc/75/41/58/575754158.db2.gz VJTVNYCWBRCLNJ-LRDDRELGSA-N 2 0 322.424 3.039 20 10 DGCDRP Oc1cccc(Cl)c1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093304 620667569 /nfs/dbraw/zinc/66/75/69/620667569.db2.gz IMIYNOUNYJMKMZ-AWEZNQCLSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c(O)c1 ZINC000853239284 620680975 /nfs/dbraw/zinc/68/09/75/620680975.db2.gz DHWZJFUJTWHIMY-WBVHZDCISA-N 2 0 302.462 3.473 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000853239251 620681048 /nfs/dbraw/zinc/68/10/48/620681048.db2.gz CVWNBAXPMOPASN-GDBMZVCRSA-N 2 0 318.461 3.173 20 10 DGCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(N(C)C)cc1 ZINC000925782699 618618857 /nfs/dbraw/zinc/61/88/57/618618857.db2.gz MOZOFVJXCUVAFM-HOCLYGCPSA-N 2 0 311.420 3.038 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(N(C)C)cc1 ZINC000925782739 618618982 /nfs/dbraw/zinc/61/89/82/618618982.db2.gz MOZOFVJXCUVAFM-ZBFHGGJFSA-N 2 0 311.420 3.038 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(N2CCCCC2)cc1 ZINC000925876533 618650739 /nfs/dbraw/zinc/65/07/39/618650739.db2.gz AQFDVHIAQUHGKE-NUJGCVRESA-N 2 0 301.478 3.455 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)cc(OC)c2O)C[C@H]1C ZINC000894044002 618698665 /nfs/dbraw/zinc/69/86/65/618698665.db2.gz HPYDSVDCAQGCFT-GDBMZVCRSA-N 2 0 306.450 3.014 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)cc(OC)c2O)C[C@@H]1C ZINC000894044004 618698842 /nfs/dbraw/zinc/69/88/42/618698842.db2.gz HPYDSVDCAQGCFT-HOCLYGCPSA-N 2 0 306.450 3.014 20 10 DGCDRP COc1cc(C)cc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c1O ZINC000894053766 618700483 /nfs/dbraw/zinc/70/04/83/618700483.db2.gz IMSITCGKNMAHTI-MRXNPFEDSA-N 2 0 306.450 3.015 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCCC[NH+]2CCC(C)CC2)c1O ZINC000894181387 618725183 /nfs/dbraw/zinc/72/51/83/618725183.db2.gz SGJCMEUUAYWFTP-UHFFFAOYSA-N 2 0 320.477 3.311 20 10 DGCDRP COc1cc(C)cc(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c1O ZINC000894360490 618772073 /nfs/dbraw/zinc/77/20/73/618772073.db2.gz WVLVBQLDLAKIGU-MRXNPFEDSA-N 2 0 320.477 3.167 20 10 DGCDRP COc1cccc(C[N@H+](C)CCCC[NH+]2CCCCC2)c1O ZINC000895685970 618816908 /nfs/dbraw/zinc/81/69/08/618816908.db2.gz OWAWORMDVHOEER-UHFFFAOYSA-N 2 0 306.450 3.099 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000841004142 619148426 /nfs/dbraw/zinc/14/84/26/619148426.db2.gz MQZJWIZUXTXGJJ-SJLPKXTDSA-N 2 0 303.494 3.353 20 10 DGCDRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1O ZINC000902500673 619643990 /nfs/dbraw/zinc/64/39/90/619643990.db2.gz GRWDYFUUZNVUPR-NQYLQCIDSA-N 2 0 324.424 3.299 20 10 DGCDRP Cc1ccc(O)c(C[NH+]2CCC(C[NH3+])(c3ccccc3)CC2)c1 ZINC000904459551 619923790 /nfs/dbraw/zinc/92/37/90/619923790.db2.gz UZDPPABGLUUYAS-UHFFFAOYSA-N 2 0 310.441 3.193 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCCC34CC4)cc2)CC1 ZINC000858332925 621176913 /nfs/dbraw/zinc/17/69/13/621176913.db2.gz RLRYJJSFSKODNU-GOSISDBHSA-N 2 0 313.489 3.108 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1 ZINC000756422728 621637304 /nfs/dbraw/zinc/63/73/04/621637304.db2.gz NLWKZURQECCJSI-OAGGEKHMSA-N 2 0 320.477 3.419 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000757675067 621732911 /nfs/dbraw/zinc/73/29/11/621732911.db2.gz ZORGPCDFOIIVGR-CYBMUJFWSA-N 2 0 314.857 3.055 20 10 DGCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000768467070 622458826 /nfs/dbraw/zinc/45/88/26/622458826.db2.gz WYQSJCPGWJGSBB-OAHLLOKOSA-N 2 0 302.462 3.045 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(C)CCCCC3)cc2)CC1 ZINC000771827674 622800646 /nfs/dbraw/zinc/80/06/46/622800646.db2.gz NRMLROPAWNSVHA-UHFFFAOYSA-N 2 0 301.478 3.251 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000872253979 622868277 /nfs/dbraw/zinc/86/82/77/622868277.db2.gz NZXYKJPCSQKHCU-RTRPANQVSA-N 2 0 301.478 3.134 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)cc1 ZINC000773754642 623068514 /nfs/dbraw/zinc/06/85/14/623068514.db2.gz RGIPRRRYHYQFJJ-GOSISDBHSA-N 2 0 303.494 3.449 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH2+][C@H]1CCCCC12CC[NH2+]CC2 ZINC000873232169 623084457 /nfs/dbraw/zinc/08/44/57/623084457.db2.gz AYWJZTZZWRIQQR-INIZCTEOSA-N 2 0 308.853 3.448 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)cc1 ZINC000873233070 623085937 /nfs/dbraw/zinc/08/59/37/623085937.db2.gz YKRQMGICOHPVPT-SFHVURJKSA-N 2 0 301.478 3.155 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1O ZINC000873249319 623090966 /nfs/dbraw/zinc/09/09/66/623090966.db2.gz KWGSCKACCPAQTI-NDMJEZRESA-N 2 0 302.340 3.189 20 10 DGCDRP CC[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775638927 623300553 /nfs/dbraw/zinc/30/05/53/623300553.db2.gz QGRXJWJAFBEADY-UHFFFAOYSA-N 2 0 323.484 3.461 20 10 DGCDRP Cc1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c(O)c1 ZINC000877007439 623765108 /nfs/dbraw/zinc/76/51/08/623765108.db2.gz PYKDXDGWVBEWPU-LJQANCHMSA-N 2 0 324.468 3.355 20 10 DGCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccncc1 ZINC000883290979 626638099 /nfs/dbraw/zinc/63/80/99/626638099.db2.gz OPKFPNCSYMRLOZ-FQEVSTJZSA-N 2 0 324.472 3.074 20 10 DGCDRP CSC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CC[NH+](C)CC1 ZINC000810252938 626993076 /nfs/dbraw/zinc/99/30/76/626993076.db2.gz WZFPZRYMHIYAHF-AWEZNQCLSA-N 2 0 308.491 3.179 20 10 DGCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000925784224 627794805 /nfs/dbraw/zinc/79/48/05/627794805.db2.gz IFRALTFEQQYBRU-UHIISALHSA-N 2 0 316.367 3.307 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)c2c1c(F)ccc2O ZINC000925846001 627805293 /nfs/dbraw/zinc/80/52/93/627805293.db2.gz MXUXDABOVUUCQB-KMXJZHQMSA-N 2 0 304.409 3.201 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@](C[NH3+])(c3ccccc3)C2)c(O)c1 ZINC000925887100 627812289 /nfs/dbraw/zinc/81/22/89/627812289.db2.gz RMGOEKCZDYAQLH-RIFZZMRRSA-N 2 0 310.441 3.410 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)C1C[NH2+]C1 ZINC000817897183 627955569 /nfs/dbraw/zinc/95/55/69/627955569.db2.gz GQBLSVRHXYNYIH-OAHLLOKOSA-N 2 0 301.478 3.153 20 10 DGCDRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817898592 627956352 /nfs/dbraw/zinc/95/63/52/627956352.db2.gz JNDGDXOZNSQFKH-UTKZUKDTSA-N 2 0 323.484 3.335 20 10 DGCDRP CC[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817937636 627966414 /nfs/dbraw/zinc/96/64/14/627966414.db2.gz YQWXOYPCORJSPA-CYBMUJFWSA-N 2 0 302.340 3.204 20 10 DGCDRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cc(Br)ccc1O ZINC000817947149 627970500 /nfs/dbraw/zinc/97/05/00/627970500.db2.gz LJEKGONJSRFTDL-OIKLOGQESA-N 2 0 313.239 3.075 20 10 DGCDRP CC[C@H]([NH2+]CC1([NH3+])CCC1)c1ccc(C(F)(F)F)cc1O ZINC000817964605 627977096 /nfs/dbraw/zinc/97/70/96/627977096.db2.gz FOVBLDOXZXQNCL-LBPRGKRZSA-N 2 0 302.340 3.333 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817965383 627977611 /nfs/dbraw/zinc/97/76/11/627977611.db2.gz PVDCGRABTMDXCS-STQMWFEESA-N 2 0 302.340 3.189 20 10 DGCDRP [NH3+][C@@H](C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O)C1CC1 ZINC000817965335 627977819 /nfs/dbraw/zinc/97/78/19/627977819.db2.gz OQWWYBPTDNICTF-OALUTQOASA-N 2 0 310.441 3.393 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(N2CCCCC2)cc1 ZINC000817969086 627978922 /nfs/dbraw/zinc/97/89/22/627978922.db2.gz QZRWJUPJVPJBPP-FUHWJXTLSA-N 2 0 301.478 3.470 20 10 DGCDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000817976241 627980808 /nfs/dbraw/zinc/98/08/08/627980808.db2.gz IRWSESSRMOUQMG-MNOVXSKESA-N 2 0 315.255 3.323 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cc(Cl)ccc1O ZINC000817985295 627983037 /nfs/dbraw/zinc/98/30/37/627983037.db2.gz BYIGQUJTXMWZDJ-FIRUKDTASA-N 2 0 308.853 3.474 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000818430897 628022424 /nfs/dbraw/zinc/02/24/24/628022424.db2.gz BABMAXNRRUYRFK-MRXNPFEDSA-N 2 0 301.478 3.025 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)c(Cl)c1 ZINC000818431812 628022552 /nfs/dbraw/zinc/02/25/52/628022552.db2.gz UDGXJCXKDIPMBO-ZDUSSCGKSA-N 2 0 308.853 3.318 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)C3CCC3)cc2)CC1 ZINC000824886608 628702929 /nfs/dbraw/zinc/70/29/29/628702929.db2.gz FXFFWSXKGTVEEW-UHFFFAOYSA-N 2 0 301.478 3.107 20 10 DGCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835035247 629830261 /nfs/dbraw/zinc/83/02/61/629830261.db2.gz FADIEOGVTHEURB-YEODSOHDSA-N 2 0 301.478 3.087 20 10 DGCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835052291 629836995 /nfs/dbraw/zinc/83/69/95/629836995.db2.gz BZSDSOCFRKMSGC-OOFWQKGWSA-N 2 0 301.478 3.086 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]C(C)(C)CCC[NH+](C)C)cc1 ZINC000835055522 629838326 /nfs/dbraw/zinc/83/83/26/629838326.db2.gz VLZDNKLVRQJUDB-CLFYSBASSA-N 2 0 303.494 3.476 20 10 DGCDRP CCC([NH3+])(CC)C[NH2+]Cc1cc(Br)cc(C)c1O ZINC000841031446 630397930 /nfs/dbraw/zinc/39/79/30/630397930.db2.gz UJEAWXSEYKQVKR-UHFFFAOYSA-N 2 0 315.255 3.070 20 10 DGCDRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000841078985 630405349 /nfs/dbraw/zinc/40/53/49/630405349.db2.gz GRXFLGCYVJTYDA-OAHLLOKOSA-N 2 0 314.429 3.188 20 10 DGCDRP CCOc1cccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)c1O ZINC000841086833 630406275 /nfs/dbraw/zinc/40/62/75/630406275.db2.gz MZDIRGYCMBZXQQ-KRWDZBQOSA-N 2 0 314.429 3.361 20 10 DGCDRP [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000843045348 630607812 /nfs/dbraw/zinc/60/78/12/630607812.db2.gz NUUXCWMCAZCCRE-SMDDNHRTSA-N 2 0 312.816 3.149 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC(C[NH2+]C)CC2)cc1F ZINC000843049670 630608167 /nfs/dbraw/zinc/60/81/67/630608167.db2.gz QWWWEQVRVMRWPH-UHFFFAOYSA-N 2 0 307.457 3.103 20 10 DGCDRP CC[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@H]1[NH3+] ZINC000843053697 630608620 /nfs/dbraw/zinc/60/86/20/630608620.db2.gz RERHFNABBUBCHQ-PKOBYXMFSA-N 2 0 301.478 3.236 20 10 DGCDRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843051923 630608694 /nfs/dbraw/zinc/60/86/94/630608694.db2.gz MWBSZPGJMBJSAD-FUHWJXTLSA-N 2 0 301.478 3.236 20 10 DGCDRP CCCN(CCC)c1ccc(C[N@@H+]2CC[C@@H](C[NH2+]C)C2)cc1 ZINC000843052555 630608987 /nfs/dbraw/zinc/60/89/87/630608987.db2.gz NSKWXGWNTAHFHB-SFHVURJKSA-N 2 0 303.494 3.354 20 10 DGCDRP CCOc1ccc(O)c(C[N@H+](CCC[NH3+])Cc2ccccc2)c1 ZINC000843107203 630614538 /nfs/dbraw/zinc/61/45/38/630614538.db2.gz CILTXTAZBWSHJJ-UHFFFAOYSA-N 2 0 314.429 3.142 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126645 630616620 /nfs/dbraw/zinc/61/66/20/630616620.db2.gz MNOKTBBZQMJAGH-IEBWSBKVSA-N 2 0 315.505 3.273 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1 ZINC000843125221 630616733 /nfs/dbraw/zinc/61/67/33/630616733.db2.gz OKYAZNJCUAGJPP-ILEOKINWSA-N 2 0 313.489 3.087 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC000843127917 630616942 /nfs/dbraw/zinc/61/69/42/630616942.db2.gz UPWILJXLWVHZHM-CVEARBPZSA-N 2 0 318.461 3.003 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cc1C ZINC000843128284 630617242 /nfs/dbraw/zinc/61/72/42/630617242.db2.gz VQNBZNBQIBCDCR-IRXDYDNUSA-N 2 0 302.462 3.221 20 10 DGCDRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000844220477 630712695 /nfs/dbraw/zinc/71/26/95/630712695.db2.gz DWDRANFOJIHLDP-SFHVURJKSA-N 2 0 315.505 3.498 20 10 DGCDRP CCc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000846100500 631209460 /nfs/dbraw/zinc/20/94/60/631209460.db2.gz NWSBZDVGGOYBDI-UHFFFAOYSA-N 2 0 323.484 3.291 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)c1O ZINC000846166096 631213078 /nfs/dbraw/zinc/21/30/78/631213078.db2.gz SENLVUPPUOGSDF-CABCVRRESA-N 2 0 306.450 3.316 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)c1O ZINC000846167509 631213196 /nfs/dbraw/zinc/21/31/96/631213196.db2.gz ZCMCMRMMYSKBMJ-AWEZNQCLSA-N 2 0 306.450 3.173 20 10 DGCDRP COc1cc(C[NH2+]CCCC[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC000850094026 632054409 /nfs/dbraw/zinc/05/44/09/632054409.db2.gz BAEXFGGHUMRWKU-UHFFFAOYSA-N 2 0 308.466 3.130 20 10 DGCDRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc(F)ccc1O ZINC000850582830 632201913 /nfs/dbraw/zinc/20/19/13/632201913.db2.gz LMMXXFFVXLJVBJ-ZDUSSCGKSA-N 2 0 306.425 3.304 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000164395038 658930675 /nfs/dbraw/zinc/93/06/75/658930675.db2.gz DSPAFAQJGNULOQ-GOSISDBHSA-N 2 0 302.462 3.459 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000378951310 685145993 /nfs/dbraw/zinc/14/59/93/685145993.db2.gz HTXCXOPWJQOVRI-IEBWSBKVSA-N 2 0 301.478 3.249 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CC[C@@H](C[NH3+])C3)cc2)CC1 ZINC001576735248 1191866654 /nfs/dbraw/zinc/86/66/54/1191866654.db2.gz YIZJFTOBKLYJJM-MSOLQXFVSA-N 2 0 301.478 3.140 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC001345942723 1179627674 /nfs/dbraw/zinc/62/76/74/1179627674.db2.gz GNCFQECLVZLKFC-FQEVSTJZSA-N 2 0 313.489 3.251 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+]CC3CC[NH+](C)CC3)cc2)CC1 ZINC001355253804 1181022215 /nfs/dbraw/zinc/02/22/15/1181022215.db2.gz WJIKCAGMXRFGRQ-UHFFFAOYSA-N 2 0 315.505 3.354 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCC[C@H](C[C@@H]([NH3+])C3CCCC3)C2)cc1 ZINC001356082672 1181138231 /nfs/dbraw/zinc/13/82/31/1181138231.db2.gz BOQVVVNFFKDQEU-VQIMIIECSA-N 2 0 301.478 3.388 20 10 DGCDRP C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C ZINC001461002474 1182753117 /nfs/dbraw/zinc/75/31/17/1182753117.db2.gz WPPMLXIYQUWLKZ-FUHIMQAGSA-N 2 0 315.505 3.353 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3(C)CCCCC3)cc2)CC1 ZINC001474165940 1183875942 /nfs/dbraw/zinc/87/59/42/1183875942.db2.gz MKNNEGJZYDQSPC-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP Cc1cc(O)c(C[NH2+]Cc2ccc3c[nH+]cn3c2)c(Cl)c1 ZINC001474174740 1183877080 /nfs/dbraw/zinc/87/70/80/1183877080.db2.gz XHAFWLVVBQXNMH-UHFFFAOYSA-N 2 0 301.777 3.292 20 10 DGCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001560291570 1189306384 /nfs/dbraw/zinc/30/63/84/1189306384.db2.gz WQJSTSOVPWNIBX-SFHVURJKSA-N 2 0 301.478 3.108 20 10 DGCDRP COc1cc(C)c(C[NH2+]C2CCC(C)([NH+](C)C)CC2)c(O)c1 ZINC001652987051 1195677953 /nfs/dbraw/zinc/67/79/53/1195677953.db2.gz WWXXSFPZHXPSKQ-UHFFFAOYSA-N 2 0 306.450 3.062 20 10 DGCDRP Cc1ccc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001655625669 1195942733 /nfs/dbraw/zinc/94/27/33/1195942733.db2.gz KBTZQSVKPSHCJJ-UHFFFAOYSA-N 2 0 323.484 3.079 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3CCC=CCC3)cc2)CC1 ZINC001658655095 1196285510 /nfs/dbraw/zinc/28/55/10/1196285510.db2.gz GUASGYPBZUGLGK-UHFFFAOYSA-N 2 0 313.489 3.274 20 10 DGCDRP Nc1cc[nH+]c(N2CCCC3=C[C@H]4C[C@H](C[N@@H+]5CCCC[C@H]45)[C@@H]32)c1 ZINC001155631510 1089193648 /nfs/dbraw/zinc/19/36/48/1089193648.db2.gz ZUDLTGXWORQYAS-IXIUHKBRSA-N 2 0 324.472 3.063 20 10 DGCDRP Cc1ccc(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4O)C[C@H]3C2)cc1 ZINC001203552011 1090753860 /nfs/dbraw/zinc/75/38/60/1090753860.db2.gz WUSJAUKOCFKKES-WOJBJXKFSA-N 2 0 322.452 3.264 20 10 DGCDRP COc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c1 ZINC001203680186 1090778697 /nfs/dbraw/zinc/77/86/97/1090778697.db2.gz JHQOJEVRYYOQQU-DLBZAZTESA-N 2 0 318.461 3.240 20 10 DGCDRP c1ccc([C@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001205340168 1091192671 /nfs/dbraw/zinc/19/26/71/1091192671.db2.gz PRSNNBRQCRVCGP-FQEVSTJZSA-N 2 0 321.468 3.086 20 10 DGCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC001205570980 1091259122 /nfs/dbraw/zinc/25/91/22/1091259122.db2.gz RCQBVUIHCQXXIX-GOSISDBHSA-N 2 0 302.393 3.198 20 10 DGCDRP C[C@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001205904959 1091403546 /nfs/dbraw/zinc/40/35/46/1091403546.db2.gz YUAFNBPIKTXGIK-JKSUJKDBSA-N 2 0 311.473 3.465 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCC[C@H]1C[NH3+] ZINC001205993490 1091439566 /nfs/dbraw/zinc/43/95/66/1091439566.db2.gz HUGBBOXACYZIFG-WMZOPIPTSA-N 2 0 301.478 3.094 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC001205991478 1091440089 /nfs/dbraw/zinc/44/00/89/1091440089.db2.gz BAOLFNIEIWFNHQ-AEFFLSMTSA-N 2 0 303.494 3.340 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c(O)c1 ZINC001206003473 1091445999 /nfs/dbraw/zinc/44/59/99/1091445999.db2.gz IIGJHMLRQWHGEH-JKSUJKDBSA-N 2 0 319.493 3.045 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]4CCC[C@@H]4C3)cc2)CC1 ZINC001139408989 1091552325 /nfs/dbraw/zinc/55/23/25/1091552325.db2.gz RQRYOECKTSJOIX-RBUKOAKNSA-N 2 0 313.489 3.060 20 10 DGCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001139408073 1091552473 /nfs/dbraw/zinc/55/24/73/1091552473.db2.gz JHDGNYRVFGIJKE-ZWKOTPCHSA-N 2 0 315.505 3.306 20 10 DGCDRP CCCC[N@H+](CCC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139409325 1091552529 /nfs/dbraw/zinc/55/25/29/1091552529.db2.gz IXNUWLFCVXGUIU-UHFFFAOYSA-N 2 0 303.494 3.451 20 10 DGCDRP C[C@H]1CC[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001206770070 1091734225 /nfs/dbraw/zinc/73/42/25/1091734225.db2.gz QIJDBNRHYAFBGI-HOTGVXAUSA-N 2 0 311.473 3.465 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)Cc3ccccc3)cc2)CC1 ZINC001140300397 1091818305 /nfs/dbraw/zinc/81/83/05/1091818305.db2.gz OCDVCRYFRWMGRL-UHFFFAOYSA-N 2 0 323.484 3.461 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(C)(C)CC3)cc2)CC1 ZINC001140304218 1091821114 /nfs/dbraw/zinc/82/11/14/1091821114.db2.gz JCXPSKNFHGYLNP-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(O)c(C)c2O)CC1 ZINC001140749743 1091985621 /nfs/dbraw/zinc/98/56/21/1091985621.db2.gz LJYOPEMJKNSXNE-UHFFFAOYSA-N 2 0 306.450 3.103 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](CC)CCC[NH+](C)C)c(O)c1 ZINC001140857635 1092033292 /nfs/dbraw/zinc/03/32/92/1092033292.db2.gz UXRDUWYGZOWGMR-UHFFFAOYSA-N 2 0 307.482 3.012 20 10 DGCDRP CCc1ccc(C[N@@H+]2CCC[C@]3(CCC[NH+](C)C3)C2)c(O)c1 ZINC001276804880 1094976256 /nfs/dbraw/zinc/97/62/56/1094976256.db2.gz MRMILYLOKKILKA-IBGZPJMESA-N 2 0 302.462 3.262 20 10 DGCDRP COc1ccc(O)c(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222162007 1095468779 /nfs/dbraw/zinc/46/87/79/1095468779.db2.gz VXWUJPGMZZQPGA-LJQANCHMSA-N 2 0 318.461 3.147 20 10 DGCDRP Cc1ccc(O)c(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222167053 1095471143 /nfs/dbraw/zinc/47/11/43/1095471143.db2.gz HFRHSLJDJDIULX-LJQANCHMSA-N 2 0 302.462 3.446 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[NH+]2CCC3(CCC[NH2+]3)CC2)c1 ZINC001228557449 1097141871 /nfs/dbraw/zinc/14/18/71/1097141871.db2.gz ZRKXPKWMBLKBEF-UHFFFAOYSA-N 2 0 302.462 3.408 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H](N)[C@H](F)CC2)c2ccccc21 ZINC001206167020 1097193112 /nfs/dbraw/zinc/19/31/12/1097193112.db2.gz WAQLGYHBIAZLGY-QZTJIDSGSA-N 2 0 315.436 3.167 20 10 DGCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)C[C@@H]2C1 ZINC001231883572 1097878629 /nfs/dbraw/zinc/87/86/29/1097878629.db2.gz PWSRUNCPMYGSLY-HDICACEKSA-N 2 0 310.441 3.319 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]2C1 ZINC001233287095 1098276483 /nfs/dbraw/zinc/27/64/83/1098276483.db2.gz WIWWTJFPDIPAKE-IAGOWNOFSA-N 2 0 316.489 3.463 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)CC2)ccc1N(C)C ZINC001235044813 1098771074 /nfs/dbraw/zinc/77/10/74/1098771074.db2.gz KVVLLEIYCUYNKA-LJQANCHMSA-N 2 0 301.478 3.169 20 10 DGCDRP Cc1cccc(C[NH+]2CCC3(CC2)C[NH2+]Cc2ccccc23)c1O ZINC001235093928 1098796781 /nfs/dbraw/zinc/79/67/81/1098796781.db2.gz KVOWKHWSEYEEOA-UHFFFAOYSA-N 2 0 322.452 3.338 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CCCC23CC[NH2+]CC3)c1O ZINC001235144840 1098835774 /nfs/dbraw/zinc/83/57/74/1098835774.db2.gz PYSLPXILUNPXCK-UHFFFAOYSA-N 2 0 302.462 3.408 20 10 DGCDRP CC(C)(C)c1ccc(C[NH+]2CCC(C3C[NH2+]C3)CC2)c(O)c1 ZINC001235340592 1098963936 /nfs/dbraw/zinc/96/39/36/1098963936.db2.gz RICPLUSNTZPCQZ-UHFFFAOYSA-N 2 0 302.462 3.121 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@@H]3F)c(O)c1 ZINC001235405912 1099001475 /nfs/dbraw/zinc/00/14/75/1099001475.db2.gz POTZZHBJIAWTES-HKUYNNGSSA-N 2 0 320.452 3.213 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@H]3F)c(O)c1 ZINC001235405913 1099002889 /nfs/dbraw/zinc/00/28/89/1099002889.db2.gz POTZZHBJIAWTES-IEBWSBKVSA-N 2 0 320.452 3.213 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC(C3CC[NH2+]CC3)CC2)c(O)c1 ZINC001235705805 1099138449 /nfs/dbraw/zinc/13/84/49/1099138449.db2.gz LDEZWDUEUVWPPC-UHFFFAOYSA-N 2 0 302.462 3.221 20 10 DGCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1cc(C(F)(F)F)ccc1O ZINC001235718019 1099144221 /nfs/dbraw/zinc/14/42/21/1099144221.db2.gz SCMZPBJWKZDHFN-UHFFFAOYSA-N 2 0 316.367 3.233 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CCC2CC[NH2+]CC2)c(O)c1 ZINC001235716687 1099144296 /nfs/dbraw/zinc/14/42/96/1099144296.db2.gz GAEFKETZJYQCGP-UHFFFAOYSA-N 2 0 319.493 3.060 20 10 DGCDRP Cc1cc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)ccc1N(C)C ZINC001236599916 1099694896 /nfs/dbraw/zinc/69/48/96/1099694896.db2.gz WZUFZTANJLUHCM-KRWDZBQOSA-N 2 0 301.478 3.025 20 10 DGCDRP Oc1cc2ccccc2cc1C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001236841388 1099827436 /nfs/dbraw/zinc/82/74/36/1099827436.db2.gz YRXZGSZIDALUST-UHFFFAOYSA-N 2 0 319.408 3.263 20 10 DGCDRP CCC[NH+](CCC)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236930761 1099880543 /nfs/dbraw/zinc/88/05/43/1099880543.db2.gz FQDYRZPCYGYXTI-UHFFFAOYSA-N 2 0 307.457 3.200 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@@H](C)C1 ZINC001236939664 1099882109 /nfs/dbraw/zinc/88/21/09/1099882109.db2.gz UCWBWXHQKIBNIK-HOTGVXAUSA-N 2 0 319.468 3.198 20 10 DGCDRP C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236931984 1099882502 /nfs/dbraw/zinc/88/25/02/1099882502.db2.gz MXEBBTLNHHXNOD-HOTGVXAUSA-N 2 0 319.468 3.340 20 10 DGCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@H]1C ZINC001236938244 1099882911 /nfs/dbraw/zinc/88/29/11/1099882911.db2.gz IMRINUWJJJFHBK-HOTGVXAUSA-N 2 0 319.468 3.198 20 10 DGCDRP Cc1cc(F)cc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)c1O ZINC001238062366 1100346038 /nfs/dbraw/zinc/34/60/38/1100346038.db2.gz PGUSXQQVZNXMIE-UHFFFAOYSA-N 2 0 308.441 3.392 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246523389 1104577205 /nfs/dbraw/zinc/57/72/05/1104577205.db2.gz GXGKQTUPBQBBHR-PMUMKWKESA-N 2 0 302.462 3.363 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246919299 1104737722 /nfs/dbraw/zinc/73/77/22/1104737722.db2.gz GXOOZZWTIBOAMD-DZFIZOCASA-N 2 0 301.478 3.248 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)cc1 ZINC001275833166 1104926185 /nfs/dbraw/zinc/92/61/85/1104926185.db2.gz ANKVAMZUSNPQKD-FQEVSTJZSA-N 2 0 315.505 3.451 20 10 DGCDRP Cc1cc(C)c(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c(O)c1 ZINC001256852950 1106497902 /nfs/dbraw/zinc/49/79/02/1106497902.db2.gz RUOFROGLXWPRNX-UHFFFAOYSA-N 2 0 311.429 3.163 20 10 DGCDRP CCCC[C@H](CC)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001257411027 1106584146 /nfs/dbraw/zinc/58/41/46/1106584146.db2.gz PMVYMSNRXBDSFS-SFHVURJKSA-N 2 0 303.494 3.497 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+]CCC(C)C)cc2F)CC1 ZINC001321090983 1107247292 /nfs/dbraw/zinc/24/72/92/1107247292.db2.gz RDILSLTZCHAKJH-UHFFFAOYSA-N 2 0 307.457 3.103 20 10 DGCDRP c1[nH+]cn2cc(C[NH2+]Cc3ccc(N4CCCC4)cc3)ccc12 ZINC001261378455 1107423839 /nfs/dbraw/zinc/42/38/39/1107423839.db2.gz ZSNAIMGNODDZCP-UHFFFAOYSA-N 2 0 306.413 3.224 20 10 DGCDRP COc1cc(C[NH2+]CC(C)(C)C[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC001308182432 1111391705 /nfs/dbraw/zinc/39/17/05/1111391705.db2.gz YEAMDKDOQONZET-UHFFFAOYSA-N 2 0 322.493 3.376 20 10 DGCDRP CCC[NH+]1CCC([N@H+](C)Cc2cc(OCC)ccc2O)CC1 ZINC000092165825 193169434 /nfs/dbraw/zinc/16/94/34/193169434.db2.gz KODYODJUFMBINU-UHFFFAOYSA-N 2 0 306.450 3.097 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000093563586 193268720 /nfs/dbraw/zinc/26/87/20/193268720.db2.gz OVXSOFGSFCSXOO-IBGZPJMESA-N 2 0 301.478 3.203 20 10 DGCDRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000273540853 130134300 /nfs/dbraw/zinc/13/43/00/130134300.db2.gz YEEQBFZEOOFPII-CQSZACIVSA-N 2 0 300.446 3.184 20 10 DGCDRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1O ZINC000183591027 432306690 /nfs/dbraw/zinc/30/66/90/432306690.db2.gz AKVKYNWCZCZSPW-HNNXBMFYSA-N 2 0 311.429 3.354 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000192696832 432402385 /nfs/dbraw/zinc/40/23/85/432402385.db2.gz XJNWSTVQXMXQTI-JLYLLQBASA-N 2 0 301.478 3.248 20 10 DGCDRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC000192932262 432431426 /nfs/dbraw/zinc/43/14/26/432431426.db2.gz FCPIPKLZFHMWEW-IBGZPJMESA-N 2 0 322.452 3.233 20 10 DGCDRP CCCC[NH+]1CCC([NH2+][C@H](C)c2cc(OC)ccc2O)CC1 ZINC000192844589 432420893 /nfs/dbraw/zinc/42/08/93/432420893.db2.gz QYDXLUMOFNZFCD-CQSZACIVSA-N 2 0 306.450 3.316 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c1 ZINC000276608253 432822177 /nfs/dbraw/zinc/82/21/77/432822177.db2.gz DVCHEUWJWBVTSX-UHFFFAOYSA-N 2 0 306.450 3.003 20 10 DGCDRP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000292796225 433594578 /nfs/dbraw/zinc/59/45/78/433594578.db2.gz MZYKIQVCPIWSRG-FQEVSTJZSA-N 2 0 313.489 3.205 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000377704682 433969319 /nfs/dbraw/zinc/96/93/19/433969319.db2.gz YAYJZMHZMJYXSN-UHFFFAOYSA-N 2 0 324.472 3.248 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(-n3ccnc3)nc2)c(O)c1C ZINC000363862773 434168253 /nfs/dbraw/zinc/16/82/53/434168253.db2.gz ZCTUTRCVNIHOTP-OAHLLOKOSA-N 2 0 322.412 3.441 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c1 ZINC000194190373 295168345 /nfs/dbraw/zinc/16/83/45/295168345.db2.gz ACCLFSRANQPSLA-CABCVRRESA-N 2 0 306.450 3.173 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@H+](CC)C[C@H]2C)cc1F ZINC000742385874 574994935 /nfs/dbraw/zinc/99/49/35/574994935.db2.gz ZJQUHXCEACBORD-QAPCUYQASA-N 2 0 321.484 3.492 20 10 DGCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2c(O)ccc3ccncc32)C1 ZINC000743390693 575049309 /nfs/dbraw/zinc/04/93/09/575049309.db2.gz UXHXSQQJRSACNW-HNNXBMFYSA-N 2 0 313.445 3.104 20 10 DGCDRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000746381333 575448870 /nfs/dbraw/zinc/44/88/70/575448870.db2.gz HPEUWCXYWBMMGF-MRXNPFEDSA-N 2 0 314.473 3.045 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093794 620668180 /nfs/dbraw/zinc/66/81/80/620668180.db2.gz RJJBDHJJTLUURJ-AWEZNQCLSA-N 2 0 308.853 3.257 20 10 DGCDRP COc1cccc(C[NH2+]C2CC[NH+](CCC(C)C)CC2)c1O ZINC000894458421 618339980 /nfs/dbraw/zinc/33/99/80/618339980.db2.gz QYXQFMUQLDDKDD-UHFFFAOYSA-N 2 0 306.450 3.001 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)cc(OC)c2O)C[C@H]1C ZINC000894044005 618698720 /nfs/dbraw/zinc/69/87/20/618698720.db2.gz HPYDSVDCAQGCFT-ZBFHGGJFSA-N 2 0 306.450 3.014 20 10 DGCDRP COc1cccc(O)c1C[NH2+]C[C@@H](N)c1ccc(C(C)C)cc1 ZINC000841037447 619207613 /nfs/dbraw/zinc/20/76/13/619207613.db2.gz QHMAFEVHMBVEES-QGZVFWFLSA-N 2 0 314.429 3.314 20 10 DGCDRP COc1ccc(N2CC[C@H]([NH2+]C[C@H]([NH3+])CCC(C)(C)C)C2)cc1 ZINC000904376542 619918258 /nfs/dbraw/zinc/91/82/58/619918258.db2.gz BCXOGKRXTIEEDJ-CVEARBPZSA-N 2 0 319.493 3.017 20 10 DGCDRP Cc1cccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1O ZINC000904476945 619924609 /nfs/dbraw/zinc/92/46/09/619924609.db2.gz VCDQDULWOXLYMF-FXAWDEMLSA-N 2 0 324.424 3.046 20 10 DGCDRP Cc1ccc(O)c(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000904473432 619924757 /nfs/dbraw/zinc/92/47/57/619924757.db2.gz ISSWHBAVPVDONK-XLIONFOSSA-N 2 0 324.424 3.046 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c1O ZINC000841086264 620225004 /nfs/dbraw/zinc/22/50/04/620225004.db2.gz GWMRLOOMHJDTEW-CJNGLKHVSA-N 2 0 308.853 3.318 20 10 DGCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)c1O ZINC000817958769 620894934 /nfs/dbraw/zinc/89/49/34/620894934.db2.gz MHATWOARCQPWCF-ZWNOBZJWSA-N 2 0 315.255 3.097 20 10 DGCDRP CCOc1cccc(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)c1O ZINC000922847886 621108157 /nfs/dbraw/zinc/10/81/57/621108157.db2.gz ICGQTTVIDZEUBT-UHFFFAOYSA-N 2 0 318.461 3.288 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000839182849 621343677 /nfs/dbraw/zinc/34/36/77/621343677.db2.gz QPFDCHTUEQSOOH-WLPBJKJWSA-N 2 0 301.478 3.087 20 10 DGCDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000839182836 621343928 /nfs/dbraw/zinc/34/39/28/621343928.db2.gz QCOJWVQIEADDDX-IBGZPJMESA-N 2 0 315.505 3.498 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2c1c(F)ccc2O ZINC000756416034 621636965 /nfs/dbraw/zinc/63/69/65/621636965.db2.gz GIIFYOKAJFILNV-OSFYFWSMSA-N 2 0 304.409 3.296 20 10 DGCDRP CC[NH+]1CCC(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756534667 621646113 /nfs/dbraw/zinc/64/61/13/621646113.db2.gz MFWRXWQTFWGWIN-DOMZBBRYSA-N 2 0 306.425 3.401 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000757640479 621730766 /nfs/dbraw/zinc/73/07/66/621730766.db2.gz XEZKOFIBLNMOGC-GXTWGEPZSA-N 2 0 306.425 3.401 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CCC[NH+]2CCCC2)cc1 ZINC000760808387 621966708 /nfs/dbraw/zinc/96/67/08/621966708.db2.gz JZRPIZNRBNHXHC-UHFFFAOYSA-N 2 0 303.494 3.451 20 10 DGCDRP CC[N@H+](CCC1CC1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000761225389 621995823 /nfs/dbraw/zinc/99/58/23/621995823.db2.gz GOEUPQBSAUWNJF-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP C[C@H](CCC1CC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000768950548 622487589 /nfs/dbraw/zinc/48/75/89/622487589.db2.gz AAUGBAAMSVSQTM-MRXNPFEDSA-N 2 0 301.478 3.107 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c(O)c1 ZINC000769497238 622534175 /nfs/dbraw/zinc/53/41/75/622534175.db2.gz ATPMPVZHKVGCII-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP CC[C@@H](C)C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000771868384 622807077 /nfs/dbraw/zinc/80/70/77/622807077.db2.gz MTKPBDZLNIESGP-QGZVFWFLSA-N 2 0 315.505 3.354 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC[NH2+]CC1 ZINC000873220963 623079347 /nfs/dbraw/zinc/07/93/47/623079347.db2.gz DIGKHBULRVTRPL-MRXNPFEDSA-N 2 0 301.478 3.155 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC[NH2+]CC1 ZINC000873222885 623080379 /nfs/dbraw/zinc/08/03/79/623080379.db2.gz DIGKHBULRVTRPL-INIZCTEOSA-N 2 0 301.478 3.155 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c2c1c(F)ccc2O ZINC000873244523 623089254 /nfs/dbraw/zinc/08/92/54/623089254.db2.gz MITFFRGYQYYDCV-MBNYWOFBSA-N 2 0 306.425 3.447 20 10 DGCDRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000873271587 623100343 /nfs/dbraw/zinc/10/03/43/623100343.db2.gz IYJWZVAIWHAVEN-UONOGXRCSA-N 2 0 302.462 3.310 20 10 DGCDRP CC(C)[C@@H](C)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775637300 623300703 /nfs/dbraw/zinc/30/07/03/623300703.db2.gz ONUJEFQJIOMOFM-QGZVFWFLSA-N 2 0 315.505 3.447 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3C(C)(C)C)cc2)CC1 ZINC000775678993 623311944 /nfs/dbraw/zinc/31/19/44/623311944.db2.gz KVZAZOADAFUTBL-IBGZPJMESA-N 2 0 315.505 3.449 20 10 DGCDRP CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775708877 623317367 /nfs/dbraw/zinc/31/73/67/623317367.db2.gz PIJJXCCBOLAPTF-SJLPKXTDSA-N 2 0 301.478 3.059 20 10 DGCDRP CC[C@H]1[C@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775998174 623362301 /nfs/dbraw/zinc/36/23/01/623362301.db2.gz DSLQLOWRMGPSCY-APWZRJJASA-N 2 0 301.478 3.059 20 10 DGCDRP CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775998177 623362756 /nfs/dbraw/zinc/36/27/56/623362756.db2.gz DSLQLOWRMGPSCY-LPHOPBHVSA-N 2 0 301.478 3.059 20 10 DGCDRP Cc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000877486949 623908231 /nfs/dbraw/zinc/90/82/31/623908231.db2.gz ONGMDDVJJDMDHH-SFHVURJKSA-N 2 0 310.441 3.312 20 10 DGCDRP C[C@@H]1CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000783266082 624333017 /nfs/dbraw/zinc/33/30/17/624333017.db2.gz NEBHHIUZQXTYQE-OXQOHEQNSA-N 2 0 313.489 3.107 20 10 DGCDRP CCOc1ccc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c(O)c1 ZINC000791011080 625737211 /nfs/dbraw/zinc/73/72/11/625737211.db2.gz MZJYKSUWPXAXSI-UHFFFAOYSA-N 2 0 306.450 3.003 20 10 DGCDRP C[C@H]([NH2+]Cc1cc(F)cc(F)c1[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000883085169 625921466 /nfs/dbraw/zinc/92/14/66/625921466.db2.gz KGOKKKSHFVCPSP-STQMWFEESA-N 2 0 324.415 3.413 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000796772262 626081166 /nfs/dbraw/zinc/08/11/66/626081166.db2.gz PQWIAKNWJBEUHB-GUDVDZBRSA-N 2 0 301.478 3.023 20 10 DGCDRP C[N@@H+]1CCC[C@@]2(CC[NH+](Cc3cc4c(cc3O)CCCC4)C2)C1 ZINC000840085984 626751695 /nfs/dbraw/zinc/75/16/95/626751695.db2.gz JIDGCIIPMLNDKU-HXUWFJFHSA-N 2 0 314.473 3.189 20 10 DGCDRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1c([O-])cccc1F ZINC000886496753 627153181 /nfs/dbraw/zinc/15/31/81/627153181.db2.gz GOMAQCUBOYNHHG-ZDUSSCGKSA-N 2 0 302.393 3.444 20 10 DGCDRP COc1ccc(O)c(C[NH2+]C2CCC(C)([NH+]3CCCC3)CC2)c1 ZINC000886547953 627160859 /nfs/dbraw/zinc/16/08/59/627160859.db2.gz UUGLERJOYWNCPQ-UHFFFAOYSA-N 2 0 318.461 3.288 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817945613 627970401 /nfs/dbraw/zinc/97/04/01/627970401.db2.gz HVFSSQNUBLUIQB-CVEARBPZSA-N 2 0 319.468 3.466 20 10 DGCDRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cc(Br)ccc1O ZINC000817947148 627970809 /nfs/dbraw/zinc/97/08/09/627970809.db2.gz LJEKGONJSRFTDL-GCVQQVDUSA-N 2 0 313.239 3.075 20 10 DGCDRP CC(C)[NH2+]CCC[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000817954275 627973306 /nfs/dbraw/zinc/97/33/06/627973306.db2.gz WYXAGUGGOUGTHZ-LLVKDONJSA-N 2 0 315.255 3.193 20 10 DGCDRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc2c(cc1O)CCCC2 ZINC000817979529 627981787 /nfs/dbraw/zinc/98/17/87/627981787.db2.gz BQRGSTYEFBBFFS-PBHICJAKSA-N 2 0 302.462 3.454 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(N2CCCCC2)cc1 ZINC000817982477 627983863 /nfs/dbraw/zinc/98/38/63/627983863.db2.gz SSPHEXLSWUWDTO-XYJFISCASA-N 2 0 301.478 3.455 20 10 DGCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c1O ZINC000817985692 627984452 /nfs/dbraw/zinc/98/44/52/627984452.db2.gz GYHNMPYSLSBXPV-RMRHIDDWSA-N 2 0 308.853 3.393 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000817987408 627984481 /nfs/dbraw/zinc/98/44/81/627984481.db2.gz YTVRVDFYVKRYJK-DOTOQJQBSA-N 2 0 301.478 3.468 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000817987216 627984623 /nfs/dbraw/zinc/98/46/23/627984623.db2.gz YHZSZBASKUJOGD-AEFFLSMTSA-N 2 0 301.478 3.468 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1Cl ZINC000824933041 628708858 /nfs/dbraw/zinc/70/88/58/628708858.db2.gz ATLPQPPEKUDHKR-CJNGLKHVSA-N 2 0 308.853 3.270 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2c1c(F)ccc2O ZINC000834891798 629799364 /nfs/dbraw/zinc/79/93/64/629799364.db2.gz JLWKUFLMGFCRAN-HHQTYALHSA-N 2 0 304.409 3.294 20 10 DGCDRP C[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)C[NH+]1CCCC1 ZINC000835034834 629830751 /nfs/dbraw/zinc/83/07/51/629830751.db2.gz FKLFJUZNUATPEZ-TUYSUELWSA-N 2 0 301.478 3.087 20 10 DGCDRP CC(C)[NH+]1CCC([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835037180 629831473 /nfs/dbraw/zinc/83/14/73/629831473.db2.gz SYVRWCBZWWEATL-AATRIKPKSA-N 2 0 301.478 3.228 20 10 DGCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835052293 629837033 /nfs/dbraw/zinc/83/70/33/629837033.db2.gz BZSDSOCFRKMSGC-QWNKOJSDSA-N 2 0 301.478 3.086 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N(C)C)cc2C)C[C@H]1C ZINC000840918605 630378270 /nfs/dbraw/zinc/37/82/70/630378270.db2.gz WPYZFDVNIPAARU-APWZRJJASA-N 2 0 303.494 3.366 20 10 DGCDRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(N(C)C)cc2C)CC1 ZINC000840931820 630380007 /nfs/dbraw/zinc/38/00/07/630380007.db2.gz KIWWSLNKXPVNAP-UHFFFAOYSA-N 2 0 303.494 3.273 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000841087457 630405949 /nfs/dbraw/zinc/40/59/49/630405949.db2.gz NWNXDBPYONRKDA-RJOJHWARSA-N 2 0 313.489 3.230 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000841088736 630406629 /nfs/dbraw/zinc/40/66/29/630406629.db2.gz AUHKVHQUVGBFBJ-GOSISDBHSA-N 2 0 313.489 3.441 20 10 DGCDRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000844902219 630970701 /nfs/dbraw/zinc/97/07/01/630970701.db2.gz LVZRFUBYAUSSMG-ICSRJNTNSA-N 2 0 313.489 3.238 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2F)c2c1c(F)ccc2O ZINC000844923738 630986017 /nfs/dbraw/zinc/98/60/17/630986017.db2.gz JRXYCQUFQDCRJQ-BMIGLBTASA-N 2 0 318.367 3.467 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c1O ZINC000846155982 631212557 /nfs/dbraw/zinc/21/25/57/631212557.db2.gz JLEDUOVQPXTYOO-JKSUJKDBSA-N 2 0 320.477 3.419 20 10 DGCDRP CCC[N@H+](Cc1ccc2c(c1)C[NH2+]CC2)Cc1ccccc1O ZINC000846218699 631215515 /nfs/dbraw/zinc/21/55/15/631215515.db2.gz RCVHODLBDMOGMZ-UHFFFAOYSA-N 2 0 310.441 3.450 20 10 DGCDRP CC[C@@](C)([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000850383270 632134008 /nfs/dbraw/zinc/13/40/08/632134008.db2.gz DEDYLWKKKUBGGO-LJQANCHMSA-N 2 0 301.478 3.107 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c1 ZINC000184936906 660195974 /nfs/dbraw/zinc/19/59/74/660195974.db2.gz NKWAQTGIKILHSK-CQSZACIVSA-N 2 0 314.429 3.313 20 10 DGCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000160315354 655606050 /nfs/dbraw/zinc/60/60/50/655606050.db2.gz KNCFPCYIZHAARW-INIZCTEOSA-N 2 0 316.489 3.435 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)C)cc2F)CC1 ZINC000236896102 656964238 /nfs/dbraw/zinc/96/42/38/656964238.db2.gz WJZCVJLDRULISZ-UHFFFAOYSA-N 2 0 307.457 3.103 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC000192935067 658808804 /nfs/dbraw/zinc/80/88/04/658808804.db2.gz JGFQUPFHYFAJNE-GFCCVEGCSA-N 2 0 306.450 3.361 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1F ZINC000158719216 661876881 /nfs/dbraw/zinc/87/68/81/661876881.db2.gz KCLUTGICVSMSSI-HNNXBMFYSA-N 2 0 321.484 3.492 20 10 DGCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc4c(cc3O)CCCC4)CC[C@H]21 ZINC000245547884 662236187 /nfs/dbraw/zinc/23/61/87/662236187.db2.gz WSYMHDFXUPCKEP-PKOBYXMFSA-N 2 0 314.473 3.187 20 10 DGCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@H]2CC1 ZINC001275799847 1177939273 /nfs/dbraw/zinc/93/92/73/1177939273.db2.gz UIXZOHOXQITTOO-IYBDPMFKSA-N 2 0 316.489 3.463 20 10 DGCDRP CC(C)C[N@H+](C)CCC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001346193864 1179667727 /nfs/dbraw/zinc/66/77/27/1179667727.db2.gz AQWOTUQFQRJQRU-UHFFFAOYSA-N 2 0 303.494 3.354 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCC[C@H](C[C@H]([NH3+])C3CCCC3)C2)cc1 ZINC001356082669 1181139108 /nfs/dbraw/zinc/13/91/08/1181139108.db2.gz BOQVVVNFFKDQEU-APWZRJJASA-N 2 0 301.478 3.388 20 10 DGCDRP CC[NH+](CC)CCC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001657023751 1196093779 /nfs/dbraw/zinc/09/37/79/1196093779.db2.gz OZGNZQJGMPZNCV-UHFFFAOYSA-N 2 0 303.494 3.449 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC001560355015 1189316702 /nfs/dbraw/zinc/31/67/02/1189316702.db2.gz LEIYUGGKKBFWMH-UHFFFAOYSA-N 2 0 302.462 3.223 20 10 DGCDRP C[C@@H]([NH2+]C1CCC(C)([NH+]2CCOCC2)CC1)c1ccccc1O ZINC001652968887 1195675583 /nfs/dbraw/zinc/67/55/83/1195675583.db2.gz LGYWHFXMPHFDHB-MDCZIUGASA-N 2 0 318.461 3.076 20 10 DGCDRP C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001657156659 1196111958 /nfs/dbraw/zinc/11/19/58/1196111958.db2.gz FIZGAIBLPOCEFV-IRXDYDNUSA-N 2 0 315.505 3.353 20 10 DGCDRP CC[C@]1(C)CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001658802189 1196302095 /nfs/dbraw/zinc/30/20/95/1196302095.db2.gz MZIVXSSHNJROLL-WOJBJXKFSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)C[NH+]1CCCCC1 ZINC001661054800 1196559485 /nfs/dbraw/zinc/55/94/85/1196559485.db2.gz SNPBRSLYYXJVTN-HNNXBMFYSA-N 2 0 307.457 3.103 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3ccc(N(CC)CC)cc3)C[C@@H]2C1 ZINC001203946561 1090848537 /nfs/dbraw/zinc/84/85/37/1090848537.db2.gz VPSIPDGCCAYZPY-OALUTQOASA-N 2 0 315.505 3.306 20 10 DGCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]2CC1 ZINC001276445523 1090911117 /nfs/dbraw/zinc/91/11/17/1090911117.db2.gz ODLPCABLOVJNSA-IYBDPMFKSA-N 2 0 316.489 3.463 20 10 DGCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccc2c(c1)CCCN2C ZINC001138359210 1091152862 /nfs/dbraw/zinc/15/28/62/1091152862.db2.gz NPPQRWNHJJHWIW-UHFFFAOYSA-N 2 0 303.494 3.233 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c(OC)c1 ZINC001205264771 1091155336 /nfs/dbraw/zinc/15/53/36/1091155336.db2.gz LUYWWEXDHZYPFA-IBGZPJMESA-N 2 0 319.493 3.245 20 10 DGCDRP C[C@]1([NH3+])CCC[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)CC1 ZINC001205274370 1091161293 /nfs/dbraw/zinc/16/12/93/1091161293.db2.gz WDKDKHPNSAIKTJ-FQEVSTJZSA-N 2 0 313.489 3.089 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)cc1Cl ZINC001205571782 1091260408 /nfs/dbraw/zinc/26/04/08/1091260408.db2.gz XQWXKKGIXQRXCZ-HNNXBMFYSA-N 2 0 300.805 3.007 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c(O)c1 ZINC001205582933 1091266493 /nfs/dbraw/zinc/26/64/93/1091266493.db2.gz ZUBJJJFLWBAOPF-GOSISDBHSA-N 2 0 308.441 3.343 20 10 DGCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cc3ccccc3cc2O)CC1 ZINC001205581529 1091266886 /nfs/dbraw/zinc/26/68/86/1091266886.db2.gz VGWJJFKXEGOQEC-GOSISDBHSA-N 2 0 302.393 3.198 20 10 DGCDRP COc1cc(C[NH+]2[C@H](C)CCC[C@H]2C)cc(C[NH+](C)C)c1O ZINC001139253510 1091501439 /nfs/dbraw/zinc/50/14/39/1091501439.db2.gz WJJUEANVJJQPAE-ZIAGYGMSSA-N 2 0 306.450 3.225 20 10 DGCDRP COc1cc(C[N@@H+]2CCCC[C@@](C)(F)C2)cc(C[NH+](C)C)c1O ZINC001139254079 1091501620 /nfs/dbraw/zinc/50/16/20/1091501620.db2.gz CWRGCZOKBHLAJE-GOSISDBHSA-N 2 0 324.440 3.177 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@H]2C(C)C)cc(C[NH+](C)C)c1O ZINC001139259067 1091503602 /nfs/dbraw/zinc/50/36/02/1091503602.db2.gz GYOPNSVWZZVLDY-MRXNPFEDSA-N 2 0 306.450 3.083 20 10 DGCDRP COc1cc(C[N@H+](C)CC2CCCCC2)cc(C[NH+](C)C)c1O ZINC001139258811 1091504547 /nfs/dbraw/zinc/50/45/47/1091504547.db2.gz XAYCYQLBVWCUHC-UHFFFAOYSA-N 2 0 320.477 3.475 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@](C)(F)CC3)cc2)CC1 ZINC001139408392 1091551422 /nfs/dbraw/zinc/55/14/22/1091551422.db2.gz LHDVGJSURSCWOE-IBGZPJMESA-N 2 0 319.468 3.153 20 10 DGCDRP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001206362730 1091600054 /nfs/dbraw/zinc/60/00/54/1091600054.db2.gz QEBOKJSCROCIJU-GOSISDBHSA-N 2 0 302.393 3.198 20 10 DGCDRP Cc1cc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)ccc1N(C)C ZINC001206588604 1091679482 /nfs/dbraw/zinc/67/94/82/1091679482.db2.gz CMGCTUNHFOYWCP-SFHVURJKSA-N 2 0 303.494 3.414 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H](C)CC34CC4)cc2)CC1 ZINC001140305515 1091820497 /nfs/dbraw/zinc/82/04/97/1091820497.db2.gz AIHMNYDEHBSXFL-KRWDZBQOSA-N 2 0 313.489 3.203 20 10 DGCDRP Cc1c(O)ccc(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c1O ZINC001140746236 1091983696 /nfs/dbraw/zinc/98/36/96/1091983696.db2.gz WRMKDIOQESNRFY-QGZVFWFLSA-N 2 0 318.461 3.247 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@H]2CC[NH3+])c1O ZINC000404315970 1094254275 /nfs/dbraw/zinc/25/42/75/1094254275.db2.gz OEYNQWIIOGITND-SMDDNHRTSA-N 2 0 312.841 3.004 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@]3(CCC[NH+](C)C3)C2)c(O)c1 ZINC001276814241 1095110071 /nfs/dbraw/zinc/11/00/71/1095110071.db2.gz FOZOZQONDAWVGO-IBGZPJMESA-N 2 0 318.461 3.099 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c1O ZINC001222147979 1095456963 /nfs/dbraw/zinc/45/69/63/1095456963.db2.gz GWYLROWKVUTWQE-IBGZPJMESA-N 2 0 302.462 3.265 20 10 DGCDRP CC(C)c1ccc(C[N@@H+]2CCC[C@]3(CCC[NH2+]C3)C2)c(O)c1 ZINC001222277395 1095526766 /nfs/dbraw/zinc/52/67/66/1095526766.db2.gz NJKOPPCVYHZMKI-IBGZPJMESA-N 2 0 302.462 3.481 20 10 DGCDRP CC(C)(C)c1ccc(O)c(CN2CCC[C@]3(CCC[NH2+]3)C2)c1 ZINC001222355736 1095569386 /nfs/dbraw/zinc/56/93/86/1095569386.db2.gz UPRXZFYFQMNFEL-LJQANCHMSA-N 2 0 302.462 3.408 20 10 DGCDRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001172358229 1097124135 /nfs/dbraw/zinc/12/41/35/1097124135.db2.gz GNUFUVNKJVLXPI-ZHALLVOQSA-N 2 0 315.505 3.353 20 10 DGCDRP Cc1cc(F)cc(CN2CCC[C@@]3(CCC[N@@H+](C)C3)C2)c1O ZINC001277518947 1097750253 /nfs/dbraw/zinc/75/02/53/1097750253.db2.gz GFSCDTXCNWEOIS-GOSISDBHSA-N 2 0 306.425 3.148 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCN(c3cc[nH+]cc3C)CC2)c(O)c1 ZINC001231850232 1097863967 /nfs/dbraw/zinc/86/39/67/1097863967.db2.gz MQLRZBKWLPPOIC-UHFFFAOYSA-N 2 0 311.429 3.035 20 10 DGCDRP CC(C)C[NH+]1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001177199303 1098487962 /nfs/dbraw/zinc/48/79/62/1098487962.db2.gz ICWJNKNYNFCAOZ-UHFFFAOYSA-N 2 0 315.505 3.497 20 10 DGCDRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](Cc1cccc(-c3ccccc3)c1O)C2 ZINC001234996344 1098739094 /nfs/dbraw/zinc/73/90/94/1098739094.db2.gz BEPKXXKZHDBBLI-WIYYLYMNSA-N 2 0 322.452 3.443 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2CC3(C2)CC[NH2+]CC3)cc1 ZINC001235088697 1098790791 /nfs/dbraw/zinc/79/07/91/1098790791.db2.gz KRZSXZYKGMXGAJ-UHFFFAOYSA-N 2 0 309.457 3.280 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCCCC34CC[NH2+]CC4)ccc21 ZINC001235191316 1098868053 /nfs/dbraw/zinc/86/80/53/1098868053.db2.gz ROVFWLZRSGIKSH-UHFFFAOYSA-N 2 0 313.489 3.177 20 10 DGCDRP Oc1cc(O)c(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)cc1Cl ZINC001235241198 1098913068 /nfs/dbraw/zinc/91/30/68/1098913068.db2.gz NGVZIORBIQPGKE-HNNXBMFYSA-N 2 0 324.852 3.105 20 10 DGCDRP CC(C)(C)c1cc(O)c(C[N@@H+]2CC[C@H](C3C[NH2+]C3)C2)cc1Cl ZINC001235340814 1098965176 /nfs/dbraw/zinc/96/51/76/1098965176.db2.gz MNNHSWGFNXRZQY-LBPRGKRZSA-N 2 0 322.880 3.384 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H](C3C[NH2+]C3)C2)cc1 ZINC001235342934 1098966550 /nfs/dbraw/zinc/96/65/50/1098966550.db2.gz YCAAKLDDPNCGHH-GOSISDBHSA-N 2 0 309.457 3.135 20 10 DGCDRP c1ccc([C@@H]2CC[N@H+]2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235949499 1099283248 /nfs/dbraw/zinc/28/32/48/1099283248.db2.gz MUYGZVHETMJYGI-FQEVSTJZSA-N 2 0 307.441 3.043 20 10 DGCDRP c1ccc(C[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C2CC2)cc1 ZINC001235994689 1099317671 /nfs/dbraw/zinc/31/76/71/1099317671.db2.gz VHFKUGMJRWQHSP-UHFFFAOYSA-N 2 0 321.468 3.261 20 10 DGCDRP CCC[N@H+](Cc1ccc(N(CC)CC)cc1O)C1CC[NH2+]CC1 ZINC001236182445 1099453216 /nfs/dbraw/zinc/45/32/16/1099453216.db2.gz PBJNIYBQFDSFAM-UHFFFAOYSA-N 2 0 319.493 3.202 20 10 DGCDRP CC(C)(C)c1ccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(O)c1 ZINC001236321802 1099535116 /nfs/dbraw/zinc/53/51/16/1099535116.db2.gz WPMHCYQFOJRCAJ-GASCZTMLSA-N 2 0 302.462 3.121 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236374084 1099560326 /nfs/dbraw/zinc/56/03/26/1099560326.db2.gz OXRHDKJJRWMESA-GOSISDBHSA-N 2 0 315.505 3.497 20 10 DGCDRP CC(C)C[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551473 1099677128 /nfs/dbraw/zinc/67/71/28/1099677128.db2.gz QPFFJZCUOMCRSJ-UAPYVXQJSA-N 2 0 303.494 3.481 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236598244 1099694934 /nfs/dbraw/zinc/69/49/34/1099694934.db2.gz JETZEWLCAAYVIU-GOSISDBHSA-N 2 0 313.489 3.251 20 10 DGCDRP Oc1cc(O)c(CN([C@H]2CC[NH2+]C2)C2CCCCC2)cc1Cl ZINC001236653712 1099724079 /nfs/dbraw/zinc/72/40/79/1099724079.db2.gz MIFHTIDSIRZPHH-AWEZNQCLSA-N 2 0 324.852 3.248 20 10 DGCDRP CC(C)[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236941532 1099881611 /nfs/dbraw/zinc/88/16/11/1099881611.db2.gz CHQXFCNTWYQXLN-LJQANCHMSA-N 2 0 319.468 3.198 20 10 DGCDRP CCCC[N@H+](CC)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236932418 1099882362 /nfs/dbraw/zinc/88/23/62/1099882362.db2.gz OPNPLRCOKWIXMU-UHFFFAOYSA-N 2 0 307.457 3.200 20 10 DGCDRP C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236938246 1099883314 /nfs/dbraw/zinc/88/33/14/1099883314.db2.gz IMRINUWJJJFHBK-JKSUJKDBSA-N 2 0 319.468 3.198 20 10 DGCDRP CCN(CCC[NH+](C)C)Cc1c(O)cccc1OC(F)(F)F ZINC001237113845 1099978050 /nfs/dbraw/zinc/97/80/50/1099978050.db2.gz FFAPUXVWKGMRQA-UHFFFAOYSA-N 2 0 320.355 3.064 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)[C@H]1CC[NH3+] ZINC001326465722 1103327678 /nfs/dbraw/zinc/32/76/78/1103327678.db2.gz WIIKHYJAHVXZDP-APWZRJJASA-N 2 0 301.478 3.236 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC[C@@]3(CCC[N@@H+](C)C3)C2)c(O)c1 ZINC001276366071 1103576061 /nfs/dbraw/zinc/57/60/61/1103576061.db2.gz YLUGUAWYJRGVNW-LJQANCHMSA-N 2 0 302.462 3.317 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c1O ZINC001328413267 1103938727 /nfs/dbraw/zinc/93/87/27/1103938727.db2.gz XHUREYDJVLDESA-UHFFFAOYSA-N 2 0 324.852 3.020 20 10 DGCDRP CC[C@@H](C)C[C@H](CC)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246171811 1104418683 /nfs/dbraw/zinc/41/86/83/1104418683.db2.gz DYLWRJOWJSHUPT-AEFFLSMTSA-N 2 0 303.494 3.401 20 10 DGCDRP CC(C)=CCC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246172258 1104419267 /nfs/dbraw/zinc/41/92/67/1104419267.db2.gz HDSVOJAQDQGMIA-QGZVFWFLSA-N 2 0 301.478 3.321 20 10 DGCDRP C[C@@H]1CC([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H](C)C1 ZINC001246172264 1104419378 /nfs/dbraw/zinc/41/93/78/1104419378.db2.gz HINDZYWEGGSYAV-HOTGVXAUSA-N 2 0 301.478 3.011 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](Cc3ccccc3)C2)cc1 ZINC001246314441 1104483809 /nfs/dbraw/zinc/48/38/09/1104483809.db2.gz XNCQSUNNSJXKHD-WOJBJXKFSA-N 2 0 323.484 3.206 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@H]2CC[NH2+][C@@H](C(C)(C)C)C2)cc1 ZINC001246901893 1104728672 /nfs/dbraw/zinc/72/86/72/1104728672.db2.gz PMJIIQJEUOCMFD-ZWKOTPCHSA-N 2 0 303.494 3.351 20 10 DGCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCCC4)cc3)CC[C@H]21 ZINC001319730167 1108614007 /nfs/dbraw/zinc/61/40/07/1108614007.db2.gz WOQUDHPMOHXMCT-AZUAARDMSA-N 2 0 313.489 3.203 20 10 DGCDRP CC(C)[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308920127 1111493776 /nfs/dbraw/zinc/49/37/76/1111493776.db2.gz ZWKMLGMQTHXQRB-UXHICEINSA-N 2 0 315.505 3.353 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273566836 130138240 /nfs/dbraw/zinc/13/82/40/130138240.db2.gz JTAWMMFLZAPNSS-HZPDHXFCSA-N 2 0 308.466 3.016 20 10 DGCDRP C[NH+](C)C[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000271177724 432346319 /nfs/dbraw/zinc/34/63/19/432346319.db2.gz KSSSFMUQZYDWEB-MRXNPFEDSA-N 2 0 310.441 3.443 20 10 DGCDRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1O ZINC000183591045 432306885 /nfs/dbraw/zinc/30/68/85/432306885.db2.gz AKVKYNWCZCZSPW-OAHLLOKOSA-N 2 0 311.429 3.354 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(O)c1 ZINC000185206724 432477183 /nfs/dbraw/zinc/47/71/83/432477183.db2.gz SFFWNLMLNYQFHO-IXDOHACOSA-N 2 0 320.477 3.241 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]C2CC[NH+](C(C)C)CC2)c1O ZINC000228670186 432719771 /nfs/dbraw/zinc/71/97/71/432719771.db2.gz OWAKEJNACBHQRV-UHFFFAOYSA-N 2 0 312.841 3.017 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)c(O)c1C ZINC000278778204 432900789 /nfs/dbraw/zinc/90/07/89/432900789.db2.gz YECNSVDHBIZTHE-RDJZCZTQSA-N 2 0 320.477 3.161 20 10 DGCDRP Cn1ccnc1[C@H]1CCC[N@H+](Cc2c([O-])ccc(Cl)c2F)C1 ZINC000373228798 433137984 /nfs/dbraw/zinc/13/79/84/433137984.db2.gz NDMJGQZWMGCKMN-NSHDSACASA-N 2 0 323.799 3.298 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1C ZINC000369701463 434598042 /nfs/dbraw/zinc/59/80/42/434598042.db2.gz FACDDCJOBQXZGN-UHFFFAOYSA-N 2 0 302.462 3.317 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000093683333 522181944 /nfs/dbraw/zinc/18/19/44/522181944.db2.gz ZUBSSYLRSLPKBH-SFHVURJKSA-N 2 0 301.478 3.060 20 10 DGCDRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000853247375 620681920 /nfs/dbraw/zinc/68/19/20/620681920.db2.gz NGIDFVPDYCYTOU-OAHLLOKOSA-N 2 0 317.399 3.234 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1CCCN1C)c1ccc(N2CCCCC2)cc1 ZINC000154507125 620682950 /nfs/dbraw/zinc/68/29/50/620682950.db2.gz UEEFAXXTFZTOBU-QFBILLFUSA-N 2 0 301.478 3.422 20 10 DGCDRP Oc1ccc2ccccc2c1C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000023847484 617793525 /nfs/dbraw/zinc/79/35/25/617793525.db2.gz UVZUOTKWUDHEHM-UHFFFAOYSA-N 2 0 319.408 3.263 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(N(C)C)cc1 ZINC000925782688 618618914 /nfs/dbraw/zinc/61/89/14/618618914.db2.gz MOZOFVJXCUVAFM-GDBMZVCRSA-N 2 0 311.420 3.038 20 10 DGCDRP C[C@H]1C[C@H](C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH2+]1 ZINC000841003264 619136834 /nfs/dbraw/zinc/13/68/34/619136834.db2.gz PDVJFGZHKCAUQH-PKOBYXMFSA-N 2 0 315.505 3.497 20 10 DGCDRP Cc1cccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1O ZINC000904476946 619924716 /nfs/dbraw/zinc/92/47/16/619924716.db2.gz VCDQDULWOXLYMF-PXNSSMCTSA-N 2 0 324.424 3.046 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C)[C@H](C[NH3+])C2)cc1F ZINC000841100817 620450696 /nfs/dbraw/zinc/45/06/96/620450696.db2.gz KXAPIIJVYUAAKJ-GOEBONIOSA-N 2 0 307.457 3.089 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)c2c1c(F)ccc2O ZINC000858490665 621197612 /nfs/dbraw/zinc/19/76/12/621197612.db2.gz LKSKNMYGRZHIGH-VNHYZAJKSA-N 2 0 306.425 3.401 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756639785 621655113 /nfs/dbraw/zinc/65/51/13/621655113.db2.gz FAIHJBLLEOFNCT-NFAWXSAZSA-N 2 0 324.440 3.026 20 10 DGCDRP C[NH+](C)CC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000768302562 622449440 /nfs/dbraw/zinc/44/94/40/622449440.db2.gz IHGSRLWMKZBJCA-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000768466746 622458656 /nfs/dbraw/zinc/45/86/56/622458656.db2.gz WAGCSHAJXUTMCU-INIZCTEOSA-N 2 0 316.489 3.435 20 10 DGCDRP C[C@@H](CCC1CC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000768950547 622487544 /nfs/dbraw/zinc/48/75/44/622487544.db2.gz AAUGBAAMSVSQTM-INIZCTEOSA-N 2 0 301.478 3.107 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N(C)C)c(F)c2)[C@@H](C)C1 ZINC000769488802 622533535 /nfs/dbraw/zinc/53/35/35/622533535.db2.gz ZOUALUIBYYBDRT-WMLDXEAASA-N 2 0 307.457 3.054 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC34CCC(CC3)C4)cc2)CC1 ZINC000771858541 622804917 /nfs/dbraw/zinc/80/49/17/622804917.db2.gz QSMZOAFXOBUSIR-UHFFFAOYSA-N 2 0 313.489 3.108 20 10 DGCDRP CC(C)[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000773145897 622991573 /nfs/dbraw/zinc/99/15/73/622991573.db2.gz NTVKOJVDAURQAF-QGZVFWFLSA-N 2 0 315.505 3.353 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000773755998 623068847 /nfs/dbraw/zinc/06/88/47/623068847.db2.gz SLIJERVIJGXVPV-LJQANCHMSA-N 2 0 315.505 3.306 20 10 DGCDRP c1cc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)cc2c1OCC2 ZINC000873232979 623085827 /nfs/dbraw/zinc/08/58/27/623085827.db2.gz UZHYLXRCPSNOTQ-GOSISDBHSA-N 2 0 300.446 3.024 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c2c1c(F)ccc2O ZINC000873244521 623089434 /nfs/dbraw/zinc/08/94/34/623089434.db2.gz MITFFRGYQYYDCV-BZPMIXESSA-N 2 0 306.425 3.447 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1O ZINC000873255943 623093581 /nfs/dbraw/zinc/09/35/81/623093581.db2.gz KWGSCKACCPAQTI-GAFUQQFSSA-N 2 0 302.340 3.189 20 10 DGCDRP CC(C)[C@H](C)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775637299 623301201 /nfs/dbraw/zinc/30/12/01/623301201.db2.gz ONUJEFQJIOMOFM-KRWDZBQOSA-N 2 0 315.505 3.447 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C ZINC000775669177 623310153 /nfs/dbraw/zinc/31/01/53/623310153.db2.gz TVXKLQOKJXQTTE-SJORKVTESA-N 2 0 301.478 3.059 20 10 DGCDRP Cc1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c(O)c1 ZINC000877007438 623764993 /nfs/dbraw/zinc/76/49/93/623764993.db2.gz PYKDXDGWVBEWPU-IBGZPJMESA-N 2 0 324.468 3.355 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cc1 ZINC000877685157 623992148 /nfs/dbraw/zinc/99/21/48/623992148.db2.gz NWWANJUWIUZSIL-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000877711694 624002023 /nfs/dbraw/zinc/00/20/23/624002023.db2.gz VSTJAQQYQWPCSJ-UHFFFAOYSA-N 2 0 303.494 3.414 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1 ZINC000796694978 626073968 /nfs/dbraw/zinc/07/39/68/626073968.db2.gz NDBBWXOBMBIMAB-UHFFFAOYSA-N 2 0 303.494 3.495 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000809767353 626949257 /nfs/dbraw/zinc/94/92/57/626949257.db2.gz INHYXCFYTYQDRW-QUCCMNQESA-N 2 0 315.505 3.449 20 10 DGCDRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1c([O-])cccc1F ZINC000886496752 627153158 /nfs/dbraw/zinc/15/31/58/627153158.db2.gz GOMAQCUBOYNHHG-CYBMUJFWSA-N 2 0 302.393 3.444 20 10 DGCDRP C[NH+]1CCN(c2ccc(CNc3cccc(C4CC4)n3)cc2)CC1 ZINC000815143640 627636675 /nfs/dbraw/zinc/63/66/75/627636675.db2.gz MWZPKRJFTZIMMG-UHFFFAOYSA-N 2 0 322.456 3.323 20 10 DGCDRP CC1(C)[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925543640 627751132 /nfs/dbraw/zinc/75/11/32/627751132.db2.gz NIZYANAQFZRDRI-CEXWTWQISA-N 2 0 313.489 3.153 20 10 DGCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cc(Cl)ccc1O ZINC000925777873 627793846 /nfs/dbraw/zinc/79/38/46/627793846.db2.gz RGYSPTAYRLMUKL-GXFFZTMASA-N 2 0 318.795 3.331 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc2ccccc2c1O ZINC000925787019 627795771 /nfs/dbraw/zinc/79/57/71/627795771.db2.gz YRKGHOPMSWGIAE-JSGCOSHPSA-N 2 0 320.383 3.441 20 10 DGCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)CC[C@H]21 ZINC000816521240 627801826 /nfs/dbraw/zinc/80/18/26/627801826.db2.gz KLUPJGIADMOLFN-VQIMIIECSA-N 2 0 310.441 3.462 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000817893623 627954524 /nfs/dbraw/zinc/95/45/24/627954524.db2.gz GHQGAXHROMKICN-XUVXKRRUSA-N 2 0 315.505 3.461 20 10 DGCDRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Br)cc1O ZINC000817948069 627971371 /nfs/dbraw/zinc/97/13/71/627971371.db2.gz UDPDAXCNNWZWML-GCVQQVDUSA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000817957254 627973932 /nfs/dbraw/zinc/97/39/32/627973932.db2.gz KEGYKEIEVKDNGW-XLIONFOSSA-N 2 0 323.484 3.312 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000817963816 627976761 /nfs/dbraw/zinc/97/67/61/627976761.db2.gz VRECOSXHLSEVFL-QWHCGFSZSA-N 2 0 300.402 3.271 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2c1c(F)ccc2O ZINC000817968546 627979030 /nfs/dbraw/zinc/97/90/30/627979030.db2.gz LIKUULRVQGKKFO-ZBEGNZNMSA-N 2 0 312.388 3.473 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000817970852 627980291 /nfs/dbraw/zinc/98/02/91/627980291.db2.gz GFQRNIGTUZQDSL-RYRKJORJSA-N 2 0 301.478 3.468 20 10 DGCDRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc2c(cc1O)CCCC2 ZINC000817979532 627981666 /nfs/dbraw/zinc/98/16/66/627981666.db2.gz BQRGSTYEFBBFFS-WMLDXEAASA-N 2 0 302.462 3.454 20 10 DGCDRP CC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1cc(Br)ccc1O ZINC000817977884 627981920 /nfs/dbraw/zinc/98/19/20/627981920.db2.gz RCNHNYAHBCUSQA-GWCFXTLKSA-N 2 0 315.255 3.323 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)cc1 ZINC000818431416 628022435 /nfs/dbraw/zinc/02/24/35/628022435.db2.gz LPTINVMIAXSUEB-QGZVFWFLSA-N 2 0 315.505 3.497 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1Cl ZINC000824933042 628708969 /nfs/dbraw/zinc/70/89/69/628708969.db2.gz ATLPQPPEKUDHKR-CZUORRHYSA-N 2 0 308.853 3.270 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](CCF)C3)cc2)CC1 ZINC000827270787 628943780 /nfs/dbraw/zinc/94/37/80/628943780.db2.gz FZHYKAXNHNFGFI-KRWDZBQOSA-N 2 0 319.468 3.010 20 10 DGCDRP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000834514393 629719911 /nfs/dbraw/zinc/71/99/11/629719911.db2.gz VNTAHDLHLWMFMZ-INMHGKMJSA-N 2 0 302.462 3.337 20 10 DGCDRP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000834514389 629719923 /nfs/dbraw/zinc/71/99/23/629719923.db2.gz VNTAHDLHLWMFMZ-BFYDXBDKSA-N 2 0 302.462 3.337 20 10 DGCDRP CCC[NH+]1CCC(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835036169 629830350 /nfs/dbraw/zinc/83/03/50/629830350.db2.gz AVTGDESHJRJAFN-AATRIKPKSA-N 2 0 315.505 3.477 20 10 DGCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835035244 629830603 /nfs/dbraw/zinc/83/06/03/629830603.db2.gz FADIEOGVTHEURB-FZMUQLTDSA-N 2 0 301.478 3.087 20 10 DGCDRP CC(C)C[NH+]1CCC([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835035163 629830641 /nfs/dbraw/zinc/83/06/41/629830641.db2.gz GIIFSCHNOTVFDD-AATRIKPKSA-N 2 0 315.505 3.476 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1 ZINC000835044127 629834009 /nfs/dbraw/zinc/83/40/09/629834009.db2.gz WWKPLOHTMDHXRN-IIFCEKJISA-N 2 0 301.478 3.228 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N(C)C)cc2C)C[C@@H]1C ZINC000840918607 630378130 /nfs/dbraw/zinc/37/81/30/630378130.db2.gz WPYZFDVNIPAARU-LPHOPBHVSA-N 2 0 303.494 3.366 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000840940417 630381120 /nfs/dbraw/zinc/38/11/20/630381120.db2.gz YTAMFHUOSDRMJB-UHFFFAOYSA-N 2 0 301.478 3.121 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000841029803 630398199 /nfs/dbraw/zinc/39/81/99/630398199.db2.gz SKOYVDFQVQLRGY-CYBMUJFWSA-N 2 0 300.402 3.100 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000841086249 630405982 /nfs/dbraw/zinc/40/59/82/630405982.db2.gz GPMAUTXMAXRQBB-ICSRJNTNSA-N 2 0 315.505 3.497 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000841086250 630406190 /nfs/dbraw/zinc/40/61/90/630406190.db2.gz GPMAUTXMAXRQBB-QUCCMNQESA-N 2 0 315.505 3.497 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cc1 ZINC000842765482 630573510 /nfs/dbraw/zinc/57/35/10/630573510.db2.gz WRAAZWZCPGOMBY-CTNGQTDRSA-N 2 0 323.484 3.188 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)cc1 ZINC000843043652 630607540 /nfs/dbraw/zinc/60/75/40/630607540.db2.gz ATECCGBFYCKNLD-DPZZJQGRSA-N 2 0 313.489 3.230 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c1O ZINC000843044190 630607745 /nfs/dbraw/zinc/60/77/45/630607745.db2.gz AAIDTKXVHYXBJM-INIZCTEOSA-N 2 0 308.853 3.318 20 10 DGCDRP CCN(Cc1ccccc1)c1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1 ZINC000843048388 630608121 /nfs/dbraw/zinc/60/81/21/630608121.db2.gz QBOUFWWLPGKUBG-HXUWFJFHSA-N 2 0 323.484 3.494 20 10 DGCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126047 630616714 /nfs/dbraw/zinc/61/67/14/630616714.db2.gz FFULDVJIRJXCNT-ZIAGYGMSSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cc1C ZINC000843128282 630617301 /nfs/dbraw/zinc/61/73/01/630617301.db2.gz VQNBZNBQIBCDCR-DLBZAZTESA-N 2 0 302.462 3.221 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2F)c2c1c(F)ccc2O ZINC000844923743 630985768 /nfs/dbraw/zinc/98/57/68/630985768.db2.gz JRXYCQUFQDCRJQ-ZUZCIYMTSA-N 2 0 318.367 3.467 20 10 DGCDRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000844926440 630988080 /nfs/dbraw/zinc/98/80/80/630988080.db2.gz UJJDSKOXYWSCRT-CQSZACIVSA-N 2 0 302.462 3.311 20 10 DGCDRP COc1cccc([C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1O ZINC000846142714 631211547 /nfs/dbraw/zinc/21/15/47/631211547.db2.gz CCCWKOMFITVRIE-XJKSGUPXSA-N 2 0 308.466 3.418 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1 ZINC000849349774 631900381 /nfs/dbraw/zinc/90/03/81/631900381.db2.gz HAGVVTOPMDNZKX-MRXNPFEDSA-N 2 0 318.461 3.003 20 10 DGCDRP Oc1ccccc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000179582285 655909011 /nfs/dbraw/zinc/90/90/11/655909011.db2.gz ZILNKAOOYRXOIB-UHFFFAOYSA-N 2 0 302.462 3.480 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000840931200 656445681 /nfs/dbraw/zinc/44/56/81/656445681.db2.gz VBGZQFCIVYRFRK-UHFFFAOYSA-N 2 0 301.478 3.168 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000164392287 658930410 /nfs/dbraw/zinc/93/04/10/658930410.db2.gz LOSPKDPJDFBOEZ-AWEZNQCLSA-N 2 0 320.477 3.082 20 10 DGCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3c(O)ccc4ccccc43)CC[C@@H]21 ZINC000164623916 658939599 /nfs/dbraw/zinc/93/95/99/658939599.db2.gz QQFCNDVOSPAYRZ-LPHOPBHVSA-N 2 0 310.441 3.462 20 10 DGCDRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000324199188 659609240 /nfs/dbraw/zinc/60/92/40/659609240.db2.gz XZWWRMTYMSEICK-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000192920206 662115849 /nfs/dbraw/zinc/11/58/49/662115849.db2.gz IXLSBLCQJOEHIM-HXUWFJFHSA-N 2 0 323.484 3.364 20 10 DGCDRP Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000383936772 685169403 /nfs/dbraw/zinc/16/94/03/685169403.db2.gz CYFVMAOFPWUYRU-MJGOQNOKSA-N 2 0 322.452 3.491 20 10 DGCDRP CN(C)c1ccc([C@@H](N)C[NH2+]Cc2ccc3[nH]ccc3c2)cc1 ZINC001578424776 1191942398 /nfs/dbraw/zinc/94/23/98/1191942398.db2.gz VGNTZLWHAZDCJK-SFHVURJKSA-N 2 0 308.429 3.024 20 10 DGCDRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001335947481 1178974752 /nfs/dbraw/zinc/97/47/52/1178974752.db2.gz JQHLGJLFIUHASR-FQEVSTJZSA-N 2 0 315.505 3.484 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3cc(Cl)ccc3O)C[C@@H]2C1 ZINC001352114252 1180299197 /nfs/dbraw/zinc/29/91/97/1180299197.db2.gz ZKNRPPKWHDEAAS-HEHGZKQESA-N 2 0 308.853 3.208 20 10 DGCDRP C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C ZINC001461002476 1182753680 /nfs/dbraw/zinc/75/36/80/1182753680.db2.gz WPPMLXIYQUWLKZ-MBOZVWFJSA-N 2 0 315.505 3.353 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c(O)c1 ZINC001461935532 1182881242 /nfs/dbraw/zinc/88/12/42/1182881242.db2.gz OBDSJRSXAVZZQW-MRXNPFEDSA-N 2 0 318.461 3.160 20 10 DGCDRP CC(C)C[C@@H](CN1CCCC1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001474155740 1183874779 /nfs/dbraw/zinc/87/47/79/1183874779.db2.gz NVTNYQJHYPVEKJ-SFHVURJKSA-N 2 0 302.462 3.222 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]Cc2ccc3c[nH+]cn3c2)cc1 ZINC001474173993 1183877234 /nfs/dbraw/zinc/87/72/34/1183877234.db2.gz HJIPDRZUIVDLHF-ARJAWSKDSA-N 2 0 306.413 3.203 20 10 DGCDRP COc1cc(C)c(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c(O)c1 ZINC001474350740 1183908593 /nfs/dbraw/zinc/90/85/93/1183908593.db2.gz OYULHLIQGSYOAK-OAHLLOKOSA-N 2 0 306.450 3.015 20 10 DGCDRP COc1cc(C)c(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)c(O)c1 ZINC001561034252 1189423129 /nfs/dbraw/zinc/42/31/29/1189423129.db2.gz LCCKCJBZGLJYBI-UHFFFAOYSA-N 2 0 318.461 3.206 20 10 DGCDRP CCC[NH+]1CCC([N@H+](C)Cc2c(C)cc(OC)cc2O)CC1 ZINC001621168852 1193812548 /nfs/dbraw/zinc/81/25/48/1193812548.db2.gz MMYFJCIMUHONBI-UHFFFAOYSA-N 2 0 306.450 3.015 20 10 DGCDRP CCCC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCC1 ZINC001650771303 1195380172 /nfs/dbraw/zinc/38/01/72/1195380172.db2.gz AJFLGFZGKDUZEH-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)c1 ZINC001658028668 1196204207 /nfs/dbraw/zinc/20/42/07/1196204207.db2.gz YTDSFGCHOOQTFO-WMZOPIPTSA-N 2 0 302.462 3.432 20 10 DGCDRP CCC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCC1 ZINC001659915276 1196428731 /nfs/dbraw/zinc/42/87/31/1196428731.db2.gz NTIISOSXAFTBKM-FQEVSTJZSA-N 2 0 315.505 3.497 20 10 DGCDRP CN(c1ccc2c(c1)C[N@@H+](Cc1ccccc1)C2)C(C)(C)C[NH3+] ZINC001170059875 1081972337 /nfs/dbraw/zinc/97/23/37/1081972337.db2.gz WRPYVYSHADBXBA-UHFFFAOYSA-N 2 0 309.457 3.376 20 10 DGCDRP Cc1c(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c2ccccc2n1C ZINC001204735176 1084941682 /nfs/dbraw/zinc/94/16/82/1084941682.db2.gz MUDVLRFDCNFUJM-UHFFFAOYSA-N 2 0 311.473 3.452 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168388098 1087547959 /nfs/dbraw/zinc/54/79/59/1087547959.db2.gz BFGHBSNEKMSFRE-UHFFFAOYSA-N 2 0 301.478 3.059 20 10 DGCDRP CCOc1cccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c1O ZINC001203609291 1090766609 /nfs/dbraw/zinc/76/66/09/1090766609.db2.gz OUUAQFMUMBFJSL-UHFFFAOYSA-N 2 0 320.477 3.343 20 10 DGCDRP CCCC[NH+]1CCC([N@H+](C)Cc2cc(OC)ccc2O)CC1 ZINC001203684234 1090779991 /nfs/dbraw/zinc/77/99/91/1090779991.db2.gz PIFWKKITJXIDMP-UHFFFAOYSA-N 2 0 306.450 3.097 20 10 DGCDRP C[N@H+](CCC[NH+]1CCCC1)Cc1ccc(N2CCCC2)cc1 ZINC001204327004 1090949780 /nfs/dbraw/zinc/94/97/80/1090949780.db2.gz LFTQHVOUJRJPGE-UHFFFAOYSA-N 2 0 301.478 3.205 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C[C@H]1C[NH3+] ZINC001205296193 1091168970 /nfs/dbraw/zinc/16/89/70/1091168970.db2.gz IRBFHQLHAHWXCU-NVXWUHKLSA-N 2 0 311.473 3.323 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)CC[C@@H]1C[NH3+] ZINC001205638466 1091292881 /nfs/dbraw/zinc/29/28/81/1091292881.db2.gz OGRFWSGNYOTUFI-HUUCEWRRSA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)CC[C@H]1C[NH3+] ZINC001205638464 1091292980 /nfs/dbraw/zinc/29/29/80/1091292980.db2.gz OGRFWSGNYOTUFI-CABCVRRESA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC[C@@H]1C[NH3+] ZINC001205638615 1091293253 /nfs/dbraw/zinc/29/32/53/1091293253.db2.gz PYMHIKXTIDKSDM-VXGBXAGGSA-N 2 0 316.367 3.218 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c1 ZINC001205786771 1091348502 /nfs/dbraw/zinc/34/85/02/1091348502.db2.gz BGCCMPUNSYBVFW-AWEZNQCLSA-N 2 0 312.404 3.106 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCC[C@H]1C[NH3+] ZINC001205993487 1091440047 /nfs/dbraw/zinc/44/00/47/1091440047.db2.gz HUGBBOXACYZIFG-AEFFLSMTSA-N 2 0 301.478 3.094 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@H](C)[C@@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139255245 1091501182 /nfs/dbraw/zinc/50/11/82/1091501182.db2.gz OMRLRZZXBLQKBE-GJZGRUSLSA-N 2 0 320.477 3.330 20 10 DGCDRP COc1cc(C[N@H+](CC2CC2)C(C)C)cc(C[NH+](C)C)c1O ZINC001139256993 1091501648 /nfs/dbraw/zinc/50/16/48/1091501648.db2.gz OFGWQESYUCRRHN-UHFFFAOYSA-N 2 0 306.450 3.083 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3CC4(C3)CCCCC4)cc2)CC1 ZINC001139413119 1091552104 /nfs/dbraw/zinc/55/21/04/1091552104.db2.gz RMGWCEBJXMDGQR-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@](C)(F)C3)cc2)CC1 ZINC001139409077 1091552490 /nfs/dbraw/zinc/55/24/90/1091552490.db2.gz VBSMPXXQRNSIEP-LJQANCHMSA-N 2 0 319.468 3.153 20 10 DGCDRP C[C@H]1C[NH2+]CC[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001206285299 1091561782 /nfs/dbraw/zinc/56/17/82/1091561782.db2.gz LAKYBRWJSAMVOM-AWEZNQCLSA-N 2 0 314.404 3.240 20 10 DGCDRP Cc1cc(N2CC[NH+](Cc3c(C)ccc(C)c3O)CC2)cc[nH+]1 ZINC001140184983 1091795494 /nfs/dbraw/zinc/79/54/94/1091795494.db2.gz NBASELHWGVCRNX-UHFFFAOYSA-N 2 0 311.429 3.035 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC3(C)C)cc2)CC1 ZINC001140300007 1091818581 /nfs/dbraw/zinc/81/85/81/1091818581.db2.gz INPFXMQWBYUSDJ-UHFFFAOYSA-N 2 0 301.478 3.203 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)C3CCCC3)cc2)CC1 ZINC001140304282 1091819563 /nfs/dbraw/zinc/81/95/63/1091819563.db2.gz LSIYJRXOICIMBJ-UHFFFAOYSA-N 2 0 301.478 3.203 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](CF)C3)cc2)CC1 ZINC001140304542 1091819785 /nfs/dbraw/zinc/81/97/85/1091819785.db2.gz UFGNSMJPDNTQGG-GOSISDBHSA-N 2 0 319.468 3.010 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](CF)C3)cc2)CC1 ZINC001140304543 1091820127 /nfs/dbraw/zinc/82/01/27/1091820127.db2.gz UFGNSMJPDNTQGG-SFHVURJKSA-N 2 0 319.468 3.010 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C)[C@@H]3C)cc2)CC1 ZINC001140304028 1091820281 /nfs/dbraw/zinc/82/02/81/1091820281.db2.gz FBAMUINLKJBCNZ-ROUUACIJSA-N 2 0 315.505 3.449 20 10 DGCDRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(C(F)(F)F)cc1O ZINC001276505858 1091836010 /nfs/dbraw/zinc/83/60/10/1091836010.db2.gz ZVXNNQUVJFMRKH-AGUYFDCRSA-N 2 0 314.351 3.126 20 10 DGCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(-n4c(C)ccc4C)cc3)C[C@@H]2C1 ZINC001209520500 1092808264 /nfs/dbraw/zinc/80/82/64/1092808264.db2.gz ZQOCJWIQNPDDKG-BGYRXZFFSA-N 2 0 323.484 3.478 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c1 ZINC001222149033 1095459110 /nfs/dbraw/zinc/45/91/10/1095459110.db2.gz VIXQQFINDKSHRW-IBGZPJMESA-N 2 0 302.462 3.265 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CC([NH3+])C3)CC2)cc1 ZINC001222211847 1095495467 /nfs/dbraw/zinc/49/54/67/1095495467.db2.gz NXTWVZJKRBACBU-UHFFFAOYSA-N 2 0 301.478 3.236 20 10 DGCDRP CCN(CC)c1ccc(CN2CCC[C@]23CCC[NH2+]C3)cc1 ZINC001222237472 1095505840 /nfs/dbraw/zinc/50/58/40/1095505840.db2.gz KUBGJSSYSCUXQC-IBGZPJMESA-N 2 0 301.478 3.251 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@]3(CCC[NH2+]C3)C2)ccc1N(C)C ZINC001222265803 1095521563 /nfs/dbraw/zinc/52/15/63/1095521563.db2.gz ZLRALSOIXQBPPQ-IBGZPJMESA-N 2 0 301.478 3.027 20 10 DGCDRP Cc1cc(CN2CCC3(CCCC[NH2+]3)CC2)ccc1N(C)C ZINC001222293538 1095532838 /nfs/dbraw/zinc/53/28/38/1095532838.db2.gz WPHVIBPNUGZZIS-UHFFFAOYSA-N 2 0 301.478 3.169 20 10 DGCDRP CC(C)c1ccc(C[NH+]2CCC3(CCC[NH2+]C3)CC2)c(O)c1 ZINC001222457620 1095623421 /nfs/dbraw/zinc/62/34/21/1095623421.db2.gz SRSNQYUNPQMDSU-UHFFFAOYSA-N 2 0 302.462 3.481 20 10 DGCDRP Cc1cc(C[N@@H+]2CC[C@H]3C[NH2+]CC[C@H]32)c(C)n1-c1ccccc1 ZINC001222620296 1095695368 /nfs/dbraw/zinc/69/53/68/1095695368.db2.gz LMJCLTHQAXSVKJ-FXAWDEMLSA-N 2 0 309.457 3.278 20 10 DGCDRP CC(C)(C)c1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c(O)c1 ZINC001222629459 1095699717 /nfs/dbraw/zinc/69/97/17/1095699717.db2.gz IBXQDNRBQGPSFM-GASCZTMLSA-N 2 0 302.462 3.121 20 10 DGCDRP C[N@@H+]1CC[C@]2(CC[NH+](Cc3cc(C(C)(C)C)ccc3O)C2)C1 ZINC001233286919 1098276669 /nfs/dbraw/zinc/27/66/69/1098276669.db2.gz OPCLHGTXPWULAV-IBGZPJMESA-N 2 0 302.462 3.217 20 10 DGCDRP Cc1ccc(C)c(C[N@@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1O ZINC001235155293 1098842183 /nfs/dbraw/zinc/84/21/83/1098842183.db2.gz OAWCTKILCUEAFB-SFHVURJKSA-N 2 0 302.462 3.363 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c(O)c1 ZINC001235157021 1098842874 /nfs/dbraw/zinc/84/28/74/1098842874.db2.gz PXGHGSDBIMKSGT-GOSISDBHSA-N 2 0 318.461 3.063 20 10 DGCDRP Cc1cc(F)cc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c1O ZINC001235237152 1098910159 /nfs/dbraw/zinc/91/01/59/1098910159.db2.gz JPYGPUMTBIYXOW-QGZVFWFLSA-N 2 0 306.425 3.194 20 10 DGCDRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](Cc1cccc(-c3ccccc3)c1O)C2 ZINC001235246491 1098919740 /nfs/dbraw/zinc/91/97/40/1098919740.db2.gz XSROMPGGRJPZHV-YLJYHZDGSA-N 2 0 308.425 3.372 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@@H]3F)cc1 ZINC001235403695 1099001977 /nfs/dbraw/zinc/00/19/77/1099001977.db2.gz LVFIAPALVAMNIJ-RBUKOAKNSA-N 2 0 319.468 3.056 20 10 DGCDRP C[NH2+]CC1CC[NH+](Cc2ccc(N(C)C)c3ccccc23)CC1 ZINC001235678544 1099122516 /nfs/dbraw/zinc/12/25/16/1099122516.db2.gz MOPZQTNGQNSNKQ-UHFFFAOYSA-N 2 0 311.473 3.337 20 10 DGCDRP C[N@@H+](Cc1ccc(C(C)(C)C)cc1O)CC1CC[NH+](C)CC1 ZINC001235685380 1099127099 /nfs/dbraw/zinc/12/70/99/1099127099.db2.gz PIPGKQTUVLKEGW-UHFFFAOYSA-N 2 0 304.478 3.463 20 10 DGCDRP CC(C)(C)c1cc(O)c(C[N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)cc1Cl ZINC001235936105 1099271439 /nfs/dbraw/zinc/27/14/39/1099271439.db2.gz HTEBVWQSNUPRCT-OCCSQVGLSA-N 2 0 322.880 3.384 20 10 DGCDRP Cc1cc(F)cc(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1O ZINC001236459818 1099623114 /nfs/dbraw/zinc/62/31/14/1099623114.db2.gz ZQYNCTJRYIRVCM-UHFFFAOYSA-N 2 0 308.441 3.440 20 10 DGCDRP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(F)ccc2O)CC2CCC2)CC1 ZINC001236542465 1099672748 /nfs/dbraw/zinc/67/27/48/1099672748.db2.gz RBKWPKPYTRYPNW-QAQDUYKDSA-N 2 0 306.425 3.403 20 10 DGCDRP CN1CCCc2cc(C[N@H+](C3CCC3)C3CC[NH2+]CC3)ccc21 ZINC001236633740 1099714775 /nfs/dbraw/zinc/71/47/75/1099714775.db2.gz KZVIQIMLPZHWDP-UHFFFAOYSA-N 2 0 313.489 3.176 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c2ccccc21 ZINC001236817501 1099805127 /nfs/dbraw/zinc/80/51/27/1099805127.db2.gz CCFCBWGYYRBTCI-IPELMVKDSA-N 2 0 309.457 3.075 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)CC(C)C ZINC001236948957 1099888804 /nfs/dbraw/zinc/88/88/04/1099888804.db2.gz YKOLOEZAUVYNQU-UHFFFAOYSA-N 2 0 321.484 3.446 20 10 DGCDRP C[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001237189071 1100022962 /nfs/dbraw/zinc/02/29/62/1100022962.db2.gz UJOPNBJUXXYJON-SAABIXHNSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246524133 1104577064 /nfs/dbraw/zinc/57/70/64/1104577064.db2.gz JSJXMIVYPLQFAZ-RDTXWAMCSA-N 2 0 314.473 3.364 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@]3(CCC[NH+](C)C3)C2)c1O ZINC001275271759 1104698321 /nfs/dbraw/zinc/69/83/21/1104698321.db2.gz XSNFIOUOKGVSPE-IBGZPJMESA-N 2 0 318.461 3.099 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)C2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001246901318 1104728991 /nfs/dbraw/zinc/72/89/91/1104728991.db2.gz LVVZCKFOPRFFOW-UHFFFAOYSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C[C@H](CC)[NH2+]1 ZINC001246901099 1104729230 /nfs/dbraw/zinc/72/92/30/1104729230.db2.gz KMARENHPUWCUSS-IZZQQSIFSA-N 2 0 303.494 3.494 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246924021 1104738678 /nfs/dbraw/zinc/73/86/78/1104738678.db2.gz LKOQGSCZAIANCX-PMACEKPBSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H](C)C1 ZINC001258152226 1106681919 /nfs/dbraw/zinc/68/19/19/1106681919.db2.gz UDJYCEYDZUHCFH-DZFIZOCASA-N 2 0 315.505 3.353 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCCCC[NH+]2CCCCC2)c1O ZINC001262109966 1107621902 /nfs/dbraw/zinc/62/19/02/1107621902.db2.gz MOXZSXJNZHVTSF-UHFFFAOYSA-N 2 0 320.477 3.455 20 10 DGCDRP CC(C)[C@@H]1CC[N@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001323332313 1107938600 /nfs/dbraw/zinc/93/86/00/1107938600.db2.gz YEJGNLAYCHLJSB-QGZVFWFLSA-N 2 0 319.468 3.055 20 10 DGCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCCC4)cc3)CC[C@@H]21 ZINC001319730169 1108614091 /nfs/dbraw/zinc/61/40/91/1108614091.db2.gz WOQUDHPMOHXMCT-QUCCMNQESA-N 2 0 313.489 3.203 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)cc1F ZINC001308553127 1111443267 /nfs/dbraw/zinc/44/32/67/1111443267.db2.gz HETCWGRLVYBSND-XYJFISCASA-N 2 0 319.468 3.102 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000284297106 131067911 /nfs/dbraw/zinc/06/79/11/131067911.db2.gz YKELALAXAUHOJN-CVEARBPZSA-N 2 0 308.466 3.016 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000093683800 431916702 /nfs/dbraw/zinc/91/67/02/431916702.db2.gz ITGHMGFQCNJGEB-MRXNPFEDSA-N 2 0 318.461 3.099 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1O ZINC000183428116 432293670 /nfs/dbraw/zinc/29/36/70/432293670.db2.gz XJEJRAHCZRJRKO-HNNXBMFYSA-N 2 0 314.429 3.183 20 10 DGCDRP CCC[N@H+](Cc1ccc(-n2ccnc2)nc1)Cc1ccccc1O ZINC000177097062 432584599 /nfs/dbraw/zinc/58/45/99/432584599.db2.gz DZLSXRWUXWWTFE-UHFFFAOYSA-N 2 0 322.412 3.385 20 10 DGCDRP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000178254465 432711759 /nfs/dbraw/zinc/71/17/59/432711759.db2.gz BAGBICGNSUNGJJ-HNNXBMFYSA-N 2 0 301.478 3.278 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)c(O)c1C ZINC000278778206 432900646 /nfs/dbraw/zinc/90/06/46/432900646.db2.gz YECNSVDHBIZTHE-WBVHZDCISA-N 2 0 320.477 3.161 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c(O)c1 ZINC000293661037 433821698 /nfs/dbraw/zinc/82/16/98/433821698.db2.gz NXPACNWRBZZWOI-LJQANCHMSA-N 2 0 318.461 3.099 20 10 DGCDRP Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000131343921 526357234 /nfs/dbraw/zinc/35/72/34/526357234.db2.gz VQNWOJGJEKOSIJ-INIZCTEOSA-N 2 0 310.441 3.463 20 10 DGCDRP CCOc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c(O)c1 ZINC000853093588 620667975 /nfs/dbraw/zinc/66/79/75/620667975.db2.gz OQDZWKARBGWDDH-INIZCTEOSA-N 2 0 318.461 3.003 20 10 DGCDRP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1C ZINC000853093986 620668037 /nfs/dbraw/zinc/66/80/37/620668037.db2.gz VTIVCRUMGUTVQJ-SFHVURJKSA-N 2 0 302.462 3.215 20 10 DGCDRP CC[N@H+](CCC[NH+]1CCCC1)Cc1cc(C)cc(OC)c1O ZINC000894776707 618453923 /nfs/dbraw/zinc/45/39/23/618453923.db2.gz JVXWJETVEXQBGY-UHFFFAOYSA-N 2 0 306.450 3.017 20 10 DGCDRP CCOc1cccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1O ZINC000841030541 619166455 /nfs/dbraw/zinc/16/64/55/619166455.db2.gz XXQQGLXEYLVMSO-CYBMUJFWSA-N 2 0 300.402 3.100 20 10 DGCDRP C[C@]1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCC[NH2+]C1 ZINC000841056048 619249138 /nfs/dbraw/zinc/24/91/38/619249138.db2.gz AYRMEZHVVFSHMP-IBGZPJMESA-N 2 0 301.478 3.156 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000858179550 621162098 /nfs/dbraw/zinc/16/20/98/621162098.db2.gz NWTPWPKHXGRDBL-AEFFLSMTSA-N 2 0 317.521 3.454 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000839182846 621344085 /nfs/dbraw/zinc/34/40/85/621344085.db2.gz QPFDCHTUEQSOOH-JXTAAOLFSA-N 2 0 301.478 3.087 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@@H]1CC=CCC1 ZINC000753574738 621449938 /nfs/dbraw/zinc/44/99/38/621449938.db2.gz DQFBGSPQGZBJSK-GOSISDBHSA-N 2 0 313.489 3.227 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2c1c(F)ccc2O ZINC000756416033 621636938 /nfs/dbraw/zinc/63/69/38/621636938.db2.gz GIIFYOKAJFILNV-CXTNEJHOSA-N 2 0 304.409 3.296 20 10 DGCDRP C[C@H]1CC[C@H](NCc2ccc(N(C)C)cc2C(F)(F)F)C[NH2+]1 ZINC000863649698 621693238 /nfs/dbraw/zinc/69/32/38/621693238.db2.gz GTTZKTFSJYQHEN-AAEUAGOBSA-N 2 0 315.383 3.002 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000757675107 621732839 /nfs/dbraw/zinc/73/28/39/621732839.db2.gz ZYBJTKDQRPVOJV-DZGCQCFKSA-N 2 0 324.440 3.028 20 10 DGCDRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC000768301899 622449302 /nfs/dbraw/zinc/44/93/02/622449302.db2.gz FAIPUZCXXLIGAO-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP COc1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c(O)cc1C ZINC000768465886 622458235 /nfs/dbraw/zinc/45/82/35/622458235.db2.gz RTDQSUPYGJVKOM-UHFFFAOYSA-N 2 0 320.477 3.263 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(O)c1 ZINC000769467701 622530194 /nfs/dbraw/zinc/53/01/94/622530194.db2.gz ZRUYYRGGLIYSOG-KRWDZBQOSA-N 2 0 318.461 3.241 20 10 DGCDRP CCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)c(O)c1 ZINC000769470746 622530990 /nfs/dbraw/zinc/53/09/90/622530990.db2.gz OTNBYTGUMINLNU-GDBMZVCRSA-N 2 0 306.450 3.096 20 10 DGCDRP C[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000771854067 622803687 /nfs/dbraw/zinc/80/36/87/622803687.db2.gz PYJBHFOYBKNOBC-MRXNPFEDSA-N 2 0 303.494 3.210 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c2c1c(F)ccc2O ZINC000873263690 623097099 /nfs/dbraw/zinc/09/70/99/623097099.db2.gz KBPUHFMBMOKQLK-AIUMHDJVSA-N 2 0 304.409 3.200 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+](CC3CC3)CC3CC3)cc2)CC1 ZINC000775701672 623316001 /nfs/dbraw/zinc/31/60/01/623316001.db2.gz JQOJVYJHUBOGHI-UHFFFAOYSA-N 2 0 313.489 3.060 20 10 DGCDRP C[C@@H]1CCCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775702087 623316061 /nfs/dbraw/zinc/31/60/61/623316061.db2.gz POPNMWRTSWZMFB-QGZVFWFLSA-N 2 0 301.478 3.203 20 10 DGCDRP C[C@H](c1ccccn1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000780893853 623995470 /nfs/dbraw/zinc/99/54/70/623995470.db2.gz UFEFUMMCDROJAE-QGZVFWFLSA-N 2 0 324.472 3.026 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C3CC(C)(C)C3)cc2F)CC1 ZINC000788577427 625220237 /nfs/dbraw/zinc/22/02/37/625220237.db2.gz MLYMSNCDFIGROI-UHFFFAOYSA-N 2 0 319.468 3.246 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccsc1 ZINC000800888474 626382961 /nfs/dbraw/zinc/38/29/61/626382961.db2.gz FJAJTLWPDDDVED-OAHLLOKOSA-N 2 0 315.486 3.351 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1F ZINC000809755582 626947401 /nfs/dbraw/zinc/94/74/01/626947401.db2.gz LUDAATLAWSKXET-KRWDZBQOSA-N 2 0 319.468 3.055 20 10 DGCDRP CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809768605 626949991 /nfs/dbraw/zinc/94/99/91/626949991.db2.gz QCIQLRMUEAZOCL-FUHWJXTLSA-N 2 0 301.478 3.201 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1O ZINC000809767954 626950155 /nfs/dbraw/zinc/95/01/55/626950155.db2.gz YXBTYOWFAHCKMS-XJKSGUPXSA-N 2 0 308.853 3.270 20 10 DGCDRP CCCC[C@H](C)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000811520571 627287140 /nfs/dbraw/zinc/28/71/40/627287140.db2.gz QQMBCKRSUQMSJC-KRWDZBQOSA-N 2 0 303.494 3.449 20 10 DGCDRP Cc1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)ccc1N(C)C ZINC000815055116 627619374 /nfs/dbraw/zinc/61/93/74/627619374.db2.gz WESBEOGFZZHADI-LJQANCHMSA-N 2 0 315.505 3.369 20 10 DGCDRP Cc1cc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)ccc1N(C)C ZINC000815056032 627619959 /nfs/dbraw/zinc/61/99/59/627619959.db2.gz YWJPGRKYZVFEPA-LJQANCHMSA-N 2 0 315.505 3.225 20 10 DGCDRP Oc1c(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)ccc2ccccc21 ZINC000816514976 627800913 /nfs/dbraw/zinc/80/09/13/627800913.db2.gz LVUYWXOXJMILHD-MRXNPFEDSA-N 2 0 310.441 3.463 20 10 DGCDRP C[C@@H]([NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000925887750 627812704 /nfs/dbraw/zinc/81/27/04/627812704.db2.gz LTCDGOOUPJCUIV-BSIFCXSSSA-N 2 0 323.484 3.462 20 10 DGCDRP C[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccc4ccccc4c3O)C2)C1 ZINC000816642074 627818389 /nfs/dbraw/zinc/81/83/89/627818389.db2.gz OQHMNSMIXZPZOH-HXUWFJFHSA-N 2 0 310.441 3.463 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CCC[C@@H]3C[NH3+])cc2)CC1 ZINC000817901241 627957185 /nfs/dbraw/zinc/95/71/85/627957185.db2.gz AFBFSGZNKUJMTB-MJGOQNOKSA-N 2 0 301.478 3.140 20 10 DGCDRP CC[NH2+]CCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817942668 627969741 /nfs/dbraw/zinc/96/97/41/627969741.db2.gz CNXBEKUZDBJZJJ-HNNXBMFYSA-N 2 0 307.457 3.466 20 10 DGCDRP CCC([NH3+])(CC)C[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000817960001 627976253 /nfs/dbraw/zinc/97/62/53/627976253.db2.gz JXVBDONKVKLLHS-SNVBAGLBSA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1cc2c(cc1O)CCCC2 ZINC000817960149 627976255 /nfs/dbraw/zinc/97/62/55/627976255.db2.gz KYZSKWOMZHTCOU-QANKJYHBSA-N 2 0 302.462 3.439 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000817963817 627977052 /nfs/dbraw/zinc/97/70/52/627977052.db2.gz VRECOSXHLSEVFL-STQMWFEESA-N 2 0 300.402 3.271 20 10 DGCDRP [NH3+][C@@H](C[NH2+][C@H](CCc1ccccc1)c1ccccc1O)C1CC1 ZINC000817965336 627977478 /nfs/dbraw/zinc/97/74/78/627977478.db2.gz OQWWYBPTDNICTF-RBUKOAKNSA-N 2 0 310.441 3.393 20 10 DGCDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000817970466 627978957 /nfs/dbraw/zinc/97/89/57/627978957.db2.gz WHNOJOHECDPVTQ-SWHYSGLUSA-N 2 0 316.367 3.450 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817970767 627979713 /nfs/dbraw/zinc/97/97/13/627979713.db2.gz DQZWUQGHIMECKJ-RLFYNMQTSA-N 2 0 319.468 3.465 20 10 DGCDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817976544 627981615 /nfs/dbraw/zinc/98/16/15/627981615.db2.gz NERKVNTXSSFJTQ-QWRGUYRKSA-N 2 0 315.255 3.323 20 10 DGCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1O ZINC000817985695 627984072 /nfs/dbraw/zinc/98/40/72/627984072.db2.gz GYHNMPYSLSBXPV-SFDCQRBFSA-N 2 0 308.853 3.393 20 10 DGCDRP Cc1cc(O)c(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1Cl ZINC000825125111 628730571 /nfs/dbraw/zinc/73/05/71/628730571.db2.gz HATSAOHEKYHFQZ-UHFFFAOYSA-N 2 0 308.853 3.318 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C\c2ccc(N(C)C)cc2)[C@@H](C)C1 ZINC000835026113 629827350 /nfs/dbraw/zinc/82/73/50/629827350.db2.gz QMDXNSFXYFLSPS-KQCIVJTHSA-N 2 0 315.505 3.428 20 10 DGCDRP CC(C)[NH+]1CCC([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835037182 629831155 /nfs/dbraw/zinc/83/11/55/629831155.db2.gz SYVRWCBZWWEATL-WAYWQWQTSA-N 2 0 301.478 3.228 20 10 DGCDRP CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000841005049 630394405 /nfs/dbraw/zinc/39/44/05/630394405.db2.gz DDURHFPVERAAJD-FUHWJXTLSA-N 2 0 303.494 3.351 20 10 DGCDRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000841033878 630399441 /nfs/dbraw/zinc/39/94/41/630399441.db2.gz CSEZILQTKKIYCD-JXFKEZNVSA-N 2 0 315.505 3.444 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000841071761 630404369 /nfs/dbraw/zinc/40/43/69/630404369.db2.gz AQAJGALQSQJFNI-SFHVURJKSA-N 2 0 301.478 3.299 20 10 DGCDRP Cc1cc(Br)cc(C[NH2+][C@@H](C)CCCC[NH3+])c1O ZINC000841079920 630405403 /nfs/dbraw/zinc/40/54/03/630405403.db2.gz ORNRYMHPKFJICI-NSHDSACASA-N 2 0 315.255 3.070 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H]1C[NH3+] ZINC000841100275 630408075 /nfs/dbraw/zinc/40/80/75/630408075.db2.gz AQYPQJARHGPTTP-WMZOPIPTSA-N 2 0 301.478 3.094 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000843043845 630607434 /nfs/dbraw/zinc/60/74/34/630607434.db2.gz LAFKMTHOKYBONV-INIZCTEOSA-N 2 0 308.853 3.318 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cc1F ZINC000843127463 630616875 /nfs/dbraw/zinc/61/68/75/630616875.db2.gz REZKLNYHIVVWPN-SJORKVTESA-N 2 0 319.468 3.103 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c1O ZINC000846138986 631211314 /nfs/dbraw/zinc/21/13/14/631211314.db2.gz ZGYYTEDKRLFDEV-LSDHHAIUSA-N 2 0 306.450 3.316 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)c1O ZINC000846139553 631211563 /nfs/dbraw/zinc/21/15/63/631211563.db2.gz VHDQAZBGJXLOMN-CQSZACIVSA-N 2 0 306.450 3.172 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c1O ZINC000848912765 631782860 /nfs/dbraw/zinc/78/28/60/631782860.db2.gz VOOWWQUJXXOKBH-QGZVFWFLSA-N 2 0 302.462 3.118 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)cc1F ZINC000849350309 631900755 /nfs/dbraw/zinc/90/07/55/631900755.db2.gz NLLXWFJMVBRSAW-KRWDZBQOSA-N 2 0 319.468 3.103 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000850584078 632202179 /nfs/dbraw/zinc/20/21/79/632202179.db2.gz QGKZQSSAMCPIEX-CQSZACIVSA-N 2 0 318.461 3.173 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)cc1 ZINC000852106466 632556127 /nfs/dbraw/zinc/55/61/27/632556127.db2.gz YVDAKHGIJJCTCM-IBGZPJMESA-N 2 0 301.478 3.060 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cc2c(cc1O)CCCC2 ZINC000185404154 660221518 /nfs/dbraw/zinc/22/15/18/660221518.db2.gz IHJHDYDQWAYAPQ-CABCVRRESA-N 2 0 302.462 3.263 20 10 DGCDRP CC[NH2+]CC1CC[NH+](Cc2ccc(N(CC)CC)cc2)CC1 ZINC000066057128 655929492 /nfs/dbraw/zinc/92/94/92/655929492.db2.gz PHKFAZPBYOBKNM-UHFFFAOYSA-N 2 0 303.494 3.354 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157714600 659094106 /nfs/dbraw/zinc/09/41/06/659094106.db2.gz XFGLFFUEDXRNIC-MJGOQNOKSA-N 2 0 301.478 3.278 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000174629079 659454343 /nfs/dbraw/zinc/45/43/43/659454343.db2.gz ABJHBJQANGVAIB-APWZRJJASA-N 2 0 303.494 3.353 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+]CC3CC[NH2+]CC3)cc2)CC1 ZINC001576734977 1191866657 /nfs/dbraw/zinc/86/66/57/1191866657.db2.gz OVBBPVKCAWTHIP-UHFFFAOYSA-N 2 0 301.478 3.012 20 10 DGCDRP COc1cc(C[NH2+][C@H](C)C2CC[NH2+]CC2)c(O)c(C(C)(C)C)c1 ZINC001579153889 1191967756 /nfs/dbraw/zinc/96/77/56/1191967756.db2.gz OEHXYHKJCKSJAQ-CYBMUJFWSA-N 2 0 320.477 3.176 20 10 DGCDRP COc1cc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])c(O)c(C(C)(C)C)c1 ZINC001579152679 1191967986 /nfs/dbraw/zinc/96/79/86/1191967986.db2.gz AAJFETRPQHBMJS-SUMWQHHRSA-N 2 0 320.477 3.305 20 10 DGCDRP COc1ccc(C[NH2+][C@H]2C[C@@](C[NH3+])(c3ccccc3)C2)cc1C ZINC001579218127 1191969160 /nfs/dbraw/zinc/96/91/60/1191969160.db2.gz UMXOIBPSVHZFQF-PUZFROQSSA-N 2 0 310.441 3.152 20 10 DGCDRP COc1cc(C)c(C[NH2+]CCC2CC[NH+](C(C)C)CC2)c(O)c1 ZINC001462475728 1182958891 /nfs/dbraw/zinc/95/88/91/1182958891.db2.gz UUGUHCGYBJUALU-UHFFFAOYSA-N 2 0 320.477 3.309 20 10 DGCDRP CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560258080 1189300344 /nfs/dbraw/zinc/30/03/44/1189300344.db2.gz SRWNBCFHWKOTJN-UYAOXDASSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560476521 1189331867 /nfs/dbraw/zinc/33/18/67/1189331867.db2.gz LNIVZTDEYDWPFW-RTBURBONSA-N 2 0 315.505 3.354 20 10 DGCDRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560571049 1189343190 /nfs/dbraw/zinc/34/31/90/1189343190.db2.gz FMUYHFLPWSMUGX-QFBILLFUSA-N 2 0 315.505 3.353 20 10 DGCDRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3ccc(N4CCCCC4)cc3)[C@@H]2C1 ZINC001621108433 1193804123 /nfs/dbraw/zinc/80/41/23/1193804123.db2.gz OVMKARWJIQQMTL-SXLOBPIMSA-N 2 0 313.489 3.107 20 10 DGCDRP C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001656636287 1196056460 /nfs/dbraw/zinc/05/64/60/1196056460.db2.gz QVFXCOZYLSTFOO-APWZRJJASA-N 2 0 301.478 3.107 20 10 DGCDRP C[C@H]([NH2+]Cc1cc(F)ccc1O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001658822076 1196304841 /nfs/dbraw/zinc/30/48/41/1196304841.db2.gz GYUGWCIURQFMGR-UONOGXRCSA-N 2 0 306.425 3.274 20 10 DGCDRP CC[NH+]1CCC(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 ZINC001659472321 1196386606 /nfs/dbraw/zinc/38/66/06/1196386606.db2.gz RQCOTOZRIQHLGE-KRWDZBQOSA-N 2 0 317.521 3.314 20 10 DGCDRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC001660949339 1196545641 /nfs/dbraw/zinc/54/56/41/1196545641.db2.gz MHVBTKRPMDNIPM-INIZCTEOSA-N 2 0 321.484 3.493 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167970395 1085904350 /nfs/dbraw/zinc/90/43/50/1085904350.db2.gz JGBWCAGPWVWKGO-CTXDPNEZSA-N 2 0 313.489 3.248 20 10 DGCDRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001203934365 1090842742 /nfs/dbraw/zinc/84/27/42/1090842742.db2.gz SOHHBNBBDAHIFS-UHFFFAOYSA-N 2 0 303.494 3.305 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c(Cl)c1 ZINC001205570000 1091258224 /nfs/dbraw/zinc/25/82/24/1091258224.db2.gz CEUIHEJUJZKPOB-INIZCTEOSA-N 2 0 313.848 3.059 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c1 ZINC001205578650 1091264240 /nfs/dbraw/zinc/26/42/40/1091264240.db2.gz IDBKYAQHYYUNBQ-GOSISDBHSA-N 2 0 308.441 3.343 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)CC[C@@H]1C[NH3+] ZINC001205602672 1091273416 /nfs/dbraw/zinc/27/34/16/1091273416.db2.gz LGIUPIHPFNXFKC-SJLPKXTDSA-N 2 0 301.478 3.094 20 10 DGCDRP C[C@@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001205922851 1091415265 /nfs/dbraw/zinc/41/52/65/1091415265.db2.gz BVRVIHKIIUFMDC-ZIAGYGMSSA-N 2 0 316.445 3.136 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)cc1 ZINC001205991481 1091439289 /nfs/dbraw/zinc/43/92/89/1091439289.db2.gz BAOLFNIEIWFNHQ-WMZOPIPTSA-N 2 0 303.494 3.340 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2Cl)CCC[C@H]1C[NH3+] ZINC001206005648 1091446420 /nfs/dbraw/zinc/44/64/20/1091446420.db2.gz YXXUAPOUWMTZLR-KGLIPLIRSA-N 2 0 309.885 3.213 20 10 DGCDRP COc1cc(C[N@H+](C)C2CCCCC2)cc(C[NH+](C)C)c1O ZINC001139253583 1091501456 /nfs/dbraw/zinc/50/14/56/1091501456.db2.gz ZITIXSAOJIMHOH-UHFFFAOYSA-N 2 0 306.450 3.227 20 10 DGCDRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001206305248 1091571432 /nfs/dbraw/zinc/57/14/32/1091571432.db2.gz XDOKYUMUVOTWES-LJQANCHMSA-N 2 0 301.478 3.238 20 10 DGCDRP Cc1c[nH+]ccc1N1CC[NH+](Cc2ccc(N(C)C)c(C)c2)CC1 ZINC001139673839 1091639519 /nfs/dbraw/zinc/63/95/19/1091639519.db2.gz GBMJDRANECLGQS-UHFFFAOYSA-N 2 0 324.472 3.087 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(CC[NH3+])CC2)c2ccccc21 ZINC001206500995 1091651228 /nfs/dbraw/zinc/65/12/28/1091651228.db2.gz ZLUFBZDKLBLFIX-UHFFFAOYSA-N 2 0 311.473 3.467 20 10 DGCDRP Cc1cc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)ccc1N(C)C ZINC001206588603 1091679774 /nfs/dbraw/zinc/67/97/74/1091679774.db2.gz CMGCTUNHFOYWCP-GOSISDBHSA-N 2 0 303.494 3.414 20 10 DGCDRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cc(F)ccc1O ZINC001140058506 1091752436 /nfs/dbraw/zinc/75/24/36/1091752436.db2.gz DJQMZJFNOAMCIB-DLBZAZTESA-N 2 0 306.425 3.370 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@H](C)C3)cc2)CC1 ZINC001140301934 1091818537 /nfs/dbraw/zinc/81/85/37/1091818537.db2.gz DRMRECCNMKKKSU-SFHVURJKSA-N 2 0 315.505 3.451 20 10 DGCDRP Cc1cnccc1O[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001140342296 1091834917 /nfs/dbraw/zinc/83/49/17/1091834917.db2.gz CFDLDMQBUGJIEW-CYBMUJFWSA-N 2 0 318.804 3.402 20 10 DGCDRP Cc1ccc(O)c(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001140620985 1091934145 /nfs/dbraw/zinc/93/41/45/1091934145.db2.gz JXUDCWDMLTUINE-PMACEKPBSA-N 2 0 322.452 3.264 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CCC[NH+]2CCCC2)c(O)c1 ZINC001140855356 1092031058 /nfs/dbraw/zinc/03/10/58/1092031058.db2.gz WGVAGXLVMWRTFM-UHFFFAOYSA-N 2 0 319.493 3.156 20 10 DGCDRP Cc1ccc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c(O)c1 ZINC001140950243 1092077252 /nfs/dbraw/zinc/07/72/52/1092077252.db2.gz WVZBZKQNIDFVOF-UHFFFAOYSA-N 2 0 302.462 3.254 20 10 DGCDRP C[N@@H+](Cc1cccc(C(C)(C)C)c1O)CC1CC[NH+](C)CC1 ZINC001143110294 1092616986 /nfs/dbraw/zinc/61/69/86/1092616986.db2.gz BTVYMRMRBWOHSL-UHFFFAOYSA-N 2 0 304.478 3.463 20 10 DGCDRP Oc1ccc(C[NH+]2CCCC3(CCCC[NH2+]C3)CCC2)cc1O ZINC001222110033 1095437279 /nfs/dbraw/zinc/43/72/79/1095437279.db2.gz UUKWHMNEHFOUHA-UHFFFAOYSA-N 2 0 318.461 3.234 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001222401456 1095596267 /nfs/dbraw/zinc/59/62/67/1095596267.db2.gz STBARQLZRIMRAZ-UHFFFAOYSA-N 2 0 313.489 3.252 20 10 DGCDRP Cc1ccc(C)c(C[N@@H+]2C[C@@H](c3ccccc3)C3(C[NH2+]C3)C2)c1O ZINC001222602521 1095687363 /nfs/dbraw/zinc/68/73/63/1095687363.db2.gz SEYOOAFAZARUMG-IBGZPJMESA-N 2 0 322.452 3.198 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@H]3C[NH2+]CC[C@H]32)cc1 ZINC001222620653 1095698608 /nfs/dbraw/zinc/69/86/08/1095698608.db2.gz WXMLMJMHRHKRAB-AZUAARDMSA-N 2 0 309.457 3.278 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC001118242847 1095964953 /nfs/dbraw/zinc/96/49/53/1095964953.db2.gz LFADTAATQPBKKR-MOPGFXCFSA-N 2 0 313.489 3.108 20 10 DGCDRP CC[C@H](CC(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001172389636 1097142992 /nfs/dbraw/zinc/14/29/92/1097142992.db2.gz OTJIPNJHZIFXGF-GOSISDBHSA-N 2 0 303.494 3.353 20 10 DGCDRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC001173108163 1097331595 /nfs/dbraw/zinc/33/15/95/1097331595.db2.gz ZIWNLCNPHZHRNS-UHFFFAOYSA-N 2 0 303.494 3.495 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c(O)c1 ZINC001231849513 1097863859 /nfs/dbraw/zinc/86/38/59/1097863859.db2.gz QWKXAEQCKOTJCT-UHFFFAOYSA-N 2 0 302.462 3.317 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCCC23CC[NH2+]CC3)ccc1N(C)C ZINC001235190573 1098868373 /nfs/dbraw/zinc/86/83/73/1098868373.db2.gz WHSRVVJDBVECDE-UHFFFAOYSA-N 2 0 301.478 3.169 20 10 DGCDRP CCOc1cccc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c1O ZINC001235232197 1098905792 /nfs/dbraw/zinc/90/57/92/1098905792.db2.gz VRZJGGNMOICDHQ-QGZVFWFLSA-N 2 0 318.461 3.145 20 10 DGCDRP Nc1ccc(C[N@@H+]2CC[C@@]3(c4ccccc4)CC[NH2+]C[C@H]3C2)cc1 ZINC001235385199 1098990129 /nfs/dbraw/zinc/99/01/29/1098990129.db2.gz UCNPIMPMHKQSPA-PZJWPPBQSA-N 2 0 321.468 3.022 20 10 DGCDRP Cc1c(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@H]3F)c2ccccc2n1C ZINC001235404189 1099001702 /nfs/dbraw/zinc/00/17/02/1099001702.db2.gz MZSIYVBRFDKHEX-RTBURBONSA-N 2 0 315.436 3.010 20 10 DGCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]1c1ccccc1)C[NH2+]CCO2 ZINC001235675255 1099118939 /nfs/dbraw/zinc/11/89/39/1099118939.db2.gz SYQHCFJLXYMQTF-GOSISDBHSA-N 2 0 324.424 3.211 20 10 DGCDRP C[NH+]1CC2(C1)CC[NH+](Cc1ccc(C(C)(C)C)cc1O)CC2 ZINC001235678818 1099122055 /nfs/dbraw/zinc/12/20/55/1099122055.db2.gz NHYNUXXNEDKMJU-UHFFFAOYSA-N 2 0 302.462 3.217 20 10 DGCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]2C1 ZINC001235680125 1099124549 /nfs/dbraw/zinc/12/45/49/1099124549.db2.gz ILZRRLTUAJLAFS-HZPDHXFCSA-N 2 0 302.462 3.073 20 10 DGCDRP CCC[C@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235693927 1099132381 /nfs/dbraw/zinc/13/23/81/1099132381.db2.gz KFEDDTRWIUYSBM-INIZCTEOSA-N 2 0 304.434 3.029 20 10 DGCDRP Cc1cc(CN2CCCC3(C[NH2+]C3)C2)c(C)n1-c1ccccc1 ZINC001235710849 1099139265 /nfs/dbraw/zinc/13/92/65/1099139265.db2.gz ICYZWRTVYYOLTB-UHFFFAOYSA-N 2 0 309.457 3.280 20 10 DGCDRP CC[N@H+](Cc1cc(Cl)c(Cl)cc1[O-])C1CC[NH2+]CC1 ZINC001235765285 1099170828 /nfs/dbraw/zinc/17/08/28/1099170828.db2.gz YFZPHEJHRUIDHC-UHFFFAOYSA-N 2 0 303.233 3.273 20 10 DGCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@H]3CCCC[C@H]31)C[NH2+]CCO2 ZINC001235868986 1099226755 /nfs/dbraw/zinc/22/67/55/1099226755.db2.gz XWTQMIVIOHIJJS-RHSMWYFYSA-N 2 0 316.445 3.029 20 10 DGCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]3CCCC[C@@H]31)C[NH2+]CCO2 ZINC001235868990 1099227757 /nfs/dbraw/zinc/22/77/57/1099227757.db2.gz XWTQMIVIOHIJJS-YOEHRIQHSA-N 2 0 316.445 3.029 20 10 DGCDRP Oc1ccc(F)c(Cl)c1C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC001235889084 1099234272 /nfs/dbraw/zinc/23/42/72/1099234272.db2.gz WFFVWHOBOKPQOW-CQSZACIVSA-N 2 0 312.816 3.149 20 10 DGCDRP CC[N@H+](Cc1cccs1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236088257 1099379249 /nfs/dbraw/zinc/37/92/49/1099379249.db2.gz BTVGMYREEBXIFN-UHFFFAOYSA-N 2 0 315.486 3.180 20 10 DGCDRP Oc1c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cccc1-c1ccccc1 ZINC001236320079 1099533922 /nfs/dbraw/zinc/53/39/22/1099533922.db2.gz BDEXMRMSZNKEFO-HDICACEKSA-N 2 0 322.452 3.491 20 10 DGCDRP Cc1c(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c2ccccc2n1C ZINC001236599595 1099695549 /nfs/dbraw/zinc/69/55/49/1099695549.db2.gz TVGLJRBQAQLRJS-MRXNPFEDSA-N 2 0 311.473 3.451 20 10 DGCDRP Cc1cc(Cl)cc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c1O ZINC001236602549 1099697108 /nfs/dbraw/zinc/69/71/08/1099697108.db2.gz XDSREZDMOFSLRB-ZDUSSCGKSA-N 2 0 308.853 3.318 20 10 DGCDRP CCC[N@@H+](Cc1cc(C(F)(F)F)ccc1O)C[C@H]1CC[NH2+]C1 ZINC001236843778 1099828030 /nfs/dbraw/zinc/82/80/30/1099828030.db2.gz QXHOLPNYKQGZRP-LBPRGKRZSA-N 2 0 316.367 3.233 20 10 DGCDRP c1cc(N2CCCC2)ccc1CN(C1CCC1)[C@H]1CCC[NH2+]C1 ZINC001237146490 1099995790 /nfs/dbraw/zinc/99/57/90/1099995790.db2.gz SENNNDBDCHBWBQ-FQEVSTJZSA-N 2 0 313.489 3.393 20 10 DGCDRP COc1cc(Cl)cc(CN(C2CCC2)[C@@H]2CCC[NH2+]C2)c1O ZINC001237156573 1100006060 /nfs/dbraw/zinc/00/60/60/1100006060.db2.gz ONRRAGQOMMXSFE-OAHLLOKOSA-N 2 0 324.852 3.161 20 10 DGCDRP Oc1cc(Cl)c(F)cc1CN(C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC001237159282 1100006890 /nfs/dbraw/zinc/00/68/90/1100006890.db2.gz ABEYPOYPHWBHCN-CYBMUJFWSA-N 2 0 312.816 3.291 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)CCCC[NH+]2CCCCC2)cc1 ZINC001197286537 1101530161 /nfs/dbraw/zinc/53/01/61/1101530161.db2.gz XQVCHBQPODFEGO-UHFFFAOYSA-N 2 0 303.494 3.451 20 10 DGCDRP C[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001199227749 1102086811 /nfs/dbraw/zinc/08/68/11/1102086811.db2.gz LBCQBZUXRMSAQE-WMZOPIPTSA-N 2 0 301.478 3.107 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)cc1 ZINC001203933961 1102121036 /nfs/dbraw/zinc/12/10/36/1102121036.db2.gz IIAGVFOANFQGKN-UHFFFAOYSA-N 2 0 315.505 3.306 20 10 DGCDRP C[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC001201930470 1102752714 /nfs/dbraw/zinc/75/27/14/1102752714.db2.gz ZNBCGHAQQWOERU-GOSISDBHSA-N 2 0 323.484 3.332 20 10 DGCDRP CC(C)(C[NH2+]Cc1ccc(N2CCCC2)cc1)C[NH+]1CCCC1 ZINC001326257203 1103248743 /nfs/dbraw/zinc/24/87/43/1103248743.db2.gz PPXSQBQYTMYEIB-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)cc1 ZINC001275833205 1104926268 /nfs/dbraw/zinc/92/62/68/1104926268.db2.gz BSTZERFSYWEHIH-KDURUIRLSA-N 2 0 315.505 3.306 20 10 DGCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(N4CCCC4)cc3)(C1)CCC2 ZINC001275959752 1104968737 /nfs/dbraw/zinc/96/87/37/1104968737.db2.gz FUGWXNAPQHCYAZ-VQTJNVASSA-N 2 0 313.489 3.441 20 10 DGCDRP CN(C)c1ccc(CN2CCC[C@]3(CC[N@H+](C)C3)C2)c(Cl)c1 ZINC001276156036 1105032977 /nfs/dbraw/zinc/03/29/77/1105032977.db2.gz MLCJFBKRVPMWII-GOSISDBHSA-N 2 0 321.896 3.324 20 10 DGCDRP C[C@@H](CC(F)(F)F)[NH2+]C1CC[NH+](Cc2ccccc2O)CC1 ZINC001255639380 1106282461 /nfs/dbraw/zinc/28/24/61/1106282461.db2.gz KYHQWRCPLYNLSZ-LBPRGKRZSA-N 2 0 316.367 3.287 20 10 DGCDRP CC(C)(C[NH2+]Cc1ccc2c(c1)CCCO2)C[NH+]1CCCC1 ZINC001308389491 1111424210 /nfs/dbraw/zinc/42/42/10/1111424210.db2.gz GZRIMTKKDZSVKQ-UHFFFAOYSA-N 2 0 302.462 3.223 20 10 DGCDRP C[C@@H]([NH2+][C@@H](C)Cn1ccnc1)c1ccc(Br)cc1O ZINC000273301164 130105048 /nfs/dbraw/zinc/10/50/48/130105048.db2.gz BNHIOTSIZWRLKU-WDEREUQCSA-N 2 0 324.222 3.091 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273566837 130139114 /nfs/dbraw/zinc/13/91/14/130139114.db2.gz JTAWMMFLZAPNSS-JKSUJKDBSA-N 2 0 308.466 3.016 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000185670744 286443192 /nfs/dbraw/zinc/44/31/92/286443192.db2.gz ICXQCLCCOJIFPD-TZMCWYRMSA-N 2 0 314.857 3.053 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C[C@@H]1n1ccnc1 ZINC000091960336 431906090 /nfs/dbraw/zinc/90/60/90/431906090.db2.gz PZHIOQPXSALXDU-DOMZBBRYSA-N 2 0 305.809 3.325 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1C ZINC000153448220 432410136 /nfs/dbraw/zinc/41/01/36/432410136.db2.gz JDANRTRPTSZACC-GOSISDBHSA-N 2 0 302.462 3.459 20 10 DGCDRP CC[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1O ZINC000155412072 432554511 /nfs/dbraw/zinc/55/45/11/432554511.db2.gz NFJQXTGOQOCQQT-SOLBZPMBSA-N 2 0 320.477 3.322 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)c1 ZINC000186545729 432605689 /nfs/dbraw/zinc/60/56/89/432605689.db2.gz ZACDAZUGMJXWDO-CABCVRRESA-N 2 0 306.450 3.316 20 10 DGCDRP Oc1cccc2c1[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CC2 ZINC000296960337 432942467 /nfs/dbraw/zinc/94/24/67/432942467.db2.gz RCBNPSVIAOWUQL-GOSISDBHSA-N 2 0 323.440 3.281 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423085841 434206520 /nfs/dbraw/zinc/20/65/20/434206520.db2.gz LOUACBYTVMNRKL-OKZBNKHCSA-N 2 0 311.473 3.497 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000556877824 435034926 /nfs/dbraw/zinc/03/49/26/435034926.db2.gz MRHVJSUCSNTFAD-KSZLIROESA-N 2 0 311.473 3.449 20 10 DGCDRP Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)CC2 ZINC000853240315 620680879 /nfs/dbraw/zinc/68/08/79/620680879.db2.gz OWJMWKLOHPFNQG-DOTOQJQBSA-N 2 0 300.446 3.091 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000853239254 620680945 /nfs/dbraw/zinc/68/09/45/620680945.db2.gz CVWNBAXPMOPASN-ZBFHGGJFSA-N 2 0 318.461 3.173 20 10 DGCDRP CN(C)c1ccc(C[N@H+](CC2CC[NH+](C)CC2)C2CC2)cc1 ZINC000891595919 617847560 /nfs/dbraw/zinc/84/75/60/617847560.db2.gz GITLJNDJJVQIQE-UHFFFAOYSA-N 2 0 301.478 3.059 20 10 DGCDRP C[NH+]1CCC(C[N@H+](Cc2ccccc2O)C2CCCC2)CC1 ZINC000892012230 617944169 /nfs/dbraw/zinc/94/41/69/617944169.db2.gz LZOAYNVGOPRJJV-UHFFFAOYSA-N 2 0 302.462 3.479 20 10 DGCDRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000841028401 619165270 /nfs/dbraw/zinc/16/52/70/619165270.db2.gz DCOCLZSJOAZHMP-CYBMUJFWSA-N 2 0 301.409 3.201 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@H]1C[NH3+] ZINC000904412076 619921149 /nfs/dbraw/zinc/92/11/49/619921149.db2.gz PEZOXMNYTGUUFV-WMZOPIPTSA-N 2 0 301.478 3.094 20 10 DGCDRP [NH3+]CC1(c2ccccc2)CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000904459815 619923738 /nfs/dbraw/zinc/92/37/38/619923738.db2.gz XKXGZQLMKWFKSZ-UHFFFAOYSA-N 2 0 314.404 3.024 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)c1O ZINC000841086225 620216066 /nfs/dbraw/zinc/21/60/66/620216066.db2.gz GCUMAVLJSYCPOA-WFASDCNBSA-N 2 0 324.852 3.018 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000858179551 621162052 /nfs/dbraw/zinc/16/20/52/621162052.db2.gz NWTPWPKHXGRDBL-FUHWJXTLSA-N 2 0 317.521 3.454 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C(C)(C)C)C3)cc2)CC1 ZINC000753592658 621452314 /nfs/dbraw/zinc/45/23/14/621452314.db2.gz ZMHFOYPUUBPPTC-SFHVURJKSA-N 2 0 315.505 3.306 20 10 DGCDRP COc1cc(C)cc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1O ZINC000754742758 621529840 /nfs/dbraw/zinc/52/98/40/621529840.db2.gz ZHOVTYWWEIRNSX-KRWDZBQOSA-N 2 0 318.461 3.160 20 10 DGCDRP COc1cc(C)cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1O ZINC000754740021 621529915 /nfs/dbraw/zinc/52/99/15/621529915.db2.gz FZQMJVXLIBYFGI-INIZCTEOSA-N 2 0 318.461 3.017 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756639783 621655332 /nfs/dbraw/zinc/65/53/32/621655332.db2.gz FAIHJBLLEOFNCT-GUTXKFCHSA-N 2 0 324.440 3.026 20 10 DGCDRP C[C@@H]1CC[C@H](NCc2ccc(N(C)C)cc2C(F)(F)F)C[NH2+]1 ZINC000863649701 621693204 /nfs/dbraw/zinc/69/32/04/621693204.db2.gz GTTZKTFSJYQHEN-YPMHNXCESA-N 2 0 315.383 3.002 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000757674766 621732775 /nfs/dbraw/zinc/73/27/75/621732775.db2.gz WDXVBQZGLWBUSY-INIZCTEOSA-N 2 0 308.466 3.018 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)c1 ZINC000866518050 622131544 /nfs/dbraw/zinc/13/15/44/622131544.db2.gz RSJDPPAOCLPBCR-VNSJNIRKSA-N 2 0 306.450 3.314 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)C(C)C)cc2F)CC1 ZINC000765850722 622291455 /nfs/dbraw/zinc/29/14/55/622291455.db2.gz ARVDPEKSXXHIIM-OAHLLOKOSA-N 2 0 307.457 3.102 20 10 DGCDRP C[NH+](C)CC1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444526 622456138 /nfs/dbraw/zinc/45/61/38/622456138.db2.gz CDRZQDAKFAHVEW-UHFFFAOYSA-N 2 0 302.462 3.045 20 10 DGCDRP CC(C)(C)C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000768670915 622470564 /nfs/dbraw/zinc/47/05/64/622470564.db2.gz SNQRWVFNBZUSJD-UHFFFAOYSA-N 2 0 315.505 3.354 20 10 DGCDRP CCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)c(O)c1 ZINC000769470747 622530524 /nfs/dbraw/zinc/53/05/24/622530524.db2.gz OTNBYTGUMINLNU-GOEBONIOSA-N 2 0 306.450 3.096 20 10 DGCDRP C[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000771854066 622803393 /nfs/dbraw/zinc/80/33/93/622803393.db2.gz PYJBHFOYBKNOBC-INIZCTEOSA-N 2 0 303.494 3.210 20 10 DGCDRP CCOc1cccc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)c1O ZINC000873232763 623086149 /nfs/dbraw/zinc/08/61/49/623086149.db2.gz LARCLIYDAJDUCY-QGZVFWFLSA-N 2 0 318.461 3.193 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c2c1c(F)ccc2O ZINC000873244522 623089329 /nfs/dbraw/zinc/08/93/29/623089329.db2.gz MITFFRGYQYYDCV-DYEKYZERSA-N 2 0 306.425 3.447 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(N2CCCCCC2)cc1 ZINC000873253919 623092763 /nfs/dbraw/zinc/09/27/63/623092763.db2.gz HGFRNBMXBSEUNO-XYJFISCASA-N 2 0 301.478 3.455 20 10 DGCDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+](CC2CC2)CC1 ZINC000775139583 623234723 /nfs/dbraw/zinc/23/47/23/623234723.db2.gz DAXKOKJFIHQHCR-UHFFFAOYSA-N 2 0 301.478 3.236 20 10 DGCDRP C[C@H]1CCC[C@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775649400 623303758 /nfs/dbraw/zinc/30/37/58/623303758.db2.gz QXLBPWLPOXOHJF-PXNSSMCTSA-N 2 0 315.505 3.449 20 10 DGCDRP C[C@H](c1ccco1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775650298 623304486 /nfs/dbraw/zinc/30/44/86/623304486.db2.gz YAOKGEUQKUUFNX-MRXNPFEDSA-N 2 0 313.445 3.224 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC1CCCC1 ZINC000775666128 623309441 /nfs/dbraw/zinc/30/94/41/623309441.db2.gz SRLHDVVIUUVAMJ-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775669172 623309640 /nfs/dbraw/zinc/30/96/40/623309640.db2.gz TVXKLQOKJXQTTE-DLBZAZTESA-N 2 0 301.478 3.059 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3C4CCCC3CCC4)cc2)CC1 ZINC000775721781 623318422 /nfs/dbraw/zinc/31/84/22/623318422.db2.gz YPKHYEFUUUFWRU-UHFFFAOYSA-N 2 0 313.489 3.345 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC(C)(C)C3CC3)cc2)CC1 ZINC000815163506 627639857 /nfs/dbraw/zinc/63/98/57/627639857.db2.gz OUGHMCFXUVBPBV-UHFFFAOYSA-N 2 0 315.505 3.354 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000925793431 627796838 /nfs/dbraw/zinc/79/68/38/627796838.db2.gz YQYZXMWTMORQJB-RYRKJORJSA-N 2 0 301.478 3.183 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]C2CCC([NH+](C)C)CC2)cc1 ZINC000817414086 627896017 /nfs/dbraw/zinc/89/60/17/627896017.db2.gz RBMJIGSJWGDKCL-AATRIKPKSA-N 2 0 301.478 3.228 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3C[NH3+])cc2)CC1 ZINC000817901239 627956786 /nfs/dbraw/zinc/95/67/86/627956786.db2.gz AFBFSGZNKUJMTB-IEBWSBKVSA-N 2 0 301.478 3.140 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)CC1 ZINC000817901309 627957305 /nfs/dbraw/zinc/95/73/05/627957305.db2.gz BDAAIADPHOMHRD-DFNIBXOVSA-N 2 0 313.489 3.296 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Cl)ccc1O ZINC000817947664 627970483 /nfs/dbraw/zinc/97/04/83/627970483.db2.gz FCXFVHPQACAPOP-GFCCVEGCSA-N 2 0 304.821 3.398 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817946473 627970890 /nfs/dbraw/zinc/97/08/90/627970890.db2.gz XYSLWWIVSZKJLV-DLBZAZTESA-N 2 0 301.478 3.327 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817945616 627970940 /nfs/dbraw/zinc/97/09/40/627970940.db2.gz HVFSSQNUBLUIQB-JKSUJKDBSA-N 2 0 319.468 3.466 20 10 DGCDRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817968065 627978614 /nfs/dbraw/zinc/97/86/14/627978614.db2.gz NZSNURLUFYVMKJ-HNNXBMFYSA-N 2 0 317.452 3.386 20 10 DGCDRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)cc1 ZINC000817969091 627979068 /nfs/dbraw/zinc/97/90/68/627979068.db2.gz RJPHSDINXZIRCQ-SJLPKXTDSA-N 2 0 301.478 3.470 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2c1c(F)ccc2O ZINC000817968545 627979212 /nfs/dbraw/zinc/97/92/12/627979212.db2.gz LIKUULRVQGKKFO-MEDUHNTESA-N 2 0 312.388 3.473 20 10 DGCDRP CC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1cc(Br)ccc1O ZINC000817977885 627981726 /nfs/dbraw/zinc/98/17/26/627981726.db2.gz RCNHNYAHBCUSQA-GXFFZTMASA-N 2 0 315.255 3.323 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(N(C)C)cc1 ZINC000817985207 627983078 /nfs/dbraw/zinc/98/30/78/627983078.db2.gz HCAZQOXKPRKMNF-NTDBWNAOSA-N 2 0 301.478 3.181 20 10 DGCDRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817987163 627984438 /nfs/dbraw/zinc/98/44/38/627984438.db2.gz WZGMLJFFXDSJDV-AWEZNQCLSA-N 2 0 300.446 3.231 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC000835030452 629829832 /nfs/dbraw/zinc/82/98/32/629829832.db2.gz YEHVCRBYEANRCM-DTRRYIFCSA-N 2 0 313.489 3.182 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1 ZINC000835044128 629833906 /nfs/dbraw/zinc/83/39/06/629833906.db2.gz WWKPLOHTMDHXRN-JISXSJDESA-N 2 0 301.478 3.228 20 10 DGCDRP CN(C)c1ccc(/C=C\CN2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000835049259 629835622 /nfs/dbraw/zinc/83/56/22/629835622.db2.gz PIUQKFIJCGGTAM-YEODSOHDSA-N 2 0 301.478 3.182 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)c2c1c(F)ccc2O ZINC000840811207 630361421 /nfs/dbraw/zinc/36/14/21/630361421.db2.gz ZOPXSFSWUFGXLH-VNHYZAJKSA-N 2 0 306.425 3.401 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000840894431 630373858 /nfs/dbraw/zinc/37/38/58/630373858.db2.gz RLOWDUFFPRRYIV-IAGOWNOFSA-N 2 0 317.521 3.312 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000840895494 630374267 /nfs/dbraw/zinc/37/42/67/630374267.db2.gz YUQZXTAIXZYMOS-QRFRQXIXSA-N 2 0 315.505 3.208 20 10 DGCDRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000841033879 630399185 /nfs/dbraw/zinc/39/91/85/630399185.db2.gz CSEZILQTKKIYCD-OXJNMPFZSA-N 2 0 315.505 3.444 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1F ZINC000841088036 630406782 /nfs/dbraw/zinc/40/67/82/630406782.db2.gz XJKHWUWTNAHAES-SFHVURJKSA-N 2 0 315.436 3.462 20 10 DGCDRP C[N@@H+]1C[C@@H](C[NH2+][C@@H]2CCc3cccc(O)c32)[C@H](c2ccccc2)C1 ZINC000842923971 630593488 /nfs/dbraw/zinc/59/34/88/630593488.db2.gz MLUQKAFRHLGWEM-CEXWTWQISA-N 2 0 322.452 3.315 20 10 DGCDRP C[N@@H+]1C[C@@H](C[NH2+][C@H]2CCc3cccc(O)c32)[C@H](c2ccccc2)C1 ZINC000842923972 630593536 /nfs/dbraw/zinc/59/35/36/630593536.db2.gz MLUQKAFRHLGWEM-QYZOEREBSA-N 2 0 322.452 3.315 20 10 DGCDRP CCN(CC)c1ccc(CN2CCC[C@@H](C[NH2+]C)C2)cc1F ZINC000843044152 630607496 /nfs/dbraw/zinc/60/74/96/630607496.db2.gz FNHXIQXGRQXBLP-INIZCTEOSA-N 2 0 307.457 3.103 20 10 DGCDRP CCN(Cc1ccccc1)c1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1 ZINC000843048387 630608503 /nfs/dbraw/zinc/60/85/03/630608503.db2.gz QBOUFWWLPGKUBG-FQEVSTJZSA-N 2 0 323.484 3.494 20 10 DGCDRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843051921 630608668 /nfs/dbraw/zinc/60/86/68/630608668.db2.gz MWBSZPGJMBJSAD-AEFFLSMTSA-N 2 0 301.478 3.236 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)cc1F ZINC000843052927 630608921 /nfs/dbraw/zinc/60/89/21/630608921.db2.gz OZMYFQHVRAYYML-CQSZACIVSA-N 2 0 307.457 3.231 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC000843057389 630609244 /nfs/dbraw/zinc/60/92/44/630609244.db2.gz CXGVBKWHQQDRJB-QXAKKESOSA-N 2 0 301.478 3.092 20 10 DGCDRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC000843058028 630610158 /nfs/dbraw/zinc/61/01/58/630610158.db2.gz LMVDYHYGRKWAIU-YSIASYRMSA-N 2 0 313.489 3.236 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC000843120197 630615684 /nfs/dbraw/zinc/61/56/84/630615684.db2.gz SJHKKOGGVUKKOR-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843120171 630615810 /nfs/dbraw/zinc/61/58/10/630615810.db2.gz HLNAGHGVDWILKA-UHFFFAOYSA-N 2 0 313.489 3.252 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000843343144 630647637 /nfs/dbraw/zinc/64/76/37/630647637.db2.gz UEPKZARFZHGCBJ-FGTMMUONSA-N 2 0 301.478 3.011 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1O ZINC000846140365 631211707 /nfs/dbraw/zinc/21/17/07/631211707.db2.gz PKGMKHAJJDLPHR-JYJNAYRXSA-N 2 0 320.477 3.419 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)c1O ZINC000846150550 631212409 /nfs/dbraw/zinc/21/24/09/631212409.db2.gz RHOMSUINENZHIZ-CQSZACIVSA-N 2 0 318.461 3.458 20 10 DGCDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000848562907 631693843 /nfs/dbraw/zinc/69/38/43/631693843.db2.gz MCNBHOIOHRZLIW-GLRZTSSQSA-N 2 0 310.441 3.489 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000849350758 631901365 /nfs/dbraw/zinc/90/13/65/631901365.db2.gz VFVPLFBLVPUKHQ-LJQANCHMSA-N 2 0 315.505 3.273 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000850419962 632147108 /nfs/dbraw/zinc/14/71/08/632147108.db2.gz IZKDOPJKKSYKRH-UHFFFAOYSA-N 2 0 318.461 3.003 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000093604548 656363774 /nfs/dbraw/zinc/36/37/74/656363774.db2.gz CCCKEXYUPYQXJN-LJQANCHMSA-N 2 0 315.505 3.451 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC000192935051 658809050 /nfs/dbraw/zinc/80/90/50/658809050.db2.gz JGFQUPFHYFAJNE-LBPRGKRZSA-N 2 0 306.450 3.361 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000158006070 661869666 /nfs/dbraw/zinc/86/96/66/661869666.db2.gz OBEOGCUBYCVCNB-APWZRJJASA-N 2 0 314.473 3.458 20 10 DGCDRP Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000383936769 685169810 /nfs/dbraw/zinc/16/98/10/685169810.db2.gz CYFVMAOFPWUYRU-HKUYNNGSSA-N 2 0 322.452 3.491 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1 ZINC000396445356 685227389 /nfs/dbraw/zinc/22/73/89/685227389.db2.gz DDICVORLIFMLIK-MRXNPFEDSA-N 2 0 303.494 3.353 20 10 DGCDRP C[C@H]1C[C@@H](C[N@H+](C)Cc2ccc(N3CCCC3)cc2)CC[NH2+]1 ZINC001576597022 1191850349 /nfs/dbraw/zinc/85/03/49/1191850349.db2.gz CRJNNKMACDDRAZ-WMZOPIPTSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)cc1C ZINC001335238718 1178877431 /nfs/dbraw/zinc/87/74/31/1178877431.db2.gz TZPTXAZMEZYFCB-LZLYRXPVSA-N 2 0 302.462 3.171 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCC[C@@H](C[C@H]([NH3+])C3CCCC3)C2)cc1 ZINC001356082670 1181139031 /nfs/dbraw/zinc/13/90/31/1181139031.db2.gz BOQVVVNFFKDQEU-LPHOPBHVSA-N 2 0 301.478 3.388 20 10 DGCDRP C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C ZINC001461002477 1182753393 /nfs/dbraw/zinc/75/33/93/1182753393.db2.gz WPPMLXIYQUWLKZ-UWVAXJGDSA-N 2 0 315.505 3.353 20 10 DGCDRP CCOCc1cc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)ccc1OC ZINC001560358631 1189318337 /nfs/dbraw/zinc/31/83/37/1189318337.db2.gz QWGAGNAZUNBMCN-MSOLQXFVSA-N 2 0 320.477 3.194 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]3C3CCC3)cc2)CC1 ZINC001560985793 1189415450 /nfs/dbraw/zinc/41/54/50/1189415450.db2.gz LPORJOHKFAEXIH-WOJBJXKFSA-N 2 0 313.489 3.107 20 10 DGCDRP C[C@@H](CC(C)(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001656383040 1196033838 /nfs/dbraw/zinc/03/38/38/1196033838.db2.gz QZZFDSUMJOUVME-INIZCTEOSA-N 2 0 303.494 3.353 20 10 DGCDRP Cc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1C ZINC001656855739 1196075803 /nfs/dbraw/zinc/07/58/03/1196075803.db2.gz RKHXYBYRITWWGX-UHFFFAOYSA-N 2 0 323.484 3.345 20 10 DGCDRP CCC[C@H](C)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001658508046 1196267154 /nfs/dbraw/zinc/26/71/54/1196267154.db2.gz UKAMJYSTRAKLBS-KRWDZBQOSA-N 2 0 303.494 3.354 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC[C@H]3C=CCC3)cc2)CC1 ZINC001663193941 1196808499 /nfs/dbraw/zinc/80/84/99/1196808499.db2.gz UQNKFUPVUHMFDG-SFHVURJKSA-N 2 0 313.489 3.274 20 10 DGCDRP Nc1ccc(C[N@@H+]2C[C@@H]3CC[NH+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000380110495 1197703534 /nfs/dbraw/zinc/70/35/34/1197703534.db2.gz ZIZUFFBOSZFCRK-VQTJNVASSA-N 2 0 321.468 3.223 20 10 DGCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000314945589 1199797230 /nfs/dbraw/zinc/79/72/30/1199797230.db2.gz RPPZQLDYTMVFFG-SFHVURJKSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1ccc(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4O)C[C@@H]3C2)cc1 ZINC001203552010 1090753851 /nfs/dbraw/zinc/75/38/51/1090753851.db2.gz WUSJAUKOCFKKES-PMACEKPBSA-N 2 0 322.452 3.264 20 10 DGCDRP C[NH+]1CCC2(CC[N@H+](Cc3ccc(N4CCCC4)cc3)C2)CC1 ZINC001204321091 1090948212 /nfs/dbraw/zinc/94/82/12/1090948212.db2.gz GDWPCQMGXNCAKQ-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3ccc(N4CCCC4)cc3)C[C@H]2C1 ZINC001204328535 1090950943 /nfs/dbraw/zinc/95/09/43/1090950943.db2.gz INJNHPMGRSGJQF-RTBURBONSA-N 2 0 313.489 3.060 20 10 DGCDRP C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001205164402 1091116238 /nfs/dbraw/zinc/11/62/38/1091116238.db2.gz FKZNKXRBMDICLJ-KRWDZBQOSA-N 2 0 321.468 3.216 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)CC[C@H]1C[NH3+] ZINC001205602673 1091273302 /nfs/dbraw/zinc/27/33/02/1091273302.db2.gz LGIUPIHPFNXFKC-WMZOPIPTSA-N 2 0 301.478 3.094 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@@H](C)C[C@@H]2C)cc(C[NH+](C)C)c1O ZINC001139258227 1091504018 /nfs/dbraw/zinc/50/40/18/1091504018.db2.gz NBUPKHJDSSTALT-KGLIPLIRSA-N 2 0 306.450 3.083 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@](C)(F)C3)cc2)CC1 ZINC001139409076 1091551523 /nfs/dbraw/zinc/55/15/23/1091551523.db2.gz VBSMPXXQRNSIEP-IBGZPJMESA-N 2 0 319.468 3.153 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)c(O)c1 ZINC001206311821 1091573563 /nfs/dbraw/zinc/57/35/63/1091573563.db2.gz VKPKUZNKGWBKBQ-LJQANCHMSA-N 2 0 319.493 3.189 20 10 DGCDRP Cc1cc(N2CC[NH+](Cc3ccc(N(C)C)c(C)c3)CC2)cc[nH+]1 ZINC001139673524 1091639381 /nfs/dbraw/zinc/63/93/81/1091639381.db2.gz DJVDGQBCAJUYGR-UHFFFAOYSA-N 2 0 324.472 3.087 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@@H+]3C[C@H](C[NH3+])CC[C@H]3C)c2c1 ZINC001206805712 1091747812 /nfs/dbraw/zinc/74/78/12/1091747812.db2.gz CRQVZALISDXYQH-KGLIPLIRSA-N 2 0 314.429 3.113 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3C[C@@H]4CCC[C@H]4C3)cc2)CC1 ZINC001140301094 1091818036 /nfs/dbraw/zinc/81/80/36/1091818036.db2.gz YTCJXPNOXHUSGZ-OALUTQOASA-N 2 0 313.489 3.060 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+](C(C)C)C(C)C)cc2)CC1 ZINC001140300794 1091818786 /nfs/dbraw/zinc/81/87/86/1091818786.db2.gz ULWIRRZHIIKJFX-UHFFFAOYSA-N 2 0 303.494 3.447 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(CC4)CC3)cc2)CC1 ZINC001140302701 1091819597 /nfs/dbraw/zinc/81/95/97/1091819597.db2.gz YGDKGKVLPDBYBC-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)CC1 ZINC001140306221 1091819637 /nfs/dbraw/zinc/81/96/37/1091819637.db2.gz PVALHLFPQBRZIO-QZTJIDSGSA-N 2 0 315.505 3.306 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](CC3CC3)C(C)C)cc2)CC1 ZINC001140304393 1091819878 /nfs/dbraw/zinc/81/98/78/1091819878.db2.gz NHBXBBQPGAOYDQ-UHFFFAOYSA-N 2 0 315.505 3.449 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC34CCCC4)cc2)CC1 ZINC001140302140 1091820849 /nfs/dbraw/zinc/82/08/49/1091820849.db2.gz LEXBXVCKKAHLEG-UHFFFAOYSA-N 2 0 313.489 3.347 20 10 DGCDRP Cc1c(O)ccc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)c1O ZINC001140748977 1091985391 /nfs/dbraw/zinc/98/53/91/1091985391.db2.gz MSFLRXOEEYSGSH-IRXDYDNUSA-N 2 0 318.461 3.245 20 10 DGCDRP C[N@@H+]1CCCC2(CC[NH+](Cc3cc(Cl)c(O)cc3O)CC2)C1 ZINC001276617010 1092660414 /nfs/dbraw/zinc/66/04/14/1092660414.db2.gz MIYQYUPTHGLVMV-UHFFFAOYSA-N 2 0 324.852 3.059 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000316871783 1095198516 /nfs/dbraw/zinc/19/85/16/1095198516.db2.gz WNZLDZRJAGAMAG-QXSJWSMHSA-N 2 0 300.446 3.465 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@]23CCC[NH2+]CC3)cc1Cl ZINC001222314082 1095545044 /nfs/dbraw/zinc/54/50/44/1095545044.db2.gz BULNCUZPIZHGTE-KRWDZBQOSA-N 2 0 308.853 3.462 20 10 DGCDRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC001116565793 1095602459 /nfs/dbraw/zinc/60/24/59/1095602459.db2.gz XDISXFBNVGBZRE-GUTXKFCHSA-N 2 0 306.425 3.401 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC001118016083 1095923031 /nfs/dbraw/zinc/92/30/31/1095923031.db2.gz TURIBAFLHHTUCO-ICSRJNTNSA-N 2 0 313.489 3.251 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC001118242849 1095965180 /nfs/dbraw/zinc/96/51/80/1095965180.db2.gz LFADTAATQPBKKR-RBUKOAKNSA-N 2 0 313.489 3.108 20 10 DGCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322553619 1096729244 /nfs/dbraw/zinc/72/92/44/1096729244.db2.gz BPUNGLOXQYPGPE-NIOBXDJOSA-N 2 0 300.446 3.464 20 10 DGCDRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(N3CCCC3)cc1)C2 ZINC001172102942 1097053555 /nfs/dbraw/zinc/05/35/55/1097053555.db2.gz QWVLYTPQLYUURF-VJDPLVQDSA-N 2 0 313.489 3.392 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCN(c3cc[nH+]c(C)c3)CC2)c(O)c1 ZINC001231850404 1097864266 /nfs/dbraw/zinc/86/42/66/1097864266.db2.gz ORIOTQGTOBYWMP-UHFFFAOYSA-N 2 0 311.429 3.035 20 10 DGCDRP CCC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCC1 ZINC001177961598 1098653249 /nfs/dbraw/zinc/65/32/49/1098653249.db2.gz KTOFXKWIISUETF-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c1O ZINC001234994454 1098739544 /nfs/dbraw/zinc/73/95/44/1098739544.db2.gz TZSKXFBCQSODAW-IBGZPJMESA-N 2 0 302.462 3.265 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)c2ccccc21 ZINC001235030043 1098759580 /nfs/dbraw/zinc/75/95/80/1098759580.db2.gz DUJLPLOUITYHMP-HXUWFJFHSA-N 2 0 309.457 3.091 20 10 DGCDRP Cc1cccc(C[N@@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c1O ZINC001235355341 1098974395 /nfs/dbraw/zinc/97/43/95/1098974395.db2.gz OUUSBODYWIBUAI-TZIWHRDSSA-N 2 0 322.452 3.280 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001235363823 1098981038 /nfs/dbraw/zinc/98/10/38/1098981038.db2.gz KFEWILNDOSPVRY-FPOVZHCZSA-N 2 0 322.452 3.145 20 10 DGCDRP CCc1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235423898 1099016829 /nfs/dbraw/zinc/01/68/29/1099016829.db2.gz GYGDGBMOFCYVLX-IAGOWNOFSA-N 2 0 302.462 3.166 20 10 DGCDRP Cc1cc(C)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235426371 1099018807 /nfs/dbraw/zinc/01/88/07/1099018807.db2.gz KQGZKXIHJILPPY-IAGOWNOFSA-N 2 0 302.462 3.221 20 10 DGCDRP Cc1cc(C)c(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235426372 1099019391 /nfs/dbraw/zinc/01/93/91/1099019391.db2.gz KQGZKXIHJILPPY-IRXDYDNUSA-N 2 0 302.462 3.221 20 10 DGCDRP CCCC1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235673149 1099116034 /nfs/dbraw/zinc/11/60/34/1099116034.db2.gz LYZVQHUHLKGWSE-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC(C3CC[NH2+]CC3)CC2)c1O ZINC001235701929 1099136051 /nfs/dbraw/zinc/13/60/51/1099136051.db2.gz OHULYJBAXOIJTA-UHFFFAOYSA-N 2 0 302.462 3.221 20 10 DGCDRP CCc1ccc(C[NH+]2CCC(C3CC[NH2+]CC3)CC2)c(O)c1 ZINC001235701433 1099136306 /nfs/dbraw/zinc/13/63/06/1099136306.db2.gz CBQPNCORCKEKAU-UHFFFAOYSA-N 2 0 302.462 3.166 20 10 DGCDRP Cc1cc(F)cc(C[NH+]2CCC(C3CC[NH2+]CC3)CC2)c1O ZINC001235703114 1099136585 /nfs/dbraw/zinc/13/65/85/1099136585.db2.gz RQYVSYQRJNDSEM-UHFFFAOYSA-N 2 0 306.425 3.051 20 10 DGCDRP C[N@H+](C/C=C/c1ccccc1)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235961940 1099294567 /nfs/dbraw/zinc/29/45/67/1099294567.db2.gz JTFJHDPGUWAKCW-VMPITWQZSA-N 2 0 324.424 3.019 20 10 DGCDRP CC(C)(C)c1ccc(C[NH+]2CC3(C2)CCC[NH2+]CC3)c(O)c1 ZINC001236010246 1099332200 /nfs/dbraw/zinc/33/22/00/1099332200.db2.gz USMPRCIGRIHCDR-UHFFFAOYSA-N 2 0 302.462 3.265 20 10 DGCDRP Cc1cc(O)c(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)cc1Cl ZINC001236600396 1099697501 /nfs/dbraw/zinc/69/75/01/1099697501.db2.gz HUKNEFDNFGNNMO-ZDUSSCGKSA-N 2 0 308.853 3.318 20 10 DGCDRP COc1cc(C)c(C[N@H+](C(C)C)C2CCN(C)CC2)c(O)c1 ZINC001236815758 1099802727 /nfs/dbraw/zinc/80/27/27/1099802727.db2.gz NYJUOSGXCGMLBJ-UHFFFAOYSA-N 2 0 306.450 3.014 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)cc1 ZINC001236818144 1099805882 /nfs/dbraw/zinc/80/58/82/1099805882.db2.gz GLLCHMVSBBEHQO-SXLOBPIMSA-N 2 0 309.457 3.263 20 10 DGCDRP COc1cc(C)c(CN2CCC([NH+]3CCCCC3)CC2)c(O)c1 ZINC001236819121 1099805991 /nfs/dbraw/zinc/80/59/91/1099805991.db2.gz UBMCSJZGYBWLJW-UHFFFAOYSA-N 2 0 318.461 3.160 20 10 DGCDRP Cc1cccc(O)c1C[NH+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001237488495 1100141288 /nfs/dbraw/zinc/14/12/88/1100141288.db2.gz ZBHSZYCPLGVKMK-OALUTQOASA-N 2 0 322.452 3.264 20 10 DGCDRP Cc1cc(F)cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c1O ZINC001238064300 1100348905 /nfs/dbraw/zinc/34/89/05/1100348905.db2.gz ABZVBDKODVUHKX-UHFFFAOYSA-N 2 0 306.425 3.148 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)cc1 ZINC001203942845 1102224647 /nfs/dbraw/zinc/22/46/47/1102224647.db2.gz UHZXPJMKBBNPJO-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC001326035740 1103188831 /nfs/dbraw/zinc/18/88/31/1103188831.db2.gz MEMAXTPTTKJAEH-GHMZBOCLSA-N 2 0 315.255 3.112 20 10 DGCDRP CC[NH2+]CC1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001326200085 1103233211 /nfs/dbraw/zinc/23/32/11/1103233211.db2.gz NSHCBUXDBFJELO-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP CC[C@H]([NH2+]C[C@H](C)C[NH2+]C)c1ccc(C(F)(F)F)cc1O ZINC001326474174 1103332211 /nfs/dbraw/zinc/33/22/11/1103332211.db2.gz TYYIPEGPXJPJNE-MFKMUULPSA-N 2 0 304.356 3.307 20 10 DGCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3ccc4ccccc4c3O)C[C@H]2CC1 ZINC001276373999 1103696120 /nfs/dbraw/zinc/69/61/20/1103696120.db2.gz NRUXPAIHVHBCLO-CALCHBBNSA-N 2 0 310.441 3.319 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC001329036527 1104133019 /nfs/dbraw/zinc/13/30/19/1104133019.db2.gz MXPBULWWQCUDOJ-JKJDWNRSSA-N 2 0 300.446 3.227 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC2CC[NH+](CC)CC2)cc1F ZINC001649171012 1104162428 /nfs/dbraw/zinc/16/24/28/1104162428.db2.gz JGMFDJYYTUKLKF-UHFFFAOYSA-N 2 0 321.484 3.493 20 10 DGCDRP COc1ccc(C[NH2+]C2CCC3(CC[NH2+]CC3)CC2)cc1C ZINC001246344686 1104501224 /nfs/dbraw/zinc/50/12/24/1104501224.db2.gz KVBLXLRXCAGPGS-UHFFFAOYSA-N 2 0 302.462 3.406 20 10 DGCDRP Oc1ccccc1C[N@H+]1C[C@@H]2CC[NH+](C3CCCC3)CC[C@@H]2C1 ZINC001275267793 1104697986 /nfs/dbraw/zinc/69/79/86/1104697986.db2.gz WYGOVKACBGJZJA-CALCHBBNSA-N 2 0 314.473 3.479 20 10 DGCDRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1c(O)ccc3ccccc31)C2 ZINC001276078499 1105009521 /nfs/dbraw/zinc/00/95/21/1105009521.db2.gz QGIFDNFGHBZJOQ-HXUWFJFHSA-N 2 0 310.441 3.463 20 10 DGCDRP CC(C)C[NH+]1CCC([N@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001258016563 1106658251 /nfs/dbraw/zinc/65/82/51/1106658251.db2.gz ABVFAEWSMIPUIL-UHFFFAOYSA-N 2 0 303.494 3.305 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCCC3)cc2)[C@H](C)C1 ZINC001319717062 1108607738 /nfs/dbraw/zinc/60/77/38/1108607738.db2.gz KGKAYNOIMZDCOT-YLJYHZDGSA-N 2 0 315.505 3.449 20 10 DGCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc(OC)c2O)CC1 ZINC000134165253 432074800 /nfs/dbraw/zinc/07/48/00/432074800.db2.gz BLLBSNAYVKVWHJ-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000293836849 131774177 /nfs/dbraw/zinc/77/41/77/131774177.db2.gz XNKXTYWHQOXUQA-HNNXBMFYSA-N 2 0 306.450 3.318 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1O ZINC000093683567 431916767 /nfs/dbraw/zinc/91/67/67/431916767.db2.gz IQMUSDSWOFYZLF-MRXNPFEDSA-N 2 0 318.461 3.099 20 10 DGCDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000093770025 431916785 /nfs/dbraw/zinc/91/67/85/431916785.db2.gz KFZZGCWVJMMSDK-IBGZPJMESA-N 2 0 315.505 3.451 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CC2(C[NH+](C)C)CCCC2)c1 ZINC000183950807 432338785 /nfs/dbraw/zinc/33/87/85/432338785.db2.gz NWIPGZUPNYVTDV-AWEZNQCLSA-N 2 0 306.450 3.173 20 10 DGCDRP COCC[N@H+](C)CCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185008704 432455853 /nfs/dbraw/zinc/45/58/53/432455853.db2.gz NWSRJKDGIGHPDV-HNNXBMFYSA-N 2 0 316.445 3.164 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC000186142528 432562154 /nfs/dbraw/zinc/56/21/54/432562154.db2.gz IZIKNLMRWCXNOZ-JKSUJKDBSA-N 2 0 320.477 3.419 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c(O)c1 ZINC000277625337 432864972 /nfs/dbraw/zinc/86/49/72/432864972.db2.gz XIPOIFMBVCJDFH-MRXNPFEDSA-N 2 0 306.450 3.097 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c(O)c1 ZINC000293661034 433821976 /nfs/dbraw/zinc/82/19/76/433821976.db2.gz NXPACNWRBZZWOI-IBGZPJMESA-N 2 0 318.461 3.099 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000556877847 435035580 /nfs/dbraw/zinc/03/55/80/435035580.db2.gz MRHVJSUCSNTFAD-KZNAEPCWSA-N 2 0 311.473 3.449 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c(O)c1 ZINC000156096244 520352313 /nfs/dbraw/zinc/35/23/13/520352313.db2.gz AKBBALXAMRFFSH-QAPCUYQASA-N 2 0 318.461 3.097 20 10 DGCDRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000746381330 575449006 /nfs/dbraw/zinc/44/90/06/575449006.db2.gz HPEUWCXYWBMMGF-INIZCTEOSA-N 2 0 314.473 3.045 20 10 DGCDRP Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)CC2 ZINC000853240602 620680963 /nfs/dbraw/zinc/68/09/63/620680963.db2.gz OWJMWKLOHPFNQG-RDJZCZTQSA-N 2 0 300.446 3.091 20 10 DGCDRP C[C@H]([NH2+]CC1([NH3+])CCCC1)c1cc(Br)ccc1O ZINC000854222819 620785816 /nfs/dbraw/zinc/78/58/16/620785816.db2.gz LDWMXQFOWQYPRC-JTQLQIEISA-N 2 0 313.239 3.077 20 10 DGCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)cc1 ZINC000925779998 618617504 /nfs/dbraw/zinc/61/75/04/618617504.db2.gz DDGXGXMXQBJNHJ-UKRRQHHQSA-N 2 0 311.420 3.038 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)cc1 ZINC000925779999 618617588 /nfs/dbraw/zinc/61/75/88/618617588.db2.gz DDGXGXMXQBJNHJ-ZFWWWQNUSA-N 2 0 311.420 3.038 20 10 DGCDRP COc1cc(C)cc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1O ZINC000894195927 618727200 /nfs/dbraw/zinc/72/72/00/618727200.db2.gz QELFMSKVVIOIAL-UHFFFAOYSA-N 2 0 306.450 3.062 20 10 DGCDRP COc1ccc(O)c(C[N@H+](C)CCCC[NH+]2CCCCC2)c1 ZINC000895682521 618818379 /nfs/dbraw/zinc/81/83/79/618818379.db2.gz GPUWCDKPISNNDU-UHFFFAOYSA-N 2 0 306.450 3.099 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)Cc2cccc3c2CC[NH2+]C3)cc1 ZINC000903873676 619827338 /nfs/dbraw/zinc/82/73/38/619827338.db2.gz KBEXYEADTIWZLW-UHFFFAOYSA-N 2 0 309.457 3.030 20 10 DGCDRP Cc1cc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)ccc1N(C)C ZINC000923364797 621178938 /nfs/dbraw/zinc/17/89/38/621178938.db2.gz OQVSYNQNZCPFHP-SFHVURJKSA-N 2 0 301.478 3.025 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)c2c1c(F)ccc2O ZINC000858490662 621197625 /nfs/dbraw/zinc/19/76/25/621197625.db2.gz LKSKNMYGRZHIGH-IPYPFGDCSA-N 2 0 306.425 3.401 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)c2c1c(F)ccc2O ZINC000858490663 621197628 /nfs/dbraw/zinc/19/76/28/621197628.db2.gz LKSKNMYGRZHIGH-NFAWXSAZSA-N 2 0 306.425 3.401 20 10 DGCDRP C[C@@H]([NH2+]CCOCCC[NH3+])c1ccc(N2CCCCCC2)cc1 ZINC000863547019 621683191 /nfs/dbraw/zinc/68/31/91/621683191.db2.gz NSBKRWSYSYZVAY-QGZVFWFLSA-N 2 0 319.493 3.083 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000757675117 621732852 /nfs/dbraw/zinc/73/28/52/621732852.db2.gz ZYBJTKDQRPVOJV-HIFRSBDPSA-N 2 0 324.440 3.028 20 10 DGCDRP CN(C)c1ccc(C[N@H+](CC[C@@H]2CCC[NH+]2C)C2CC2)cc1 ZINC000759846396 621895827 /nfs/dbraw/zinc/89/58/27/621895827.db2.gz UCUMPRZESRGLQU-SFHVURJKSA-N 2 0 301.478 3.201 20 10 DGCDRP CCOc1ccc(C[NH2+]CCC2CC[NH+](C(C)C)CC2)c(O)c1 ZINC000865717388 621982833 /nfs/dbraw/zinc/98/28/33/621982833.db2.gz XPDDUJURZSRZOQ-UHFFFAOYSA-N 2 0 320.477 3.391 20 10 DGCDRP CC(C)[NH+]1CCC(CC[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000866468259 622123266 /nfs/dbraw/zinc/12/32/66/622123266.db2.gz DFBBMQFVZBYYCB-QGZVFWFLSA-N 2 0 302.462 3.480 20 10 DGCDRP CCC(CC)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000773145867 622991228 /nfs/dbraw/zinc/99/12/28/622991228.db2.gz NJBPFROIRBEJDQ-UHFFFAOYSA-N 2 0 315.505 3.497 20 10 DGCDRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000873251804 623092290 /nfs/dbraw/zinc/09/22/90/623092290.db2.gz OJOUVRNPXAJZSF-ZIFCJYIRSA-N 2 0 310.441 3.393 20 10 DGCDRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000873256793 623093754 /nfs/dbraw/zinc/09/37/54/623093754.db2.gz OJOUVRNPXAJZSF-LNLFQRSKSA-N 2 0 310.441 3.393 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000873257409 623094026 /nfs/dbraw/zinc/09/40/26/623094026.db2.gz UTXUJTDITMFRRX-FMKPAKJESA-N 2 0 305.441 3.204 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000873258786 623094435 /nfs/dbraw/zinc/09/44/35/623094435.db2.gz UTXUJTDITMFRRX-IIAWOOMASA-N 2 0 305.441 3.204 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000873265953 623097817 /nfs/dbraw/zinc/09/78/17/623097817.db2.gz YGLOYONHFORDCN-ONIAQPFYSA-N 2 0 301.478 3.324 20 10 DGCDRP CC[C@H]1C[C@H](C)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775708879 623317073 /nfs/dbraw/zinc/31/70/73/623317073.db2.gz PIJJXCCBOLAPTF-WMZOPIPTSA-N 2 0 301.478 3.059 20 10 DGCDRP CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775708874 623317502 /nfs/dbraw/zinc/31/75/02/623317502.db2.gz PIJJXCCBOLAPTF-FUHWJXTLSA-N 2 0 301.478 3.059 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000876810523 623711922 /nfs/dbraw/zinc/71/19/22/623711922.db2.gz ANJPUINYTUSPRM-YJBOKZPZSA-N 2 0 300.446 3.149 20 10 DGCDRP Cc1ccc(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(O)c1 ZINC000877044879 623774535 /nfs/dbraw/zinc/77/45/35/623774535.db2.gz KCJUONFDYFLCGE-UHFFFAOYSA-N 2 0 302.393 3.191 20 10 DGCDRP Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(O)c1 ZINC000877190147 623822821 /nfs/dbraw/zinc/82/28/21/623822821.db2.gz XIOSAQSYPRZERD-DOTOQJQBSA-N 2 0 302.462 3.443 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cc1C ZINC000877684372 623991214 /nfs/dbraw/zinc/99/12/14/623991214.db2.gz NYMXBUQWGXHZQV-UHFFFAOYSA-N 2 0 302.462 3.317 20 10 DGCDRP COc1ccc(O)c(C[N@H+](CC(C)C)CC2CC[NH+](C)CC2)c1 ZINC000877767558 624028794 /nfs/dbraw/zinc/02/87/94/624028794.db2.gz NJEGALPAAHTWNG-UHFFFAOYSA-N 2 0 320.477 3.201 20 10 DGCDRP C[C@@H]([NH2+]Cc1cc(F)cc(F)c1[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000883085167 625921977 /nfs/dbraw/zinc/92/19/77/625921977.db2.gz KGOKKKSHFVCPSP-OLZOCXBDSA-N 2 0 324.415 3.413 20 10 DGCDRP Cc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cs1 ZINC000883283888 626636476 /nfs/dbraw/zinc/63/64/76/626636476.db2.gz XARNXDPBOXAEGA-UHFFFAOYSA-N 2 0 315.486 3.098 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCC4)CC3)cc2)CC1 ZINC000809707356 626939448 /nfs/dbraw/zinc/93/94/48/626939448.db2.gz VRYLRDZGEFLSHY-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1F ZINC000809755583 626947685 /nfs/dbraw/zinc/94/76/85/626947685.db2.gz LUDAATLAWSKXET-QGZVFWFLSA-N 2 0 319.468 3.055 20 10 DGCDRP C[C@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)C[NH+](C)C ZINC000813785909 627511684 /nfs/dbraw/zinc/51/16/84/627511684.db2.gz HXQUKVSMNNLJNE-GFCCVEGCSA-N 2 0 317.399 3.059 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(C4CC4)CC3)cc2)CC1 ZINC000814172197 627546763 /nfs/dbraw/zinc/54/67/63/627546763.db2.gz CHJQKEUIIFVNDZ-UHFFFAOYSA-N 2 0 313.489 3.060 20 10 DGCDRP Cc1cc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)ccc1N(C)C ZINC000815056031 627619949 /nfs/dbraw/zinc/61/99/49/627619949.db2.gz YWJPGRKYZVFEPA-IBGZPJMESA-N 2 0 315.505 3.225 20 10 DGCDRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(N(C)C)c(C)c2)CC1 ZINC000815057577 627620724 /nfs/dbraw/zinc/62/07/24/627620724.db2.gz UOPHLLSBOLXJAF-UHFFFAOYSA-N 2 0 303.494 3.367 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)cc1 ZINC000925512036 627745110 /nfs/dbraw/zinc/74/51/10/627745110.db2.gz YQVYUAMUFUTSMA-RTBURBONSA-N 2 0 301.478 3.011 20 10 DGCDRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816583478 627811434 /nfs/dbraw/zinc/81/14/34/627811434.db2.gz LRNUEVAJNGIHII-UHFFFAOYSA-N 2 0 312.816 3.245 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000817894290 627954692 /nfs/dbraw/zinc/95/46/92/627954692.db2.gz LEIRYSHWIKUNEA-CEXWTWQISA-N 2 0 301.478 3.071 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000817897837 627955504 /nfs/dbraw/zinc/95/55/04/627955504.db2.gz CCMLFNBVIGKVIZ-XUVXKRRUSA-N 2 0 313.489 3.297 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)C1C[NH2+]C1 ZINC000817932731 627965830 /nfs/dbraw/zinc/96/58/30/627965830.db2.gz XKSUHXQOGNIFPY-KGLIPLIRSA-N 2 0 321.896 3.274 20 10 DGCDRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817941781 627968385 /nfs/dbraw/zinc/96/83/85/627968385.db2.gz RNLQCQPFYOCZSZ-AWEZNQCLSA-N 2 0 316.367 3.451 20 10 DGCDRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817947379 627970410 /nfs/dbraw/zinc/97/04/10/627970410.db2.gz MKBZCNHCTBEGND-ZQIUZPCESA-N 2 0 302.462 3.310 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(CC[NH3+])cc2)c2c1c(F)ccc2O ZINC000817950251 627972112 /nfs/dbraw/zinc/97/21/12/627972112.db2.gz XDFSHVSVVMAAMJ-LRDDRELGSA-N 2 0 314.404 3.371 20 10 DGCDRP CC[C@H]([NH2+]C[C@@H]([NH3+])C(C)C)c1cc(Br)ccc1O ZINC000817957364 627973976 /nfs/dbraw/zinc/97/39/76/627973976.db2.gz BESQYXXRPJHMBM-OLZOCXBDSA-N 2 0 315.255 3.179 20 10 DGCDRP C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000817957255 627974240 /nfs/dbraw/zinc/97/42/40/627974240.db2.gz KEGYKEIEVKDNGW-YLJYHZDGSA-N 2 0 323.484 3.312 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)ccc1O ZINC000817969724 627978619 /nfs/dbraw/zinc/97/86/19/627978619.db2.gz YSRQRUMFZJTMKC-LLVKDONJSA-N 2 0 302.805 3.500 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c2c1c(F)ccc2O ZINC000817974814 627980684 /nfs/dbraw/zinc/98/06/84/627980684.db2.gz FRZJFALGFNGZEX-RGCMKSIDSA-N 2 0 306.425 3.434 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c2c1c(F)ccc2O ZINC000817974813 627980985 /nfs/dbraw/zinc/98/09/85/627980985.db2.gz FRZJFALGFNGZEX-PWNZVWSESA-N 2 0 306.425 3.434 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cc(Cl)ccc1O ZINC000817985296 627983405 /nfs/dbraw/zinc/98/34/05/627983405.db2.gz BYIGQUJTXMWZDJ-GMZLATJGSA-N 2 0 308.853 3.474 20 10 DGCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000817987413 627984034 /nfs/dbraw/zinc/98/40/34/627984034.db2.gz YTVRVDFYVKRYJK-WBVHZDCISA-N 2 0 301.478 3.468 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000817987533 627984592 /nfs/dbraw/zinc/98/45/92/627984592.db2.gz UCMQDCTWTFDFDN-HNONPPJISA-N 2 0 314.473 3.310 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C2CCC(C)([NH+]3CCC3)CC2)c1O ZINC000927039303 628001707 /nfs/dbraw/zinc/00/17/07/628001707.db2.gz UIUSMYPQAHTDKK-XVTSOASTSA-N 2 0 318.461 3.458 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000827949764 629007128 /nfs/dbraw/zinc/00/71/28/629007128.db2.gz NSDBDBNFYNAFEO-GOSISDBHSA-N 2 0 315.505 3.273 20 10 DGCDRP CCc1cccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000827951104 629007147 /nfs/dbraw/zinc/00/71/47/629007147.db2.gz WLLSHAROKCGFMC-MRXNPFEDSA-N 2 0 302.462 3.166 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C/c2ccc(N(C)C)cc2)[C@@H](C)C1 ZINC000835026112 629828159 /nfs/dbraw/zinc/82/81/59/629828159.db2.gz QMDXNSFXYFLSPS-DZCMZPKPSA-N 2 0 315.505 3.428 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000835036372 629830251 /nfs/dbraw/zinc/83/02/51/629830251.db2.gz PTUZUTQWNOBVBZ-ONEGZZNKSA-N 2 0 313.489 3.230 20 10 DGCDRP CCC[NH+]1CCC([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835043470 629833097 /nfs/dbraw/zinc/83/30/97/629833097.db2.gz UTUCITIWWRIRDA-AATRIKPKSA-N 2 0 301.478 3.230 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000835043668 629833852 /nfs/dbraw/zinc/83/38/52/629833852.db2.gz BAMXOSZWFXAHGO-WAYWQWQTSA-N 2 0 301.478 3.087 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)c2c1c(F)ccc2O ZINC000840811206 630361517 /nfs/dbraw/zinc/36/15/17/630361517.db2.gz ZOPXSFSWUFGXLH-UMVBOHGHSA-N 2 0 306.425 3.401 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000840932382 630380177 /nfs/dbraw/zinc/38/01/77/630380177.db2.gz PXGHSDVMIUPFNL-KRWDZBQOSA-N 2 0 303.494 3.271 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000840940462 630381109 /nfs/dbraw/zinc/38/11/09/630381109.db2.gz AEVMVPCXKAEWDR-UHFFFAOYSA-N 2 0 301.478 3.025 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000840942568 630382022 /nfs/dbraw/zinc/38/20/22/630382022.db2.gz HFQYUYVAMHYPGG-UHFFFAOYSA-N 2 0 315.505 3.369 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1F ZINC000841031169 630398275 /nfs/dbraw/zinc/39/82/75/630398275.db2.gz URTQOTPIPXXWSL-XYPWUTKMSA-N 2 0 305.441 3.045 20 10 DGCDRP CCOCc1cc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)ccc1OC ZINC000841079273 630405522 /nfs/dbraw/zinc/40/55/22/630405522.db2.gz KRNSSSQSWWSLPV-WKILWMFISA-N 2 0 320.477 3.086 20 10 DGCDRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000841078984 630405568 /nfs/dbraw/zinc/40/55/68/630405568.db2.gz GRXFLGCYVJTYDA-HNNXBMFYSA-N 2 0 314.429 3.188 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000843043654 630607734 /nfs/dbraw/zinc/60/77/34/630607734.db2.gz ATECCGBFYCKNLD-FBQMEGEOSA-N 2 0 313.489 3.230 20 10 DGCDRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843051925 630608658 /nfs/dbraw/zinc/60/86/58/630608658.db2.gz MWBSZPGJMBJSAD-WMZOPIPTSA-N 2 0 301.478 3.236 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CCC[NH2+]C1 ZINC000843059923 630610122 /nfs/dbraw/zinc/61/01/22/630610122.db2.gz USRHHCHMNYRGSA-GOSISDBHSA-N 2 0 301.478 3.108 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)cc1F ZINC000843112647 630615095 /nfs/dbraw/zinc/61/50/95/630615095.db2.gz KHNWYVMKXDSBNA-HNNXBMFYSA-N 2 0 307.457 3.233 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1 ZINC000843125730 630616197 /nfs/dbraw/zinc/61/61/97/630616197.db2.gz GKKMLMPQVDXSSV-OALUTQOASA-N 2 0 315.505 3.354 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c1O ZINC000843125243 630616210 /nfs/dbraw/zinc/61/62/10/630616210.db2.gz OXOOBJMCVOLCEY-KGLIPLIRSA-N 2 0 308.853 3.176 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC000843127922 630616925 /nfs/dbraw/zinc/61/69/25/630616925.db2.gz UPWILJXLWVHZHM-HZPDHXFCSA-N 2 0 318.461 3.003 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1F ZINC000843341227 630647713 /nfs/dbraw/zinc/64/77/13/630647713.db2.gz SOVPXAWLERQCBI-GVDBMIGSSA-N 2 0 319.468 3.150 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000843343146 630647783 /nfs/dbraw/zinc/64/77/83/630647783.db2.gz UEPKZARFZHGCBJ-OKZBNKHCSA-N 2 0 301.478 3.011 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2F)c2c1c(F)ccc2O ZINC000844923742 630986204 /nfs/dbraw/zinc/98/62/04/630986204.db2.gz JRXYCQUFQDCRJQ-MEBBXXQBSA-N 2 0 318.367 3.467 20 10 DGCDRP COc1cccc([C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1O ZINC000846142709 631211664 /nfs/dbraw/zinc/21/16/64/631211664.db2.gz CCCWKOMFITVRIE-BBRMVZONSA-N 2 0 308.466 3.418 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c1O ZINC000846155977 631212486 /nfs/dbraw/zinc/21/24/86/631212486.db2.gz JLEDUOVQPXTYOO-HOTGVXAUSA-N 2 0 320.477 3.419 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CC2(C[NH+](C)C)CCCC2)c1O ZINC000846161962 631213050 /nfs/dbraw/zinc/21/30/50/631213050.db2.gz DDDLMPPUHLBAIQ-CQSZACIVSA-N 2 0 306.450 3.173 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000849350077 631900926 /nfs/dbraw/zinc/90/09/26/631900926.db2.gz JRVDBVLXLCWIPP-SFHVURJKSA-N 2 0 315.505 3.273 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cc2c(cc1O)CCCC2 ZINC000185404135 660221551 /nfs/dbraw/zinc/22/15/51/660221551.db2.gz IHJHDYDQWAYAPQ-GJZGRUSLSA-N 2 0 302.462 3.263 20 10 DGCDRP Cc1ccc(O)c(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000793246508 661017173 /nfs/dbraw/zinc/01/71/73/661017173.db2.gz JXUDCWDMLTUINE-BGYRXZFFSA-N 2 0 322.452 3.264 20 10 DGCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc4c(cc3O)CCCC4)CC[C@@H]21 ZINC000160434298 655632677 /nfs/dbraw/zinc/63/26/77/655632677.db2.gz WSYMHDFXUPCKEP-HKUYNNGSSA-N 2 0 314.473 3.187 20 10 DGCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000320265944 656939122 /nfs/dbraw/zinc/93/91/22/656939122.db2.gz SFWDBWHUAWPGOQ-IBGZPJMESA-N 2 0 315.505 3.497 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1F ZINC000158719352 661877017 /nfs/dbraw/zinc/87/70/17/661877017.db2.gz KCLUTGICVSMSSI-OAHLLOKOSA-N 2 0 321.484 3.492 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CC[NH+](C)CC1 ZINC000396471548 685227292 /nfs/dbraw/zinc/22/72/92/685227292.db2.gz XQUXJNZHALZMJS-INIZCTEOSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1cc(O)c(C[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1Cl ZINC001579638498 1191983460 /nfs/dbraw/zinc/98/34/60/1191983460.db2.gz ZPZULMHJNVWGCH-UHFFFAOYSA-N 2 0 302.805 3.247 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3cc(Cl)ccc3O)C[C@@H]2C1 ZINC001352114251 1180299408 /nfs/dbraw/zinc/29/94/08/1180299408.db2.gz ZKNRPPKWHDEAAS-DVOMOZLQSA-N 2 0 308.853 3.208 20 10 DGCDRP CCOCc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)ccc1OC ZINC001461065771 1182762981 /nfs/dbraw/zinc/76/29/81/1182762981.db2.gz VRFVFYVLSYKOPE-INIZCTEOSA-N 2 0 320.477 3.053 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]34C[C@H]3CCCC4)cc2)CC1 ZINC001461758330 1182850457 /nfs/dbraw/zinc/85/04/57/1182850457.db2.gz YAVSOXOVPITKMM-QUCCMNQESA-N 2 0 313.489 3.108 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001462662583 1182982258 /nfs/dbraw/zinc/98/22/58/1182982258.db2.gz FGDYKJHRIJOBBD-UHFFFAOYSA-N 2 0 303.494 3.414 20 10 DGCDRP CC(C)[NH+]1CCC(CC[NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC001474227083 1183885690 /nfs/dbraw/zinc/88/56/90/1183885690.db2.gz PUWOIXDWOPMESL-UHFFFAOYSA-N 2 0 321.484 3.492 20 10 DGCDRP COc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(O)c1 ZINC001474473647 1183927971 /nfs/dbraw/zinc/92/79/71/1183927971.db2.gz XZYXIRFRCFYSBM-UHFFFAOYSA-N 2 0 318.461 3.288 20 10 DGCDRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3ccc(N4CCCCC4)cc3)[C@H]2C1 ZINC001621108434 1193804005 /nfs/dbraw/zinc/80/40/05/1193804005.db2.gz OVMKARWJIQQMTL-YSIASYRMSA-N 2 0 313.489 3.107 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCCCCC3)cc2)CC1 ZINC000039129909 1194064999 /nfs/dbraw/zinc/06/49/99/1194064999.db2.gz ZBYZQWXZFHJFCJ-UHFFFAOYSA-N 2 0 301.478 3.251 20 10 DGCDRP COc1cc(C)c(C[NH2+]CCCCC[NH+]2CCCC2)c(O)c1 ZINC001652549244 1195616188 /nfs/dbraw/zinc/61/61/88/1195616188.db2.gz TUYGDRFMKWJQDU-UHFFFAOYSA-N 2 0 306.450 3.065 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCCC3CCCC3)cc2)CC1 ZINC001655169397 1195885834 /nfs/dbraw/zinc/88/58/34/1195885834.db2.gz SUEBYGMFOFQCOY-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001656636288 1196056618 /nfs/dbraw/zinc/05/66/18/1196056618.db2.gz QVFXCOZYLSTFOO-LPHOPBHVSA-N 2 0 301.478 3.107 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)c1 ZINC001658028667 1196203918 /nfs/dbraw/zinc/20/39/18/1196203918.db2.gz YTDSFGCHOOQTFO-SJLPKXTDSA-N 2 0 302.462 3.432 20 10 DGCDRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccccc1O ZINC001167968186 1085894831 /nfs/dbraw/zinc/89/48/31/1085894831.db2.gz NTXCPFOFBKEIIC-HZTRTUMWSA-N 2 0 300.446 3.448 20 10 DGCDRP CC1(C)C=Cc2c(O)c(C[N@@H+]3CCCC[C@H](C[NH3+])C3)ccc2O1 ZINC001206649829 1088352171 /nfs/dbraw/zinc/35/21/71/1088352171.db2.gz ZQVHKOOORKTEBA-CQSZACIVSA-N 2 0 316.445 3.137 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001203560830 1090756477 /nfs/dbraw/zinc/75/64/77/1090756477.db2.gz HDZOMLYEMDZSAV-AZUAARDMSA-N 2 0 322.452 3.346 20 10 DGCDRP COc1ccc(O)c(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c1 ZINC001203674881 1090777663 /nfs/dbraw/zinc/77/76/63/1090777663.db2.gz FCEBLVJJKHXHAQ-KRWDZBQOSA-N 2 0 318.461 3.241 20 10 DGCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(N2CCCC2)cc1 ZINC001204328309 1090950550 /nfs/dbraw/zinc/95/05/50/1090950550.db2.gz GRYHNDQUJVSPRV-UHFFFAOYSA-N 2 0 303.494 3.451 20 10 DGCDRP C[C@H]1C[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C[C@H]1C[NH3+] ZINC001205151656 1091113848 /nfs/dbraw/zinc/11/38/48/1091113848.db2.gz XXWAIIPMXVLQLT-SUMWQHHRSA-N 2 0 314.404 3.225 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3c4ccccc4n(C)c3C)C[C@@H]2C1 ZINC001138259283 1091128067 /nfs/dbraw/zinc/12/80/67/1091128067.db2.gz DMYFYJUULRSFKX-IRXDYDNUSA-N 2 0 311.473 3.260 20 10 DGCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3c4ccccc4n(C)c3C)C[C@@H]2C1 ZINC001138259278 1091128286 /nfs/dbraw/zinc/12/82/86/1091128286.db2.gz DMYFYJUULRSFKX-CALCHBBNSA-N 2 0 311.473 3.260 20 10 DGCDRP CC1(C)C=Cc2c(O)c(C[N@@H+]3CCC[C@](C)([NH3+])CC3)ccc2O1 ZINC001205296892 1091171239 /nfs/dbraw/zinc/17/12/39/1091171239.db2.gz WCKUOWCDMXRIFL-IBGZPJMESA-N 2 0 316.445 3.280 20 10 DGCDRP Cc1c(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c2ccccc2n1C ZINC001205559443 1091252787 /nfs/dbraw/zinc/25/27/87/1091252787.db2.gz QYDFVDQENNRLPY-GOSISDBHSA-N 2 0 303.425 3.140 20 10 DGCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC001205570156 1091260586 /nfs/dbraw/zinc/26/05/86/1091260586.db2.gz GKLZJGZSFFLTSR-GOSISDBHSA-N 2 0 302.393 3.198 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c(O)c1 ZINC001205788156 1091347298 /nfs/dbraw/zinc/34/72/98/1091347298.db2.gz MXMYOJCUPCDTKV-AWEZNQCLSA-N 2 0 312.404 3.106 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCC[C@H]1C[NH3+] ZINC001206012508 1091449579 /nfs/dbraw/zinc/44/95/79/1091449579.db2.gz MAFGOEPVORPYPQ-CABCVRRESA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2O)CCC[C@H]1C[NH3+] ZINC001206026838 1091456938 /nfs/dbraw/zinc/45/69/38/1091456938.db2.gz UIDLYTIBRZSFHV-NEPJUHHUSA-N 2 0 316.367 3.218 20 10 DGCDRP COc1cc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)cc(C[NH+](C)C)c1O ZINC001139256305 1091501640 /nfs/dbraw/zinc/50/16/40/1091501640.db2.gz YFHJBPPCYVOYHY-HZPDHXFCSA-N 2 0 318.461 3.084 20 10 DGCDRP C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139404590 1091549574 /nfs/dbraw/zinc/54/95/74/1091549574.db2.gz PVWSUUJEDUMCHU-IAGOWNOFSA-N 2 0 301.478 3.201 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC1CCCCC1 ZINC001139412736 1091551690 /nfs/dbraw/zinc/55/16/90/1091551690.db2.gz LUSBIOBHBIUVAZ-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2cc3ccccc3cc2O)C1 ZINC001206370188 1091603323 /nfs/dbraw/zinc/60/33/23/1091603323.db2.gz LRTLMZVJNGABQG-GOSISDBHSA-N 2 0 302.393 3.198 20 10 DGCDRP C[C@@H]1CC[C@@H](C[NH3+])CN1Cc1c(O)ccc(Cl)c1Cl ZINC001206810560 1091749303 /nfs/dbraw/zinc/74/93/03/1091749303.db2.gz NYFFQMSYQRGLKF-ZJUUUORDSA-N 2 0 303.233 3.258 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCN(c3cc[nH+]cc3C)CC2)c1O ZINC001140185007 1091794651 /nfs/dbraw/zinc/79/46/51/1091794651.db2.gz NZRNCYQQHCCPCS-UHFFFAOYSA-N 2 0 311.429 3.035 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)CC1 ZINC001140300454 1091818056 /nfs/dbraw/zinc/81/80/56/1091818056.db2.gz QAJHTTRYOPPHEK-QGZVFWFLSA-N 2 0 301.478 3.060 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)CC1 ZINC001140300427 1091818382 /nfs/dbraw/zinc/81/83/82/1091818382.db2.gz PHYVSRWKQBYTGH-QGZVFWFLSA-N 2 0 301.478 3.203 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](F)CC3)cc2)CC1 ZINC001140302512 1091820455 /nfs/dbraw/zinc/82/04/55/1091820455.db2.gz SRTPOCZSNSHETP-GOSISDBHSA-N 2 0 319.468 3.153 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(CF)CC3)cc2)CC1 ZINC001140304729 1091820518 /nfs/dbraw/zinc/82/05/18/1091820518.db2.gz ZQDJPIXMUNIHQB-UHFFFAOYSA-N 2 0 319.468 3.010 20 10 DGCDRP C[NH+](C)CC(C)(C)C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001207285900 1091910207 /nfs/dbraw/zinc/91/02/07/1091910207.db2.gz PQWBBOZPHPUARC-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP C[C@H](CC1CCCC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001207326580 1091924812 /nfs/dbraw/zinc/92/48/12/1091924812.db2.gz QWBAXMFLKUOKLE-QGZVFWFLSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[NH+]1CCC(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)CC1 ZINC001208598976 1092419418 /nfs/dbraw/zinc/41/94/18/1092419418.db2.gz BQEWQOSNMYTQIV-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP CCc1cccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)c1O ZINC001336888807 1094773747 /nfs/dbraw/zinc/77/37/47/1094773747.db2.gz MKOHYARODVEMEL-JQHSSLGASA-N 2 0 302.462 3.117 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC[N@@H+]1C ZINC000316426122 1095172854 /nfs/dbraw/zinc/17/28/54/1095172854.db2.gz BETZFULSCWCIOO-WMZOPIPTSA-N 2 0 301.478 3.249 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c(O)c1 ZINC001222155267 1095463154 /nfs/dbraw/zinc/46/31/54/1095463154.db2.gz YZRCFFKVNHHCID-IBGZPJMESA-N 2 0 302.462 3.265 20 10 DGCDRP Oc1ccc(F)cc1C[N@@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222167777 1095474592 /nfs/dbraw/zinc/47/45/92/1095474592.db2.gz QWCKVDBDFLYMCY-SFHVURJKSA-N 2 0 306.425 3.277 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001119032635 1096122858 /nfs/dbraw/zinc/12/28/58/1096122858.db2.gz YNSBEFSADJTBIL-LJIZCISZSA-N 2 0 300.446 3.369 20 10 DGCDRP C[NH+]1CCC2(CC[N@H+](Cc3c(O)ccc4ccccc43)C2)CC1 ZINC001231590460 1097785481 /nfs/dbraw/zinc/78/54/81/1097785481.db2.gz CAEVNLSFVGKRAC-UHFFFAOYSA-N 2 0 310.441 3.463 20 10 DGCDRP COc1cc(N(C)C)ccc1C[N@H+](C(C)C)C1CCN(C)CC1 ZINC001231857645 1097866182 /nfs/dbraw/zinc/86/61/82/1097866182.db2.gz MAIZGXMRHHTYIX-UHFFFAOYSA-N 2 0 319.493 3.066 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]2C1 ZINC001233287096 1098276567 /nfs/dbraw/zinc/27/65/67/1098276567.db2.gz WIWWTJFPDIPAKE-IRXDYDNUSA-N 2 0 316.489 3.463 20 10 DGCDRP CCC(CC)C[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC001177692992 1098586035 /nfs/dbraw/zinc/58/60/35/1098586035.db2.gz HIURSRGDAJJSGH-UHFFFAOYSA-N 2 0 321.484 3.493 20 10 DGCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3cccc(-c4ccccc4)c3O)C[C@@H]2C1 ZINC001234998286 1098740979 /nfs/dbraw/zinc/74/09/79/1098740979.db2.gz DTOCLMHYDWFBAB-KDURUIRLSA-N 2 0 322.452 3.443 20 10 DGCDRP Cc1cc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)ccc1N(C)C ZINC001235229642 1098904305 /nfs/dbraw/zinc/90/43/05/1098904305.db2.gz RWTAWEFHMXIAMA-IBGZPJMESA-N 2 0 315.505 3.415 20 10 DGCDRP COc1cc(C)c(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c(O)c1 ZINC001235241118 1098912946 /nfs/dbraw/zinc/91/29/46/1098912946.db2.gz YLHLJJAZTBYUKG-SFHVURJKSA-N 2 0 318.461 3.063 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@@H]3F)c(O)c1 ZINC001235405917 1099002596 /nfs/dbraw/zinc/00/25/96/1099002596.db2.gz POTZZHBJIAWTES-PKOBYXMFSA-N 2 0 320.452 3.213 20 10 DGCDRP Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235432906 1099031122 /nfs/dbraw/zinc/03/11/22/1099031122.db2.gz ZILYUHLFPOIYSI-KGLIPLIRSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1cc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001235928546 1099264588 /nfs/dbraw/zinc/26/45/88/1099264588.db2.gz AGXYRZQOCFUJAN-PKOBYXMFSA-N 2 0 309.457 3.135 20 10 DGCDRP [NH3+][C@@H]1[C@@H]2CC[C@H]1C[N@@H+](Cc1cccc(-c3ccccc3)c1O)C2 ZINC001235960788 1099294327 /nfs/dbraw/zinc/29/43/27/1099294327.db2.gz ZOAKSXCHPAFHKK-HGKCTWBKSA-N 2 0 308.425 3.228 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[NH+]2CC3(C2)CCC[NH2+]CC3)c1 ZINC001236009441 1099332914 /nfs/dbraw/zinc/33/29/14/1099332914.db2.gz MJPQAZFRYXAJEQ-UHFFFAOYSA-N 2 0 302.462 3.265 20 10 DGCDRP Cc1cccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1O ZINC001236374488 1099559461 /nfs/dbraw/zinc/55/94/61/1099559461.db2.gz DBQHAXRYOFRJNB-MRXNPFEDSA-N 2 0 302.462 3.445 20 10 DGCDRP CCC[N@@H+](Cc1cc(C(F)(F)F)ccc1O)C[C@@H]1CC[NH2+]C1 ZINC001236843777 1099827946 /nfs/dbraw/zinc/82/79/46/1099827946.db2.gz QXHOLPNYKQGZRP-GFCCVEGCSA-N 2 0 316.367 3.233 20 10 DGCDRP CCC(CC)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236942824 1099882236 /nfs/dbraw/zinc/88/22/36/1099882236.db2.gz NKTVMRIEMVMCIM-UHFFFAOYSA-N 2 0 307.457 3.198 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C[C@H]1CC1(C)C ZINC001236943021 1099885247 /nfs/dbraw/zinc/88/52/47/1099885247.db2.gz PANKBJXUUYUJNU-MRXNPFEDSA-N 2 0 319.468 3.055 20 10 DGCDRP C[NH+]1CCC2(CC[N@H+](Cc3cc(Cl)cc(F)c3[O-])C2)CC1 ZINC001237622111 1100191607 /nfs/dbraw/zinc/19/16/07/1100191607.db2.gz MSBPZNFRRGDUTB-UHFFFAOYSA-N 2 0 312.816 3.102 20 10 DGCDRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC001326035742 1103188801 /nfs/dbraw/zinc/18/88/01/1103188801.db2.gz MEMAXTPTTKJAEH-MNOVXSKESA-N 2 0 315.255 3.112 20 10 DGCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)[C@H]1CC[NH3+] ZINC001326465724 1103328747 /nfs/dbraw/zinc/32/87/47/1103328747.db2.gz WIIKHYJAHVXZDP-LPHOPBHVSA-N 2 0 301.478 3.236 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC3(CCC[N@@H+](C)C3)CC2)c(O)c1 ZINC001276365296 1103563187 /nfs/dbraw/zinc/56/31/87/1103563187.db2.gz NICURUHDCJHXIZ-UHFFFAOYSA-N 2 0 302.462 3.317 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)c1O ZINC001206565982 1103841375 /nfs/dbraw/zinc/84/13/75/1103841375.db2.gz XCTCNNXJFQZGNF-INIZCTEOSA-N 2 0 312.841 3.005 20 10 DGCDRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001206566136 1103847651 /nfs/dbraw/zinc/84/76/51/1103847651.db2.gz XOOXVERMGWWXTQ-HNNXBMFYSA-N 2 0 316.367 3.362 20 10 DGCDRP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001328783369 1104068389 /nfs/dbraw/zinc/06/83/89/1104068389.db2.gz LLNQUIRFHFEFSB-GOSISDBHSA-N 2 0 301.478 3.108 20 10 DGCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccc(N3CCCC3)cc2)C1 ZINC001261186395 1107354961 /nfs/dbraw/zinc/35/49/61/1107354961.db2.gz FWKYBICKVSEDPM-ICSRJNTNSA-N 2 0 313.489 3.203 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC001319711308 1108604512 /nfs/dbraw/zinc/60/45/12/1108604512.db2.gz IKMJJXGNLCMBOG-IBGZPJMESA-N 2 0 313.489 3.205 20 10 DGCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OC)c(COCC)c2)C1 ZINC001308224019 1111400340 /nfs/dbraw/zinc/40/03/40/1111400340.db2.gz CDJIULLMKRFRLE-QGZVFWFLSA-N 2 0 320.477 3.053 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCCC3(C)C)cc2)CC1 ZINC001308313758 1111415044 /nfs/dbraw/zinc/41/50/44/1111415044.db2.gz JKTFMTVOABXLKE-LJQANCHMSA-N 2 0 315.505 3.497 20 10 DGCDRP Oc1cccc2c1[C@@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)CC2 ZINC000297576374 275061603 /nfs/dbraw/zinc/06/16/03/275061603.db2.gz GYGOXMXFGLSOEF-KRWDZBQOSA-N 2 0 300.446 3.376 20 10 DGCDRP CCOc1cccc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c1O ZINC000077290547 431581039 /nfs/dbraw/zinc/58/10/39/431581039.db2.gz GPBZUJYQCPROFW-OAHLLOKOSA-N 2 0 306.450 3.003 20 10 DGCDRP CCOc1cccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c1O ZINC000093688498 431917253 /nfs/dbraw/zinc/91/72/53/431917253.db2.gz LMYZKOVZJPTYBB-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C[C@@H]1n1ccnc1 ZINC000091960337 431906733 /nfs/dbraw/zinc/90/67/33/431906733.db2.gz PZHIOQPXSALXDU-WFASDCNBSA-N 2 0 305.809 3.325 20 10 DGCDRP CCOc1ccc(O)c(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1 ZINC000271047559 432320309 /nfs/dbraw/zinc/32/03/09/432320309.db2.gz SDTGHXKDKWSRRR-UHFFFAOYSA-N 2 0 306.450 3.096 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N(C)C)cc1 ZINC000152430800 432332228 /nfs/dbraw/zinc/33/22/28/432332228.db2.gz YDUAXUQRACYFKK-DNVCBOLYSA-N 2 0 301.478 3.278 20 10 DGCDRP c1ccc(C[N@H+]2CC[C@H](C[NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC000192932243 432430495 /nfs/dbraw/zinc/43/04/95/432430495.db2.gz FCPIPKLZFHMWEW-LJQANCHMSA-N 2 0 322.452 3.233 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000185670724 432521809 /nfs/dbraw/zinc/52/18/09/432521809.db2.gz ICXQCLCCOJIFPD-OCCSQVGLSA-N 2 0 314.857 3.053 20 10 DGCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CCC[NH+](C)C)c1O ZINC000186913389 432636126 /nfs/dbraw/zinc/63/61/26/432636126.db2.gz ZRSDTFJRLLLZSD-LLVKDONJSA-N 2 0 315.255 3.065 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c(O)c1 ZINC000277625336 432865159 /nfs/dbraw/zinc/86/51/59/432865159.db2.gz XIPOIFMBVCJDFH-INIZCTEOSA-N 2 0 306.450 3.097 20 10 DGCDRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000278374072 432891970 /nfs/dbraw/zinc/89/19/70/432891970.db2.gz DQAJBATVNPCFCZ-HNNXBMFYSA-N 2 0 301.478 3.278 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000280166374 433008587 /nfs/dbraw/zinc/00/85/87/433008587.db2.gz QYTYHOOKYAHHSD-WBVHZDCISA-N 2 0 308.466 3.098 20 10 DGCDRP CC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(C)cc1O ZINC000280233418 433020981 /nfs/dbraw/zinc/02/09/81/433020981.db2.gz VKSXAKOCNDAMPZ-WMZOPIPTSA-N 2 0 320.477 3.242 20 10 DGCDRP Cn1ccnc1[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000373230618 433138449 /nfs/dbraw/zinc/13/84/49/433138449.db2.gz NQUGLRLGNCMCIM-LBPRGKRZSA-N 2 0 305.809 3.159 20 10 DGCDRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(N(C)C)cc1 ZINC000296118639 434516591 /nfs/dbraw/zinc/51/65/91/434516591.db2.gz ZZISIFJCXOFLKG-ZCTYVAAUSA-N 2 0 301.478 3.419 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)c1 ZINC000194190386 295167255 /nfs/dbraw/zinc/16/72/55/295167255.db2.gz ACCLFSRANQPSLA-LSDHHAIUSA-N 2 0 306.450 3.173 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1F ZINC000740004806 574917853 /nfs/dbraw/zinc/91/78/53/574917853.db2.gz WRUKIZKUDDLTKO-KRWDZBQOSA-N 2 0 321.484 3.492 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1F ZINC000742385873 574995226 /nfs/dbraw/zinc/99/52/26/574995226.db2.gz ZJQUHXCEACBORD-MAUKXSAKSA-N 2 0 321.484 3.492 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853239390 620681021 /nfs/dbraw/zinc/68/10/21/620681021.db2.gz GODGBDYLXRZOSR-GDBMZVCRSA-N 2 0 318.461 3.173 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCC[NH+](C(C)C)C(C)C)c1O ZINC000894326236 618764902 /nfs/dbraw/zinc/76/49/02/618764902.db2.gz NJHBGVKPZHPELE-UHFFFAOYSA-N 2 0 308.466 3.308 20 10 DGCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903873433 619827466 /nfs/dbraw/zinc/82/74/66/619827466.db2.gz RHETXDUGYZKDHW-AYHJJNSGSA-N 2 0 301.478 3.105 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1CC[NH3+] ZINC000903977123 619848532 /nfs/dbraw/zinc/84/85/32/619848532.db2.gz JSONJSMODZCVPI-SJLPKXTDSA-N 2 0 301.478 3.094 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)c1O ZINC000841086263 620225706 /nfs/dbraw/zinc/22/57/06/620225706.db2.gz GWMRLOOMHJDTEW-BBRMVZONSA-N 2 0 308.853 3.318 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)ccc21 ZINC000858116008 621154274 /nfs/dbraw/zinc/15/42/74/621154274.db2.gz HYLPOEDJLYBVCO-KRWDZBQOSA-N 2 0 301.478 3.031 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000839182146 621344068 /nfs/dbraw/zinc/34/40/68/621344068.db2.gz LDCNNMVTALGMEH-SFHVURJKSA-N 2 0 303.494 3.354 20 10 DGCDRP COc1cc(C)cc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1O ZINC000754740024 621529987 /nfs/dbraw/zinc/52/99/87/621529987.db2.gz FZQMJVXLIBYFGI-MRXNPFEDSA-N 2 0 318.461 3.017 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2c1c(F)ccc2O ZINC000756416031 621636925 /nfs/dbraw/zinc/63/69/25/621636925.db2.gz GIIFYOKAJFILNV-BHPKHCPMSA-N 2 0 304.409 3.296 20 10 DGCDRP C[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000757881350 621744859 /nfs/dbraw/zinc/74/48/59/621744859.db2.gz FYSHCGXJGOUGJF-KRWDZBQOSA-N 2 0 324.472 3.026 20 10 DGCDRP C[NH+]1CCC(C[NH2+]Cc2ccccc2O)(c2ccccc2)CC1 ZINC000865774078 621992641 /nfs/dbraw/zinc/99/26/41/621992641.db2.gz OREMPEGIXDMTAQ-UHFFFAOYSA-N 2 0 310.441 3.145 20 10 DGCDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC000768926007 622485623 /nfs/dbraw/zinc/48/56/23/622485623.db2.gz HRFADJCFYWFTMU-UHFFFAOYSA-N 2 0 303.494 3.305 20 10 DGCDRP CCOc1ccc(O)c(C[N@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)c1 ZINC000769469590 622530540 /nfs/dbraw/zinc/53/05/40/622530540.db2.gz AOIRVRAZZOMTDU-ZBFHGGJFSA-N 2 0 306.450 3.096 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC(C)(C)C3)cc2)CC1 ZINC000771866838 622805850 /nfs/dbraw/zinc/80/58/50/622805850.db2.gz BVLHVLVGBKYIMO-KRWDZBQOSA-N 2 0 301.478 3.107 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)cc1 ZINC000773754645 623069175 /nfs/dbraw/zinc/06/91/75/623069175.db2.gz RGIPRRRYHYQFJJ-SFHVURJKSA-N 2 0 303.494 3.449 20 10 DGCDRP CCOc1ccc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)c(O)c1 ZINC000873232795 623086004 /nfs/dbraw/zinc/08/60/04/623086004.db2.gz MOWIHFRNSGWSTQ-SFHVURJKSA-N 2 0 318.461 3.193 20 10 DGCDRP [NH3+][C@H]1C[C@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000873256794 623093457 /nfs/dbraw/zinc/09/34/57/623093457.db2.gz OJOUVRNPXAJZSF-ZHALLVOQSA-N 2 0 310.441 3.393 20 10 DGCDRP C[C@H]1CCCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775702085 623316020 /nfs/dbraw/zinc/31/60/20/623316020.db2.gz POPNMWRTSWZMFB-KRWDZBQOSA-N 2 0 301.478 3.203 20 10 DGCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(C)CCCC1 ZINC000787337840 625002681 /nfs/dbraw/zinc/00/26/81/625002681.db2.gz RDXGKARCWUWFNU-UHFFFAOYSA-N 2 0 301.478 3.203 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000809703748 626939292 /nfs/dbraw/zinc/93/92/92/626939292.db2.gz PHIZOVJNBBVAOF-NRFANRHFSA-N 2 0 322.452 3.490 20 10 DGCDRP CC[C@@H](CSC)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809767046 626948755 /nfs/dbraw/zinc/94/87/55/626948755.db2.gz FSJSJKQZYGHCAA-KRWDZBQOSA-N 2 0 321.534 3.012 20 10 DGCDRP C[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)C[NH+](C)C ZINC000813785916 627511529 /nfs/dbraw/zinc/51/15/29/627511529.db2.gz HXQUKVSMNNLJNE-LBPRGKRZSA-N 2 0 317.399 3.059 20 10 DGCDRP Cc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000107797450 627546057 /nfs/dbraw/zinc/54/60/57/627546057.db2.gz QSUDDCKHCNWSHY-UHFFFAOYSA-N 2 0 309.457 3.037 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc2ccccc2c1O ZINC000925787021 627795507 /nfs/dbraw/zinc/79/55/07/627795507.db2.gz YRKGHOPMSWGIAE-OCCSQVGLSA-N 2 0 320.383 3.441 20 10 DGCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000816611920 627814216 /nfs/dbraw/zinc/81/42/16/627814216.db2.gz AJFHRZIIZQOHTK-NHYWBVRUSA-N 2 0 312.816 3.101 20 10 DGCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000816611919 627814986 /nfs/dbraw/zinc/81/49/86/627814986.db2.gz AJFHRZIIZQOHTK-IAQYHMDHSA-N 2 0 312.816 3.101 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000817893617 627954427 /nfs/dbraw/zinc/95/44/27/627954427.db2.gz GHQGAXHROMKICN-SLFFLAALSA-N 2 0 315.505 3.461 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1F ZINC000817901174 627956034 /nfs/dbraw/zinc/95/60/34/627956034.db2.gz SVONSIRNCZUOKW-KBAYOESNSA-N 2 0 319.468 3.292 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)ccc21 ZINC000817901766 627957355 /nfs/dbraw/zinc/95/73/55/627957355.db2.gz YHSDSKCOXUXYOW-CEXWTWQISA-N 2 0 313.489 3.079 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)C1C[NH2+]C1 ZINC000817932732 627965783 /nfs/dbraw/zinc/96/57/83/627965783.db2.gz XKSUHXQOGNIFPY-UONOGXRCSA-N 2 0 321.896 3.274 20 10 DGCDRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817955566 627974224 /nfs/dbraw/zinc/97/42/24/627974224.db2.gz ZAPWNVLWKIJNIO-IRXDYDNUSA-N 2 0 301.478 3.327 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000817963815 627977106 /nfs/dbraw/zinc/97/71/06/627977106.db2.gz VRECOSXHLSEVFL-OLZOCXBDSA-N 2 0 300.402 3.271 20 10 DGCDRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817965673 627977556 /nfs/dbraw/zinc/97/75/56/627977556.db2.gz BQRHIQSZRXCSAI-LIRRHRJNSA-N 2 0 302.462 3.311 20 10 DGCDRP [NH3+]C1(C[NH2+][C@@H]2CCc3cccc(O)c32)C2CC3CC(C2)CC1C3 ZINC000817983324 627983555 /nfs/dbraw/zinc/98/35/55/627983555.db2.gz AGTJGFNZWGFBAV-HTMWUWIFSA-N 2 0 312.457 3.123 20 10 DGCDRP Cc1cc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)ccc1N1CCCCC1 ZINC000827813533 628993687 /nfs/dbraw/zinc/99/36/87/628993687.db2.gz UDPPZQNGDYGSHO-LJQANCHMSA-N 2 0 315.505 3.369 20 10 DGCDRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000834514651 629719750 /nfs/dbraw/zinc/71/97/50/629719750.db2.gz VNTAHDLHLWMFMZ-UXLLHSPISA-N 2 0 302.462 3.337 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000835035053 629830247 /nfs/dbraw/zinc/83/02/47/629830247.db2.gz DKGVSSVDPZQVLO-VURMDHGXSA-N 2 0 301.478 3.231 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000835036370 629830366 /nfs/dbraw/zinc/83/03/66/629830366.db2.gz PTUZUTQWNOBVBZ-ARJAWSKDSA-N 2 0 313.489 3.230 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000835034415 629830423 /nfs/dbraw/zinc/83/04/23/629830423.db2.gz ANIGYISQPYKZOW-PLNGDYQASA-N 2 0 313.489 3.372 20 10 DGCDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835038577 629831022 /nfs/dbraw/zinc/83/10/22/629831022.db2.gz UBTQVEJJWAEVGR-WPGJWXSHSA-N 2 0 315.505 3.476 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000835044129 629833924 /nfs/dbraw/zinc/83/39/24/629833924.db2.gz WWKPLOHTMDHXRN-LJJUJYJISA-N 2 0 301.478 3.228 20 10 DGCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840918288 630378008 /nfs/dbraw/zinc/37/80/08/630378008.db2.gz ZEMIRBLZVYMQHG-QGZVFWFLSA-N 2 0 303.494 3.225 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c(Cl)c1 ZINC000840920399 630378700 /nfs/dbraw/zinc/37/87/00/630378700.db2.gz GPUNFPSDPNUNJO-BBRMVZONSA-N 2 0 308.853 3.270 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000840949347 630383605 /nfs/dbraw/zinc/38/36/05/630383605.db2.gz WZZPLUPXEAGXQP-IBGZPJMESA-N 2 0 315.505 3.225 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000841029805 630398119 /nfs/dbraw/zinc/39/81/19/630398119.db2.gz SKOYVDFQVQLRGY-ZDUSSCGKSA-N 2 0 300.402 3.100 20 10 DGCDRP C[C@H]([NH3+])c1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000841027988 630398229 /nfs/dbraw/zinc/39/82/29/630398229.db2.gz ISABAZAEKOTAHX-INIZCTEOSA-N 2 0 324.472 3.070 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cc1F ZINC000841032235 630399115 /nfs/dbraw/zinc/39/91/15/630399115.db2.gz AEQVSWBACUPVFD-HOCLYGCPSA-N 2 0 307.457 3.150 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1F ZINC000841072314 630404418 /nfs/dbraw/zinc/40/44/18/630404418.db2.gz ILFMEIMWCLYCQO-INIZCTEOSA-N 2 0 307.457 3.294 20 10 DGCDRP CCCN(CCC)c1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)cc1 ZINC000843051706 630608595 /nfs/dbraw/zinc/60/85/95/630608595.db2.gz KSAYTYBGHVUEKG-LPHOPBHVSA-N 2 0 303.494 3.482 20 10 DGCDRP CC[NH2+]CC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000843055784 630609486 /nfs/dbraw/zinc/60/94/86/630609486.db2.gz PPRRBYHPEVQOKC-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)cc1 ZINC000843057390 630609503 /nfs/dbraw/zinc/60/95/03/630609503.db2.gz CXGVBKWHQQDRJB-UHOSZYNNSA-N 2 0 301.478 3.092 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CC[NH2+]C3)CC2)cc1F ZINC000843125828 630616728 /nfs/dbraw/zinc/61/67/28/630616728.db2.gz ALQTZJCQSWMVOE-UHFFFAOYSA-N 2 0 319.468 3.247 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000843343147 630647530 /nfs/dbraw/zinc/64/75/30/630647530.db2.gz UEPKZARFZHGCBJ-RCCFBDPRSA-N 2 0 301.478 3.011 20 10 DGCDRP C[NH2+]Cc1ccccc1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000844904291 630972640 /nfs/dbraw/zinc/97/26/40/630972640.db2.gz GXUIZYUBGSVJRL-SREVYHEPSA-N 2 0 309.457 3.275 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000846055148 631208378 /nfs/dbraw/zinc/20/83/78/631208378.db2.gz JGZWAEZGOHJTOP-UHFFFAOYSA-N 2 0 317.820 3.199 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c1O ZINC000846138984 631211428 /nfs/dbraw/zinc/21/14/28/631211428.db2.gz ZGYYTEDKRLFDEV-GJZGRUSLSA-N 2 0 306.450 3.316 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c1O ZINC000846137381 631211478 /nfs/dbraw/zinc/21/14/78/631211478.db2.gz ORNYAWQAKRKLLZ-LBPRGKRZSA-N 2 0 306.450 3.361 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c1O ZINC000846146985 631211977 /nfs/dbraw/zinc/21/19/77/631211977.db2.gz UFFSPYBKHAEHAW-HUUCEWRRSA-N 2 0 306.450 3.173 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1F ZINC000848561773 631693886 /nfs/dbraw/zinc/69/38/86/631693886.db2.gz BSLIQEFDMIAECU-IYBDPMFKSA-N 2 0 307.457 3.102 20 10 DGCDRP CCOc1cccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c1O ZINC000850420558 632146515 /nfs/dbraw/zinc/14/65/15/632146515.db2.gz PGMQTWXQIGQEOE-UHFFFAOYSA-N 2 0 318.461 3.003 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[NH+]2CCC(C)CC2)c1 ZINC000192936795 658813086 /nfs/dbraw/zinc/81/30/86/658813086.db2.gz PKIWZWBOBZBLJD-HNNXBMFYSA-N 2 0 306.450 3.173 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC)C2)cc1 ZINC000093770677 662359983 /nfs/dbraw/zinc/35/99/83/662359983.db2.gz ZZBBBKFAKHSSRU-SFHVURJKSA-N 2 0 303.494 3.306 20 10 DGCDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000387221745 1177458646 /nfs/dbraw/zinc/45/86/46/1177458646.db2.gz SRSZJAFDYBECDG-UHFFFAOYSA-N 2 0 303.494 3.497 20 10 DGCDRP CCC[NH+]1CCC(C[NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC001200231426 1180470622 /nfs/dbraw/zinc/47/06/22/1180470622.db2.gz ANUFRHIOIBOHTH-UHFFFAOYSA-N 2 0 302.462 3.223 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC001354234659 1180753742 /nfs/dbraw/zinc/75/37/42/1180753742.db2.gz ILRKIEAZHGJUQP-AGIUHOORSA-N 2 0 310.388 3.083 20 10 DGCDRP CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001474013216 1183849380 /nfs/dbraw/zinc/84/93/80/1183849380.db2.gz DPFPNOOJXKZFGC-IEBWSBKVSA-N 2 0 315.505 3.497 20 10 DGCDRP CCSCC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001474025790 1183853703 /nfs/dbraw/zinc/85/37/03/1183853703.db2.gz ZVUDOBGLNXWMGX-MRXNPFEDSA-N 2 0 321.534 3.060 20 10 DGCDRP CC[C@H]1CCC[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560476519 1189331832 /nfs/dbraw/zinc/33/18/32/1189331832.db2.gz LNIVZTDEYDWPFW-OALUTQOASA-N 2 0 315.505 3.354 20 10 DGCDRP CC1(C)[C@@H]2[NH2+]CCC[C@@H]2[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001576389936 1191579490 /nfs/dbraw/zinc/57/94/90/1191579490.db2.gz NIZYANAQFZRDRI-OTWHNJEPSA-N 2 0 313.489 3.153 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC001652941006 1195673378 /nfs/dbraw/zinc/67/33/78/1195673378.db2.gz SQHOKTYJLNUVCT-UHFFFAOYSA-N 2 0 315.505 3.369 20 10 DGCDRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001657322249 1196130206 /nfs/dbraw/zinc/13/02/06/1196130206.db2.gz DXOMONJJQNCUJA-PKOBYXMFSA-N 2 0 301.478 3.249 20 10 DGCDRP c1cc(N2CCC(C[NH2+]Cc3ccc4c(c3)CCO4)CC2)cc[nH+]1 ZINC001657649600 1196164478 /nfs/dbraw/zinc/16/44/78/1196164478.db2.gz SKKUHHXRGNLQLU-UHFFFAOYSA-N 2 0 323.440 3.023 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccc(Cl)cc3O)C[C@@H]2C1 ZINC001660892231 1196538704 /nfs/dbraw/zinc/53/87/04/1196538704.db2.gz HYPKSQGEPBRNOZ-DUVNUKRYSA-N 2 0 308.853 3.208 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+]CCCC(C)C)cc2F)CC1 ZINC001661314088 1196593078 /nfs/dbraw/zinc/59/30/78/1196593078.db2.gz HAAXIFAKQVLVRU-UHFFFAOYSA-N 2 0 321.484 3.493 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3ccc(N4CCCC4)cc3)C[C@@H]2C1 ZINC001204328533 1090950993 /nfs/dbraw/zinc/95/09/93/1090950993.db2.gz INJNHPMGRSGJQF-OALUTQOASA-N 2 0 313.489 3.060 20 10 DGCDRP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001205009173 1091083588 /nfs/dbraw/zinc/08/35/88/1091083588.db2.gz IRCVWPYQIVOXEV-MRXNPFEDSA-N 2 0 311.473 3.337 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c(OC)c1 ZINC001205264772 1091154588 /nfs/dbraw/zinc/15/45/88/1091154588.db2.gz LUYWWEXDHZYPFA-LJQANCHMSA-N 2 0 319.493 3.245 20 10 DGCDRP C[C@@]1([NH3+])CCC[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)CC1 ZINC001205274371 1091159972 /nfs/dbraw/zinc/15/99/72/1091159972.db2.gz WDKDKHPNSAIKTJ-HXUWFJFHSA-N 2 0 313.489 3.089 20 10 DGCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001205558098 1091251528 /nfs/dbraw/zinc/25/15/28/1091251528.db2.gz BTUUBOHMXRPGGY-IBGZPJMESA-N 2 0 319.468 3.330 20 10 DGCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H]1CC1(C)C ZINC001202870063 1091358366 /nfs/dbraw/zinc/35/83/66/1091358366.db2.gz QVLMECRGUKZHQW-RTBURBONSA-N 2 0 315.505 3.353 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2Cl)CCC[C@@H]1C[NH3+] ZINC001206005649 1091445540 /nfs/dbraw/zinc/44/55/40/1091445540.db2.gz YXXUAPOUWMTZLR-UONOGXRCSA-N 2 0 309.885 3.213 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c(O)c1 ZINC001206003472 1091445828 /nfs/dbraw/zinc/44/58/28/1091445828.db2.gz IIGJHMLRQWHGEH-HZPDHXFCSA-N 2 0 319.493 3.045 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)cc(C[NH+](C)C)c1O ZINC001139256269 1091501096 /nfs/dbraw/zinc/50/10/96/1091501096.db2.gz XQHFRXTVWKBAQT-HOTGVXAUSA-N 2 0 318.461 3.084 20 10 DGCDRP CC[C@@H]1CCC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139257561 1091501551 /nfs/dbraw/zinc/50/15/51/1091501551.db2.gz FEABJCQUNUTDNS-CQSZACIVSA-N 2 0 306.450 3.084 20 10 DGCDRP COc1cc(C[NH+]2CC3CCC(CC3)C2)cc(C[NH+](C)C)c1O ZINC001139259166 1091503488 /nfs/dbraw/zinc/50/34/88/1091503488.db2.gz KOOWORXXPXOMSF-UHFFFAOYSA-N 2 0 318.461 3.084 20 10 DGCDRP COc1cc(C[N@H+](C)[C@H]2CC[C@H](C)CC2)cc(C[NH+](C)C)c1O ZINC001139260385 1091503662 /nfs/dbraw/zinc/50/36/62/1091503662.db2.gz RIQMVMCHPOEAIR-CZIWCDLHSA-N 2 0 320.477 3.473 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC4(CCC4)C3)cc2)CC1 ZINC001139410897 1091551081 /nfs/dbraw/zinc/55/10/81/1091551081.db2.gz KREDMIHNDWNELK-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]4CCC[C@@H]4C3)cc2)CC1 ZINC001139408991 1091551736 /nfs/dbraw/zinc/55/17/36/1091551736.db2.gz RQRYOECKTSJOIX-RTBURBONSA-N 2 0 313.489 3.060 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N2CC[NH+](CC)CC2)cc1)CC1CC1 ZINC001140300043 1091818478 /nfs/dbraw/zinc/81/84/78/1091818478.db2.gz KBLVTIJLYUSBQG-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)c(O)c1 ZINC001140854834 1092030452 /nfs/dbraw/zinc/03/04/52/1092030452.db2.gz CQVLWZXKWMDNPH-UHFFFAOYSA-N 2 0 319.493 3.012 20 10 DGCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]2C1 ZINC001143105205 1092615102 /nfs/dbraw/zinc/61/51/02/1092615102.db2.gz MNNOEBPPXYXRBE-ZBFHGGJFSA-N 2 0 302.462 3.073 20 10 DGCDRP CC[NH+]1C[C@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]2C1 ZINC001143116805 1092618361 /nfs/dbraw/zinc/61/83/61/1092618361.db2.gz LEBWYDMHINYZQU-HOTGVXAUSA-N 2 0 302.462 3.073 20 10 DGCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3ccc(-n4c(C)ccc4C)cc3)C[C@H]2C1 ZINC001209520502 1092808077 /nfs/dbraw/zinc/80/80/77/1092808077.db2.gz ZQOCJWIQNPDDKG-WOJBJXKFSA-N 2 0 323.484 3.478 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001337785087 1095094106 /nfs/dbraw/zinc/09/41/06/1095094106.db2.gz JMAYVYPTIRABPG-OAGGEKHMSA-N 2 0 320.477 3.195 20 10 DGCDRP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccc(N)cc3)C2)CC1 ZINC001337834382 1095111036 /nfs/dbraw/zinc/11/10/36/1095111036.db2.gz RFICMHOWIHJYNA-SFHVURJKSA-N 2 0 301.478 3.213 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)ccc1N(C)C ZINC001222265804 1095521678 /nfs/dbraw/zinc/52/16/78/1095521678.db2.gz ZLRALSOIXQBPPQ-LJQANCHMSA-N 2 0 301.478 3.027 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001222453123 1095622170 /nfs/dbraw/zinc/62/21/70/1095622170.db2.gz QYAMJGPGXKSHNW-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP COc1cc(C)cc(C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1O ZINC001119510045 1096215552 /nfs/dbraw/zinc/21/55/52/1096215552.db2.gz MFPKZJRYSXGYQN-MRXNPFEDSA-N 2 0 308.466 3.165 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322553609 1096730175 /nfs/dbraw/zinc/73/01/75/1096730175.db2.gz BPUNGLOXQYPGPE-MOTUXRJWSA-N 2 0 300.446 3.464 20 10 DGCDRP CN(C)c1ccc(C[N@H+]2CC[C@@H](F)[C@@H](N)CC2)c2ccccc21 ZINC001206167019 1097193319 /nfs/dbraw/zinc/19/33/19/1097193319.db2.gz WAQLGYHBIAZLGY-MSOLQXFVSA-N 2 0 315.436 3.167 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)c(Cl)c1 ZINC001206311853 1098664727 /nfs/dbraw/zinc/66/47/27/1098664727.db2.gz VXVKUOTVPSRGTG-QGZVFWFLSA-N 2 0 309.885 3.357 20 10 DGCDRP Oc1c(CN2CC[C@@H]3CC[NH2+][C@@H]3C2)cccc1-c1ccccc1 ZINC001235021988 1098755032 /nfs/dbraw/zinc/75/50/32/1098755032.db2.gz UNFCUTTXAHMIQS-QFBILLFUSA-N 2 0 308.425 3.243 20 10 DGCDRP Cc1cc(C[NH+]2CC3(C2)CC[NH2+]CC3)c(C)n1-c1ccccc1 ZINC001235090389 1098793137 /nfs/dbraw/zinc/79/31/37/1098793137.db2.gz XRRYTRALPDBWRN-UHFFFAOYSA-N 2 0 309.457 3.280 20 10 DGCDRP Cc1ccc(C[N@@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c(O)c1 ZINC001235354197 1098975071 /nfs/dbraw/zinc/97/50/71/1098975071.db2.gz BSUCNAYEAHHRGZ-TZIWHRDSSA-N 2 0 322.452 3.280 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@@H]3F)c1 ZINC001235400220 1098995658 /nfs/dbraw/zinc/99/56/58/1098995658.db2.gz CRIYVJBBLBAXAM-HKUYNNGSSA-N 2 0 320.452 3.213 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@H]3F)c1O ZINC001235408097 1099004370 /nfs/dbraw/zinc/00/43/70/1099004370.db2.gz UAGQBIIKYSABHH-APWZRJJASA-N 2 0 320.452 3.213 20 10 DGCDRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](Cc1ccc(C(C)(C)C)cc1O)C2 ZINC001235678644 1099121598 /nfs/dbraw/zinc/12/15/98/1099121598.db2.gz JZULGSRDAZVMEQ-VQIMIIECSA-N 2 0 302.462 3.073 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC001235868915 1099228109 /nfs/dbraw/zinc/22/81/09/1099228109.db2.gz WRFXXROJOIWPCC-AZUAARDMSA-N 2 0 313.489 3.251 20 10 DGCDRP CCN(Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC001236003953 1099324869 /nfs/dbraw/zinc/32/48/69/1099324869.db2.gz BXVSENIBZOUBSS-LJQANCHMSA-N 2 0 301.478 3.251 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)C2CCC([NH2+]C)CC2)cc1 ZINC001236213346 1099468196 /nfs/dbraw/zinc/46/81/96/1099468196.db2.gz PBZDAALWDQGQAT-UHFFFAOYSA-N 2 0 303.494 3.495 20 10 DGCDRP CC[N@H+](Cc1ccc(C)cc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236245989 1099499298 /nfs/dbraw/zinc/49/92/98/1099499298.db2.gz WRCAUDHNISRJLI-UHFFFAOYSA-N 2 0 323.484 3.427 20 10 DGCDRP C[NH+]1CCC2(CC[N@H+](Cc3cc4ccccc4cc3O)C2)CC1 ZINC001236831144 1099818429 /nfs/dbraw/zinc/81/84/29/1099818429.db2.gz FKWWPPUOXRXBII-UHFFFAOYSA-N 2 0 310.441 3.463 20 10 DGCDRP CC(C)[NH+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C(C)C ZINC001236931231 1099879976 /nfs/dbraw/zinc/87/99/76/1099879976.db2.gz HPRHKYBYDUDCCH-UHFFFAOYSA-N 2 0 307.457 3.196 20 10 DGCDRP CC[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236942043 1099883397 /nfs/dbraw/zinc/88/33/97/1099883397.db2.gz IULPFZXYZLICHY-INIZCTEOSA-N 2 0 319.468 3.200 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])C2)c2ccccc21 ZINC001237059218 1099949688 /nfs/dbraw/zinc/94/96/88/1099949688.db2.gz RULALKAHADYJQR-FQEVSTJZSA-N 2 0 311.473 3.467 20 10 DGCDRP C[NH+](C)CC1CC[NH+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001237138824 1099989461 /nfs/dbraw/zinc/98/94/61/1099989461.db2.gz HFWARBVKZHJUES-UHFFFAOYSA-N 2 0 316.367 3.185 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c(O)c1 ZINC001237415415 1100119270 /nfs/dbraw/zinc/11/92/70/1100119270.db2.gz NMAGKGIEZPMSEI-PBHICJAKSA-N 2 0 302.462 3.264 20 10 DGCDRP CSC(C)(C)C[C@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246172811 1104418944 /nfs/dbraw/zinc/41/89/44/1104418944.db2.gz IPCSBKSIQVPCCL-HNNXBMFYSA-N 2 0 321.534 3.106 20 10 DGCDRP Cc1cc(C)c(C[NH2+][C@H]2CC[NH2+][C@@H](Cc3ccccc3)C2)c(O)c1 ZINC001246345248 1104501125 /nfs/dbraw/zinc/50/11/25/1104501125.db2.gz VWKMSCFEZJGYKQ-OALUTQOASA-N 2 0 324.468 3.462 20 10 DGCDRP CC(C)[C@H]1C[C@@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)CC[NH2+]1 ZINC001246793611 1104679128 /nfs/dbraw/zinc/67/91/28/1104679128.db2.gz UYVXCVDBPUVOFP-VQTJNVASSA-N 2 0 315.505 3.495 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246924022 1104738116 /nfs/dbraw/zinc/73/81/16/1104738116.db2.gz LKOQGSCZAIANCX-UXHICEINSA-N 2 0 315.505 3.497 20 10 DGCDRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(C(C)(C)C)c1O ZINC001275798847 1104912379 /nfs/dbraw/zinc/91/23/79/1104912379.db2.gz LWIBLSPCZBYRSX-MQVJKMGUSA-N 2 0 302.462 3.405 20 10 DGCDRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(C(C)(C)C)cc1O ZINC001276287358 1105076915 /nfs/dbraw/zinc/07/69/15/1105076915.db2.gz SHJNBUKYZPTZCD-ALOPSCKCSA-N 2 0 302.462 3.405 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[NH2+][C@H]1CC2CCN(CC2)C1 ZINC001254837184 1106145847 /nfs/dbraw/zinc/14/58/47/1106145847.db2.gz SHKVRQCXYLADOY-IBGZPJMESA-N 2 0 313.489 3.251 20 10 DGCDRP CC(C)CC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001256352549 1106408684 /nfs/dbraw/zinc/40/86/84/1106408684.db2.gz JYXCEXSTDRJYQU-KRWDZBQOSA-N 2 0 303.494 3.353 20 10 DGCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccc(N3CCCC3)cc2)C1 ZINC001261186394 1107355310 /nfs/dbraw/zinc/35/53/10/1107355310.db2.gz FWKYBICKVSEDPM-AZUAARDMSA-N 2 0 313.489 3.203 20 10 DGCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCCC4)cc3)CC[C@@H]21 ZINC001319730168 1108614232 /nfs/dbraw/zinc/61/42/32/1108614232.db2.gz WOQUDHPMOHXMCT-ICSRJNTNSA-N 2 0 313.489 3.203 20 10 DGCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCCC4)cc3)CC[C@H]21 ZINC001319730170 1108614514 /nfs/dbraw/zinc/61/45/14/1108614514.db2.gz WOQUDHPMOHXMCT-UYAOXDASSA-N 2 0 313.489 3.203 20 10 DGCDRP C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308237744 1111403156 /nfs/dbraw/zinc/40/31/56/1111403156.db2.gz QQZRPIYWKRBMBS-IEBWSBKVSA-N 2 0 315.505 3.354 20 10 DGCDRP C[N@@H+](Cc1ccccc1O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000179573792 432062869 /nfs/dbraw/zinc/06/28/69/432062869.db2.gz YGOILMACGLRJJD-SFHVURJKSA-N 2 0 310.441 3.346 20 10 DGCDRP C[N@@H+](Cc1ccccc1O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000179573809 432063093 /nfs/dbraw/zinc/06/30/93/432063093.db2.gz YGOILMACGLRJJD-GOSISDBHSA-N 2 0 310.441 3.346 20 10 DGCDRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2O)C1 ZINC000179564253 432063416 /nfs/dbraw/zinc/06/34/16/432063416.db2.gz MVNYOMITPIQXIU-DLBZAZTESA-N 2 0 302.462 3.479 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273566835 130138758 /nfs/dbraw/zinc/13/87/58/130138758.db2.gz JTAWMMFLZAPNSS-HOTGVXAUSA-N 2 0 308.466 3.016 20 10 DGCDRP CC[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccccc1O ZINC000155412184 288039403 /nfs/dbraw/zinc/03/94/03/288039403.db2.gz NFJQXTGOQOCQQT-NUJGCVRESA-N 2 0 320.477 3.322 20 10 DGCDRP CCOc1cccc(C[NH2+]CCC[NH+]2CCC(C)CC2)c1O ZINC000074336508 431414237 /nfs/dbraw/zinc/41/42/37/431414237.db2.gz CYEKJXZHOVCTBH-UHFFFAOYSA-N 2 0 306.450 3.003 20 10 DGCDRP CN1CCC([N@H+](Cc2ccccc2)Cc2ccccc2O)CC1 ZINC000290486950 433065751 /nfs/dbraw/zinc/06/57/51/433065751.db2.gz OKNYQMWIGJYEMW-UHFFFAOYSA-N 2 0 310.441 3.489 20 10 DGCDRP CCOc1cccc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)c1O ZINC000077290549 331673683 /nfs/dbraw/zinc/67/36/83/331673683.db2.gz GPBZUJYQCPROFW-HNNXBMFYSA-N 2 0 306.450 3.003 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@H+](CC)C[C@@H]2C)cc1F ZINC000742385875 574995364 /nfs/dbraw/zinc/99/53/64/574995364.db2.gz ZJQUHXCEACBORD-YJBOKZPZSA-N 2 0 321.484 3.492 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CC[C@H](C)[NH+]2CCCCC2)c1O ZINC000894445930 618335913 /nfs/dbraw/zinc/33/59/13/618335913.db2.gz QXBCKVSYLASNOI-HNNXBMFYSA-N 2 0 306.450 3.063 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000840936296 618610490 /nfs/dbraw/zinc/61/04/90/618610490.db2.gz IRWUESFTFDQJGO-UHFFFAOYSA-N 2 0 311.473 3.412 20 10 DGCDRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000925794358 618621269 /nfs/dbraw/zinc/62/12/69/618621269.db2.gz DJCJHKVHICQPCV-JKIFEVAISA-N 2 0 302.462 3.167 20 10 DGCDRP CCC[NH+]1CCC([N@H+](C)Cc2cc(C)cc(OC)c2O)CC1 ZINC000893967522 618684896 /nfs/dbraw/zinc/68/48/96/618684896.db2.gz NRGUCDNNAXYGMM-UHFFFAOYSA-N 2 0 306.450 3.015 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000841004129 619148429 /nfs/dbraw/zinc/14/84/29/619148429.db2.gz MQZJWIZUXTXGJJ-AEFFLSMTSA-N 2 0 303.494 3.353 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000841004143 619148591 /nfs/dbraw/zinc/14/85/91/619148591.db2.gz MQZJWIZUXTXGJJ-WMZOPIPTSA-N 2 0 303.494 3.353 20 10 DGCDRP COc1cccc(C[NH+]2CCC([C@@H]3CCC[NH2+]CC3)CC2)c1O ZINC000904410972 619920361 /nfs/dbraw/zinc/92/03/61/619920361.db2.gz IHOUPCUXFHKXIW-OAHLLOKOSA-N 2 0 318.461 3.003 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(C4CCC4)CCC3)cc2)CC1 ZINC000839186145 621345210 /nfs/dbraw/zinc/34/52/10/621345210.db2.gz JAJSRZRVOWCEFN-UHFFFAOYSA-N 2 0 313.489 3.251 20 10 DGCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC000756450214 621639515 /nfs/dbraw/zinc/63/95/15/621639515.db2.gz RCEJVFWOIBZPOC-UMVBOHGHSA-N 2 0 306.425 3.401 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]CCC2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756546838 621646537 /nfs/dbraw/zinc/64/65/37/621646537.db2.gz SHIRRNZRLKLTCP-DOMZBBRYSA-N 2 0 306.425 3.401 20 10 DGCDRP CCOc1ccc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)c(O)c1 ZINC000865765568 621991460 /nfs/dbraw/zinc/99/14/60/621991460.db2.gz AHAAKGCMNAWIBX-UHFFFAOYSA-N 2 0 306.450 3.143 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)C(C)C)cc2F)CC1 ZINC000765850721 622291300 /nfs/dbraw/zinc/29/13/00/622291300.db2.gz ARVDPEKSXXHIIM-HNNXBMFYSA-N 2 0 307.457 3.102 20 10 DGCDRP COc1cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c(O)cc1C ZINC000768448616 622456700 /nfs/dbraw/zinc/45/67/00/622456700.db2.gz SWEFUEXTCWPVKI-UHFFFAOYSA-N 2 0 320.477 3.261 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC3=CCCCC3)cc2)CC1 ZINC000771818359 622799584 /nfs/dbraw/zinc/79/95/84/622799584.db2.gz MSWWUOIILAQSAZ-UHFFFAOYSA-N 2 0 313.489 3.419 20 10 DGCDRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000873271586 623100331 /nfs/dbraw/zinc/10/03/31/623100331.db2.gz IYJWZVAIWHAVEN-KBPBESRZSA-N 2 0 302.462 3.310 20 10 DGCDRP CC(C)C[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775652774 623304900 /nfs/dbraw/zinc/30/49/00/623304900.db2.gz SLCBNAQRIPZJEN-HXUWFJFHSA-N 2 0 315.505 3.449 20 10 DGCDRP C[C@H](C1CC1)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775654279 623305840 /nfs/dbraw/zinc/30/58/40/623305840.db2.gz WLEAJMYQLXQAIW-MRXNPFEDSA-N 2 0 313.489 3.201 20 10 DGCDRP C[C@@H](C1CC1)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775654278 623306360 /nfs/dbraw/zinc/30/63/60/623306360.db2.gz WLEAJMYQLXQAIW-INIZCTEOSA-N 2 0 313.489 3.201 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3C[C@@H]4CCCC[C@H]4C3)cc2)CC1 ZINC000775698743 623315871 /nfs/dbraw/zinc/31/58/71/623315871.db2.gz RZHCMPBSEYFECL-OALUTQOASA-N 2 0 313.489 3.060 20 10 DGCDRP CC(C)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCC1 ZINC000775716315 623318293 /nfs/dbraw/zinc/31/82/93/623318293.db2.gz UAJJHSGEBIWJDZ-UHFFFAOYSA-N 2 0 301.478 3.201 20 10 DGCDRP Cc1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c(O)c1 ZINC000876811574 623713710 /nfs/dbraw/zinc/71/37/10/623713710.db2.gz LIILZWLXWIVCGA-CRAIPNDOSA-N 2 0 300.446 3.149 20 10 DGCDRP CCOc1cccc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c1O ZINC000877683928 623991210 /nfs/dbraw/zinc/99/12/10/623991210.db2.gz BVUSOUYZOQRAGG-UHFFFAOYSA-N 2 0 318.461 3.099 20 10 DGCDRP CCOc1ccc(O)c(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c1 ZINC000877684749 623992187 /nfs/dbraw/zinc/99/21/87/623992187.db2.gz VSNKWAVLYPZLAY-UHFFFAOYSA-N 2 0 318.461 3.099 20 10 DGCDRP C[N@@H+]1CCC[C@]2(CC[NH+](Cc3cc4c(cc3O)CCCC4)C2)C1 ZINC000840085982 626751604 /nfs/dbraw/zinc/75/16/04/626751604.db2.gz JIDGCIIPMLNDKU-FQEVSTJZSA-N 2 0 314.473 3.189 20 10 DGCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1O ZINC000808675594 626848261 /nfs/dbraw/zinc/84/82/61/626848261.db2.gz MNJPYPMPXMDGQZ-QWHCGFSZSA-N 2 0 308.853 3.489 20 10 DGCDRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc(F)ccc2O)cc1 ZINC000809738795 626944272 /nfs/dbraw/zinc/94/42/72/626944272.db2.gz KBRGOOGUDNDLFC-UHFFFAOYSA-N 2 0 302.393 3.225 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000809767354 626949370 /nfs/dbraw/zinc/94/93/70/626949370.db2.gz INHYXCFYTYQDRW-UYAOXDASSA-N 2 0 315.505 3.449 20 10 DGCDRP CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809768604 626950201 /nfs/dbraw/zinc/95/02/01/626950201.db2.gz QCIQLRMUEAZOCL-AEFFLSMTSA-N 2 0 301.478 3.201 20 10 DGCDRP CC[C@H]([NH2+]CCC[NH+](C)C)c1ccc(C(F)(F)F)cc1O ZINC000810208570 626988338 /nfs/dbraw/zinc/98/83/38/626988338.db2.gz WLYMYJQEEYQKNZ-ZDUSSCGKSA-N 2 0 304.356 3.403 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@@](C[NH3+])(c3ccccc3)C2)c(O)c1 ZINC000925887099 627812267 /nfs/dbraw/zinc/81/22/67/627812267.db2.gz RMGOEKCZDYAQLH-MDYRTPRTSA-N 2 0 310.441 3.410 20 10 DGCDRP CC(C)[C@H]1[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1(C)C ZINC000816624974 627816478 /nfs/dbraw/zinc/81/64/78/627816478.db2.gz NEMRPHQDVVBPBE-LJQANCHMSA-N 2 0 315.505 3.305 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000817895708 627954463 /nfs/dbraw/zinc/95/44/63/627954463.db2.gz ZPVCFOCGDWRVQS-CQSZACIVSA-N 2 0 312.461 3.074 20 10 DGCDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817900827 627956173 /nfs/dbraw/zinc/95/61/73/627956173.db2.gz WPVASPJFHMDVFM-HNNXBMFYSA-N 2 0 324.472 3.300 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817946474 627970535 /nfs/dbraw/zinc/97/05/35/627970535.db2.gz XYSLWWIVSZKJLV-IAGOWNOFSA-N 2 0 301.478 3.327 20 10 DGCDRP CC[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817955504 627974253 /nfs/dbraw/zinc/97/42/53/627974253.db2.gz XPOFPIHWZMRAGO-SMDDNHRTSA-N 2 0 316.367 3.451 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)ccc1O ZINC000817969725 627979081 /nfs/dbraw/zinc/97/90/81/627979081.db2.gz YSRQRUMFZJTMKC-NSHDSACASA-N 2 0 302.805 3.500 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2c1c(F)ccc2O ZINC000817968544 627979144 /nfs/dbraw/zinc/97/91/44/627979144.db2.gz LIKUULRVQGKKFO-BZNIZROVSA-N 2 0 312.388 3.473 20 10 DGCDRP [NH3+]C1(C[NH2+][C@H]2CCc3cccc(O)c32)C2CC3CC(C2)CC1C3 ZINC000817983327 627983587 /nfs/dbraw/zinc/98/35/87/627983587.db2.gz AGTJGFNZWGFBAV-KHDTYFSGSA-N 2 0 312.457 3.123 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000817987537 627984610 /nfs/dbraw/zinc/98/46/10/627984610.db2.gz UCMQDCTWTFDFDN-XDKFSHSGSA-N 2 0 314.473 3.310 20 10 DGCDRP Cc1cc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)ccc1N1CCCCC1 ZINC000827813531 628993572 /nfs/dbraw/zinc/99/35/72/628993572.db2.gz UDPPZQNGDYGSHO-IBGZPJMESA-N 2 0 315.505 3.369 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835039705 629832401 /nfs/dbraw/zinc/83/24/01/629832401.db2.gz IWPHTYCVGLUNOW-AATRIKPKSA-N 2 0 315.505 3.477 20 10 DGCDRP CN(C)c1ccc(/C=C/CN(C)CCC[NH+]2CCCC2)cc1 ZINC000835050404 629836657 /nfs/dbraw/zinc/83/66/57/629836657.db2.gz ARPUYSPRGDOXJI-SOFGYWHQSA-N 2 0 301.478 3.184 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000835051025 629836864 /nfs/dbraw/zinc/83/68/64/629836864.db2.gz ADYACCMYFZFYSZ-ONEGZZNKSA-N 2 0 313.489 3.230 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000835052957 629837554 /nfs/dbraw/zinc/83/75/54/629837554.db2.gz IVBVXDIXBKQSPH-XLKJWTSGSA-N 2 0 313.489 3.182 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000840935427 630380753 /nfs/dbraw/zinc/38/07/53/630380753.db2.gz PDIIUYQMULLITA-JLYLLQBASA-N 2 0 301.478 3.166 20 10 DGCDRP C[C@@H]1C[C@H](C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH2+]1 ZINC000841003262 630394260 /nfs/dbraw/zinc/39/42/60/630394260.db2.gz PDVJFGZHKCAUQH-IEBWSBKVSA-N 2 0 315.505 3.497 20 10 DGCDRP CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000841005051 630394299 /nfs/dbraw/zinc/39/42/99/630394299.db2.gz DDURHFPVERAAJD-WMZOPIPTSA-N 2 0 303.494 3.351 20 10 DGCDRP C[C@H]1C[C@@H](C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)CC[NH2+]1 ZINC000841004174 630394568 /nfs/dbraw/zinc/39/45/68/630394568.db2.gz BNODEOJMHACPAJ-RDJZCZTQSA-N 2 0 301.478 3.105 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)c1O ZINC000843046033 630608230 /nfs/dbraw/zinc/60/82/30/630608230.db2.gz SVEAFAOLWJJPQA-BBRMVZONSA-N 2 0 308.853 3.318 20 10 DGCDRP CCCN(CCC)c1ccc(C[N@@H+]2CC[C@H](C[NH2+]C)C2)cc1 ZINC000843052553 630608704 /nfs/dbraw/zinc/60/87/04/630608704.db2.gz NSKWXGWNTAHFHB-GOSISDBHSA-N 2 0 303.494 3.354 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC000843127925 630617033 /nfs/dbraw/zinc/61/70/33/630617033.db2.gz UPWILJXLWVHZHM-JKSUJKDBSA-N 2 0 318.461 3.003 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2[O-])[C@H]1CC[NH3+] ZINC000844902103 630970219 /nfs/dbraw/zinc/97/02/19/630970219.db2.gz NKKKRONGSYQLHW-YGRLFVJLSA-N 2 0 300.805 3.134 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000844907811 630975381 /nfs/dbraw/zinc/97/53/81/630975381.db2.gz OBTAAQWFUYEWGP-ARJAWSKDSA-N 2 0 313.420 3.153 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC(CC[NH3+])CC2)cc1F ZINC000844911144 630977017 /nfs/dbraw/zinc/97/70/17/630977017.db2.gz LKKGSKZCXMDYAW-UHFFFAOYSA-N 2 0 307.457 3.233 20 10 DGCDRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)c(O)c1 ZINC000844922942 630983134 /nfs/dbraw/zinc/98/31/34/630983134.db2.gz FIZXOIUEXSVKIM-CYBMUJFWSA-N 2 0 302.393 3.458 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cccc(OC)c2O)CC1 ZINC000846144481 631211763 /nfs/dbraw/zinc/21/17/63/631211763.db2.gz GUGKEIJKTWEOMA-AWEZNQCLSA-N 2 0 306.450 3.173 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)c1O ZINC000846143238 631211846 /nfs/dbraw/zinc/21/18/46/631211846.db2.gz CWAYKMOVKWXOHJ-LSDHHAIUSA-N 2 0 306.450 3.172 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c1O ZINC000846155980 631212650 /nfs/dbraw/zinc/21/26/50/631212650.db2.gz JLEDUOVQPXTYOO-HZPDHXFCSA-N 2 0 320.477 3.419 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CC2(C[NH+](C)C)CCCC2)c1O ZINC000846161961 631213042 /nfs/dbraw/zinc/21/30/42/631213042.db2.gz DDDLMPPUHLBAIQ-AWEZNQCLSA-N 2 0 306.450 3.173 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)c1O ZINC000846172167 631213645 /nfs/dbraw/zinc/21/36/45/631213645.db2.gz XBGKFHOOQDJYTC-OAHLLOKOSA-N 2 0 306.450 3.318 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CCC[C@@H]([NH3+])C3)cc2)CC1 ZINC000848717973 631733194 /nfs/dbraw/zinc/73/31/94/631733194.db2.gz DUXCKLHLJRMUTH-MSOLQXFVSA-N 2 0 301.478 3.282 20 10 DGCDRP CCc1cccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1O ZINC000848888478 631773700 /nfs/dbraw/zinc/77/37/00/631773700.db2.gz UZHGLJIUXCWNON-GOSISDBHSA-N 2 0 302.462 3.405 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000849350503 631900907 /nfs/dbraw/zinc/90/09/07/631900907.db2.gz OQDIMGZSTFRRFT-AWEZNQCLSA-N 2 0 308.853 3.257 20 10 DGCDRP CC[C@](C)([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000850383269 632133971 /nfs/dbraw/zinc/13/39/71/632133971.db2.gz DEDYLWKKKUBGGO-IBGZPJMESA-N 2 0 301.478 3.107 20 10 DGCDRP CC[C@@H]([NH2+][C@@H](C)CN(C)CCC[NH+](C)C)c1ccc(C)cc1O ZINC000850502173 632173238 /nfs/dbraw/zinc/17/32/38/632173238.db2.gz SIBPRNDZDBNTRD-FUHWJXTLSA-N 2 0 321.509 3.013 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1O ZINC000850585340 632203405 /nfs/dbraw/zinc/20/34/05/632203405.db2.gz WHZZAVJOZMDHEO-CQSZACIVSA-N 2 0 318.461 3.173 20 10 DGCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000320265945 656939250 /nfs/dbraw/zinc/93/92/50/656939250.db2.gz SFWDBWHUAWPGOQ-LJQANCHMSA-N 2 0 315.505 3.497 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000192920194 662116034 /nfs/dbraw/zinc/11/60/34/662116034.db2.gz IXLSBLCQJOEHIM-FQEVSTJZSA-N 2 0 323.484 3.364 20 10 DGCDRP C[N@H+](CCC[NH2+][C@H]1CCc2cccc(O)c21)Cc1ccccc1 ZINC000381800247 685160113 /nfs/dbraw/zinc/16/01/13/685160113.db2.gz SFRKKIRVMHKPAX-SFHVURJKSA-N 2 0 310.441 3.491 20 10 DGCDRP COc1cc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c(O)c(C(C)(C)C)c1 ZINC001579152676 1191967730 /nfs/dbraw/zinc/96/77/30/1191967730.db2.gz AAJFETRPQHBMJS-CXAGYDPISA-N 2 0 320.477 3.305 20 10 DGCDRP Cc1cc(O)c(C[NH2+][C@@H]2[C@H]3CCC[NH2+][C@@H]3C2(C)C)cc1Cl ZINC001579637976 1191983475 /nfs/dbraw/zinc/98/34/75/1191983475.db2.gz LIPXYWIRYSDGOU-VBNZEHGJSA-N 2 0 308.853 3.220 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C/C=C\c3ccccc3)cc2)CC1 ZINC001620877992 1192521336 /nfs/dbraw/zinc/52/13/36/1192521336.db2.gz WDIYOAORRYAEJE-YVMONPNESA-N 2 0 321.468 3.241 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C/C=C/c3ccccc3)cc2)CC1 ZINC001620877991 1192521650 /nfs/dbraw/zinc/52/16/50/1192521650.db2.gz WDIYOAORRYAEJE-VMPITWQZSA-N 2 0 321.468 3.241 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC001332422433 1178442929 /nfs/dbraw/zinc/44/29/29/1178442929.db2.gz WBAVKAPIYWNFEP-QHHYFVSCSA-N 2 0 300.446 3.371 20 10 DGCDRP CC[NH+](CC)CC[C@@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001474305087 1183901136 /nfs/dbraw/zinc/90/11/36/1183901136.db2.gz FLTAULBRDRIGNG-XZVRFQMRSA-N 2 0 303.494 3.476 20 10 DGCDRP COc1cc(C)c(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c(O)c1 ZINC001474350739 1183909384 /nfs/dbraw/zinc/90/93/84/1183909384.db2.gz OYULHLIQGSYOAK-HNNXBMFYSA-N 2 0 306.450 3.015 20 10 DGCDRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560571047 1189342953 /nfs/dbraw/zinc/34/29/53/1189342953.db2.gz FMUYHFLPWSMUGX-APWZRJJASA-N 2 0 315.505 3.353 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(C)cc(OC)cc2O)C[C@@H]1C ZINC001560636404 1189351871 /nfs/dbraw/zinc/35/18/71/1189351871.db2.gz FNPHRTZWYQRNFJ-GJZGRUSLSA-N 2 0 306.450 3.014 20 10 DGCDRP CCC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)CCC[NH+](C)C ZINC001621314028 1193829208 /nfs/dbraw/zinc/82/92/08/1193829208.db2.gz STZIYJBCRRZYQA-VQHVLOKHSA-N 2 0 303.494 3.430 20 10 DGCDRP C[C@@H]1CCC[C@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001656963152 1196088065 /nfs/dbraw/zinc/08/80/65/1196088065.db2.gz VAIMLKBMGIKTTO-MJGOQNOKSA-N 2 0 315.505 3.354 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c1 ZINC001658192768 1196223591 /nfs/dbraw/zinc/22/35/91/1196223591.db2.gz CTROBVMJKGZHCE-LJQANCHMSA-N 2 0 302.462 3.433 20 10 DGCDRP CC(C)C[N@H+](C)CCC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001658230283 1196228734 /nfs/dbraw/zinc/22/87/34/1196228734.db2.gz XYUQDVUZUKRWFP-SOFGYWHQSA-N 2 0 303.494 3.333 20 10 DGCDRP CC[C@]1(C)CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001658802188 1196302780 /nfs/dbraw/zinc/30/27/80/1196302780.db2.gz MZIVXSSHNJROLL-VQTJNVASSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCC1 ZINC001660588226 1196501060 /nfs/dbraw/zinc/50/10/60/1196501060.db2.gz PZDWCGDMZISVBS-IBGZPJMESA-N 2 0 301.478 3.107 20 10 DGCDRP c1cc2c(cc1C[NH2+]CCCCC[NH+]1CCCC1)CCCO2 ZINC001662536297 1196729029 /nfs/dbraw/zinc/72/90/29/1196729029.db2.gz JYWNFUBYNVZGBQ-UHFFFAOYSA-N 2 0 302.462 3.367 20 10 DGCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc(Cl)cc(OC)c3O)(C1)CCC2 ZINC001276448964 1090926499 /nfs/dbraw/zinc/92/64/99/1090926499.db2.gz TWMSCERMBHLPGX-DLBZAZTESA-N 2 0 324.852 3.209 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)cc1 ZINC001205546633 1091249381 /nfs/dbraw/zinc/24/93/81/1091249381.db2.gz XOHXRGSSRNDNSA-GOSISDBHSA-N 2 0 307.457 3.186 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H]2C)c(OC)c1 ZINC001205901321 1091400190 /nfs/dbraw/zinc/40/01/90/1091400190.db2.gz CMBSGPATONBLJS-HOTGVXAUSA-N 2 0 319.493 3.101 20 10 DGCDRP C[C@@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001205922849 1091414708 /nfs/dbraw/zinc/41/47/08/1091414708.db2.gz BVRVIHKIIUFMDC-KGLIPLIRSA-N 2 0 316.445 3.136 20 10 DGCDRP COc1cc(C[N@@H+]2CCC23CCCCC3)cc(C[NH+](C)C)c1O ZINC001139253999 1091501332 /nfs/dbraw/zinc/50/13/32/1091501332.db2.gz BDSCRIQPRDWJJO-UHFFFAOYSA-N 2 0 318.461 3.371 20 10 DGCDRP COc1cc(C[N@@H+]2CCCC[C@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139252973 1091501372 /nfs/dbraw/zinc/50/13/72/1091501372.db2.gz HMVHXRRTRBLXKP-AWEZNQCLSA-N 2 0 306.450 3.084 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@H](C)C[C@@H]2C)cc(C[NH+](C)C)c1O ZINC001139258226 1091503438 /nfs/dbraw/zinc/50/34/38/1091503438.db2.gz NBUPKHJDSSTALT-KBPBESRZSA-N 2 0 306.450 3.083 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3C[C@H]4CCC[C@@H]4C3)cc2)CC1 ZINC001140301095 1091818240 /nfs/dbraw/zinc/81/82/40/1091818240.db2.gz YTCJXPNOXHUSGZ-RTBURBONSA-N 2 0 313.489 3.060 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C)CC3)cc2)CC1 ZINC001140301951 1091818985 /nfs/dbraw/zinc/81/89/85/1091818985.db2.gz FHTKEXJKVMDNIH-SFHVURJKSA-N 2 0 315.505 3.451 20 10 DGCDRP Cc1cnccc1O[C@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001140342297 1091835368 /nfs/dbraw/zinc/83/53/68/1091835368.db2.gz CFDLDMQBUGJIEW-ZDUSSCGKSA-N 2 0 318.804 3.402 20 10 DGCDRP CC[NH+]1CCC(N(C)Cc2ccc(N(C)C)cc2Cl)CC1 ZINC001140924938 1092065478 /nfs/dbraw/zinc/06/54/78/1092065478.db2.gz XIHBWXZKTMGKRZ-UHFFFAOYSA-N 2 0 309.885 3.322 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)CC2(C[NH+](C)C)CCCC2)cc1 ZINC001208187159 1092249776 /nfs/dbraw/zinc/24/97/76/1092249776.db2.gz HSXLQXSFXPTELS-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154428 1092568147 /nfs/dbraw/zinc/56/81/47/1092568147.db2.gz QOKVQZIHLCQZCX-BWTSREIZSA-N 2 0 301.478 3.200 20 10 DGCDRP Oc1cccc2c1C[N@H+](C[C@@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001208951864 1092608291 /nfs/dbraw/zinc/60/82/91/1092608291.db2.gz FIWMQGGDVFJRJP-GOSISDBHSA-N 2 0 322.452 3.272 20 10 DGCDRP CC(C)c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)c(O)c1 ZINC001276815566 1095140541 /nfs/dbraw/zinc/14/05/41/1095140541.db2.gz WEBOMJVBOHPCNJ-IBGZPJMESA-N 2 0 302.462 3.433 20 10 DGCDRP COc1ccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c(O)c1 ZINC001222162021 1095469733 /nfs/dbraw/zinc/46/97/33/1095469733.db2.gz WJPCRXCFYYEXMQ-LJQANCHMSA-N 2 0 318.461 3.147 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222172011 1095476197 /nfs/dbraw/zinc/47/61/97/1095476197.db2.gz HGFGPDFUEWQSAI-IBGZPJMESA-N 2 0 302.462 3.446 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)cc1 ZINC001222265635 1095520972 /nfs/dbraw/zinc/52/09/72/1095520972.db2.gz WYZUPOKLLVXXMX-HXUWFJFHSA-N 2 0 315.505 3.498 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@]3(CCC[NH2+]C3)C2)cc1 ZINC001222265625 1095521133 /nfs/dbraw/zinc/52/11/33/1095521133.db2.gz WYZUPOKLLVXXMX-FQEVSTJZSA-N 2 0 315.505 3.498 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCC2)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC001116437344 1095551961 /nfs/dbraw/zinc/55/19/61/1095551961.db2.gz ZRKHXRMDJBAXID-GOSISDBHSA-N 2 0 301.478 3.060 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H](N)[C@@H](F)CC2)c2ccccc21 ZINC001206167021 1097193535 /nfs/dbraw/zinc/19/35/35/1097193535.db2.gz WAQLGYHBIAZLGY-ROUUACIJSA-N 2 0 315.436 3.167 20 10 DGCDRP CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001173266027 1097390168 /nfs/dbraw/zinc/39/01/68/1097390168.db2.gz KLRDJHLDBJQKMS-AEFFLSMTSA-N 2 0 301.478 3.107 20 10 DGCDRP CC[NH+]1C[C@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]2C1 ZINC001233287213 1098275888 /nfs/dbraw/zinc/27/58/88/1098275888.db2.gz BURHHYRJHNXDBQ-HOTGVXAUSA-N 2 0 302.462 3.073 20 10 DGCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]2C1 ZINC001233287214 1098276526 /nfs/dbraw/zinc/27/65/26/1098276526.db2.gz BURHHYRJHNXDBQ-HZPDHXFCSA-N 2 0 302.462 3.073 20 10 DGCDRP C[NH+](C)CC1CC[NH+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001233454497 1098339872 /nfs/dbraw/zinc/33/98/72/1098339872.db2.gz WUUPJQMJKYLBPI-UHFFFAOYSA-N 2 0 316.367 3.185 20 10 DGCDRP CCOCc1cc(C[NH2+]C[C@H]2CCC[N@H+](CC)C2)ccc1OC ZINC001177542099 1098552929 /nfs/dbraw/zinc/55/29/29/1098552929.db2.gz JLFJRYCLOLAHLF-QGZVFWFLSA-N 2 0 320.477 3.053 20 10 DGCDRP Oc1ccc(-c2ccc(F)cc2)cc1CN1CC[C@H]2[NH2+]CC[C@H]21 ZINC001235081947 1098788360 /nfs/dbraw/zinc/78/83/60/1098788360.db2.gz LNSPZKFFESXECH-QZTJIDSGSA-N 2 0 312.388 3.135 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c1O ZINC001235230253 1098903765 /nfs/dbraw/zinc/90/37/65/1098903765.db2.gz UNSQNRGJIMNMRG-SFHVURJKSA-N 2 0 302.462 3.363 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)ccc1N(C)C ZINC001235421693 1099013830 /nfs/dbraw/zinc/01/38/30/1099013830.db2.gz BXSRGNLZTFLFSK-RBUKOAKNSA-N 2 0 315.505 3.273 20 10 DGCDRP C[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)CC1CC[NH2+]CC1 ZINC001235433337 1099032538 /nfs/dbraw/zinc/03/25/38/1099032538.db2.gz TVCZVUONHJMXOW-UHFFFAOYSA-N 2 0 316.445 3.008 20 10 DGCDRP C[N@H+](CC[C@@H]1CCCC[NH2+]1)Cc1ccc(N2CCCC2)cc1 ZINC001235694729 1099132042 /nfs/dbraw/zinc/13/20/42/1099132042.db2.gz RTFZTVNNYVVCIO-SFHVURJKSA-N 2 0 301.478 3.251 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236935237 1099882945 /nfs/dbraw/zinc/88/29/45/1099882945.db2.gz GUVAOLVNYZGGDX-MRXNPFEDSA-N 2 0 319.468 3.200 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC34CCCC4)c(F)c2)CC1 ZINC001236934125 1099883067 /nfs/dbraw/zinc/88/30/67/1099883067.db2.gz CYXINYQHVLNMNA-UHFFFAOYSA-N 2 0 317.452 3.096 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC001237386753 1100102572 /nfs/dbraw/zinc/10/25/72/1100102572.db2.gz AFZKSIAWZYIISU-AZUAARDMSA-N 2 0 313.489 3.251 20 10 DGCDRP Cc1cc(F)cc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c1O ZINC001238062299 1100346558 /nfs/dbraw/zinc/34/65/58/1100346558.db2.gz OLFQKWOOQTXCML-UHFFFAOYSA-N 2 0 320.452 3.394 20 10 DGCDRP Cc1cnccc1O[C@H]1CC[N@H+](Cc2cc(F)cc(C)c2O)C1 ZINC001238066682 1100349330 /nfs/dbraw/zinc/34/93/30/1100349330.db2.gz OGTRQPWLNAMXQY-INIZCTEOSA-N 2 0 316.376 3.196 20 10 DGCDRP COc1cc(O)c(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)cc1Cl ZINC001206563451 1103789167 /nfs/dbraw/zinc/78/91/67/1103789167.db2.gz CVAALRCPTBMBGZ-MRXNPFEDSA-N 2 0 312.841 3.005 20 10 DGCDRP CC[C@@H](C)C[C@@H](CC)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246171815 1104418615 /nfs/dbraw/zinc/41/86/15/1104418615.db2.gz DYLWRJOWJSHUPT-SJLPKXTDSA-N 2 0 303.494 3.401 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001246313699 1104484129 /nfs/dbraw/zinc/48/41/29/1104484129.db2.gz VVIWXKNEKIHUQT-UHFFFAOYSA-N 2 0 301.478 3.155 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246527649 1104577194 /nfs/dbraw/zinc/57/71/94/1104577194.db2.gz UCFAFCPBNPSSPC-HRLGVUPISA-N 2 0 314.473 3.220 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246527661 1104578014 /nfs/dbraw/zinc/57/80/14/1104578014.db2.gz UCFAFCPBNPSSPC-MMMWYMCRSA-N 2 0 314.473 3.220 20 10 DGCDRP Oc1ccccc1C[NH+]1CCC2(C[NH+](C3CCCC3)C2)CC1 ZINC001275266945 1104698059 /nfs/dbraw/zinc/69/80/59/1104698059.db2.gz GVLHFOCQEDVPEY-UHFFFAOYSA-N 2 0 300.446 3.233 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246919301 1104737028 /nfs/dbraw/zinc/73/70/28/1104737028.db2.gz GXOOZZWTIBOAMD-IZZQQSIFSA-N 2 0 301.478 3.248 20 10 DGCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc4c(c3)CCCO4)(C1)CCC2 ZINC001275630730 1104839470 /nfs/dbraw/zinc/83/94/70/1104839470.db2.gz MONHQMDVRORVRO-RBUKOAKNSA-N 2 0 300.446 3.166 20 10 DGCDRP CC[C@@H]([NH2+]CC[C@@H](C)[NH2+]C)c1cc(Br)ccc1O ZINC001261424273 1107428006 /nfs/dbraw/zinc/42/80/06/1107428006.db2.gz QIVAIWKJANNZLA-ZWNOBZJWSA-N 2 0 315.255 3.193 20 10 DGCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001323322670 1107934788 /nfs/dbraw/zinc/93/47/88/1107934788.db2.gz MMNMTTXORSQUFL-IBGZPJMESA-N 2 0 315.505 3.451 20 10 DGCDRP CC[C@H]1C[C@H](C)C[N@@H+]1Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001319707754 1108602875 /nfs/dbraw/zinc/60/28/75/1108602875.db2.gz XSRWGKHNYBYMFY-RDJZCZTQSA-N 2 0 319.468 3.198 20 10 DGCDRP C[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308237746 1111402853 /nfs/dbraw/zinc/40/28/53/1111402853.db2.gz QQZRPIYWKRBMBS-PKOBYXMFSA-N 2 0 315.505 3.354 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3C[C@@H]4CCCC[C@@H]43)cc2)CC1 ZINC001308917673 1111493450 /nfs/dbraw/zinc/49/34/50/1111493450.db2.gz DQCISVMTJPDPRJ-IHPCNDPISA-N 2 0 313.489 3.107 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)cc1F ZINC000271780138 432424545 /nfs/dbraw/zinc/42/45/45/432424545.db2.gz DKZKOINPMZEXDF-UHFFFAOYSA-N 2 0 305.441 3.023 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(O)c1 ZINC000185206743 432477462 /nfs/dbraw/zinc/47/74/62/432477462.db2.gz SFFWNLMLNYQFHO-BBWFWOEESA-N 2 0 320.477 3.241 20 10 DGCDRP CC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(C)cc1O ZINC000280233403 433020530 /nfs/dbraw/zinc/02/05/30/433020530.db2.gz VKSXAKOCNDAMPZ-AEFFLSMTSA-N 2 0 320.477 3.242 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)c1O ZINC000894179867 618725071 /nfs/dbraw/zinc/72/50/71/618725071.db2.gz HYUKMXIFFCLVKI-OAHLLOKOSA-N 2 0 320.477 3.311 20 10 DGCDRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000902486964 619646257 /nfs/dbraw/zinc/64/62/57/619646257.db2.gz FUNCGPWFLVISSS-IIAWOOMASA-N 2 0 305.441 3.204 20 10 DGCDRP COc1ccc(N2CC[C@@H]([NH2+]C[C@H]([NH3+])CCC(C)(C)C)C2)cc1 ZINC000904376544 619918202 /nfs/dbraw/zinc/91/82/02/619918202.db2.gz BCXOGKRXTIEEDJ-HZPDHXFCSA-N 2 0 319.493 3.017 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1C[NH3+] ZINC000904412074 619920685 /nfs/dbraw/zinc/92/06/85/619920685.db2.gz PEZOXMNYTGUUFV-FUHWJXTLSA-N 2 0 301.478 3.094 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)cc1 ZINC000922848801 621108541 /nfs/dbraw/zinc/10/85/41/621108541.db2.gz XWTJVNBNWIBLKN-UHFFFAOYSA-N 2 0 301.478 3.249 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000756422730 621637655 /nfs/dbraw/zinc/63/76/55/621637655.db2.gz NLWKZURQECCJSI-OWCLPIDISA-N 2 0 320.477 3.419 20 10 DGCDRP CC[NH+]1CCC(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756534670 621646020 /nfs/dbraw/zinc/64/60/20/621646020.db2.gz MFWRXWQTFWGWIN-WFASDCNBSA-N 2 0 306.425 3.401 20 10 DGCDRP C[C@H]1CC[C@@H](NCc2ccc(N(C)C)cc2C(F)(F)F)C[NH2+]1 ZINC000863649700 621693399 /nfs/dbraw/zinc/69/33/99/621693399.db2.gz GTTZKTFSJYQHEN-WCQYABFASA-N 2 0 315.383 3.002 20 10 DGCDRP CCOc1ccc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c(O)c1 ZINC000769483179 622532242 /nfs/dbraw/zinc/53/22/42/622532242.db2.gz NPJMSJCKLSFAPY-INIZCTEOSA-N 2 0 306.450 3.097 20 10 DGCDRP CC[C@H](C)C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000771868382 622806910 /nfs/dbraw/zinc/80/69/10/622806910.db2.gz MTKPBDZLNIESGP-KRWDZBQOSA-N 2 0 315.505 3.354 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)cc1 ZINC000773757067 623068568 /nfs/dbraw/zinc/06/85/68/623068568.db2.gz YIFRJURBCFGZNN-LPHOPBHVSA-N 2 0 303.494 3.447 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]([NH3+])Cc2ccccc2)c1 ZINC000873235696 623086797 /nfs/dbraw/zinc/08/67/97/623086797.db2.gz SDRFBTYJRFSWBD-GOEBONIOSA-N 2 0 314.429 3.012 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3c3ccc[nH]3)cc2)CC1 ZINC000775630587 623299801 /nfs/dbraw/zinc/29/98/01/623299801.db2.gz MHSAWJHTKRBFJB-HXUWFJFHSA-N 2 0 324.472 3.104 20 10 DGCDRP CC[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775654239 623304300 /nfs/dbraw/zinc/30/43/00/623304300.db2.gz JKYMZOQIPFGBCC-KRWDZBQOSA-N 2 0 301.478 3.060 20 10 DGCDRP CC(C)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC1CC1 ZINC000775656787 623305904 /nfs/dbraw/zinc/30/59/04/623305904.db2.gz MQURUXWNWLQAMI-UHFFFAOYSA-N 2 0 301.478 3.059 20 10 DGCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775663846 623308208 /nfs/dbraw/zinc/30/82/08/623308208.db2.gz FHCTYSUPFBYFAJ-KRWDZBQOSA-N 2 0 301.478 3.060 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000876810521 623711896 /nfs/dbraw/zinc/71/18/96/623711896.db2.gz ANJPUINYTUSPRM-MAUKXSAKSA-N 2 0 300.446 3.149 20 10 DGCDRP Cc1cccc(O)c1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000877136186 623801706 /nfs/dbraw/zinc/80/17/06/623801706.db2.gz BBVYRMVZSFCHJZ-UHFFFAOYSA-N 2 0 311.429 3.102 20 10 DGCDRP C[C@H]([NH2+]CCC[NH2+][C@@H](C)c1ccccc1O)c1ccccc1O ZINC000879650459 624624796 /nfs/dbraw/zinc/62/47/96/624624796.db2.gz AVATXWZNICNRFK-GJZGRUSLSA-N 2 0 314.429 3.489 20 10 DGCDRP CC[C@H]([NH2+]CCC(C)(C)[NH3+])c1cc(Br)ccc1O ZINC000925739587 627785319 /nfs/dbraw/zinc/78/53/19/627785319.db2.gz ZPJSHHWOEFKTFI-LBPRGKRZSA-N 2 0 315.255 3.323 20 10 DGCDRP Cc1ccc([C@H](C)N2CCc3sc(C[NH3+])nc3C2)c(O)c1C ZINC000925751551 627787473 /nfs/dbraw/zinc/78/74/73/627787473.db2.gz NSTXAYMUJVGMKQ-LBPRGKRZSA-N 2 0 317.458 3.044 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3C[NH3+])cc2)CC1 ZINC000817901242 627956765 /nfs/dbraw/zinc/95/67/65/627956765.db2.gz AFBFSGZNKUJMTB-PKOBYXMFSA-N 2 0 301.478 3.140 20 10 DGCDRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817941719 627968832 /nfs/dbraw/zinc/96/88/32/627968832.db2.gz VWWFBNUFXLVYRA-OAHLLOKOSA-N 2 0 319.468 3.466 20 10 DGCDRP C[C@H]([NH2+]CCc1ccc(N)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000817957251 627973846 /nfs/dbraw/zinc/97/38/46/627973846.db2.gz KEGYKEIEVKDNGW-PXNSSMCTSA-N 2 0 323.484 3.312 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]([NH3+])C(C)C)c1cc(Br)ccc1O ZINC000817957365 627974140 /nfs/dbraw/zinc/97/41/40/627974140.db2.gz BESQYXXRPJHMBM-QWHCGFSZSA-N 2 0 315.255 3.179 20 10 DGCDRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817955565 627974258 /nfs/dbraw/zinc/97/42/58/627974258.db2.gz ZAPWNVLWKIJNIO-IAGOWNOFSA-N 2 0 301.478 3.327 20 10 DGCDRP CCC([NH3+])(CC)C[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000817959990 627975560 /nfs/dbraw/zinc/97/55/60/627975560.db2.gz JSNPXTUMYFPWOR-SNVBAGLBSA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817965668 627977425 /nfs/dbraw/zinc/97/74/25/627977425.db2.gz BQRHIQSZRXCSAI-AUUYWEPGSA-N 2 0 302.462 3.311 20 10 DGCDRP CC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817967022 627977802 /nfs/dbraw/zinc/97/78/02/627977802.db2.gz COGZYYSEATVHRW-AWEZNQCLSA-N 2 0 314.351 3.371 20 10 DGCDRP CC[C@H]([NH2+][C@H](C)CCC[NH3+])c1cc(Br)ccc1O ZINC000817977886 627981270 /nfs/dbraw/zinc/98/12/70/627981270.db2.gz RCNHNYAHBCUSQA-MFKMUULPSA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(N2CCCCC2)cc1 ZINC000817983647 627983748 /nfs/dbraw/zinc/98/37/48/627983748.db2.gz HIAGZEWEUSQQFH-INIZCTEOSA-N 2 0 301.478 3.470 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2c1c(F)ccc2O ZINC000817984881 627983860 /nfs/dbraw/zinc/98/38/60/627983860.db2.gz BITYIFDGAIQULH-BZPMIXESSA-N 2 0 304.409 3.344 20 10 DGCDRP Cc1cc(Cl)cc(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)c1O ZINC000818431970 628022599 /nfs/dbraw/zinc/02/25/99/628022599.db2.gz YOSJBJMTJICLGU-CYBMUJFWSA-N 2 0 308.853 3.318 20 10 DGCDRP C[C@H]1CC2(C[N@@H+]1C/C=C/c1ccc(N(C)C)cc1)CC[NH2+]CC2 ZINC000818431706 628022696 /nfs/dbraw/zinc/02/26/96/628022696.db2.gz RIHCJXNPGNPKAD-BDUNBXCCSA-N 2 0 313.489 3.230 20 10 DGCDRP CC(C)C[NH+]1CCC([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835035165 629830665 /nfs/dbraw/zinc/83/06/65/629830665.db2.gz GIIFSCHNOTVFDD-WAYWQWQTSA-N 2 0 315.505 3.476 20 10 DGCDRP CN(C)c1ccc(/C=C/CN(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000835053150 629837461 /nfs/dbraw/zinc/83/74/61/629837461.db2.gz KUDHNRZZTGNBMC-NOKHBTLWSA-N 2 0 313.489 3.323 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000840949170 630382904 /nfs/dbraw/zinc/38/29/04/630382904.db2.gz POUWBTXZDKQSJV-UHFFFAOYSA-N 2 0 303.494 3.417 20 10 DGCDRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc(N)cc3)CC2)C1 ZINC000841034705 630400073 /nfs/dbraw/zinc/40/00/73/630400073.db2.gz JSPJGNAWCJJUHM-UZLBHIALSA-N 2 0 315.505 3.444 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000841087456 630405988 /nfs/dbraw/zinc/40/59/88/630405988.db2.gz NWNXDBPYONRKDA-CFPAGDMOSA-N 2 0 313.489 3.230 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000841087458 630406004 /nfs/dbraw/zinc/40/60/04/630406004.db2.gz NWNXDBPYONRKDA-WYTZPYIFSA-N 2 0 313.489 3.230 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccccc1O ZINC000842922004 630593539 /nfs/dbraw/zinc/59/35/39/630593539.db2.gz ULWUNGSJXZFXSK-WDYCEAGBSA-N 2 0 310.441 3.388 20 10 DGCDRP CCCN(CCC)c1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)cc1 ZINC000843051707 630608792 /nfs/dbraw/zinc/60/87/92/630608792.db2.gz KSAYTYBGHVUEKG-QFBILLFUSA-N 2 0 303.494 3.482 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCCC2)cc1)C1CCC([NH3+])CC1 ZINC000843056112 630609371 /nfs/dbraw/zinc/60/93/71/630609371.db2.gz ZUZVXFLUHUFDBZ-UHFFFAOYSA-N 2 0 301.478 3.379 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1 ZINC000843125224 630616202 /nfs/dbraw/zinc/61/62/02/630616202.db2.gz OKYAZNJCUAGJPP-QLGSUFQJSA-N 2 0 313.489 3.087 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CC[NH2+]C3)CC2)cc1 ZINC000843125909 630616654 /nfs/dbraw/zinc/61/66/54/630616654.db2.gz CIRJXYWMQIUKMS-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc1F ZINC000843126594 630616705 /nfs/dbraw/zinc/61/67/05/630616705.db2.gz LBFZVPHFGSBUKC-CALCHBBNSA-N 2 0 319.468 3.103 20 10 DGCDRP C[C@H]([NH2+]CCCCCC[NH3+])c1cc(Br)ccc1O ZINC000843341191 630647656 /nfs/dbraw/zinc/64/76/56/630647656.db2.gz HHSHLXGQPSLEHP-NSHDSACASA-N 2 0 315.255 3.324 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1F ZINC000843341233 630647880 /nfs/dbraw/zinc/64/78/80/630647880.db2.gz SOVPXAWLERQCBI-YESZJQIVSA-N 2 0 319.468 3.150 20 10 DGCDRP C[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2[O-])[C@H]1CC[NH3+] ZINC000844902099 630970192 /nfs/dbraw/zinc/97/01/92/630970192.db2.gz NKKKRONGSYQLHW-HZMBPMFUSA-N 2 0 300.805 3.134 20 10 DGCDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000844904414 630972836 /nfs/dbraw/zinc/97/28/36/630972836.db2.gz LGNNOGKJVHBIIN-UHFFFAOYSA-N 2 0 320.820 3.063 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]CCC[N@H+](C)CC(C)C)c1O ZINC000845997118 631204924 /nfs/dbraw/zinc/20/49/24/631204924.db2.gz UWFSMNCAFFRAPL-UHFFFAOYSA-N 2 0 314.857 3.122 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1O ZINC000846140366 631211565 /nfs/dbraw/zinc/21/15/65/631211565.db2.gz PKGMKHAJJDLPHR-OAGGEKHMSA-N 2 0 320.477 3.419 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1O ZINC000846140367 631211697 /nfs/dbraw/zinc/21/16/97/631211697.db2.gz PKGMKHAJJDLPHR-OWCLPIDISA-N 2 0 320.477 3.419 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c1O ZINC000848889388 631773489 /nfs/dbraw/zinc/77/34/89/631773489.db2.gz JIEQAMGYPBGSLF-MRXNPFEDSA-N 2 0 302.462 3.118 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)cc1F ZINC000849350310 631900173 /nfs/dbraw/zinc/90/01/73/631900173.db2.gz NLLXWFJMVBRSAW-QGZVFWFLSA-N 2 0 319.468 3.103 20 10 DGCDRP CCOc1cccc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c1O ZINC000849350780 631901452 /nfs/dbraw/zinc/90/14/52/631901452.db2.gz WAZGWZJLRZVVHW-INIZCTEOSA-N 2 0 318.461 3.003 20 10 DGCDRP COc1cc(C[NH2+][C@H](C)CC[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC000850097173 632055371 /nfs/dbraw/zinc/05/53/71/632055371.db2.gz SWFHSZNXHDMSIH-CYBMUJFWSA-N 2 0 308.466 3.128 20 10 DGCDRP COc1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1C ZINC000850421562 632147749 /nfs/dbraw/zinc/14/77/49/632147749.db2.gz YMNCQAUDQCINPS-UHFFFAOYSA-N 2 0 302.462 3.215 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c1 ZINC000184936867 660195990 /nfs/dbraw/zinc/19/59/90/660195990.db2.gz NKWAQTGIKILHSK-AWEZNQCLSA-N 2 0 314.429 3.313 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC3(C)C)cc2F)CC1 ZINC000793524660 661041554 /nfs/dbraw/zinc/04/15/54/661041554.db2.gz IUZMGPFUHQAISW-GOSISDBHSA-N 2 0 319.468 3.246 20 10 DGCDRP C[N@@H+](Cc1cc2c(cc1O)CCCC2)CC1CC[NH+](C)CC1 ZINC000160144759 655523513 /nfs/dbraw/zinc/52/35/13/655523513.db2.gz LPANBCFHLFXSLD-UHFFFAOYSA-N 2 0 302.462 3.045 20 10 DGCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3c(O)ccc4ccccc43)CC[C@@H]21 ZINC000164624046 658939698 /nfs/dbraw/zinc/93/96/98/658939698.db2.gz QQFCNDVOSPAYRZ-APWZRJJASA-N 2 0 310.441 3.462 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000093688290 662358414 /nfs/dbraw/zinc/35/84/14/662358414.db2.gz ZHDJKXWGVKMPBR-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP C[N@H+](CCC[NH2+][C@@H]1CCc2cccc(O)c21)Cc1ccccc1 ZINC000381800245 685159874 /nfs/dbraw/zinc/15/98/74/685159874.db2.gz SFRKKIRVMHKPAX-GOSISDBHSA-N 2 0 310.441 3.491 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@H]2C1 ZINC001333893526 1178691968 /nfs/dbraw/zinc/69/19/68/1178691968.db2.gz YXQHTUTXEIEHOA-BJLQDIEVSA-N 2 0 315.505 3.223 20 10 DGCDRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc(N)cc2)C1 ZINC001334753949 1178792136 /nfs/dbraw/zinc/79/21/36/1178792136.db2.gz KBWPDRMYWWFJJA-FUHWJXTLSA-N 2 0 301.478 3.355 20 10 DGCDRP C[C@H](CC[NH2+]Cc1ccc2c(c1)CCCO2)[NH+]1CCCCC1 ZINC001461428916 1182812902 /nfs/dbraw/zinc/81/29/02/1182812902.db2.gz AKRXAKOJDLSNPB-MRXNPFEDSA-N 2 0 302.462 3.366 20 10 DGCDRP CC[NH+](CC)CCC[N@H+](CC)Cc1c(C)cc(OC)cc1O ZINC001462199977 1182922732 /nfs/dbraw/zinc/92/27/32/1182922732.db2.gz PBWSJMYKYFKFDT-UHFFFAOYSA-N 2 0 308.466 3.263 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]CC2(C[NH+](C)C)CCCC2)cc1 ZINC001474106274 1183869010 /nfs/dbraw/zinc/86/90/10/1183869010.db2.gz HYOWEBQEFPMYCH-FPLPWBNLSA-N 2 0 315.505 3.477 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CCCN(c3cc[nH+]cc3)CC2)cc1 ZINC001643584403 1195036242 /nfs/dbraw/zinc/03/62/42/1195036242.db2.gz DDCDSYGTPWYLPN-UHFFFAOYSA-N 2 0 324.472 3.250 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1 ZINC001656181527 1196014772 /nfs/dbraw/zinc/01/47/72/1196014772.db2.gz FOJJTALKBWNRNJ-FPLPWBNLSA-N 2 0 315.505 3.477 20 10 DGCDRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001657322247 1196130407 /nfs/dbraw/zinc/13/04/07/1196130407.db2.gz DXOMONJJQNCUJA-IEBWSBKVSA-N 2 0 301.478 3.249 20 10 DGCDRP C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001657481161 1196148073 /nfs/dbraw/zinc/14/80/73/1196148073.db2.gz WOVAWPOKYQRPHL-XLIONFOSSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[C@@]1(C)CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001658802186 1196302855 /nfs/dbraw/zinc/30/28/55/1196302855.db2.gz MZIVXSSHNJROLL-UXHICEINSA-N 2 0 315.505 3.497 20 10 DGCDRP CCCC[NH+]1CCC([N@H+](C)Cc2cccc(OCC)c2O)CC1 ZINC001203617208 1084440392 /nfs/dbraw/zinc/44/03/92/1084440392.db2.gz LXIDGCFFHGXOJW-UHFFFAOYSA-N 2 0 320.477 3.487 20 10 DGCDRP CC1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001168196647 1087046555 /nfs/dbraw/zinc/04/65/55/1087046555.db2.gz IQBMEWJVMFKGCY-UHFFFAOYSA-N 2 0 301.478 3.107 20 10 DGCDRP Oc1ccccc1C[NH+]1CCC2(CCC[N@@H+]2CC2CC2)CC1 ZINC001203551949 1090754766 /nfs/dbraw/zinc/75/47/66/1090754766.db2.gz UOTMTYOUNIYUMO-UHFFFAOYSA-N 2 0 300.446 3.233 20 10 DGCDRP Cc1cccc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)c1 ZINC001204848723 1091047557 /nfs/dbraw/zinc/04/75/57/1091047557.db2.gz RTRMRNDKEBFMHJ-UHFFFAOYSA-N 2 0 309.457 3.037 20 10 DGCDRP C[C@@]1([NH3+])CCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001205289612 1091167620 /nfs/dbraw/zinc/16/76/20/1091167620.db2.gz ZPHMLIFBIXUMSG-CQSZACIVSA-N 2 0 302.340 3.114 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c1O ZINC001205592777 1091269357 /nfs/dbraw/zinc/26/93/57/1091269357.db2.gz YEPUIFIXBRHVTJ-HNNXBMFYSA-N 2 0 300.805 3.007 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1C[NH3+] ZINC001205616828 1091282350 /nfs/dbraw/zinc/28/23/50/1091282350.db2.gz HBWSTUWBUBEBGY-PKOBYXMFSA-N 2 0 315.505 3.484 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@H](C)CC2)cc(C[NH+](C)C)c1O ZINC001139254597 1091501537 /nfs/dbraw/zinc/50/15/37/1091501537.db2.gz JBHCVKCUOSIZCV-CQSZACIVSA-N 2 0 306.450 3.084 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)cc1 ZINC001206294054 1091565535 /nfs/dbraw/zinc/56/55/35/1091565535.db2.gz IZLQRZGPCOFVQL-LJQANCHMSA-N 2 0 303.494 3.484 20 10 DGCDRP COc1cc(N(C)C)ccc1C[N@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206598472 1091684935 /nfs/dbraw/zinc/68/49/35/1091684935.db2.gz KJNMCGFLOKYOED-QGZVFWFLSA-N 2 0 319.493 3.114 20 10 DGCDRP CC[NH+]1C[C@H]2C[NH+](Cc3ccc(-n4c(C)ccc4C)cc3)C[C@@H]2C1 ZINC001209520501 1092807378 /nfs/dbraw/zinc/80/73/78/1092807378.db2.gz ZQOCJWIQNPDDKG-PMACEKPBSA-N 2 0 323.484 3.478 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@]23CCC[NH2+]CC3)c1O ZINC001222321209 1095550777 /nfs/dbraw/zinc/55/07/77/1095550777.db2.gz RZGXWVMKPLHZEL-KRWDZBQOSA-N 2 0 308.853 3.462 20 10 DGCDRP Cc1c(C[NH+]2CCC3(CCC[NH2+]C3)CC2)c2ccccc2n1C ZINC001222452672 1095621548 /nfs/dbraw/zinc/62/15/48/1095621548.db2.gz JLTFMAZZFUULTC-UHFFFAOYSA-N 2 0 311.473 3.452 20 10 DGCDRP CN1CCCc2cc(C[NH+]3CCC4(CCC[NH2+]C4)CC3)ccc21 ZINC001222453346 1095621790 /nfs/dbraw/zinc/62/17/90/1095621790.db2.gz XWPWKIWLDAERRZ-UHFFFAOYSA-N 2 0 313.489 3.035 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171624546 1096937448 /nfs/dbraw/zinc/93/74/48/1096937448.db2.gz WDTMPDDZBKNRSG-UHFFFAOYSA-N 2 0 303.494 3.494 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCC[C@]4(CCC[NH2+]C4)C3)ccc21 ZINC000323049621 1096937543 /nfs/dbraw/zinc/93/75/43/1096937543.db2.gz QHYHLEFSRKECDH-FQEVSTJZSA-N 2 0 313.489 3.035 20 10 DGCDRP CC[C@@H](CC(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001172389637 1097142789 /nfs/dbraw/zinc/14/27/89/1097142789.db2.gz OTJIPNJHZIFXGF-SFHVURJKSA-N 2 0 303.494 3.353 20 10 DGCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3c(O)ccc4ccccc43)C[C@@H]2C1 ZINC001231589327 1097785136 /nfs/dbraw/zinc/78/51/36/1097785136.db2.gz GMLNFKGSRNZSGR-CALCHBBNSA-N 2 0 310.441 3.319 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)c(O)c1 ZINC001231850849 1097865813 /nfs/dbraw/zinc/86/58/13/1097865813.db2.gz VOIAVQRAUMDLGO-UHFFFAOYSA-N 2 0 302.462 3.459 20 10 DGCDRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2ccc(N(C)C)cc2O)CC1 ZINC001232839567 1098149100 /nfs/dbraw/zinc/14/91/00/1098149100.db2.gz PXQVMDUKGWVUKJ-UHFFFAOYSA-N 2 0 319.493 3.010 20 10 DGCDRP CC1CCC(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001177496855 1098543347 /nfs/dbraw/zinc/54/33/47/1098543347.db2.gz SCODNEBQDMHJJY-UHFFFAOYSA-N 2 0 315.505 3.354 20 10 DGCDRP COc1ccc2ccc(O)c(C[NH+]3CCC([NH+](C)C)CC3)c2c1 ZINC001234518389 1098577173 /nfs/dbraw/zinc/57/71/73/1098577173.db2.gz IRSDLPLUJGNQRP-UHFFFAOYSA-N 2 0 314.429 3.080 20 10 DGCDRP CC(C)(C)c1ccc(C[NH+]2CCC3(CC[NH2+]C3)CC2)c(O)c1 ZINC001235106927 1098806604 /nfs/dbraw/zinc/80/66/04/1098806604.db2.gz VDORSXYLLLNYCZ-UHFFFAOYSA-N 2 0 302.462 3.265 20 10 DGCDRP Oc1cc(Cl)ccc1C[N@@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235157986 1098844041 /nfs/dbraw/zinc/84/40/41/1098844041.db2.gz SWASZJGZKQUGQT-MRXNPFEDSA-N 2 0 308.853 3.400 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1 ZINC001235158120 1098845310 /nfs/dbraw/zinc/84/53/10/1098845310.db2.gz USUSHCBESAIEFJ-IBGZPJMESA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1cc(F)cc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c1O ZINC001235237150 1098909970 /nfs/dbraw/zinc/90/99/70/1098909970.db2.gz JPYGPUMTBIYXOW-KRWDZBQOSA-N 2 0 306.425 3.194 20 10 DGCDRP Cc1cc(C[N@@H+]2CC[C@@H](C3C[NH2+]C3)C2)c(C)n1-c1ccccc1 ZINC001235339401 1098962011 /nfs/dbraw/zinc/96/20/11/1098962011.db2.gz FYSXUDAKCJWXLH-QGZVFWFLSA-N 2 0 309.457 3.135 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@@H]3F)c1 ZINC001235400229 1098995708 /nfs/dbraw/zinc/99/57/08/1098995708.db2.gz CRIYVJBBLBAXAM-PKOBYXMFSA-N 2 0 320.452 3.213 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@@H]3F)cc1 ZINC001235403692 1099001439 /nfs/dbraw/zinc/00/14/39/1099001439.db2.gz LVFIAPALVAMNIJ-OALUTQOASA-N 2 0 319.468 3.056 20 10 DGCDRP c1ccc([C@@H]2CCC[N@H+]2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235673926 1099115928 /nfs/dbraw/zinc/11/59/28/1099115928.db2.gz JBEMVVCQRIKWNB-NRFANRHFSA-N 2 0 321.468 3.433 20 10 DGCDRP CC[NH2+]C1CC[NH+](Cc2ccc(N(C)C)c3ccccc23)CC1 ZINC001235725882 1099149414 /nfs/dbraw/zinc/14/94/14/1099149414.db2.gz QDSHUHSCTFHMHG-UHFFFAOYSA-N 2 0 311.473 3.480 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC001235868922 1099226959 /nfs/dbraw/zinc/22/69/59/1099226959.db2.gz WRFXXROJOIWPCC-QUCCMNQESA-N 2 0 313.489 3.251 20 10 DGCDRP Cc1cc(C[N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001235928544 1099264452 /nfs/dbraw/zinc/26/44/52/1099264452.db2.gz AGXYRZQOCFUJAN-IEBWSBKVSA-N 2 0 309.457 3.135 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC001235928614 1099265007 /nfs/dbraw/zinc/26/50/07/1099265007.db2.gz BCWLVAGFOVWCQI-RBUKOAKNSA-N 2 0 309.457 3.135 20 10 DGCDRP CCC[N@H+](Cc1ccc(C(F)(F)F)cc1O)C1CC[NH2+]CC1 ZINC001236184758 1099455225 /nfs/dbraw/zinc/45/52/25/1099455225.db2.gz NXBXQADSZHVBMN-UHFFFAOYSA-N 2 0 316.367 3.375 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)CCC[NH2+]C2CCCCC2)cc1 ZINC001236190290 1099456633 /nfs/dbraw/zinc/45/66/33/1099456633.db2.gz SPSXOWOVLPMWKU-UHFFFAOYSA-N 2 0 303.494 3.497 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001236274051 1099515373 /nfs/dbraw/zinc/51/53/73/1099515373.db2.gz BSBFAGCCEMROLV-UHFFFAOYSA-N 2 0 323.484 3.420 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)C[NH2+]CC2 ZINC001236281092 1099516694 /nfs/dbraw/zinc/51/66/94/1099516694.db2.gz YOAFZXBSNPLBPU-UHFFFAOYSA-N 2 0 323.484 3.420 20 10 DGCDRP CC[N@@H+](Cc1ccc(N(C)C)c2ccccc12)C[C@H]1CC[NH2+]C1 ZINC001236408965 1099581857 /nfs/dbraw/zinc/58/18/57/1099581857.db2.gz QRIPZGIAFKDOCY-INIZCTEOSA-N 2 0 311.473 3.337 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236598245 1099695205 /nfs/dbraw/zinc/69/52/05/1099695205.db2.gz JETZEWLCAAYVIU-SFHVURJKSA-N 2 0 313.489 3.251 20 10 DGCDRP CC(C)c1ccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c(O)c1 ZINC001236601616 1099697794 /nfs/dbraw/zinc/69/77/94/1099697794.db2.gz NRAYWXZZDCHRIM-HNNXBMFYSA-N 2 0 302.462 3.480 20 10 DGCDRP CCc1ccc(CN([C@H]2CC[NH2+]C2)C2CCCCC2)c(O)c1 ZINC001236661264 1099730410 /nfs/dbraw/zinc/73/04/10/1099730410.db2.gz AVPLMRGCLTXPQI-SFHVURJKSA-N 2 0 302.462 3.451 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236835697 1099824509 /nfs/dbraw/zinc/82/45/09/1099824509.db2.gz OYRIUWRVPVQGMT-IBGZPJMESA-N 2 0 315.505 3.498 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)c2ccccc21 ZINC001237384424 1100103773 /nfs/dbraw/zinc/10/37/73/1100103773.db2.gz WRJGEBHPUWNRHG-YLJYHZDGSA-N 2 0 323.484 3.480 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C1=CC[C@@H]([NH+]2CCCC2)CC1 ZINC001242694478 1102288869 /nfs/dbraw/zinc/28/88/69/1102288869.db2.gz WBIFZLVZQKUUGK-LJQANCHMSA-N 2 0 311.473 3.128 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC001329036529 1104132910 /nfs/dbraw/zinc/13/29/10/1104132910.db2.gz MXPBULWWQCUDOJ-QCODTGAPSA-N 2 0 300.446 3.227 20 10 DGCDRP CC(C)C1CCC([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001246176338 1104422973 /nfs/dbraw/zinc/42/29/73/1104422973.db2.gz WSJIIKCKYHBGMV-UHFFFAOYSA-N 2 0 315.505 3.401 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC001246517955 1104574165 /nfs/dbraw/zinc/57/41/65/1104574165.db2.gz BZCJRQMOJAWCIC-KDOFPFPSSA-N 2 0 302.462 3.364 20 10 DGCDRP C[NH+]1CCC2(CC1)C[N@H+](Cc1ccccc1O)Cc1ccccc12 ZINC001275266656 1104698277 /nfs/dbraw/zinc/69/82/77/1104698277.db2.gz CBDBOGIRMFWYJG-UHFFFAOYSA-N 2 0 322.452 3.371 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246924024 1104738014 /nfs/dbraw/zinc/73/80/14/1104738014.db2.gz LKOQGSCZAIANCX-WOJBJXKFSA-N 2 0 315.505 3.497 20 10 DGCDRP C[N@@H+]1CCC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001254501031 1106083124 /nfs/dbraw/zinc/08/31/24/1106083124.db2.gz PELCACYYHRIBBB-GOSISDBHSA-N 2 0 301.478 3.251 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC001320876920 1107171286 /nfs/dbraw/zinc/17/12/86/1107171286.db2.gz UAFNTGMATNLLCN-VQIMIIECSA-N 2 0 303.494 3.305 20 10 DGCDRP Nc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC001262488376 1107717891 /nfs/dbraw/zinc/71/78/91/1107717891.db2.gz ZZNILQNDTWOHQZ-UHFFFAOYSA-N 2 0 309.457 3.271 20 10 DGCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001323322673 1107935791 /nfs/dbraw/zinc/93/57/91/1107935791.db2.gz MMNMTTXORSQUFL-LJQANCHMSA-N 2 0 315.505 3.451 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@@]34C[NH+](C)C[C@]3(C2)CCCC4)cc1 ZINC001308171946 1111390294 /nfs/dbraw/zinc/39/02/94/1111390294.db2.gz WYTAEAAVSYPOBQ-BGYRXZFFSA-N 2 0 313.489 3.060 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCCCC3CC3)cc2)CC1 ZINC001308492090 1111434674 /nfs/dbraw/zinc/43/46/74/1111434674.db2.gz CBHIFPCTAVGUEA-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP CCOc1cccc(C[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c1O ZINC000236926958 202075256 /nfs/dbraw/zinc/07/52/56/202075256.db2.gz RUIRVNCFWCHWHV-OAHLLOKOSA-N 2 0 306.450 3.145 20 10 DGCDRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(Br)cc1O ZINC000273575662 130138167 /nfs/dbraw/zinc/13/81/67/130138167.db2.gz LRWPMCPARYPFGX-NSHDSACASA-N 2 0 315.255 3.147 20 10 DGCDRP C[NH+](C)Cc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000113318049 431342315 /nfs/dbraw/zinc/34/23/15/431342315.db2.gz LXAPPDHYWJGIOJ-UHFFFAOYSA-N 2 0 304.821 3.397 20 10 DGCDRP CCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)C[C@@H]2C)c(O)c1 ZINC000093639403 431915567 /nfs/dbraw/zinc/91/55/67/431915567.db2.gz JFGBYZKUDBPBRK-YJBOKZPZSA-N 2 0 320.477 3.343 20 10 DGCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000093770026 431917292 /nfs/dbraw/zinc/91/72/92/431917292.db2.gz KFZZGCWVJMMSDK-LJQANCHMSA-N 2 0 315.505 3.451 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC2(C[NH+](C)C)CCCC2)c1 ZINC000183950824 432338734 /nfs/dbraw/zinc/33/87/34/432338734.db2.gz NWIPGZUPNYVTDV-CQSZACIVSA-N 2 0 306.450 3.173 20 10 DGCDRP Cc1cccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000192927299 432430573 /nfs/dbraw/zinc/43/05/73/432430573.db2.gz QPWZGIRNNVAHEI-GOSISDBHSA-N 2 0 310.441 3.312 20 10 DGCDRP COc1cccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1O ZINC000365822066 434310596 /nfs/dbraw/zinc/31/05/96/434310596.db2.gz SKDLFSLLHZDAOU-UHFFFAOYSA-N 2 0 318.461 3.288 20 10 DGCDRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000295828958 434439464 /nfs/dbraw/zinc/43/94/64/434439464.db2.gz DUXTXSUYVVCXKO-WBVHZDCISA-N 2 0 302.462 3.481 20 10 DGCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cc(Cl)ccc3O)C2)CC1 ZINC000367687393 434554709 /nfs/dbraw/zinc/55/47/09/434554709.db2.gz NBMQULYEDZCNLH-CQSZACIVSA-N 2 0 308.853 3.209 20 10 DGCDRP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3O)C2)CC1 ZINC000179564221 528254074 /nfs/dbraw/zinc/25/40/74/528254074.db2.gz TZFCJAODVGYNAK-QGZVFWFLSA-N 2 0 302.462 3.336 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1F ZINC000740004808 574917828 /nfs/dbraw/zinc/91/78/28/574917828.db2.gz WRUKIZKUDDLTKO-QGZVFWFLSA-N 2 0 321.484 3.492 20 10 DGCDRP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1C ZINC000853093984 620667910 /nfs/dbraw/zinc/66/79/10/620667910.db2.gz VTIVCRUMGUTVQJ-GOSISDBHSA-N 2 0 302.462 3.215 20 10 DGCDRP Cc1cc(O)c(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1C ZINC000853093059 620667466 /nfs/dbraw/zinc/66/74/66/620667466.db2.gz AONGTRMGSCMCSO-QGZVFWFLSA-N 2 0 302.462 3.221 20 10 DGCDRP Cc1cc(O)c(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1C ZINC000853093058 620667517 /nfs/dbraw/zinc/66/75/17/620667517.db2.gz AONGTRMGSCMCSO-KRWDZBQOSA-N 2 0 302.462 3.221 20 10 DGCDRP C[NH+]1CCC(C[N@H+](Cc2ccco2)Cc2ccccc2O)CC1 ZINC000891393146 617790946 /nfs/dbraw/zinc/79/09/46/617790946.db2.gz AAXIHCZAFWFUHQ-UHFFFAOYSA-N 2 0 314.429 3.329 20 10 DGCDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000854230475 620786557 /nfs/dbraw/zinc/78/65/57/620786557.db2.gz RCDPHFFDPAVBGR-GXFFZTMASA-N 2 0 315.255 3.179 20 10 DGCDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000854230476 620786664 /nfs/dbraw/zinc/78/66/64/620786664.db2.gz RCDPHFFDPAVBGR-ZWNOBZJWSA-N 2 0 315.255 3.179 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N(C)C)cc2C)[C@@H](C)C1 ZINC000840917996 618529917 /nfs/dbraw/zinc/52/99/17/618529917.db2.gz XTOUBNMTDXREJJ-LPHOPBHVSA-N 2 0 303.494 3.223 20 10 DGCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c1O ZINC000925776484 618616148 /nfs/dbraw/zinc/61/61/48/618616148.db2.gz KRXCGBZOZSSTRF-QWRGUYRKSA-N 2 0 318.795 3.249 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCC2CC[NH+](C(C)C)CC2)c1O ZINC000895447591 618785863 /nfs/dbraw/zinc/78/58/63/618785863.db2.gz YQRUANXEASLWLB-UHFFFAOYSA-N 2 0 320.477 3.309 20 10 DGCDRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(N2CCCCCC2)cc1 ZINC000902486502 619645836 /nfs/dbraw/zinc/64/58/36/619645836.db2.gz ADNPHPWAFOJJPG-BQFCYCMXSA-N 2 0 301.478 3.455 20 10 DGCDRP Cc1ccc(O)c(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000904473428 619924922 /nfs/dbraw/zinc/92/49/22/619924922.db2.gz ISSWHBAVPVDONK-FXAWDEMLSA-N 2 0 324.424 3.046 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)cc1F ZINC000841100816 620450647 /nfs/dbraw/zinc/45/06/47/620450647.db2.gz KXAPIIJVYUAAKJ-GDBMZVCRSA-N 2 0 307.457 3.089 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCCC34CC4)cc2)CC1 ZINC000858332926 621176948 /nfs/dbraw/zinc/17/69/48/621176948.db2.gz RLRYJJSFSKODNU-SFHVURJKSA-N 2 0 313.489 3.108 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)ccc1N(C)C ZINC000923365136 621178913 /nfs/dbraw/zinc/17/89/13/621178913.db2.gz UALFGMBVYOKIOP-IEBWSBKVSA-N 2 0 301.478 3.025 20 10 DGCDRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000863651835 621693851 /nfs/dbraw/zinc/69/38/51/621693851.db2.gz NFZREWSRNOWHAW-BGYRXZFFSA-N 2 0 313.489 3.108 20 10 DGCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000768466747 622458753 /nfs/dbraw/zinc/45/87/53/622458753.db2.gz WAGCSHAJXUTMCU-MRXNPFEDSA-N 2 0 316.489 3.435 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000770350974 622624010 /nfs/dbraw/zinc/62/40/10/622624010.db2.gz HJPYXURMEHTWAI-UYAOXDASSA-N 2 0 315.505 3.449 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC(F)(F)C3)cc2)CC1 ZINC000771848935 622803416 /nfs/dbraw/zinc/80/34/16/622803416.db2.gz VLTKWUXTDOTDPC-MRXNPFEDSA-N 2 0 323.431 3.106 20 10 DGCDRP c1cc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)cc2c1OCC2 ZINC000873232980 623085820 /nfs/dbraw/zinc/08/58/20/623085820.db2.gz UZHYLXRCPSNOTQ-SFHVURJKSA-N 2 0 300.446 3.024 20 10 DGCDRP CC[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775638592 623300851 /nfs/dbraw/zinc/30/08/51/623300851.db2.gz LQZAGPVOCIVGMN-SFHVURJKSA-N 2 0 301.478 3.203 20 10 DGCDRP C[C@@H]1CC[C@@H](C)[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775702751 623316148 /nfs/dbraw/zinc/31/61/48/623316148.db2.gz WLTHQWKBLWLTPL-IAGOWNOFSA-N 2 0 301.478 3.059 20 10 DGCDRP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(O)c1 ZINC000877190148 623822552 /nfs/dbraw/zinc/82/25/52/623822552.db2.gz XIOSAQSYPRZERD-NVXWUHKLSA-N 2 0 302.462 3.443 20 10 DGCDRP COc1ccc(O)c(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC000809738626 626944491 /nfs/dbraw/zinc/94/44/91/626944491.db2.gz CERHPGQFWUAOAH-UHFFFAOYSA-N 2 0 314.429 3.094 20 10 DGCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815054716 627619941 /nfs/dbraw/zinc/61/99/41/627619941.db2.gz KXBDHFSLDUXVSK-SFHVURJKSA-N 2 0 303.494 3.225 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N(C)C)c(C)c2)C[C@@H]1C ZINC000815057649 627620097 /nfs/dbraw/zinc/62/00/97/627620097.db2.gz WHZDQAACGPYWBQ-WMZOPIPTSA-N 2 0 303.494 3.366 20 10 DGCDRP CC1(C)[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925543641 627751117 /nfs/dbraw/zinc/75/11/17/627751117.db2.gz NIZYANAQFZRDRI-QYZOEREBSA-N 2 0 313.489 3.153 20 10 DGCDRP [NH3+]C[C@@]1(c2ccccc2)C[C@H]([NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000925880784 627811046 /nfs/dbraw/zinc/81/10/46/627811046.db2.gz BHVJEDZVAPWISH-ABSDTBQOSA-N 2 0 308.425 3.028 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000817897833 627955455 /nfs/dbraw/zinc/95/54/55/627955455.db2.gz CCMLFNBVIGKVIZ-HSALFYBXSA-N 2 0 313.489 3.297 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)ccc21 ZINC000817901768 627957237 /nfs/dbraw/zinc/95/72/37/627957237.db2.gz YHSDSKCOXUXYOW-GUDVDZBRSA-N 2 0 313.489 3.079 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817945614 627970989 /nfs/dbraw/zinc/97/09/89/627970989.db2.gz HVFSSQNUBLUIQB-HOTGVXAUSA-N 2 0 319.468 3.466 20 10 DGCDRP CC[C@@H]([NH2+]CC1([NH3+])CCC1)c1cc(Br)ccc1O ZINC000817965515 627977443 /nfs/dbraw/zinc/97/74/43/627977443.db2.gz WJIRDBULUMACHD-GFCCVEGCSA-N 2 0 313.239 3.077 20 10 DGCDRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccc(Br)cc1O ZINC000817970429 627978437 /nfs/dbraw/zinc/97/84/37/627978437.db2.gz VDZGTFXEUCMYKY-WCQGTBRESA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cc2c(cc1O)CCCC2 ZINC000817977046 627981610 /nfs/dbraw/zinc/98/16/10/627981610.db2.gz ZRSVSBLIYSGKIP-FZKQIMNGSA-N 2 0 300.446 3.064 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CCC(C)([NH+]3CCC3)CC2)c1 ZINC000927038833 628001866 /nfs/dbraw/zinc/00/18/66/628001866.db2.gz RASPWOQFKWYHBR-XVTSOASTSA-N 2 0 318.461 3.458 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)cc1 ZINC000818431415 628022486 /nfs/dbraw/zinc/02/24/86/628022486.db2.gz LPTINVMIAXSUEB-KRWDZBQOSA-N 2 0 315.505 3.497 20 10 DGCDRP CCCN(Cc1ccnn1-c1cc[nH+]cc1)c1ccc(C[NH3+])cc1 ZINC000825710396 628788775 /nfs/dbraw/zinc/78/87/75/628788775.db2.gz OAQDWUFHOVUQOV-UHFFFAOYSA-N 2 0 321.428 3.143 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc1Cl ZINC000825935506 628811655 /nfs/dbraw/zinc/81/16/55/628811655.db2.gz WIDBZDOGJUHZRH-BBRMVZONSA-N 2 0 308.853 3.270 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000835035051 629830678 /nfs/dbraw/zinc/83/06/78/629830678.db2.gz DKGVSSVDPZQVLO-SOFGYWHQSA-N 2 0 301.478 3.231 20 10 DGCDRP CN(C)c1ccc(/C=C/CN2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000835049258 629835329 /nfs/dbraw/zinc/83/53/29/629835329.db2.gz PIUQKFIJCGGTAM-SUQGKYDKSA-N 2 0 301.478 3.182 20 10 DGCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835052289 629837197 /nfs/dbraw/zinc/83/71/97/629837197.db2.gz BZSDSOCFRKMSGC-DUMMIQTOSA-N 2 0 301.478 3.086 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000840894433 630373849 /nfs/dbraw/zinc/37/38/49/630373849.db2.gz RLOWDUFFPRRYIV-SJORKVTESA-N 2 0 317.521 3.312 20 10 DGCDRP Cc1cc(O)c(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(Cl)c1 ZINC000840906582 630375911 /nfs/dbraw/zinc/37/59/11/630375911.db2.gz WJMOVNMZMOAZLP-AGUYFDCRSA-N 2 0 308.853 3.459 20 10 DGCDRP C[C@H]1C[C@H](C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)CC[NH2+]1 ZINC000841004172 630394121 /nfs/dbraw/zinc/39/41/21/630394121.db2.gz BNODEOJMHACPAJ-DOTOQJQBSA-N 2 0 301.478 3.105 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1O ZINC000841028923 630398333 /nfs/dbraw/zinc/39/83/33/630398333.db2.gz IHZAQFPGPXNCFO-LLVKDONJSA-N 2 0 320.820 3.364 20 10 DGCDRP C[C@@H]([NH3+])c1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000841027989 630398438 /nfs/dbraw/zinc/39/84/38/630398438.db2.gz ISABAZAEKOTAHX-MRXNPFEDSA-N 2 0 324.472 3.070 20 10 DGCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(CC[NH3+])cc2)c(Cl)c1 ZINC000841034138 630399387 /nfs/dbraw/zinc/39/93/87/630399387.db2.gz WEAQUWGANONLSP-UHFFFAOYSA-N 2 0 304.821 3.145 20 10 DGCDRP CCCN(CCC)c1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000841035496 630399973 /nfs/dbraw/zinc/39/99/73/630399973.db2.gz HJYQXRJRICGUAF-SFHVURJKSA-N 2 0 303.494 3.402 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1C[NH3+] ZINC000841100273 630407904 /nfs/dbraw/zinc/40/79/04/630407904.db2.gz AQYPQJARHGPTTP-FUHWJXTLSA-N 2 0 301.478 3.094 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000843046398 630608495 /nfs/dbraw/zinc/60/84/95/630608495.db2.gz UGACMGPWIRZCTQ-FQEVSTJZSA-N 2 0 315.505 3.497 20 10 DGCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126107 630616324 /nfs/dbraw/zinc/61/63/24/630616324.db2.gz GOBXQBFZQUKBRU-KBPBESRZSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c(Cl)c1 ZINC000843125076 630616408 /nfs/dbraw/zinc/61/64/08/630616408.db2.gz MZGDMNLHJRNFMB-KBPBESRZSA-N 2 0 308.853 3.176 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c(Cl)c1 ZINC000843125077 630616471 /nfs/dbraw/zinc/61/64/71/630616471.db2.gz MZGDMNLHJRNFMB-KGLIPLIRSA-N 2 0 308.853 3.176 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c(Cl)c1 ZINC000843125078 630616661 /nfs/dbraw/zinc/61/66/61/630616661.db2.gz MZGDMNLHJRNFMB-UONOGXRCSA-N 2 0 308.853 3.176 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cc1C ZINC000843128285 630617228 /nfs/dbraw/zinc/61/72/28/630617228.db2.gz VQNBZNBQIBCDCR-SJORKVTESA-N 2 0 302.462 3.221 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)c(O)c1C ZINC000844925197 630988244 /nfs/dbraw/zinc/98/82/44/630988244.db2.gz RXAOULGNOHPXFS-ZDUSSCGKSA-N 2 0 302.393 3.458 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)c1O ZINC000846172166 631213559 /nfs/dbraw/zinc/21/35/59/631213559.db2.gz XBGKFHOOQDJYTC-HNNXBMFYSA-N 2 0 306.450 3.318 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)cc1C ZINC000849350311 631900224 /nfs/dbraw/zinc/90/02/24/631900224.db2.gz NNUCFCBFAPXJQN-KRWDZBQOSA-N 2 0 302.462 3.221 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)cc1C ZINC000849350313 631900320 /nfs/dbraw/zinc/90/03/20/631900320.db2.gz NNUCFCBFAPXJQN-QGZVFWFLSA-N 2 0 302.462 3.221 20 10 DGCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000849350835 631901457 /nfs/dbraw/zinc/90/14/57/631901457.db2.gz YAUWGDOERRGRPQ-AWEZNQCLSA-N 2 0 308.853 3.257 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c(O)c1 ZINC000849350797 631901575 /nfs/dbraw/zinc/90/15/75/631901575.db2.gz WSLJPAUVTOGLCP-MRXNPFEDSA-N 2 0 318.461 3.003 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000185471884 660224730 /nfs/dbraw/zinc/22/47/30/660224730.db2.gz KFZVRNIXLPBTBC-GUYCJALGSA-N 2 0 308.466 3.418 20 10 DGCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc4c(cc3O)CCCC4)CC[C@@H]21 ZINC000160434403 655632566 /nfs/dbraw/zinc/63/25/66/655632566.db2.gz WSYMHDFXUPCKEP-MJGOQNOKSA-N 2 0 314.473 3.187 20 10 DGCDRP CC[C@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157714919 659093759 /nfs/dbraw/zinc/09/37/59/659093759.db2.gz XFGLFFUEDXRNIC-HKUYNNGSSA-N 2 0 301.478 3.278 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000179569329 659932982 /nfs/dbraw/zinc/93/29/82/659932982.db2.gz ZYSXGRYISJEKCD-QGZVFWFLSA-N 2 0 302.462 3.480 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000378951312 685146232 /nfs/dbraw/zinc/14/62/32/685146232.db2.gz HTXCXOPWJQOVRI-PKOBYXMFSA-N 2 0 301.478 3.249 20 10 DGCDRP Cc1ccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(O)c1 ZINC001579696725 1191987658 /nfs/dbraw/zinc/98/76/58/1191987658.db2.gz BPVYAXKWNSFKGK-PXNSSMCTSA-N 2 0 324.424 3.046 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@H]2C1 ZINC001333893537 1178691585 /nfs/dbraw/zinc/69/15/85/1178691585.db2.gz YXQHTUTXEIEHOA-CMKODMSKSA-N 2 0 315.505 3.223 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)cc1C ZINC001335238716 1178877636 /nfs/dbraw/zinc/87/76/36/1178877636.db2.gz TZPTXAZMEZYFCB-JZXOWHBKSA-N 2 0 302.462 3.171 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3cc(Cl)ccc3O)C[C@H]2C1 ZINC001352114254 1180298550 /nfs/dbraw/zinc/29/85/50/1180298550.db2.gz ZKNRPPKWHDEAAS-XJKCOSOUSA-N 2 0 308.853 3.208 20 10 DGCDRP Cc1ccccc1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001461287314 1182792670 /nfs/dbraw/zinc/79/26/70/1182792670.db2.gz UCGVCALBEJFTTL-UHFFFAOYSA-N 2 0 323.484 3.079 20 10 DGCDRP CCC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCC1 ZINC001655917953 1195977404 /nfs/dbraw/zinc/97/74/04/1195977404.db2.gz SCZGAWFTYBWHGJ-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP Cc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1C ZINC001657888364 1196190560 /nfs/dbraw/zinc/19/05/60/1196190560.db2.gz IPJXAWNHXXJYEM-UHFFFAOYSA-N 2 0 323.484 3.345 20 10 DGCDRP Cc1ccc(C)c(NCc2ccc(N3CC[NH+](C)CC3)cc2)[nH+]1 ZINC001167426767 1082097484 /nfs/dbraw/zinc/09/74/84/1082097484.db2.gz LEBMZOVMEHCNRK-UHFFFAOYSA-N 2 0 310.445 3.062 20 10 DGCDRP CCCSC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001183532116 1083972290 /nfs/dbraw/zinc/97/22/90/1083972290.db2.gz AKZHFUQGSZICKR-INIZCTEOSA-N 2 0 321.534 3.060 20 10 DGCDRP Oc1ccc(F)c(Cl)c1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204742050 1085889891 /nfs/dbraw/zinc/88/98/91/1085889891.db2.gz GTRRDHFUVJGEGV-UHFFFAOYSA-N 2 0 312.816 3.150 20 10 DGCDRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(C(C)(C)C)ccc1O ZINC001276445500 1090911552 /nfs/dbraw/zinc/91/15/52/1090911552.db2.gz NRYMVUOMESPWPY-ALOPSCKCSA-N 2 0 302.462 3.405 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CC3(C2)CC[NH+](C)CC3)c2ccccc21 ZINC001204239705 1090931710 /nfs/dbraw/zinc/93/17/10/1090931710.db2.gz DDBRJYNHRTZZBA-UHFFFAOYSA-N 2 0 323.484 3.433 20 10 DGCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3ccc(N(C)C)c4ccccc34)C[C@H]2C1 ZINC001204241016 1090932530 /nfs/dbraw/zinc/93/25/30/1090932530.db2.gz RIBSYOHEFXLEPW-QZTJIDSGSA-N 2 0 323.484 3.289 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCCC4(CC[NH2+]CC4)C3)ccc21 ZINC001204735342 1091025892 /nfs/dbraw/zinc/02/58/92/1091025892.db2.gz PSLPFPAMAUNGNN-UHFFFAOYSA-N 2 0 313.489 3.035 20 10 DGCDRP CC[NH+]1C[C@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]2C1 ZINC001138222301 1091120403 /nfs/dbraw/zinc/12/04/03/1091120403.db2.gz QVFWLKSLYOESHH-OALUTQOASA-N 2 0 313.489 3.060 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)CC[C@H]1C[NH3+] ZINC001205626297 1091286265 /nfs/dbraw/zinc/28/62/65/1091286265.db2.gz FNAUXLQFRZFSPD-KGLIPLIRSA-N 2 0 309.885 3.213 20 10 DGCDRP C[C@@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001205904945 1091403307 /nfs/dbraw/zinc/40/33/07/1091403307.db2.gz YUAFNBPIKTXGIK-CVEARBPZSA-N 2 0 311.473 3.465 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2Cl)CCC[C@H]1C[NH3+] ZINC001206005646 1091445932 /nfs/dbraw/zinc/44/59/32/1091445932.db2.gz YXXUAPOUWMTZLR-KBPBESRZSA-N 2 0 309.885 3.213 20 10 DGCDRP C[C@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCC[C@H]1C[NH3+] ZINC001206022802 1091455773 /nfs/dbraw/zinc/45/57/73/1091455773.db2.gz CUVSZEXGRMWJPI-GJZGRUSLSA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCC[C@@H]1C[NH3+] ZINC001206022803 1091455945 /nfs/dbraw/zinc/45/59/45/1091455945.db2.gz CUVSZEXGRMWJPI-HUUCEWRRSA-N 2 0 304.478 3.497 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@H](C)[C@@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139255242 1091501990 /nfs/dbraw/zinc/50/19/90/1091501990.db2.gz OMRLRZZXBLQKBE-CABCVRRESA-N 2 0 320.477 3.330 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3CC(c4ccccc4)C3)cc2)CC1 ZINC001139412833 1091550956 /nfs/dbraw/zinc/55/09/56/1091550956.db2.gz PISFDHZXLFYMHA-UHFFFAOYSA-N 2 0 321.468 3.038 20 10 DGCDRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001206305247 1091570984 /nfs/dbraw/zinc/57/09/84/1091570984.db2.gz XDOKYUMUVOTWES-IBGZPJMESA-N 2 0 301.478 3.238 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)cc1 ZINC001206541907 1091662098 /nfs/dbraw/zinc/66/20/98/1091662098.db2.gz NELFTDXUFAWRDT-IBGZPJMESA-N 2 0 303.494 3.484 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)c(O)c1 ZINC001206554153 1091667667 /nfs/dbraw/zinc/66/76/67/1091667667.db2.gz BDWMPMSSGCPJKV-IBGZPJMESA-N 2 0 319.493 3.189 20 10 DGCDRP CC(C)[N@H+](Cc1ccc2c(c1)CCCN2C)[C@@H]1CCC[NH2+]CC1 ZINC001206591592 1091681324 /nfs/dbraw/zinc/68/13/24/1091681324.db2.gz TWAOLKNSVUFVAN-LJQANCHMSA-N 2 0 315.505 3.422 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(C[NH3+])(c3ccccc3)CC2)cc1 ZINC001206749256 1091722807 /nfs/dbraw/zinc/72/28/07/1091722807.db2.gz AXOZBBXXBRVVKA-UHFFFAOYSA-N 2 0 323.484 3.245 20 10 DGCDRP C[C@@H]1CC[C@H](C[NH3+])CN1Cc1c(O)ccc(Cl)c1Cl ZINC001206810557 1091749448 /nfs/dbraw/zinc/74/94/48/1091749448.db2.gz NYFFQMSYQRGLKF-NXEZZACHSA-N 2 0 303.233 3.258 20 10 DGCDRP C[NH+]1CCC(C2CC[NH+](Cc3cc(F)ccc3O)CC2)CC1 ZINC001140055344 1091751925 /nfs/dbraw/zinc/75/19/25/1091751925.db2.gz SJBJJFDRBSKQBU-UHFFFAOYSA-N 2 0 306.425 3.085 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4CCC[C@@H]4C3)cc2)CC1 ZINC001140301093 1091818088 /nfs/dbraw/zinc/81/80/88/1091818088.db2.gz YTCJXPNOXHUSGZ-KDURUIRLSA-N 2 0 313.489 3.060 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(C)(F)CC3)cc2)CC1 ZINC001140302022 1091818418 /nfs/dbraw/zinc/81/84/18/1091818418.db2.gz HPSBPFBLRATTEM-UHFFFAOYSA-N 2 0 319.468 3.153 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)CC1 ZINC001140300426 1091818735 /nfs/dbraw/zinc/81/87/35/1091818735.db2.gz PHYVSRWKQBYTGH-KRWDZBQOSA-N 2 0 301.478 3.203 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@](C)(CF)C3)cc2)CC1 ZINC001140302645 1091819752 /nfs/dbraw/zinc/81/97/52/1091819752.db2.gz WTELZVKYNLLVMM-IBGZPJMESA-N 2 0 319.468 3.010 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)CC(C)(C)C)cc2)CC1 ZINC001140304740 1091820628 /nfs/dbraw/zinc/82/06/28/1091820628.db2.gz ZWRRQMFUVLKCDE-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CCC[C@@]3(CCC[NH+](C)C3)C2)c(O)c1 ZINC001276806130 1094992850 /nfs/dbraw/zinc/99/28/50/1094992850.db2.gz HFDBVPVOCJCUMA-LJQANCHMSA-N 2 0 318.461 3.017 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000314767420 1095066301 /nfs/dbraw/zinc/06/63/01/1095066301.db2.gz WHKOEUFBJFFAMA-IJEWVQPXSA-N 2 0 300.446 3.323 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC[N@@H+]1C ZINC000316426120 1095173048 /nfs/dbraw/zinc/17/30/48/1095173048.db2.gz BETZFULSCWCIOO-FUHWJXTLSA-N 2 0 301.478 3.249 20 10 DGCDRP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3cc(C(C)(C)C)ccc3O)C2)C1 ZINC001233286920 1098275959 /nfs/dbraw/zinc/27/59/59/1098275959.db2.gz OPCLHGTXPWULAV-LJQANCHMSA-N 2 0 302.462 3.217 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc1Cl ZINC001235041191 1098769160 /nfs/dbraw/zinc/76/91/60/1098769160.db2.gz YASNYIAPXWMDPF-KRWDZBQOSA-N 2 0 308.853 3.462 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c1O ZINC001235041006 1098770032 /nfs/dbraw/zinc/77/00/32/1098770032.db2.gz WCGUKSWZWDZREK-QGZVFWFLSA-N 2 0 308.853 3.462 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c(O)c1 ZINC001235157023 1098844179 /nfs/dbraw/zinc/84/41/79/1098844179.db2.gz PXGHGSDBIMKSGT-SFHVURJKSA-N 2 0 318.461 3.063 20 10 DGCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c1 ZINC001235380386 1098987881 /nfs/dbraw/zinc/98/78/81/1098987881.db2.gz ONTGTXJLVHKCSG-CTNGQTDRSA-N 2 0 322.452 3.280 20 10 DGCDRP Nc1ccc(C[N@@H+]2CC[C@@]3(c4ccccc4)CC[NH2+]C[C@@H]3C2)cc1 ZINC001235385201 1098989432 /nfs/dbraw/zinc/98/94/32/1098989432.db2.gz UCNPIMPMHKQSPA-TZIWHRDSSA-N 2 0 321.468 3.022 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@H]2CCCC[C@H]21 ZINC001235868923 1099227950 /nfs/dbraw/zinc/22/79/50/1099227950.db2.gz WRFXXROJOIWPCC-UYAOXDASSA-N 2 0 313.489 3.251 20 10 DGCDRP Cc1cccc(C[N@@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)c1O ZINC001235974579 1099304188 /nfs/dbraw/zinc/30/41/88/1099304188.db2.gz RRUQXQJRPFMCHO-UHFFFAOYSA-N 2 0 322.452 3.338 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@H+](C)[C@@H]3CCCC[C@@H]3[NH3+])c2c1 ZINC001236215810 1099472421 /nfs/dbraw/zinc/47/24/21/1099472421.db2.gz IKEPUHHERFETQG-ZWKOTPCHSA-N 2 0 314.429 3.256 20 10 DGCDRP Cc1ccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c(O)c1 ZINC001236377251 1099565039 /nfs/dbraw/zinc/56/50/39/1099565039.db2.gz ZZMZRTOJQNCFIJ-MRXNPFEDSA-N 2 0 302.462 3.445 20 10 DGCDRP CCOc1ccc(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c(O)c1 ZINC001236459558 1099623430 /nfs/dbraw/zinc/62/34/30/1099623430.db2.gz UYQXCSLAOWHQTJ-UHFFFAOYSA-N 2 0 320.477 3.391 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c2ccccc21 ZINC001236817508 1099805953 /nfs/dbraw/zinc/80/59/53/1099805953.db2.gz CCFCBWGYYRBTCI-ZYSHUDEJSA-N 2 0 309.457 3.075 20 10 DGCDRP COc1ccc(O)c(C[NH+]2CCC(CC3CC[NH2+]CC3)CC2)c1 ZINC001236949694 1099888900 /nfs/dbraw/zinc/88/89/00/1099888900.db2.gz XQMAQFKPSCXZKF-UHFFFAOYSA-N 2 0 318.461 3.003 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC001237386758 1100103302 /nfs/dbraw/zinc/10/33/02/1100103302.db2.gz AFZKSIAWZYIISU-QUCCMNQESA-N 2 0 313.489 3.251 20 10 DGCDRP C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001199227746 1102087434 /nfs/dbraw/zinc/08/74/34/1102087434.db2.gz LBCQBZUXRMSAQE-AEFFLSMTSA-N 2 0 301.478 3.107 20 10 DGCDRP CC1(C)CCC[C@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001246174459 1104420850 /nfs/dbraw/zinc/42/08/50/1104420850.db2.gz QJCOZFJWAJWOEG-KRWDZBQOSA-N 2 0 301.478 3.155 20 10 DGCDRP CCC1CCC([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001246174465 1104421212 /nfs/dbraw/zinc/42/12/12/1104421212.db2.gz QOTBJBWWGSMOBB-UHFFFAOYSA-N 2 0 301.478 3.155 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@@]3(CCC[NH+](C)C3)C2)c1O ZINC001275271760 1104697722 /nfs/dbraw/zinc/69/77/22/1104697722.db2.gz XSNFIOUOKGVSPE-LJQANCHMSA-N 2 0 318.461 3.099 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC001320876918 1107172020 /nfs/dbraw/zinc/17/20/20/1107172020.db2.gz UAFNTGMATNLLCN-LPHOPBHVSA-N 2 0 303.494 3.305 20 10 DGCDRP CC[C@H]([NH2+]CC[C@H](C)[NH2+]C)c1cc(Br)ccc1O ZINC001261424270 1107427238 /nfs/dbraw/zinc/42/72/38/1107427238.db2.gz QIVAIWKJANNZLA-GWCFXTLKSA-N 2 0 315.255 3.193 20 10 DGCDRP CC(C)[C@H]1CC[N@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001323332312 1107938559 /nfs/dbraw/zinc/93/85/59/1107938559.db2.gz YEJGNLAYCHLJSB-KRWDZBQOSA-N 2 0 319.468 3.055 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000093683332 431916845 /nfs/dbraw/zinc/91/68/45/431916845.db2.gz ZUBSSYLRSLPKBH-GOSISDBHSA-N 2 0 301.478 3.060 20 10 DGCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccccc2O)[C@H](C)C1 ZINC000183515041 432298940 /nfs/dbraw/zinc/29/89/40/432298940.db2.gz KVLBRBOPCKJWIC-RYRKJORJSA-N 2 0 320.477 3.180 20 10 DGCDRP Cc1cccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000192927281 432429914 /nfs/dbraw/zinc/42/99/14/432429914.db2.gz QPWZGIRNNVAHEI-SFHVURJKSA-N 2 0 310.441 3.312 20 10 DGCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000185206424 432477618 /nfs/dbraw/zinc/47/76/18/432477618.db2.gz NBPPNTJKIWOKNP-IXDOHACOSA-N 2 0 320.477 3.241 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)c1 ZINC000186545745 432605362 /nfs/dbraw/zinc/60/53/62/432605362.db2.gz ZACDAZUGMJXWDO-LSDHHAIUSA-N 2 0 306.450 3.316 20 10 DGCDRP Cc1nccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000178698574 432768731 /nfs/dbraw/zinc/76/87/31/432768731.db2.gz LPAXRYYTNDUZHG-GJZGRUSLSA-N 2 0 300.450 3.244 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(-n3ccnc3)nc2)c(O)c1C ZINC000363862771 434169709 /nfs/dbraw/zinc/16/97/09/434169709.db2.gz ZCTUTRCVNIHOTP-HNNXBMFYSA-N 2 0 322.412 3.441 20 10 DGCDRP CC1CC[NH+](CCCC[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000295792564 434436387 /nfs/dbraw/zinc/43/63/87/434436387.db2.gz BRFLOBPIQCZSBS-QGZVFWFLSA-N 2 0 302.462 3.481 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC23CC[NH+](C)CC3)c1O ZINC000368948954 434584840 /nfs/dbraw/zinc/58/48/40/434584840.db2.gz FXTATXUBLGVNJQ-UHFFFAOYSA-N 2 0 324.852 3.114 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000370675773 434618705 /nfs/dbraw/zinc/61/87/05/434618705.db2.gz FBZQVDYKSJHZAK-KVSKMBFKSA-N 2 0 301.478 3.420 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000527528532 435012789 /nfs/dbraw/zinc/01/27/89/435012789.db2.gz YBYQSAZMKRRVJX-UHFFFAOYSA-N 2 0 311.473 3.451 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)c1 ZINC000185358133 534204748 /nfs/dbraw/zinc/20/47/48/534204748.db2.gz VRNFCQFVBSHSEP-GJZGRUSLSA-N 2 0 306.450 3.172 20 10 DGCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(OC)ccc2O)CC1 ZINC000179685208 528339595 /nfs/dbraw/zinc/33/95/95/528339595.db2.gz RYGLLKSNJUJXTG-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(F)cc(C(C)=O)c2O)C[C@H]1C ZINC000750827077 575754073 /nfs/dbraw/zinc/75/40/73/575754073.db2.gz VJTVNYCWBRCLNJ-MLGOLLRUSA-N 2 0 322.424 3.039 20 10 DGCDRP CCOc1cccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000853093189 620667481 /nfs/dbraw/zinc/66/74/81/620667481.db2.gz DMTUNGDMHHJGOZ-MRXNPFEDSA-N 2 0 318.461 3.003 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853239391 620681051 /nfs/dbraw/zinc/68/10/51/620681051.db2.gz GODGBDYLXRZOSR-GOEBONIOSA-N 2 0 318.461 3.173 20 10 DGCDRP CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)CC1CC[NH+](C)CC1 ZINC000891631091 617857752 /nfs/dbraw/zinc/85/77/52/617857752.db2.gz MRUDLQJTULQKSH-UHFFFAOYSA-N 2 0 303.494 3.305 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N(C)C)cc2C)[C@H](C)C1 ZINC000840917994 618529755 /nfs/dbraw/zinc/52/97/55/618529755.db2.gz XTOUBNMTDXREJJ-APWZRJJASA-N 2 0 303.494 3.223 20 10 DGCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c1O ZINC000925776481 618616065 /nfs/dbraw/zinc/61/60/65/618616065.db2.gz KRXCGBZOZSSTRF-GHMZBOCLSA-N 2 0 318.795 3.249 20 10 DGCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c1O ZINC000925776485 618616141 /nfs/dbraw/zinc/61/61/41/618616141.db2.gz KRXCGBZOZSSTRF-WDEREUQCSA-N 2 0 318.795 3.249 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)cc1 ZINC000925779996 618617761 /nfs/dbraw/zinc/61/77/61/618617761.db2.gz DDGXGXMXQBJNHJ-DZGCQCFKSA-N 2 0 311.420 3.038 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(N2CCCCC2)cc1 ZINC000925876532 618650723 /nfs/dbraw/zinc/65/07/23/618650723.db2.gz AQFDVHIAQUHGKE-JZXOWHBKSA-N 2 0 301.478 3.455 20 10 DGCDRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(N2CCCCCC2)cc1 ZINC000902486504 619645802 /nfs/dbraw/zinc/64/58/02/619645802.db2.gz ADNPHPWAFOJJPG-JFIYKMOQSA-N 2 0 301.478 3.455 20 10 DGCDRP Cc1cc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)ccc1N(C)C ZINC000923364796 621178901 /nfs/dbraw/zinc/17/89/01/621178901.db2.gz OQVSYNQNZCPFHP-GOSISDBHSA-N 2 0 301.478 3.025 20 10 DGCDRP COc1cc(C)cc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1O ZINC000754742759 621530076 /nfs/dbraw/zinc/53/00/76/621530076.db2.gz ZHOVTYWWEIRNSX-QGZVFWFLSA-N 2 0 318.461 3.160 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1 ZINC000756422726 621637408 /nfs/dbraw/zinc/63/74/08/621637408.db2.gz NLWKZURQECCJSI-JYJNAYRXSA-N 2 0 320.477 3.419 20 10 DGCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1)C1CC1 ZINC000765849728 622291139 /nfs/dbraw/zinc/29/11/39/622291139.db2.gz PEHCEDJOVGTEJW-SFHVURJKSA-N 2 0 319.468 3.246 20 10 DGCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2c(O)ccc3ccccc32)C1 ZINC000129226905 625560696 /nfs/dbraw/zinc/56/06/96/625560696.db2.gz AKRPREMIDIUEGI-APWZRJJASA-N 2 0 310.441 3.462 20 10 DGCDRP CC(C)[N@H+](CC[C@H]1CCC[NH+]1C)Cc1ccc(N(C)C)cc1 ZINC000767349426 622392198 /nfs/dbraw/zinc/39/21/98/622392198.db2.gz SZSTUBPYMQGPPZ-LJQANCHMSA-N 2 0 303.494 3.447 20 10 DGCDRP CCOc1cccc(C[NH+]2CCC(C[NH+](CC)CC)CC2)c1O ZINC000768304059 622449230 /nfs/dbraw/zinc/44/92/30/622449230.db2.gz ROEFUMRWRSNPEO-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000768301741 622449288 /nfs/dbraw/zinc/44/92/88/622449288.db2.gz KGBOXNKKLWLMSD-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c(O)cc1C ZINC000768445682 622456854 /nfs/dbraw/zinc/45/68/54/622456854.db2.gz IBNWETGDVBBHRC-QGZVFWFLSA-N 2 0 318.461 3.160 20 10 DGCDRP CCOc1cccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)c1O ZINC000769470055 622530947 /nfs/dbraw/zinc/53/09/47/622530947.db2.gz JIDRSGLZVGVYHW-ZBFHGGJFSA-N 2 0 306.450 3.096 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC000770350964 622623321 /nfs/dbraw/zinc/62/33/21/622623321.db2.gz HJPYXURMEHTWAI-AZUAARDMSA-N 2 0 315.505 3.449 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H]3[C@@H](CC[NH+]3C)C2)cc1C(C)C ZINC000872725335 622960262 /nfs/dbraw/zinc/96/02/62/622960262.db2.gz RSLOWICQZYQYLT-MAUKXSAKSA-N 2 0 302.462 3.350 20 10 DGCDRP CC(C)[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000773145894 622991690 /nfs/dbraw/zinc/99/16/90/622991690.db2.gz NTVKOJVDAURQAF-KRWDZBQOSA-N 2 0 315.505 3.353 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000773752822 623067886 /nfs/dbraw/zinc/06/78/86/623067886.db2.gz KJMJYAYQJFNXDD-LJQANCHMSA-N 2 0 315.505 3.451 20 10 DGCDRP C[C@@H](c1ccco1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775650297 623305374 /nfs/dbraw/zinc/30/53/74/623305374.db2.gz YAOKGEUQKUUFNX-INIZCTEOSA-N 2 0 313.445 3.224 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(C)(C)CC3)cc2)CC1 ZINC000775678706 623312381 /nfs/dbraw/zinc/31/23/81/623312381.db2.gz INJXUUMKLWGAFM-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP CC[C@@H](C)C[N@H+](CC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775732577 623321251 /nfs/dbraw/zinc/32/12/51/623321251.db2.gz OYTNKJVBAKRNNM-QGZVFWFLSA-N 2 0 303.494 3.306 20 10 DGCDRP Cc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(O)c1 ZINC000877190149 623822617 /nfs/dbraw/zinc/82/26/17/623822617.db2.gz XIOSAQSYPRZERD-RDJZCZTQSA-N 2 0 302.462 3.443 20 10 DGCDRP CCC(CC)[N@H+](CC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809787526 626953109 /nfs/dbraw/zinc/95/31/09/626953109.db2.gz GZZZUXIIXFAGDL-UHFFFAOYSA-N 2 0 303.494 3.449 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)[C@@H]3C3CC3)cc2)CC1 ZINC000811513967 627285837 /nfs/dbraw/zinc/28/58/37/627285837.db2.gz XYSSTQNARPQMGT-IBGZPJMESA-N 2 0 313.489 3.059 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000817893620 627954756 /nfs/dbraw/zinc/95/47/56/627954756.db2.gz GHQGAXHROMKICN-VAMGGRTRSA-N 2 0 315.505 3.461 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C1CCC(C[NH3+])CC1 ZINC000817934492 627965369 /nfs/dbraw/zinc/96/53/69/627965369.db2.gz JSTUAIWNZBXGSH-HJOIGYKYSA-N 2 0 303.494 3.099 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]([NH3+])C(C)C)c1cc(Br)ccc1O ZINC000817957366 627973969 /nfs/dbraw/zinc/97/39/69/627973969.db2.gz BESQYXXRPJHMBM-STQMWFEESA-N 2 0 315.255 3.179 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]([NH3+])C(C)C)c1ccc(C(F)(F)F)cc1O ZINC000817957527 627975025 /nfs/dbraw/zinc/97/50/25/627975025.db2.gz CNMDXVMRPLRFFN-QWHCGFSZSA-N 2 0 304.356 3.435 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1cc2c(cc1O)CCCC2 ZINC000817960145 627976203 /nfs/dbraw/zinc/97/62/03/627976203.db2.gz KYZSKWOMZHTCOU-FDQGKXFDSA-N 2 0 302.462 3.439 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000817970464 627978637 /nfs/dbraw/zinc/97/86/37/627978637.db2.gz WHNOJOHECDPVTQ-DDTOSNHZSA-N 2 0 316.367 3.450 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2c1c(F)ccc2O ZINC000817984884 627983823 /nfs/dbraw/zinc/98/38/23/627983823.db2.gz BITYIFDGAIQULH-YRGRVCCFSA-N 2 0 304.409 3.344 20 10 DGCDRP Cc1cc(O)c(CN2CC[C@@H](C[NH+]3CCCC3)C2)cc1Cl ZINC000824854940 628700411 /nfs/dbraw/zinc/70/04/11/628700411.db2.gz DRIOFFQUEOJCLE-AWEZNQCLSA-N 2 0 308.853 3.272 20 10 DGCDRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835034563 629830388 /nfs/dbraw/zinc/83/03/88/629830388.db2.gz BLNSVELDHAVOJA-DUMMIQTOSA-N 2 0 301.478 3.087 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]C(C)(C)CCC[NH+](C)C)cc1 ZINC000835055525 629838893 /nfs/dbraw/zinc/83/88/93/629838893.db2.gz VLZDNKLVRQJUDB-VQHVLOKHSA-N 2 0 303.494 3.476 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000840891148 630373031 /nfs/dbraw/zinc/37/30/31/630373031.db2.gz GRAYEKYDRQMHJW-KRWDZBQOSA-N 2 0 317.521 3.454 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N(C)C)cc2C)C[C@@H]1C ZINC000840918609 630377888 /nfs/dbraw/zinc/37/78/88/630377888.db2.gz WPYZFDVNIPAARU-QFBILLFUSA-N 2 0 303.494 3.366 20 10 DGCDRP CC(C)[C@H]([NH3+])C[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000841030923 630398398 /nfs/dbraw/zinc/39/83/98/630398398.db2.gz PCUMFOAYXNHLQR-GOSISDBHSA-N 2 0 314.429 3.044 20 10 DGCDRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000841033881 630399183 /nfs/dbraw/zinc/39/91/83/630399183.db2.gz CSEZILQTKKIYCD-UZLBHIALSA-N 2 0 315.505 3.444 20 10 DGCDRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc(N)cc3)CC2)C1 ZINC000841034702 630400069 /nfs/dbraw/zinc/40/00/69/630400069.db2.gz JSPJGNAWCJJUHM-JXFKEZNVSA-N 2 0 315.505 3.444 20 10 DGCDRP CCCN(CCC)c1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000841064654 630403619 /nfs/dbraw/zinc/40/36/19/630403619.db2.gz RZOQSUQLHPACPZ-QFBILLFUSA-N 2 0 303.494 3.401 20 10 DGCDRP CCN(Cc1ccccc1)c1ccc(CN2CC[C@@H]([NH3+])C2)cc1 ZINC000843044494 630607627 /nfs/dbraw/zinc/60/76/27/630607627.db2.gz DQIFJWXOEHPRFB-LJQANCHMSA-N 2 0 309.457 3.246 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)cc1 ZINC000843057391 630609593 /nfs/dbraw/zinc/60/95/93/630609593.db2.gz CXGVBKWHQQDRJB-WDSOQIARSA-N 2 0 301.478 3.092 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c(Cl)c1 ZINC000843125079 630616300 /nfs/dbraw/zinc/61/63/00/630616300.db2.gz MZGDMNLHJRNFMB-ZIAGYGMSSA-N 2 0 308.853 3.176 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1 ZINC000843125729 630616744 /nfs/dbraw/zinc/61/67/44/630616744.db2.gz GKKMLMPQVDXSSV-MOPGFXCFSA-N 2 0 315.505 3.354 20 10 DGCDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000848562397 631694026 /nfs/dbraw/zinc/69/40/26/631694026.db2.gz JGFVUHOFWUYYOD-IZAXUBKRSA-N 2 0 301.478 3.107 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1O ZINC000848887997 631773028 /nfs/dbraw/zinc/77/30/28/631773028.db2.gz KBVDTRFPPDOHLW-INIZCTEOSA-N 2 0 302.462 3.262 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850420587 632147430 /nfs/dbraw/zinc/14/74/30/632147430.db2.gz PMZIMHJCWDUZRK-UHFFFAOYSA-N 2 0 308.853 3.257 20 10 DGCDRP CC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC1CCC1 ZINC000793351276 661025745 /nfs/dbraw/zinc/02/57/45/661025745.db2.gz FOSPVZBJKIQYHR-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC3(C)C)cc2F)CC1 ZINC000793524661 661041615 /nfs/dbraw/zinc/04/16/15/661041615.db2.gz IUZMGPFUHQAISW-SFHVURJKSA-N 2 0 319.468 3.246 20 10 DGCDRP CCC[NH+]1CCC([NH2+]Cc2ccc(N(CC)CC)cc2)CC1 ZINC000078421889 655608670 /nfs/dbraw/zinc/60/86/70/655608670.db2.gz FXORDFDXXKFHKQ-UHFFFAOYSA-N 2 0 303.494 3.497 20 10 DGCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cc3c(cc2O)CCCC3)C1 ZINC000245538313 662235531 /nfs/dbraw/zinc/23/55/31/662235531.db2.gz JUGXUYLLKPDOGL-HKUYNNGSSA-N 2 0 314.473 3.187 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000246028676 662245983 /nfs/dbraw/zinc/24/59/83/662245983.db2.gz ABJHBJQANGVAIB-QFBILLFUSA-N 2 0 303.494 3.353 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000246741064 662273691 /nfs/dbraw/zinc/27/36/91/662273691.db2.gz OFYVKLGKVSSKBW-LPHOPBHVSA-N 2 0 314.473 3.458 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC)C2)cc1 ZINC000093770678 662359760 /nfs/dbraw/zinc/35/97/60/662359760.db2.gz ZZBBBKFAKHSSRU-GOSISDBHSA-N 2 0 303.494 3.306 20 10 DGCDRP Oc1cccc2c1[C@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000383936770 685169249 /nfs/dbraw/zinc/16/92/49/685169249.db2.gz CYFVMAOFPWUYRU-IEBWSBKVSA-N 2 0 322.452 3.491 20 10 DGCDRP CCOCc1cc(C[NH2+]CC[C@H]2CCC[NH2+]CC2)ccc1OC ZINC001578124554 1191927142 /nfs/dbraw/zinc/92/71/42/1191927142.db2.gz GZZBSNHYPREYCC-INIZCTEOSA-N 2 0 320.477 3.101 20 10 DGCDRP Cc1ccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(O)c1 ZINC001579696727 1191987930 /nfs/dbraw/zinc/98/79/30/1191987930.db2.gz BPVYAXKWNSFKGK-YLJYHZDGSA-N 2 0 324.424 3.046 20 10 DGCDRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc(N)cc2)C1 ZINC001334753950 1178792203 /nfs/dbraw/zinc/79/22/03/1178792203.db2.gz KBWPDRMYWWFJJA-SJLPKXTDSA-N 2 0 301.478 3.355 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC001354234664 1180753650 /nfs/dbraw/zinc/75/36/50/1180753650.db2.gz ILRKIEAZHGJUQP-JHJVBQTASA-N 2 0 310.388 3.083 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC001354234661 1180753717 /nfs/dbraw/zinc/75/37/17/1180753717.db2.gz ILRKIEAZHGJUQP-FRRDWIJNSA-N 2 0 310.388 3.083 20 10 DGCDRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001473965237 1183839961 /nfs/dbraw/zinc/83/99/61/1183839961.db2.gz XRNIPOMWRLMOPT-GOSISDBHSA-N 2 0 301.478 3.108 20 10 DGCDRP CCSCC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001474025789 1183853676 /nfs/dbraw/zinc/85/36/76/1183853676.db2.gz ZVUDOBGLNXWMGX-INIZCTEOSA-N 2 0 321.534 3.060 20 10 DGCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001560291569 1189306310 /nfs/dbraw/zinc/30/63/10/1189306310.db2.gz WQJSTSOVPWNIBX-GOSISDBHSA-N 2 0 301.478 3.108 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)cc1F ZINC001560533939 1189337805 /nfs/dbraw/zinc/33/78/05/1189337805.db2.gz IVRKFKAEPMYTOT-QGZVFWFLSA-N 2 0 321.484 3.493 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCCC3(C)C)cc2)CC1 ZINC001658016318 1196202706 /nfs/dbraw/zinc/20/27/06/1196202706.db2.gz QBHWGXMKVDMUOQ-GOSISDBHSA-N 2 0 315.505 3.354 20 10 DGCDRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC001660949340 1196545476 /nfs/dbraw/zinc/54/54/76/1196545476.db2.gz MHVBTKRPMDNIPM-MRXNPFEDSA-N 2 0 321.484 3.493 20 10 DGCDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(Cl)cc1O)CC2 ZINC001140464545 1082270328 /nfs/dbraw/zinc/27/03/28/1082270328.db2.gz UJBBNCRUWKLWDP-UHFFFAOYSA-N 2 0 308.853 3.353 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2O)CCN1c1cc[nH+]cc1 ZINC001183532572 1083971793 /nfs/dbraw/zinc/97/17/93/1083971793.db2.gz DSNPVVHPPSZQJC-CYBMUJFWSA-N 2 0 317.820 3.151 20 10 DGCDRP Cc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1O ZINC001167972733 1085911768 /nfs/dbraw/zinc/91/17/68/1085911768.db2.gz AKPVXKWPMAMMPB-AYHJJNSGSA-N 2 0 300.446 3.196 20 10 DGCDRP CC[NH+]1C[C@H]2C[NH+](Cc3ccc(N(C)C)c4ccccc34)C[C@@H]2C1 ZINC001204241017 1090932280 /nfs/dbraw/zinc/93/22/80/1090932280.db2.gz RIBSYOHEFXLEPW-ROUUACIJSA-N 2 0 323.484 3.289 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCC2)cc1)CC1CC[NH+](C)CC1 ZINC001204327475 1090950721 /nfs/dbraw/zinc/95/07/21/1090950721.db2.gz VEYNRYUQBKJGAV-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205015731 1091084334 /nfs/dbraw/zinc/08/43/34/1091084334.db2.gz DPMQWUGIXKRSBV-CQSZACIVSA-N 2 0 316.445 3.008 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@](C)([NH3+])CC3)c2c1 ZINC001205289615 1091167451 /nfs/dbraw/zinc/16/74/51/1091167451.db2.gz ZQVRPNAJUBHQJG-IBGZPJMESA-N 2 0 314.429 3.257 20 10 DGCDRP Cc1c(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c2ccccc2n1C ZINC001205559444 1091253866 /nfs/dbraw/zinc/25/38/66/1091253866.db2.gz QYDFVDQENNRLPY-SFHVURJKSA-N 2 0 303.425 3.140 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c1 ZINC001205578651 1091264631 /nfs/dbraw/zinc/26/46/31/1091264631.db2.gz IDBKYAQHYYUNBQ-SFHVURJKSA-N 2 0 308.441 3.343 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)CC[C@H]1C[NH3+] ZINC001205625962 1091285883 /nfs/dbraw/zinc/28/58/83/1091285883.db2.gz DAOWPOLOGIBUBR-GJZGRUSLSA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)CC[C@H]1C[NH3+] ZINC001205637044 1091290313 /nfs/dbraw/zinc/29/03/13/1091290313.db2.gz GHHNFOVOIVFIKK-GJZGRUSLSA-N 2 0 304.478 3.497 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c(O)c1 ZINC001205788158 1091347525 /nfs/dbraw/zinc/34/75/25/1091347525.db2.gz MXMYOJCUPCDTKV-CQSZACIVSA-N 2 0 312.404 3.106 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H]2C)c(OC)c1 ZINC001205901311 1091400518 /nfs/dbraw/zinc/40/05/18/1091400518.db2.gz CMBSGPATONBLJS-CVEARBPZSA-N 2 0 319.493 3.101 20 10 DGCDRP C[C@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001205903493 1091402221 /nfs/dbraw/zinc/40/22/21/1091402221.db2.gz PQYCXAYHRRMMIU-FUHWJXTLSA-N 2 0 301.478 3.236 20 10 DGCDRP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCC[C@@H]1C ZINC001139408071 1091551937 /nfs/dbraw/zinc/55/19/37/1091551937.db2.gz JHDGNYRVFGIJKE-ROUUACIJSA-N 2 0 315.505 3.306 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)cc1 ZINC001206294052 1091565623 /nfs/dbraw/zinc/56/56/23/1091565623.db2.gz IZLQRZGPCOFVQL-IBGZPJMESA-N 2 0 303.494 3.484 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)cc1 ZINC001206541908 1091662394 /nfs/dbraw/zinc/66/23/94/1091662394.db2.gz NELFTDXUFAWRDT-LJQANCHMSA-N 2 0 303.494 3.484 20 10 DGCDRP [NH3+]C[C@H]1CCCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001206615544 1091690535 /nfs/dbraw/zinc/69/05/35/1091690535.db2.gz IAPLBNQCSXUPHV-GOSISDBHSA-N 2 0 301.478 3.238 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C[NH3+])CC[C@@H]2C)c(OC)c1 ZINC001206769777 1091733199 /nfs/dbraw/zinc/73/31/99/1091733199.db2.gz QGFPXQXBFULJOR-JKSUJKDBSA-N 2 0 319.493 3.101 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)c1O ZINC001140182081 1091793843 /nfs/dbraw/zinc/79/38/43/1091793843.db2.gz IBNUBLRONKRJBH-UHFFFAOYSA-N 2 0 320.452 3.407 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@H](C)C3)cc2)CC1 ZINC001140301933 1091818896 /nfs/dbraw/zinc/81/88/96/1091818896.db2.gz DRMRECCNMKKKSU-GOSISDBHSA-N 2 0 315.505 3.451 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@H]3CC(C)(C)C)cc2)CC1 ZINC001203048344 1091914132 /nfs/dbraw/zinc/91/41/32/1091914132.db2.gz NLVFPDZTJJNIBE-PKOBYXMFSA-N 2 0 315.505 3.353 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](CC)C2CCN(C)CC2)c(O)c1 ZINC001140855056 1092030336 /nfs/dbraw/zinc/03/03/36/1092030336.db2.gz LYDGQAFJLMFKLF-UHFFFAOYSA-N 2 0 319.493 3.155 20 10 DGCDRP CC[N@H+](CCn1ccnc1)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141078098 1092129869 /nfs/dbraw/zinc/12/98/69/1092129869.db2.gz KRODAZXJXJGKHF-UHFFFAOYSA-N 2 0 324.472 3.104 20 10 DGCDRP CC[C@]1(C)CC[N@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001337043041 1094828663 /nfs/dbraw/zinc/82/86/63/1094828663.db2.gz XERMKPDEHHRKAR-LJQANCHMSA-N 2 0 319.468 3.200 20 10 DGCDRP CCc1ccc(C[N@@H+]2CCC[C@@]3(CCC[NH+](C)C3)C2)c(O)c1 ZINC001276804887 1094975446 /nfs/dbraw/zinc/97/54/46/1094975446.db2.gz MRMILYLOKKILKA-LJQANCHMSA-N 2 0 302.462 3.262 20 10 DGCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3c(O)cc(OC)cc3Cl)(C1)CCC2 ZINC001276806018 1094987978 /nfs/dbraw/zinc/98/79/78/1094987978.db2.gz RDXSJZDRSBJCAJ-DLBZAZTESA-N 2 0 324.852 3.209 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000314767419 1095065030 /nfs/dbraw/zinc/06/50/30/1095065030.db2.gz WHKOEUFBJFFAMA-IIAWOOMASA-N 2 0 300.446 3.323 20 10 DGCDRP Cc1ccc(O)c(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222167051 1095470506 /nfs/dbraw/zinc/47/05/06/1095470506.db2.gz HFRHSLJDJDIULX-IBGZPJMESA-N 2 0 302.462 3.446 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCC[C@]34CCC[NH2+]CC4)ccc21 ZINC001222315420 1095544740 /nfs/dbraw/zinc/54/47/40/1095544740.db2.gz NMMVFKHNESJNPQ-FQEVSTJZSA-N 2 0 313.489 3.177 20 10 DGCDRP C[NH+](C)CC1CC[NH+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233286335 1098276021 /nfs/dbraw/zinc/27/60/21/1098276021.db2.gz OZSPPDRBBXTKBQ-UHFFFAOYSA-N 2 0 304.478 3.463 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC23CC[NH2+]CC3)cc1 ZINC001235101505 1098801457 /nfs/dbraw/zinc/80/14/57/1098801457.db2.gz CJTFRMSKWQOZRE-UHFFFAOYSA-N 2 0 309.457 3.422 20 10 DGCDRP Cc1cc(C[NH+]2CCC3(CC[NH2+]CC3)CC2)ccc1N(C)C ZINC001235133061 1098831471 /nfs/dbraw/zinc/83/14/71/1098831471.db2.gz OUICHYNXLCBVBA-UHFFFAOYSA-N 2 0 301.478 3.027 20 10 DGCDRP Cc1ccc(C[N@@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c(O)c1 ZINC001235250298 1098923063 /nfs/dbraw/zinc/92/30/63/1098923063.db2.gz ARTZZBBPIUDGOW-TZIWHRDSSA-N 2 0 322.452 3.422 20 10 DGCDRP Cc1cc(C[N@@H+]2CC[C@H](C3C[NH2+]C3)C2)c(C)n1-c1ccccc1 ZINC001235339397 1098962075 /nfs/dbraw/zinc/96/20/75/1098962075.db2.gz FYSXUDAKCJWXLH-KRWDZBQOSA-N 2 0 309.457 3.135 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001235358176 1098976549 /nfs/dbraw/zinc/97/65/49/1098976549.db2.gz LTDZYLDROLNFBP-TZIWHRDSSA-N 2 0 322.452 3.280 20 10 DGCDRP Nc1ccc(C[N@@H+]2CC[C@]3(c4ccccc4)CC[NH2+]C[C@H]3C2)cc1 ZINC001235385198 1098990239 /nfs/dbraw/zinc/99/02/39/1098990239.db2.gz UCNPIMPMHKQSPA-FPOVZHCZSA-N 2 0 321.468 3.022 20 10 DGCDRP C[N@@H+](Cc1cccc(-c2ccccc2)c1O)CC1CC[NH2+]CC1 ZINC001235431721 1099027591 /nfs/dbraw/zinc/02/75/91/1099027591.db2.gz BHACEQRWXDKXCM-UHFFFAOYSA-N 2 0 310.441 3.491 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)CC2CC[NH2+]CC2)c2ccccc21 ZINC001235434013 1099031286 /nfs/dbraw/zinc/03/12/86/1099031286.db2.gz WUQGWONGDTUEOK-UHFFFAOYSA-N 2 0 311.473 3.337 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001235680097 1099124556 /nfs/dbraw/zinc/12/45/56/1099124556.db2.gz HUKPELDRHUNEPI-IRXDYDNUSA-N 2 0 316.489 3.463 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC3(C[NH2+]C3)C2)c2ccccc21 ZINC001235710795 1099139962 /nfs/dbraw/zinc/13/99/62/1099139962.db2.gz FLTOCTJPMBPVPF-UHFFFAOYSA-N 2 0 309.457 3.091 20 10 DGCDRP CC(C)c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c(O)c1 ZINC001235887634 1099234533 /nfs/dbraw/zinc/23/45/33/1099234533.db2.gz HSBCERWBAXGYHP-GOSISDBHSA-N 2 0 302.462 3.480 20 10 DGCDRP C[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)C[C@H]1CCC[NH2+]C1 ZINC001235960532 1099294231 /nfs/dbraw/zinc/29/42/31/1099294231.db2.gz YVAMVPQZHTUOGB-AWEZNQCLSA-N 2 0 316.445 3.008 20 10 DGCDRP Oc1cc2c(cc1C[N@H+](Cc1ccccc1)C1CC1)C[NH2+]CCO2 ZINC001235994723 1099317278 /nfs/dbraw/zinc/31/72/78/1099317278.db2.gz VVWTVQDZHVNOPE-UHFFFAOYSA-N 2 0 324.424 3.039 20 10 DGCDRP C[NH2+]C1CCC([N@H+](C)Cc2ccc(N(C)C)cc2Cl)CC1 ZINC001236213750 1099470341 /nfs/dbraw/zinc/47/03/41/1099470341.db2.gz UWXSMGDBYSHCLN-UHFFFAOYSA-N 2 0 309.885 3.368 20 10 DGCDRP Cc1ccc(O)c(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236375391 1099562679 /nfs/dbraw/zinc/56/26/79/1099562679.db2.gz JVENNAACJIZAFK-MRXNPFEDSA-N 2 0 302.462 3.445 20 10 DGCDRP Cc1c(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c2ccccc2n1C ZINC001236599592 1099695225 /nfs/dbraw/zinc/69/52/25/1099695225.db2.gz TVGLJRBQAQLRJS-INIZCTEOSA-N 2 0 311.473 3.451 20 10 DGCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3cc4ccccc4cc3O)C[C@@H]2C1 ZINC001236838262 1099822191 /nfs/dbraw/zinc/82/21/91/1099822191.db2.gz XOYKICZOUOMNDT-KDURUIRLSA-N 2 0 310.441 3.319 20 10 DGCDRP C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236931993 1099882471 /nfs/dbraw/zinc/88/24/71/1099882471.db2.gz MXEBBTLNHHXNOD-IYBDPMFKSA-N 2 0 319.468 3.340 20 10 DGCDRP Cc1ccc(O)c(C[NH+]2CCC(CC3CC[NH2+]CC3)CC2)c1 ZINC001236962083 1099891423 /nfs/dbraw/zinc/89/14/23/1099891423.db2.gz UTCBPZDXOZGFRM-UHFFFAOYSA-N 2 0 302.462 3.302 20 10 DGCDRP Cc1cccc(C[NH+]2CCC(CC3CC[NH2+]CC3)CC2)c1O ZINC001236961400 1099892041 /nfs/dbraw/zinc/89/20/41/1099892041.db2.gz FTJDHOZJNFAAMH-UHFFFAOYSA-N 2 0 302.462 3.302 20 10 DGCDRP CC(C)c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)c(O)c1 ZINC001237049268 1099944849 /nfs/dbraw/zinc/94/48/49/1099944849.db2.gz MXJJHAPLBHMGIG-UHFFFAOYSA-N 2 0 302.462 3.433 20 10 DGCDRP c1cc(N2CCCC2)ccc1CN(C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC001237146491 1099995963 /nfs/dbraw/zinc/99/59/63/1099995963.db2.gz SENNNDBDCHBWBQ-HXUWFJFHSA-N 2 0 313.489 3.393 20 10 DGCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC2(C1)CCCCC2 ZINC001237203709 1100032376 /nfs/dbraw/zinc/03/23/76/1100032376.db2.gz HLDATTSNJMJINA-UHFFFAOYSA-N 2 0 313.489 3.252 20 10 DGCDRP C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001199227748 1102087496 /nfs/dbraw/zinc/08/74/96/1102087496.db2.gz LBCQBZUXRMSAQE-SJLPKXTDSA-N 2 0 301.478 3.107 20 10 DGCDRP CC[C@@H]([NH2+]CC[C@@H](C)[NH2+]C)c1ccc(C(F)(F)F)cc1O ZINC001326037085 1103188068 /nfs/dbraw/zinc/18/80/68/1103188068.db2.gz VRKHMTMTANBJCL-ZWNOBZJWSA-N 2 0 304.356 3.450 20 10 DGCDRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC001326035744 1103188605 /nfs/dbraw/zinc/18/86/05/1103188605.db2.gz MEMAXTPTTKJAEH-QWRGUYRKSA-N 2 0 315.255 3.112 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)c1O ZINC001206565983 1103843878 /nfs/dbraw/zinc/84/38/78/1103843878.db2.gz XCTCNNXJFQZGNF-MRXNPFEDSA-N 2 0 312.841 3.005 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CC(C)(C)C1 ZINC001246172967 1104420688 /nfs/dbraw/zinc/42/06/88/1104420688.db2.gz JBZAHMKSKODDGH-WMZOPIPTSA-N 2 0 315.505 3.401 20 10 DGCDRP c1cc(C[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)cc2c1OCC2 ZINC001246199225 1104433689 /nfs/dbraw/zinc/43/36/89/1104433689.db2.gz KWSIEQZSLLRSMD-QGZVFWFLSA-N 2 0 300.446 3.166 20 10 DGCDRP CC[N@H+](CCC[NH+](C)C)Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249258158 1105258691 /nfs/dbraw/zinc/25/86/91/1105258691.db2.gz FGQBNFGXAATCRC-UHFFFAOYSA-N 2 0 318.461 3.350 20 10 DGCDRP CC(C)CC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001256352550 1106408334 /nfs/dbraw/zinc/40/83/34/1106408334.db2.gz JYXCEXSTDRJYQU-QGZVFWFLSA-N 2 0 303.494 3.353 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC001319711309 1108604091 /nfs/dbraw/zinc/60/40/91/1108604091.db2.gz IKMJJXGNLCMBOG-LJQANCHMSA-N 2 0 313.489 3.205 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCCC3)cc2)[C@@H](C)C1 ZINC001319717059 1108608068 /nfs/dbraw/zinc/60/80/68/1108608068.db2.gz KGKAYNOIMZDCOT-FXAWDEMLSA-N 2 0 315.505 3.449 20 10 DGCDRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308920126 1111493715 /nfs/dbraw/zinc/49/37/15/1111493715.db2.gz ZWKMLGMQTHXQRB-PMACEKPBSA-N 2 0 315.505 3.353 20 10 DGCDRP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)CC2 ZINC000297576379 285397614 /nfs/dbraw/zinc/39/76/14/285397614.db2.gz GYGOXMXFGLSOEF-QGZVFWFLSA-N 2 0 300.446 3.376 20 10 DGCDRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(F)cc1[O-] ZINC000185206541 432477908 /nfs/dbraw/zinc/47/79/08/432477908.db2.gz JIRXXPYDRIDXPU-KFWWJZLASA-N 2 0 324.440 3.071 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1 ZINC000193929040 432510748 /nfs/dbraw/zinc/51/07/48/432510748.db2.gz YHJNNTJOKWAEEC-ZDUSSCGKSA-N 2 0 306.450 3.314 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000280166367 433009098 /nfs/dbraw/zinc/00/90/98/433009098.db2.gz QYTYHOOKYAHHSD-RDJZCZTQSA-N 2 0 308.466 3.098 20 10 DGCDRP Cc1cccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1O ZINC000180765582 524402254 /nfs/dbraw/zinc/40/22/54/524402254.db2.gz QQMLAXWETUJOLO-CRAIPNDOSA-N 2 0 300.446 3.149 20 10 DGCDRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000731041543 574541929 /nfs/dbraw/zinc/54/19/29/574541929.db2.gz FYQLMYCJYFCCND-MRXNPFEDSA-N 2 0 310.441 3.491 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc(F)ccc1O ZINC000853240019 620681038 /nfs/dbraw/zinc/68/10/38/620681038.db2.gz LOZBBPQQJBDKKR-HIFRSBDPSA-N 2 0 306.425 3.304 20 10 DGCDRP CCC[NH+]1CCC([NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)CC1 ZINC000840894680 618342941 /nfs/dbraw/zinc/34/29/41/618342941.db2.gz RWTVMYJUEQVJQD-QGZVFWFLSA-N 2 0 317.521 3.456 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(N(C)C)cc2C)CC1 ZINC000840933558 618609412 /nfs/dbraw/zinc/60/94/12/618609412.db2.gz HUZFMLPHIQHJIR-UHFFFAOYSA-N 2 0 303.494 3.273 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c1O ZINC000894180757 618724999 /nfs/dbraw/zinc/72/49/99/618724999.db2.gz PXBASOIOENSFLX-MRXNPFEDSA-N 2 0 320.477 3.453 20 10 DGCDRP COc1cccc(C[NH+]2CCC([C@H]3CCC[NH2+]CC3)CC2)c1O ZINC000904410971 619920676 /nfs/dbraw/zinc/92/06/76/619920676.db2.gz IHOUPCUXFHKXIW-HNNXBMFYSA-N 2 0 318.461 3.003 20 10 DGCDRP COc1cccc(O)c1C[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC000904412465 619921097 /nfs/dbraw/zinc/92/10/97/619921097.db2.gz UCLPADWGVIRZSV-HNNXBMFYSA-N 2 0 318.461 3.003 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c1O ZINC000841086265 620225032 /nfs/dbraw/zinc/22/50/32/620225032.db2.gz GWMRLOOMHJDTEW-CZUORRHYSA-N 2 0 308.853 3.318 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)cc1F ZINC000841100819 620450750 /nfs/dbraw/zinc/45/07/50/620450750.db2.gz KXAPIIJVYUAAKJ-ZBFHGGJFSA-N 2 0 307.457 3.089 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC2CC[NH+](C)CC2)cc1F ZINC000152186156 620496252 /nfs/dbraw/zinc/49/62/52/620496252.db2.gz ATGDKQMNIDBXJM-UHFFFAOYSA-N 2 0 307.457 3.103 20 10 DGCDRP c1cc2c(cc1C[NH2+]CC1CC[NH+](CC3CC3)CC1)CCCO2 ZINC000922268586 621015662 /nfs/dbraw/zinc/01/56/62/621015662.db2.gz NEABLMRABKXZLO-UHFFFAOYSA-N 2 0 314.473 3.223 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC34CCCC4)cc2)CC1 ZINC000758592077 621790734 /nfs/dbraw/zinc/79/07/34/621790734.db2.gz FDALPJOQOZYHKV-LJQANCHMSA-N 2 0 313.489 3.251 20 10 DGCDRP CCOc1ccc(O)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1 ZINC000768926109 622485604 /nfs/dbraw/zinc/48/56/04/622485604.db2.gz ITDGZNUHXNNFHW-UHFFFAOYSA-N 2 0 320.477 3.343 20 10 DGCDRP CCOc1ccc(O)c(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)c1 ZINC000769469588 622530309 /nfs/dbraw/zinc/53/03/09/622530309.db2.gz AOIRVRAZZOMTDU-GOEBONIOSA-N 2 0 306.450 3.096 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000770350972 622623025 /nfs/dbraw/zinc/62/30/25/622623025.db2.gz HJPYXURMEHTWAI-QUCCMNQESA-N 2 0 315.505 3.449 20 10 DGCDRP Cc1cc(C)c(O)c(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)c1 ZINC000872644163 622947032 /nfs/dbraw/zinc/94/70/32/622947032.db2.gz FLLZCETZVTWKKV-UHFFFAOYSA-N 2 0 302.462 3.459 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1O ZINC000873255944 623093398 /nfs/dbraw/zinc/09/33/98/623093398.db2.gz KWGSCKACCPAQTI-IRUJWGPZSA-N 2 0 302.340 3.189 20 10 DGCDRP C[C@@H]1CCC[C@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775649402 623303349 /nfs/dbraw/zinc/30/33/49/623303349.db2.gz QXLBPWLPOXOHJF-XLIONFOSSA-N 2 0 315.505 3.449 20 10 DGCDRP Cc1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c(O)c1 ZINC000876811576 623713380 /nfs/dbraw/zinc/71/33/80/623713380.db2.gz LIILZWLXWIVCGA-QAPCUYQASA-N 2 0 300.446 3.149 20 10 DGCDRP Cc1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(O)c1 ZINC000877137194 623803095 /nfs/dbraw/zinc/80/30/95/623803095.db2.gz RUIISGXQZHUEHM-UHFFFAOYSA-N 2 0 311.429 3.102 20 10 DGCDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1c(O)cccc1Cl)CC2 ZINC000877684164 623990958 /nfs/dbraw/zinc/99/09/58/623990958.db2.gz JMYZQSXUYCBHKV-UHFFFAOYSA-N 2 0 308.853 3.353 20 10 DGCDRP C[C@@H](c1ccccn1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000780893852 623995600 /nfs/dbraw/zinc/99/56/00/623995600.db2.gz UFEFUMMCDROJAE-KRWDZBQOSA-N 2 0 324.472 3.026 20 10 DGCDRP CC[C@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccccc1O ZINC000810252338 626992906 /nfs/dbraw/zinc/99/29/06/626992906.db2.gz BXLOXUFBBHEHPQ-HNNXBMFYSA-N 2 0 308.491 3.260 20 10 DGCDRP CSC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CC[NH+](C)CC1 ZINC000810252939 626993489 /nfs/dbraw/zinc/99/34/89/626993489.db2.gz WZFPZRYMHIYAHF-CQSZACIVSA-N 2 0 308.491 3.179 20 10 DGCDRP COc1cc(C)cc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1O ZINC000887562284 627286496 /nfs/dbraw/zinc/28/64/96/627286496.db2.gz PYDJBKAUMYPEEJ-UHFFFAOYSA-N 2 0 306.450 3.014 20 10 DGCDRP CCCC[C@@H](C)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000811520572 627287158 /nfs/dbraw/zinc/28/71/58/627287158.db2.gz QQMBCKRSUQMSJC-QGZVFWFLSA-N 2 0 303.494 3.449 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc2ccccc2c1O ZINC000925787022 627795383 /nfs/dbraw/zinc/79/53/83/627795383.db2.gz YRKGHOPMSWGIAE-TZMCWYRMSA-N 2 0 320.383 3.441 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H](Cc1ccccc1)[C@@H](C)[NH3+] ZINC000817894842 627954266 /nfs/dbraw/zinc/95/42/66/627954266.db2.gz QRVZSFSHBSGROH-OXQOHEQNSA-N 2 0 311.473 3.109 20 10 DGCDRP CC[NH2+]CCC[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC000817943422 627969485 /nfs/dbraw/zinc/96/94/85/627969485.db2.gz NDXYFJJXAOJSPN-LLVKDONJSA-N 2 0 315.255 3.113 20 10 DGCDRP CC[NH2+]CCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817942669 627969510 /nfs/dbraw/zinc/96/95/10/627969510.db2.gz CNXBEKUZDBJZJJ-OAHLLOKOSA-N 2 0 307.457 3.466 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Cl)ccc1O ZINC000817947665 627970724 /nfs/dbraw/zinc/97/07/24/627970724.db2.gz FCXFVHPQACAPOP-LBPRGKRZSA-N 2 0 304.821 3.398 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817946476 627970820 /nfs/dbraw/zinc/97/08/20/627970820.db2.gz XYSLWWIVSZKJLV-SJORKVTESA-N 2 0 301.478 3.327 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817945800 627970949 /nfs/dbraw/zinc/97/09/49/627970949.db2.gz MIFOOHYKRPMRNM-SMDDNHRTSA-N 2 0 316.367 3.451 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(CC[NH3+])cc2)c2c1c(F)ccc2O ZINC000817950253 627972190 /nfs/dbraw/zinc/97/21/90/627972190.db2.gz XDFSHVSVVMAAMJ-WBMJQRKESA-N 2 0 314.404 3.371 20 10 DGCDRP CC[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817955403 627974109 /nfs/dbraw/zinc/97/41/09/627974109.db2.gz XPOFPIHWZMRAGO-RISCZKNCSA-N 2 0 316.367 3.451 20 10 DGCDRP Cc1cc(Br)cc([C@H](C)[NH2+]C[C@H]([NH3+])C(C)C)c1O ZINC000817958757 627974979 /nfs/dbraw/zinc/97/49/79/627974979.db2.gz MHATWOARCQPWCF-GWCFXTLKSA-N 2 0 315.255 3.097 20 10 DGCDRP Cc1cc(Br)cc([C@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)c1O ZINC000817958766 627975001 /nfs/dbraw/zinc/97/50/01/627975001.db2.gz MHATWOARCQPWCF-GXFFZTMASA-N 2 0 315.255 3.097 20 10 DGCDRP CC[C@H]([NH2+]C[C@@H]([NH3+])C(C)C)c1ccc(C(F)(F)F)cc1O ZINC000817957526 627975029 /nfs/dbraw/zinc/97/50/29/627975029.db2.gz CNMDXVMRPLRFFN-OLZOCXBDSA-N 2 0 304.356 3.435 20 10 DGCDRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccc(Br)cc1O ZINC000817970427 627978702 /nfs/dbraw/zinc/97/87/02/627978702.db2.gz VDZGTFXEUCMYKY-DLOVCJGASA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(N2CCCCC2)cc1 ZINC000817969088 627978725 /nfs/dbraw/zinc/97/87/25/627978725.db2.gz QZRWJUPJVPJBPP-WMZOPIPTSA-N 2 0 301.478 3.470 20 10 DGCDRP C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(N2CCCCC2)cc1 ZINC000817969087 627979105 /nfs/dbraw/zinc/97/91/05/627979105.db2.gz QZRWJUPJVPJBPP-SJLPKXTDSA-N 2 0 301.478 3.470 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000817970853 627980202 /nfs/dbraw/zinc/98/02/02/627980202.db2.gz GFQRNIGTUZQDSL-SOLBZPMBSA-N 2 0 301.478 3.468 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(N(C)C)cc1 ZINC000817985204 627983173 /nfs/dbraw/zinc/98/31/73/627983173.db2.gz HCAZQOXKPRKMNF-BMFAXAFESA-N 2 0 301.478 3.181 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c2c1c(F)ccc2O ZINC000817985092 627983194 /nfs/dbraw/zinc/98/31/94/627983194.db2.gz ABZXAGCRHJYLSG-OKWIKPQFSA-N 2 0 304.409 3.057 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(N2CCCCC2)cc1 ZINC000817982475 627983217 /nfs/dbraw/zinc/98/32/17/627983217.db2.gz SSPHEXLSWUWDTO-JZXOWHBKSA-N 2 0 301.478 3.455 20 10 DGCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1O ZINC000817985689 627984526 /nfs/dbraw/zinc/98/45/26/627984526.db2.gz GYHNMPYSLSBXPV-KYEXWDHISA-N 2 0 308.853 3.393 20 10 DGCDRP C[C@@H]1CC2(C[N@@H+]1C/C=C\c1ccc(N(C)C)cc1)CC[NH2+]CC2 ZINC000818431715 628022408 /nfs/dbraw/zinc/02/24/08/628022408.db2.gz RIHCJXNPGNPKAD-VGOKWCNXSA-N 2 0 313.489 3.230 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835039706 629831778 /nfs/dbraw/zinc/83/17/78/629831778.db2.gz IWPHTYCVGLUNOW-WAYWQWQTSA-N 2 0 315.505 3.477 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC(c3ncc[nH]3)CC2)c(Cl)c1 ZINC000840911877 630376524 /nfs/dbraw/zinc/37/65/24/630376524.db2.gz BYCYZOKIJOQEGB-UHFFFAOYSA-N 2 0 305.809 3.457 20 10 DGCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840917967 630378222 /nfs/dbraw/zinc/37/82/22/630378222.db2.gz XMBSRJGEJGQVJK-KRWDZBQOSA-N 2 0 303.494 3.225 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+][C@H](CCC[NH3+])c2ccccc2)c1 ZINC000841086753 630406028 /nfs/dbraw/zinc/40/60/28/630406028.db2.gz KZXAOOBNPVDJOF-GOSISDBHSA-N 2 0 314.429 3.361 20 10 DGCDRP [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000843045343 630607706 /nfs/dbraw/zinc/60/77/06/630607706.db2.gz NUUXCWMCAZCCRE-BXUZGUMPSA-N 2 0 312.816 3.149 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000843043925 630607827 /nfs/dbraw/zinc/60/78/27/630607827.db2.gz QHRDJNMZCOXSFL-LJQANCHMSA-N 2 0 301.478 3.025 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)cc1 ZINC000843046399 630608009 /nfs/dbraw/zinc/60/80/09/630608009.db2.gz UGACMGPWIRZCTQ-HXUWFJFHSA-N 2 0 315.505 3.497 20 10 DGCDRP C[NH2+]CC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000843049958 630608154 /nfs/dbraw/zinc/60/81/54/630608154.db2.gz WPMBLRKKRGFWJQ-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC000843117385 630615718 /nfs/dbraw/zinc/61/57/18/630615718.db2.gz PCQQJIAXSKEFPG-IBGZPJMESA-N 2 0 301.478 3.108 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126644 630616524 /nfs/dbraw/zinc/61/65/24/630616524.db2.gz MNOKTBBZQMJAGH-HKUYNNGSSA-N 2 0 315.505 3.273 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cc1F ZINC000843127457 630616953 /nfs/dbraw/zinc/61/69/53/630616953.db2.gz REZKLNYHIVVWPN-DLBZAZTESA-N 2 0 319.468 3.103 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)c(O)c1C ZINC000844925196 630987945 /nfs/dbraw/zinc/98/79/45/630987945.db2.gz RXAOULGNOHPXFS-CYBMUJFWSA-N 2 0 302.393 3.458 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)c1O ZINC000846146987 631212101 /nfs/dbraw/zinc/21/21/01/631212101.db2.gz UFFSPYBKHAEHAW-LSDHHAIUSA-N 2 0 306.450 3.173 20 10 DGCDRP Oc1cccc2c1[C@@H]([NH2+]CC1CC[NH+](CC3CC3)CC1)CC2 ZINC000850582759 632202032 /nfs/dbraw/zinc/20/20/32/632202032.db2.gz LCFYEHMWMLILJU-KRWDZBQOSA-N 2 0 300.446 3.091 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000164408876 658934702 /nfs/dbraw/zinc/93/47/02/658934702.db2.gz URYFBCPKPLKMLP-QGZVFWFLSA-N 2 0 302.462 3.317 20 10 DGCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3c(O)ccc4ccccc43)CC[C@H]21 ZINC000247111389 662300882 /nfs/dbraw/zinc/30/08/82/662300882.db2.gz QQFCNDVOSPAYRZ-VQIMIIECSA-N 2 0 310.441 3.462 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000092066056 662327323 /nfs/dbraw/zinc/32/73/23/662327323.db2.gz UECOEFAOGXPMQS-XLIONFOSSA-N 2 0 313.489 3.201 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000378951309 685146316 /nfs/dbraw/zinc/14/63/16/685146316.db2.gz HTXCXOPWJQOVRI-HKUYNNGSSA-N 2 0 301.478 3.249 20 10 DGCDRP Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000383936774 685169847 /nfs/dbraw/zinc/16/98/47/685169847.db2.gz CYFVMAOFPWUYRU-PKOBYXMFSA-N 2 0 322.452 3.491 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CC[C@H](C[NH3+])C3)cc2)CC1 ZINC001576735250 1191865999 /nfs/dbraw/zinc/86/59/99/1191865999.db2.gz YIZJFTOBKLYJJM-ROUUACIJSA-N 2 0 301.478 3.140 20 10 DGCDRP Cc1cc(O)c(C[NH2+][C@@H]2[C@@H]3CCC[NH2+][C@@H]3C2(C)C)cc1Cl ZINC001579637975 1191983643 /nfs/dbraw/zinc/98/36/43/1191983643.db2.gz LIPXYWIRYSDGOU-UHOFOFEASA-N 2 0 308.853 3.220 20 10 DGCDRP CC[NH+](CC)CC1CC[NH+](Cc2c(C)cc(OC)cc2O)CC1 ZINC001651889146 1195519871 /nfs/dbraw/zinc/51/98/71/1195519871.db2.gz ZCWKNFBAIUVQEF-UHFFFAOYSA-N 2 0 320.477 3.263 20 10 DGCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC001656244663 1196023457 /nfs/dbraw/zinc/02/34/57/1196023457.db2.gz XKMJRXWPEPDSCN-HXUWFJFHSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001657481162 1196148212 /nfs/dbraw/zinc/14/82/12/1196148212.db2.gz WOVAWPOKYQRPHL-YLJYHZDGSA-N 2 0 315.505 3.497 20 10 DGCDRP Cc1cc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@@H](C)C2)ccc1N(C)C ZINC001659975370 1196433830 /nfs/dbraw/zinc/43/38/30/1196433830.db2.gz LRTGTSBWCRSCEY-KRWDZBQOSA-N 2 0 324.472 3.167 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC(C)(C)C3)cc2)CC1 ZINC001140304582 1082124183 /nfs/dbraw/zinc/12/41/83/1082124183.db2.gz VQXHNHVFKDPFPY-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001183533938 1083973452 /nfs/dbraw/zinc/97/34/52/1083973452.db2.gz NWMVEXMATYORIP-MBOZVWFJSA-N 2 0 315.505 3.353 20 10 DGCDRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001183533935 1083974167 /nfs/dbraw/zinc/97/41/67/1083974167.db2.gz NWMVEXMATYORIP-FUHIMQAGSA-N 2 0 315.505 3.353 20 10 DGCDRP COc1ccc(O)c(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c1 ZINC001203680187 1090778841 /nfs/dbraw/zinc/77/88/41/1090778841.db2.gz JHQOJEVRYYOQQU-IRXDYDNUSA-N 2 0 318.461 3.240 20 10 DGCDRP c1cc(N2CC[NH+](Cc3ccc(N4CCCC4)cc3)CC2)cc[nH+]1 ZINC001204318977 1090948296 /nfs/dbraw/zinc/94/82/96/1090948296.db2.gz BUXQJICSSVQBEK-UHFFFAOYSA-N 2 0 322.456 3.004 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C[C@@H]1C[NH3+] ZINC001205296195 1091169361 /nfs/dbraw/zinc/16/93/61/1091169361.db2.gz IRBFHQLHAHWXCU-WBVHZDCISA-N 2 0 311.473 3.323 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C[C@H]1C[NH3+] ZINC001205319348 1091184326 /nfs/dbraw/zinc/18/43/26/1091184326.db2.gz ZGMARCAKMSEVSN-MAUKXSAKSA-N 2 0 310.441 3.476 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)CC[C@H]1C[NH3+] ZINC001205637043 1091290503 /nfs/dbraw/zinc/29/05/03/1091290503.db2.gz GHHNFOVOIVFIKK-CABCVRRESA-N 2 0 304.478 3.497 20 10 DGCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CC1(C)C ZINC001202870061 1091357110 /nfs/dbraw/zinc/35/71/10/1091357110.db2.gz QVLMECRGUKZHQW-OALUTQOASA-N 2 0 315.505 3.353 20 10 DGCDRP C[C@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2O)CCC[C@@H]1C[NH3+] ZINC001206026839 1091456828 /nfs/dbraw/zinc/45/68/28/1091456828.db2.gz UIDLYTIBRZSFHV-NWDGAFQWSA-N 2 0 316.367 3.218 20 10 DGCDRP COc1cc(C[NH+]2CCCCCCC2)cc(C[NH+](C)C)c1O ZINC001139257808 1091501735 /nfs/dbraw/zinc/50/17/35/1091501735.db2.gz GSZCKGPLSHCGMR-UHFFFAOYSA-N 2 0 306.450 3.229 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@H](C)C[C@H]2C)cc(C[NH+](C)C)c1O ZINC001139258228 1091503289 /nfs/dbraw/zinc/50/32/89/1091503289.db2.gz NBUPKHJDSSTALT-UONOGXRCSA-N 2 0 306.450 3.083 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@](C)(F)CC3)cc2)CC1 ZINC001139408397 1091552429 /nfs/dbraw/zinc/55/24/29/1091552429.db2.gz LHDVGJSURSCWOE-LJQANCHMSA-N 2 0 319.468 3.153 20 10 DGCDRP C[C@@H]1C[NH2+]CC[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001206285300 1091562072 /nfs/dbraw/zinc/56/20/72/1091562072.db2.gz LAKYBRWJSAMVOM-CQSZACIVSA-N 2 0 314.404 3.240 20 10 DGCDRP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2cc3ccccc3cc2O)C1 ZINC001206370192 1091602922 /nfs/dbraw/zinc/60/29/22/1091602922.db2.gz LRTLMZVJNGABQG-SFHVURJKSA-N 2 0 302.393 3.198 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)c2ccccc21 ZINC001206615930 1091690062 /nfs/dbraw/zinc/69/00/62/1091690062.db2.gz KLZASHPWDCYUQB-MRXNPFEDSA-N 2 0 311.473 3.467 20 10 DGCDRP C[C@H]1CC[C@H](C[NH3+])CN1Cc1c(O)ccc(Cl)c1Cl ZINC001206810559 1091749844 /nfs/dbraw/zinc/74/98/44/1091749844.db2.gz NYFFQMSYQRGLKF-VHSXEESVSA-N 2 0 303.233 3.258 20 10 DGCDRP Oc1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001140055755 1091753103 /nfs/dbraw/zinc/75/31/03/1091753103.db2.gz SNABLNUXPCGIEY-QGZVFWFLSA-N 2 0 306.425 3.372 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](F)CC3)cc2)CC1 ZINC001140302513 1091819703 /nfs/dbraw/zinc/81/97/03/1091819703.db2.gz SRTPOCZSNSHETP-SFHVURJKSA-N 2 0 319.468 3.153 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC4CCC3CC4)cc2)CC1 ZINC001140304284 1091820019 /nfs/dbraw/zinc/82/00/19/1091820019.db2.gz LXMRBWUKNUGLEY-UHFFFAOYSA-N 2 0 313.489 3.203 20 10 DGCDRP CC[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140305550 1091820673 /nfs/dbraw/zinc/82/06/73/1091820673.db2.gz BWABOIUBRZYYBJ-GOSISDBHSA-N 2 0 315.505 3.451 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)CC1 ZINC001140306222 1091820829 /nfs/dbraw/zinc/82/08/29/1091820829.db2.gz PVALHLFPQBRZIO-ROUUACIJSA-N 2 0 315.505 3.306 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CC4(C3)CCCC4)cc2)CC1 ZINC001140302139 1091820930 /nfs/dbraw/zinc/82/09/30/1091820930.db2.gz LDBOREPIPMYFIQ-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@H]2C1 ZINC001143117074 1092618434 /nfs/dbraw/zinc/61/84/34/1092618434.db2.gz RKYFVNXPPBSBBY-IAGOWNOFSA-N 2 0 316.489 3.463 20 10 DGCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@H]2C1 ZINC001143116806 1092618883 /nfs/dbraw/zinc/61/88/83/1092618883.db2.gz LEBWYDMHINYZQU-HZPDHXFCSA-N 2 0 302.462 3.073 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)cc1F ZINC001119990898 1094337966 /nfs/dbraw/zinc/33/79/66/1094337966.db2.gz YTAVELKVBXGJPE-GVDBMIGSSA-N 2 0 319.468 3.054 20 10 DGCDRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1cc3ccccc3cc1O)C2 ZINC001276812979 1095089606 /nfs/dbraw/zinc/08/96/06/1095089606.db2.gz LYURRFLAEDFAAD-HXUWFJFHSA-N 2 0 310.441 3.463 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC[N@@H+]1C ZINC000316426119 1095173197 /nfs/dbraw/zinc/17/31/97/1095173197.db2.gz BETZFULSCWCIOO-AEFFLSMTSA-N 2 0 301.478 3.249 20 10 DGCDRP COc1ccc(O)c(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222162006 1095469102 /nfs/dbraw/zinc/46/91/02/1095469102.db2.gz VXWUJPGMZZQPGA-IBGZPJMESA-N 2 0 318.461 3.147 20 10 DGCDRP Cc1cccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1O ZINC001222168120 1095472769 /nfs/dbraw/zinc/47/27/69/1095472769.db2.gz VCNDIVMJMTZIEB-IBGZPJMESA-N 2 0 302.462 3.446 20 10 DGCDRP CN1CCCc2cc(CN3CCC4(CCCC[NH2+]4)CC3)ccc21 ZINC001222292627 1095533037 /nfs/dbraw/zinc/53/30/37/1095533037.db2.gz HWGFRHBPNOSCLY-UHFFFAOYSA-N 2 0 313.489 3.177 20 10 DGCDRP Oc1cc2c(cc1C[N@@H+]1CCCC3(CCCC3)C1)C[NH2+]CCO2 ZINC001222402160 1095596075 /nfs/dbraw/zinc/59/60/75/1095596075.db2.gz ZREHAOATVPOEBV-UHFFFAOYSA-N 2 0 316.445 3.030 20 10 DGCDRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC001116565795 1095602275 /nfs/dbraw/zinc/60/22/75/1095602275.db2.gz XDISXFBNVGBZRE-NFAWXSAZSA-N 2 0 306.425 3.401 20 10 DGCDRP Cc1cc(C)c(C[N@@H+]2C[C@H](c3ccccc3)C3(C[NH2+]C3)C2)c(O)c1 ZINC001222608466 1095689388 /nfs/dbraw/zinc/68/93/88/1095689388.db2.gz AFSJOOPVRJKXSF-LJQANCHMSA-N 2 0 322.452 3.198 20 10 DGCDRP Cc1cc(F)cc(CN2CCC[C@]3(CCC[N@@H+](C)C3)C2)c1O ZINC001277518948 1097749909 /nfs/dbraw/zinc/74/99/09/1097749909.db2.gz GFSCDTXCNWEOIS-SFHVURJKSA-N 2 0 306.425 3.148 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)c(O)c1 ZINC001231846506 1097862507 /nfs/dbraw/zinc/86/25/07/1097862507.db2.gz NDVDYOOVTHEIPP-UHFFFAOYSA-N 2 0 320.452 3.407 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3ccc4ccccc4c3O)C[C@@H]2C1 ZINC001231883574 1097879241 /nfs/dbraw/zinc/87/92/41/1097879241.db2.gz PWSRUNCPMYGSLY-ROUUACIJSA-N 2 0 310.441 3.319 20 10 DGCDRP c1cc(N2CCCCC2)ccc1CN1CCCC[C@@]12CC[NH2+]C2 ZINC001235118451 1098818065 /nfs/dbraw/zinc/81/80/65/1098818065.db2.gz VJGAYVAHBLCFQN-FQEVSTJZSA-N 2 0 313.489 3.395 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC23CC[NH2+]CC3)cc1 ZINC001235141741 1098833422 /nfs/dbraw/zinc/83/34/22/1098833422.db2.gz XOQIKIYYDZZFDN-UHFFFAOYSA-N 2 0 301.478 3.251 20 10 DGCDRP Oc1cc(Cl)ccc1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235229182 1098901012 /nfs/dbraw/zinc/90/10/12/1098901012.db2.gz OYMZAHUGXAQSQZ-INIZCTEOSA-N 2 0 308.853 3.400 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235230800 1098904050 /nfs/dbraw/zinc/90/40/50/1098904050.db2.gz QSWIIOIKWOQNMK-INIZCTEOSA-N 2 0 308.853 3.400 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)c2ccccc21 ZINC001235241374 1098912894 /nfs/dbraw/zinc/91/28/94/1098912894.db2.gz SQTCQLUZQANBBC-OXQOHEQNSA-N 2 0 309.457 3.219 20 10 DGCDRP c1ccc([C@H]2CCC[N@H+]2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235673928 1099116974 /nfs/dbraw/zinc/11/69/74/1099116974.db2.gz JBEMVVCQRIKWNB-OAQYLSRUSA-N 2 0 321.468 3.433 20 10 DGCDRP Oc1cccc(Cl)c1C[NH+]1CCC(C2CC[NH2+]CC2)CC1 ZINC001235700994 1099134614 /nfs/dbraw/zinc/13/46/14/1099134614.db2.gz BDZICKGDEXKJEZ-UHFFFAOYSA-N 2 0 308.853 3.257 20 10 DGCDRP C[N@@H+](Cc1cc(Cl)c(C(C)(C)C)cc1O)C[C@@H]1CC[NH2+]C1 ZINC001235841173 1099204494 /nfs/dbraw/zinc/20/44/94/1099204494.db2.gz YBKPLYPBYLVLEE-GFCCVEGCSA-N 2 0 310.869 3.384 20 10 DGCDRP C[N@@H+](Cc1cc(Cl)c(C(C)(C)C)cc1O)C[C@H]1CC[NH2+]C1 ZINC001235841174 1099205278 /nfs/dbraw/zinc/20/52/78/1099205278.db2.gz YBKPLYPBYLVLEE-LBPRGKRZSA-N 2 0 310.869 3.384 20 10 DGCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@H]3CCCC[C@@H]31)C[NH2+]CCO2 ZINC001235868985 1099227214 /nfs/dbraw/zinc/22/72/14/1099227214.db2.gz XWTQMIVIOHIJJS-PBHICJAKSA-N 2 0 316.445 3.029 20 10 DGCDRP CC(C)(C)c1cccc(C[NH+]2CC3(C2)CCC[NH2+]CC3)c1O ZINC001236010191 1099334106 /nfs/dbraw/zinc/33/41/06/1099334106.db2.gz SAKBCCLWFCZHIG-UHFFFAOYSA-N 2 0 302.462 3.265 20 10 DGCDRP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c(C)n1-c1ccccc1 ZINC001236820361 1099805251 /nfs/dbraw/zinc/80/52/51/1099805251.db2.gz RDQXDHZHGYSXJF-FFZOFVMBSA-N 2 0 309.457 3.263 20 10 DGCDRP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001236820362 1099806031 /nfs/dbraw/zinc/80/60/31/1099806031.db2.gz RDQXDHZHGYSXJF-PWIZWCRZSA-N 2 0 309.457 3.263 20 10 DGCDRP C[C@@H]1CCCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236940378 1099883534 /nfs/dbraw/zinc/88/35/34/1099883534.db2.gz PDHXNTSMWKYQKM-MRXNPFEDSA-N 2 0 319.468 3.342 20 10 DGCDRP CC(C)c1ccc(C[NH+]2CCN(c3cc[nH+]cc3)CC2)c(O)c1 ZINC001237046201 1099941564 /nfs/dbraw/zinc/94/15/64/1099941564.db2.gz REWYAXGHPAYMAZ-UHFFFAOYSA-N 2 0 311.429 3.233 20 10 DGCDRP CC(C)c1ccc(CN2CC3(C2)CC[N@H+](CC2CC2)C3)c(O)c1 ZINC001237048290 1099942220 /nfs/dbraw/zinc/94/22/20/1099942220.db2.gz JFFIFHUSQWLPBN-UHFFFAOYSA-N 2 0 314.473 3.433 20 10 DGCDRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC001325743095 1103114743 /nfs/dbraw/zinc/11/47/43/1103114743.db2.gz JKGGQSGIGYSEPU-LSDHHAIUSA-N 2 0 307.457 3.322 20 10 DGCDRP CC[C@H]([NH2+]C[C@@H](C)C[NH2+]C)c1ccc(C(F)(F)F)cc1O ZINC001326474172 1103331521 /nfs/dbraw/zinc/33/15/21/1103331521.db2.gz TYYIPEGPXJPJNE-GWCFXTLKSA-N 2 0 304.356 3.307 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001326518864 1103353048 /nfs/dbraw/zinc/35/30/48/1103353048.db2.gz MKEZMUJSOTUZDM-UHFFFAOYSA-N 2 0 313.489 3.252 20 10 DGCDRP CCOCc1cc(C[NH2+]CC2CC[NH+](CC)CC2)ccc1OC ZINC001649171139 1104164290 /nfs/dbraw/zinc/16/42/90/1104164290.db2.gz JZYHLGPRXITBPG-UHFFFAOYSA-N 2 0 320.477 3.053 20 10 DGCDRP CC1(C)CCC([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001246171060 1104419116 /nfs/dbraw/zinc/41/91/16/1104419116.db2.gz ATPWCVWBDOOUAN-UHFFFAOYSA-N 2 0 301.478 3.155 20 10 DGCDRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1C ZINC001246174309 1104421338 /nfs/dbraw/zinc/42/13/38/1104421338.db2.gz OHAKAKMESFOLER-SOLBZPMBSA-N 2 0 301.478 3.011 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+][C@H](Cc3ccccc3)C2)cc1 ZINC001246314439 1104483920 /nfs/dbraw/zinc/48/39/20/1104483920.db2.gz XNCQSUNNSJXKHD-VQTJNVASSA-N 2 0 323.484 3.206 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@@H]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001246900258 1104728730 /nfs/dbraw/zinc/72/87/30/1104728730.db2.gz HEUPKTYLZGBIJG-GOSISDBHSA-N 2 0 301.478 3.107 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C1CCC2(C[NH2+]C2)CC1 ZINC001246917306 1104735729 /nfs/dbraw/zinc/73/57/29/1104735729.db2.gz CEGJZVFWEMFOPB-UHFFFAOYSA-N 2 0 301.478 3.107 20 10 DGCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3ccc(N4CCCC4)cc3)C[C@H]2CC1 ZINC001275960650 1104968443 /nfs/dbraw/zinc/96/84/43/1104968443.db2.gz ZKRFDSOXFIHMOJ-KDURUIRLSA-N 2 0 313.489 3.060 20 10 DGCDRP CCC1CC[NH+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)CC1 ZINC001139256085 1105398932 /nfs/dbraw/zinc/39/89/32/1105398932.db2.gz SPKCRSCBKBCLQY-UHFFFAOYSA-N 2 0 306.450 3.084 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@H]1CCC[NH+](C)CC1 ZINC001254524816 1106093297 /nfs/dbraw/zinc/09/32/97/1106093297.db2.gz ZWFQDNOHEQDEIG-SFHVURJKSA-N 2 0 301.478 3.203 20 10 DGCDRP C[C@H](CC(F)(F)F)[NH2+]C1CC[NH+](Cc2ccccc2O)CC1 ZINC001255639379 1106282106 /nfs/dbraw/zinc/28/21/06/1106282106.db2.gz KYHQWRCPLYNLSZ-GFCCVEGCSA-N 2 0 316.367 3.287 20 10 DGCDRP CC[C@H]([NH2+]CC[C@@H](C)[NH2+]C)c1cc(Br)ccc1O ZINC001261424272 1107427474 /nfs/dbraw/zinc/42/74/74/1107427474.db2.gz QIVAIWKJANNZLA-MFKMUULPSA-N 2 0 315.255 3.193 20 10 DGCDRP C[N@@H+](Cc1ccc(N)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000382756082 1108162669 /nfs/dbraw/zinc/16/26/69/1108162669.db2.gz INFSZWOYJGVNKL-IBGZPJMESA-N 2 0 309.457 3.223 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001308430529 1111428109 /nfs/dbraw/zinc/42/81/09/1111428109.db2.gz GBKGZRXFBYMYQH-UHFFFAOYSA-N 2 0 304.397 3.424 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC34CCCCC4)cc2)CC1 ZINC001308477396 1111432591 /nfs/dbraw/zinc/43/25/91/1111432591.db2.gz FOENBROVWOIWFT-IBGZPJMESA-N 2 0 313.489 3.251 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3C[C@@H]4CC[C@@H](C4)C3)cc2)CC1 ZINC001308504062 1111435482 /nfs/dbraw/zinc/43/54/82/1111435482.db2.gz YOQAPVHJNVHORC-BWTSREIZSA-N 2 0 313.489 3.107 20 10 DGCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000092066889 193152548 /nfs/dbraw/zinc/15/25/48/193152548.db2.gz IHJVOQNQAQSWPK-CRAIPNDOSA-N 2 0 300.446 3.149 20 10 DGCDRP CCC[NH+]1CCC([N@H+](C)Cc2cccc(OCC)c2O)CC1 ZINC000092165523 193169969 /nfs/dbraw/zinc/16/99/69/193169969.db2.gz FTYIJDPIIWSGQX-UHFFFAOYSA-N 2 0 306.450 3.097 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1O ZINC000183470830 432296432 /nfs/dbraw/zinc/29/64/32/432296432.db2.gz MXVMRTVBQPAROL-OAHLLOKOSA-N 2 0 314.429 3.183 20 10 DGCDRP CCOc1cccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1O ZINC000271028153 432319186 /nfs/dbraw/zinc/31/91/86/432319186.db2.gz FMCRLOQKBWSTAM-UHFFFAOYSA-N 2 0 306.450 3.096 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1C ZINC000153448066 432410502 /nfs/dbraw/zinc/41/05/02/432410502.db2.gz JDANRTRPTSZACC-SFHVURJKSA-N 2 0 302.462 3.459 20 10 DGCDRP C[N@H+]1CC=C(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000271857756 432426798 /nfs/dbraw/zinc/42/67/98/432426798.db2.gz VHMQTSRQAOJXRP-UHFFFAOYSA-N 2 0 308.425 3.411 20 10 DGCDRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1)c1ccc(F)cc1[O-] ZINC000185206524 432477522 /nfs/dbraw/zinc/47/75/22/432477522.db2.gz JIRXXPYDRIDXPU-KKUMJFAQSA-N 2 0 324.440 3.071 20 10 DGCDRP CCOc1cccc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c1O ZINC000276714141 432824959 /nfs/dbraw/zinc/82/49/59/432824959.db2.gz QUOVUFDYTBOGPJ-UHFFFAOYSA-N 2 0 306.450 3.003 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)c(O)c1C ZINC000278778201 432900350 /nfs/dbraw/zinc/90/03/50/432900350.db2.gz YECNSVDHBIZTHE-NVXWUHKLSA-N 2 0 320.477 3.161 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000556877846 435034401 /nfs/dbraw/zinc/03/44/01/435034401.db2.gz MRHVJSUCSNTFAD-KURKYZTESA-N 2 0 311.473 3.449 20 10 DGCDRP CCOCc1cc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)ccc1OC ZINC000747852778 575546333 /nfs/dbraw/zinc/54/63/33/575546333.db2.gz GFXBUAWMYDKMNY-QGZVFWFLSA-N 2 0 320.477 3.052 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853093531 620668054 /nfs/dbraw/zinc/66/80/54/620668054.db2.gz MJKDPFCXKUAYNK-INIZCTEOSA-N 2 0 318.461 3.003 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc(F)ccc1O ZINC000853240017 620680889 /nfs/dbraw/zinc/68/08/89/620680889.db2.gz LOZBBPQQJBDKKR-DZGCQCFKSA-N 2 0 306.425 3.304 20 10 DGCDRP COc1ccc(N2CC[C@H]([NH2+][C@H]3C[C@@H]([NH3+])c4ccccc43)C2)cc1 ZINC000854217187 620784992 /nfs/dbraw/zinc/78/49/92/620784992.db2.gz KKDCPIPQSGMKDN-KPOBHBOGSA-N 2 0 323.440 3.008 20 10 DGCDRP COc1cc(C)cc(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c1O ZINC000894360489 618771908 /nfs/dbraw/zinc/77/19/08/618771908.db2.gz WVLVBQLDLAKIGU-INIZCTEOSA-N 2 0 320.477 3.167 20 10 DGCDRP COc1cc(C)cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c1O ZINC000895439614 618784745 /nfs/dbraw/zinc/78/47/45/618784745.db2.gz DSKYYWAAWHDKGS-UHFFFAOYSA-N 2 0 318.461 3.017 20 10 DGCDRP CCOc1cccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1O ZINC000841030565 619166431 /nfs/dbraw/zinc/16/64/31/619166431.db2.gz XXQQGLXEYLVMSO-ZDUSSCGKSA-N 2 0 300.402 3.100 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903440717 619775884 /nfs/dbraw/zinc/77/58/84/619775884.db2.gz AMNCUCXPGAUNHU-MSOLQXFVSA-N 2 0 301.478 3.236 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C[C@@]2(C)CCC[NH2+]C2)C2CC2)cc1 ZINC000904307721 619911890 /nfs/dbraw/zinc/91/18/90/619911890.db2.gz VIHKIERGRDEDFK-IBGZPJMESA-N 2 0 301.478 3.107 20 10 DGCDRP CC[NH+](CC)CC1CC[NH+](Cc2cc(C)cc(OC)c2O)CC1 ZINC000754731362 620578338 /nfs/dbraw/zinc/57/83/38/620578338.db2.gz ABHZICDYAZIYIG-UHFFFAOYSA-N 2 0 320.477 3.263 20 10 DGCDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000922318429 621023611 /nfs/dbraw/zinc/02/36/11/621023611.db2.gz UQBTVINHSVMLLS-UHFFFAOYSA-N 2 0 302.462 3.364 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)/C=C\Cl)cc2)CC1 ZINC000922649176 621073164 /nfs/dbraw/zinc/07/31/64/621073164.db2.gz ULDUFTZSYVHSRV-HJWRWDBZSA-N 2 0 307.869 3.059 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@H]1CC=CCC1 ZINC000753574764 621450040 /nfs/dbraw/zinc/45/00/40/621450040.db2.gz DQFBGSPQGZBJSK-SFHVURJKSA-N 2 0 313.489 3.227 20 10 DGCDRP C[C@@H]1CC[C@@H](NCc2ccc(N(C)C)cc2C(F)(F)F)C[NH2+]1 ZINC000863649699 621693317 /nfs/dbraw/zinc/69/33/17/621693317.db2.gz GTTZKTFSJYQHEN-DGCLKSJQSA-N 2 0 315.383 3.002 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]CCC2CC[NH+](C(C)C)CC2)c1 ZINC000865716638 621982142 /nfs/dbraw/zinc/98/21/42/621982142.db2.gz CGMCMVGVPUFHJF-UHFFFAOYSA-N 2 0 320.477 3.391 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)c3ccccc3)cc2)CC1 ZINC000771818848 622799467 /nfs/dbraw/zinc/79/94/67/622799467.db2.gz MOFACGPIYOSISL-UHFFFAOYSA-N 2 0 323.484 3.463 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]3c3ccccc3)cc2)CC1 ZINC000775634736 623299222 /nfs/dbraw/zinc/29/92/22/623299222.db2.gz VUINDJRUAJNPIC-OAQYLSRUSA-N 2 0 321.468 3.385 20 10 DGCDRP CC[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775638590 623300807 /nfs/dbraw/zinc/30/08/07/623300807.db2.gz LQZAGPVOCIVGMN-GOSISDBHSA-N 2 0 301.478 3.203 20 10 DGCDRP CCCC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775652001 623304732 /nfs/dbraw/zinc/30/47/32/623304732.db2.gz DOYYRLKBWWOTBR-UHFFFAOYSA-N 2 0 301.478 3.203 20 10 DGCDRP CCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775658398 623306630 /nfs/dbraw/zinc/30/66/30/623306630.db2.gz NWURLBINUDDJCO-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP C[C@@H]1CC[C@H](C)[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775702753 623315501 /nfs/dbraw/zinc/31/55/01/623315501.db2.gz WLTHQWKBLWLTPL-SJORKVTESA-N 2 0 301.478 3.059 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4CCCC[C@@H]4C3)cc2)CC1 ZINC000775698740 623316116 /nfs/dbraw/zinc/31/61/16/623316116.db2.gz RZHCMPBSEYFECL-KDURUIRLSA-N 2 0 313.489 3.060 20 10 DGCDRP CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775998180 623362570 /nfs/dbraw/zinc/36/25/70/623362570.db2.gz DSLQLOWRMGPSCY-QFBILLFUSA-N 2 0 301.478 3.059 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)cc1 ZINC000796694290 626074084 /nfs/dbraw/zinc/07/40/84/626074084.db2.gz KZNPKPNRUFKILB-ZCNNSNEGSA-N 2 0 315.505 3.495 20 10 DGCDRP CC[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000806137153 626701147 /nfs/dbraw/zinc/70/11/47/626701147.db2.gz HIGKSKZEIXDONY-AEFFLSMTSA-N 2 0 319.468 3.246 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C4CC4)C3)cc2)CC1 ZINC000809786797 626952981 /nfs/dbraw/zinc/95/29/81/626952981.db2.gz LFNDMBJHFQCFGF-IBGZPJMESA-N 2 0 313.489 3.060 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+](C3CCC3)C3CCC3)cc2)CC1 ZINC000814177523 627546414 /nfs/dbraw/zinc/54/64/14/627546414.db2.gz FSPCMQSIMNXKQW-UHFFFAOYSA-N 2 0 313.489 3.345 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000815118357 627630061 /nfs/dbraw/zinc/63/00/61/627630061.db2.gz VGFVMNMMPLGDPL-DFNIBXOVSA-N 2 0 301.478 3.200 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815616812 627690981 /nfs/dbraw/zinc/69/09/81/627690981.db2.gz YRIGMQFORQLSJA-MRXNPFEDSA-N 2 0 308.466 3.018 20 10 DGCDRP CSC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC[NH+](C)CC1 ZINC000815627799 627692476 /nfs/dbraw/zinc/69/24/76/627692476.db2.gz JZXJSBQMZNMFMK-HNNXBMFYSA-N 2 0 322.518 3.487 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000817897834 627955235 /nfs/dbraw/zinc/95/52/35/627955235.db2.gz CCMLFNBVIGKVIZ-SLFFLAALSA-N 2 0 313.489 3.297 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)ccc21 ZINC000817901769 627957294 /nfs/dbraw/zinc/95/72/94/627957294.db2.gz YHSDSKCOXUXYOW-IPMKNSEASA-N 2 0 313.489 3.079 20 10 DGCDRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817965670 627977846 /nfs/dbraw/zinc/97/78/46/627977846.db2.gz BQRHIQSZRXCSAI-IFXJQAMLSA-N 2 0 302.462 3.311 20 10 DGCDRP C[C@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1ccccc1O ZINC000817984777 627983166 /nfs/dbraw/zinc/98/31/66/627983166.db2.gz ZSDJUDOIGJTBQJ-CYFGEWFFSA-N 2 0 300.446 3.196 20 10 DGCDRP [NH3+]C1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCCCC1 ZINC000841039611 630400532 /nfs/dbraw/zinc/40/05/32/630400532.db2.gz WJKUHQQHQUYBPJ-UHFFFAOYSA-N 2 0 301.478 3.428 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]CC2([NH3+])CCCCCC2)c1O ZINC000841042047 630400663 /nfs/dbraw/zinc/40/06/63/630400663.db2.gz DFZPCVFYTZQCQN-UHFFFAOYSA-N 2 0 312.841 3.196 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)cc1F ZINC000841072124 630404344 /nfs/dbraw/zinc/40/43/44/630404344.db2.gz HFEUTGKLBDTRGQ-QGZVFWFLSA-N 2 0 307.457 3.150 20 10 DGCDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000841079880 630405398 /nfs/dbraw/zinc/40/53/98/630405398.db2.gz NYKFSCNFSODFJL-LBPRGKRZSA-N 2 0 317.399 3.379 20 10 DGCDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000841079879 630405563 /nfs/dbraw/zinc/40/55/63/630405563.db2.gz NYKFSCNFSODFJL-GFCCVEGCSA-N 2 0 317.399 3.379 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000841086248 630405911 /nfs/dbraw/zinc/40/59/11/630405911.db2.gz GPMAUTXMAXRQBB-AZUAARDMSA-N 2 0 315.505 3.497 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841758040 630462920 /nfs/dbraw/zinc/46/29/20/630462920.db2.gz KBQQCFLOGYQXNT-GXTWGEPZSA-N 2 0 314.857 3.053 20 10 DGCDRP CC[NH2+]CC1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000843055765 630609530 /nfs/dbraw/zinc/60/95/30/630609530.db2.gz OTLWLGUXDXZUAN-WAYWQWQTSA-N 2 0 301.478 3.087 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC000843127919 630616898 /nfs/dbraw/zinc/61/68/98/630616898.db2.gz UPWILJXLWVHZHM-HOTGVXAUSA-N 2 0 318.461 3.003 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)cc1 ZINC000843128333 630616917 /nfs/dbraw/zinc/61/69/17/630616917.db2.gz WFYGAQISFCBMNT-IBGZPJMESA-N 2 0 315.505 3.354 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC000843128296 630617336 /nfs/dbraw/zinc/61/73/36/630617336.db2.gz VTJBZUUKOKGGME-CVEARBPZSA-N 2 0 318.461 3.003 20 10 DGCDRP C[N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000844221348 630713035 /nfs/dbraw/zinc/71/30/35/630713035.db2.gz WVEJGPFYVSEFEA-QGZVFWFLSA-N 2 0 301.478 3.108 20 10 DGCDRP C[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2[O-])[C@@H]1CC[NH3+] ZINC000844902100 630970646 /nfs/dbraw/zinc/97/06/46/630970646.db2.gz NKKKRONGSYQLHW-IINYFYTJSA-N 2 0 300.805 3.134 20 10 DGCDRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(N2CCCCC2)cc1 ZINC000844923068 630985668 /nfs/dbraw/zinc/98/56/68/630985668.db2.gz PTRXNDJEGFHQAY-INIZCTEOSA-N 2 0 301.478 3.457 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)c1O ZINC000846166097 631212953 /nfs/dbraw/zinc/21/29/53/631212953.db2.gz SENLVUPPUOGSDF-GJZGRUSLSA-N 2 0 306.450 3.316 20 10 DGCDRP CCc1cccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1O ZINC000848880229 631768232 /nfs/dbraw/zinc/76/82/32/631768232.db2.gz CNLHLVAOGHIAAB-UHFFFAOYSA-N 2 0 302.462 3.262 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1O ZINC000848887998 631773424 /nfs/dbraw/zinc/77/34/24/631773424.db2.gz KBVDTRFPPDOHLW-MRXNPFEDSA-N 2 0 302.462 3.262 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1O ZINC000849350167 631900793 /nfs/dbraw/zinc/90/07/93/631900793.db2.gz LLKMFBZNPFWHRK-INIZCTEOSA-N 2 0 318.461 3.003 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c(O)c1 ZINC000849349566 631900843 /nfs/dbraw/zinc/90/08/43/631900843.db2.gz DFAHMRDYJPOALD-MRXNPFEDSA-N 2 0 318.461 3.003 20 10 DGCDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185359430 660218564 /nfs/dbraw/zinc/21/85/64/660218564.db2.gz ULFLCHBTDTUFBH-CQSZACIVSA-N 2 0 302.462 3.263 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cc2c(cc1O)CCCC2 ZINC000185404174 660221500 /nfs/dbraw/zinc/22/15/00/660221500.db2.gz IHJHDYDQWAYAPQ-LSDHHAIUSA-N 2 0 302.462 3.263 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000185471904 660224775 /nfs/dbraw/zinc/22/47/75/660224775.db2.gz KFZVRNIXLPBTBC-DYVFJYSZSA-N 2 0 308.466 3.418 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000246894844 655553031 /nfs/dbraw/zinc/55/30/31/655553031.db2.gz UECOEFAOGXPMQS-PXNSSMCTSA-N 2 0 313.489 3.201 20 10 DGCDRP CC(=O)c1cc(Cl)cc(C[NH+]2CCC(C[NH+](C)C)CC2)c1O ZINC000314913989 656536893 /nfs/dbraw/zinc/53/68/93/656536893.db2.gz IJEBHAXNOYLQLS-UHFFFAOYSA-N 2 0 324.852 3.022 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC[NH+]2CCC(C)CC2)c1 ZINC000192936810 658813949 /nfs/dbraw/zinc/81/39/49/658813949.db2.gz PKIWZWBOBZBLJD-OAHLLOKOSA-N 2 0 306.450 3.173 20 10 DGCDRP [NH3+]CCC[N@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000230004426 659294432 /nfs/dbraw/zinc/29/44/32/659294432.db2.gz PKEUJVHDJYLACX-UHFFFAOYSA-N 2 0 304.821 3.397 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CC[NH+](C)CC1 ZINC000396471549 685227444 /nfs/dbraw/zinc/22/74/44/685227444.db2.gz XQUXJNZHALZMJS-MRXNPFEDSA-N 2 0 301.478 3.107 20 10 DGCDRP CN(Cc1cccs1)c1ccc(C[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC001578498269 1191946838 /nfs/dbraw/zinc/94/68/38/1191946838.db2.gz FWVRHMJGZLNZHB-IYBDPMFKSA-N 2 0 315.486 3.211 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1F ZINC001620964973 1192681538 /nfs/dbraw/zinc/68/15/38/1192681538.db2.gz MYNCFHVVRGSYOZ-MRXNPFEDSA-N 2 0 321.484 3.493 20 10 DGCDRP CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560258077 1189300294 /nfs/dbraw/zinc/30/02/94/1189300294.db2.gz SRWNBCFHWKOTJN-AZUAARDMSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560258079 1189300606 /nfs/dbraw/zinc/30/06/06/1189300606.db2.gz SRWNBCFHWKOTJN-QUCCMNQESA-N 2 0 315.505 3.497 20 10 DGCDRP CCOCc1cc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)ccc1OC ZINC001560358632 1189318667 /nfs/dbraw/zinc/31/86/67/1189318667.db2.gz QWGAGNAZUNBMCN-QZTJIDSGSA-N 2 0 320.477 3.194 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@H]3C3CCC3)cc2)CC1 ZINC001560985790 1189415660 /nfs/dbraw/zinc/41/56/60/1189415660.db2.gz LPORJOHKFAEXIH-PMACEKPBSA-N 2 0 313.489 3.107 20 10 DGCDRP Oc1c(C[NH2+]Cc2ccc3c[nH+]cn3c2)ccc2ccccc21 ZINC001652634704 1195630437 /nfs/dbraw/zinc/63/04/37/1195630437.db2.gz ANVOPFXJIMHHQV-UHFFFAOYSA-N 2 0 303.365 3.483 20 10 DGCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC001656244662 1196023235 /nfs/dbraw/zinc/02/32/35/1196023235.db2.gz XKMJRXWPEPDSCN-FQEVSTJZSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@@H](C[NH2+]Cc1ccc2c(c1)CCCO2)C[NH+]1CCCCC1 ZINC001656896987 1196081026 /nfs/dbraw/zinc/08/10/26/1196081026.db2.gz RFUUGZIOOGQHMK-INIZCTEOSA-N 2 0 302.462 3.223 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3C(C)(C)C3(C)C)cc2)CC1 ZINC001657226231 1196121218 /nfs/dbraw/zinc/12/12/18/1196121218.db2.gz WWJHEFJUSKEKAM-UHFFFAOYSA-N 2 0 315.505 3.210 20 10 DGCDRP CC[C@@]1(C)CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001658802184 1196302346 /nfs/dbraw/zinc/30/23/46/1196302346.db2.gz MZIVXSSHNJROLL-PMACEKPBSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@@H]([NH2+]Cc1cc(F)ccc1O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001658822077 1196305223 /nfs/dbraw/zinc/30/52/23/1196305223.db2.gz GYUGWCIURQFMGR-ZIAGYGMSSA-N 2 0 306.425 3.274 20 10 DGCDRP COc1ccc(O)c(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC001659420803 1196382006 /nfs/dbraw/zinc/38/20/06/1196382006.db2.gz PWPGXIOAUWZQCG-HUUCEWRRSA-N 2 0 318.461 3.143 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC4(CC4)C3)cc2)CC1 ZINC001663353573 1196842966 /nfs/dbraw/zinc/84/29/66/1196842966.db2.gz LVMUXZKHEOKTDL-GOSISDBHSA-N 2 0 313.489 3.251 20 10 DGCDRP CN1CCCc2cc(C[N@H+](C[C@H]3CCC[NH2+]C3)C3CC3)ccc21 ZINC000323675878 1197691283 /nfs/dbraw/zinc/69/12/83/1197691283.db2.gz GGCQBQCYEMSTQJ-KRWDZBQOSA-N 2 0 313.489 3.033 20 10 DGCDRP CC[NH+]1CCC([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000236919642 1202635487 /nfs/dbraw/zinc/63/54/87/1202635487.db2.gz LPBPLGPPAFPEQY-UHFFFAOYSA-N 2 0 301.478 3.251 20 10 DGCDRP c1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc2c1OCC2 ZINC001167964192 1085823334 /nfs/dbraw/zinc/82/33/34/1085823334.db2.gz NQBHSJADQMFJQU-YQQQUEKLSA-N 2 0 312.457 3.117 20 10 DGCDRP COc1ccc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c(O)c1 ZINC001203629348 1090768854 /nfs/dbraw/zinc/76/88/54/1090768854.db2.gz XJRRMWQDHKLRJX-DLBZAZTESA-N 2 0 318.461 3.240 20 10 DGCDRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001205009172 1091083333 /nfs/dbraw/zinc/08/33/33/1091083333.db2.gz IRCVWPYQIVOXEV-INIZCTEOSA-N 2 0 311.473 3.337 20 10 DGCDRP C[C@@H]1CC[NH2+]CC[N@@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001205333316 1091190168 /nfs/dbraw/zinc/19/01/68/1091190168.db2.gz ZZHJAUXCLKGFPR-CQSZACIVSA-N 2 0 314.404 3.382 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c(O)c1 ZINC001205582934 1091267296 /nfs/dbraw/zinc/26/72/96/1091267296.db2.gz ZUBJJJFLWBAOPF-SFHVURJKSA-N 2 0 308.441 3.343 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c1O ZINC001205592778 1091270464 /nfs/dbraw/zinc/27/04/64/1091270464.db2.gz YEPUIFIXBRHVTJ-OAHLLOKOSA-N 2 0 300.805 3.007 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@H]1C[NH3+] ZINC001205616820 1091282741 /nfs/dbraw/zinc/28/27/41/1091282741.db2.gz HBWSTUWBUBEBGY-HKUYNNGSSA-N 2 0 315.505 3.484 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)CC[C@H]1C[NH3+] ZINC001205638465 1091291792 /nfs/dbraw/zinc/29/17/92/1091291792.db2.gz OGRFWSGNYOTUFI-GJZGRUSLSA-N 2 0 304.478 3.497 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c(O)c1 ZINC001206003471 1091446588 /nfs/dbraw/zinc/44/65/88/1091446588.db2.gz IIGJHMLRQWHGEH-HOTGVXAUSA-N 2 0 319.493 3.045 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCC[C@@H]1C[NH3+] ZINC001206012510 1091450247 /nfs/dbraw/zinc/45/02/47/1091450247.db2.gz MAFGOEPVORPYPQ-HUUCEWRRSA-N 2 0 304.478 3.497 20 10 DGCDRP COc1cc(C[N@H+](C)Cc2cccs2)cc(C[NH+](C)C)c1O ZINC001139257122 1091501810 /nfs/dbraw/zinc/50/18/10/1091501810.db2.gz SCIZTZAVVAHLPF-UHFFFAOYSA-N 2 0 320.458 3.156 20 10 DGCDRP COc1cc(C[N@H+]2[C@H](C)CCC[C@@H]2C)cc(C[NH+](C)C)c1O ZINC001139253509 1091502591 /nfs/dbraw/zinc/50/25/91/1091502591.db2.gz WJJUEANVJJQPAE-OKILXGFUSA-N 2 0 306.450 3.225 20 10 DGCDRP CCCC1CC[NH+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)CC1 ZINC001139256437 1091502694 /nfs/dbraw/zinc/50/26/94/1091502694.db2.gz BEIHIYINGXFUOV-UHFFFAOYSA-N 2 0 320.477 3.475 20 10 DGCDRP COc1cc(C[NH+]2C3CCCC2CCC3)cc(C[NH+](C)C)c1O ZINC001139259153 1091504143 /nfs/dbraw/zinc/50/41/43/1091504143.db2.gz JWBSTYDKKDGYQP-UHFFFAOYSA-N 2 0 318.461 3.369 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]4CCC[C@H]4C3)cc2)CC1 ZINC001139408987 1091551602 /nfs/dbraw/zinc/55/16/02/1091551602.db2.gz RQRYOECKTSJOIX-OALUTQOASA-N 2 0 313.489 3.060 20 10 DGCDRP COc1cc(O)c(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)c(Cl)c1 ZINC001206325769 1091581973 /nfs/dbraw/zinc/58/19/73/1091581973.db2.gz JKGGSCVUPCNRQI-MRXNPFEDSA-N 2 0 312.841 3.005 20 10 DGCDRP C[C@@H]1CC[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001206770069 1091733484 /nfs/dbraw/zinc/73/34/84/1091733484.db2.gz QIJDBNRHYAFBGI-CVEARBPZSA-N 2 0 311.473 3.465 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@@H+]3C[C@@H](C[NH3+])CC[C@H]3C)c2c1 ZINC001206805714 1091748028 /nfs/dbraw/zinc/74/80/28/1091748028.db2.gz CRQVZALISDXYQH-ZIAGYGMSSA-N 2 0 314.429 3.113 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)C3CC(F)(F)C3)cc2)CC1 ZINC001140300069 1091819012 /nfs/dbraw/zinc/81/90/12/1091819012.db2.gz LKZURGIXLMBWPG-UHFFFAOYSA-N 2 0 323.431 3.058 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](CC3CC3)C3CC3)cc2)CC1 ZINC001140309341 1091819944 /nfs/dbraw/zinc/81/99/44/1091819944.db2.gz BSDWBTAGWIUCIU-UHFFFAOYSA-N 2 0 313.489 3.203 20 10 DGCDRP Cc1ccc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001140951012 1092076701 /nfs/dbraw/zinc/07/67/01/1092076701.db2.gz SZYXGBCLZJJSEX-BGYRXZFFSA-N 2 0 322.452 3.264 20 10 DGCDRP Cc1ccc(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001140951013 1092076868 /nfs/dbraw/zinc/07/68/68/1092076868.db2.gz SZYXGBCLZJJSEX-PMACEKPBSA-N 2 0 322.452 3.264 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]2C1 ZINC001143117075 1092618234 /nfs/dbraw/zinc/61/82/34/1092618234.db2.gz RKYFVNXPPBSBBY-IRXDYDNUSA-N 2 0 316.489 3.463 20 10 DGCDRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000319042941 1095371667 /nfs/dbraw/zinc/37/16/67/1095371667.db2.gz IJUDJQTVQLOUCG-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC001116565794 1095602368 /nfs/dbraw/zinc/60/23/68/1095602368.db2.gz XDISXFBNVGBZRE-GZBFAFLISA-N 2 0 306.425 3.401 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001116588332 1095608436 /nfs/dbraw/zinc/60/84/36/1095608436.db2.gz CTMRUIDLZNSIHS-HOTGVXAUSA-N 2 0 320.477 3.197 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC3(CCC[NH2+]C3)CC2)cc1Cl ZINC001222457491 1095623297 /nfs/dbraw/zinc/62/32/97/1095623297.db2.gz MCQHOXQIZKGZIG-UHFFFAOYSA-N 2 0 308.853 3.320 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc1 ZINC001118243723 1095966477 /nfs/dbraw/zinc/96/64/77/1095966477.db2.gz ZPDQGLXQTJBOSF-HWKANZROSA-N 2 0 313.489 3.231 20 10 DGCDRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC001173102458 1097328933 /nfs/dbraw/zinc/32/89/33/1097328933.db2.gz YGZIPRHLQILLME-UHFFFAOYSA-N 2 0 302.462 3.364 20 10 DGCDRP COc1cc(O)c(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)cc1Cl ZINC001206317768 1098731735 /nfs/dbraw/zinc/73/17/35/1098731735.db2.gz IIMLBRDIJONGSV-MRXNPFEDSA-N 2 0 312.841 3.005 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001235030864 1098759304 /nfs/dbraw/zinc/75/93/04/1098759304.db2.gz HBTPWWLRHLOYNM-HXUWFJFHSA-N 2 0 309.457 3.280 20 10 DGCDRP c1cc(N2CCCCC2)ccc1CN1CCCC[C@]12CC[NH2+]C2 ZINC001235118454 1098819464 /nfs/dbraw/zinc/81/94/64/1098819464.db2.gz VJGAYVAHBLCFQN-HXUWFJFHSA-N 2 0 313.489 3.395 20 10 DGCDRP CC(C)(C)c1cccc(C[NH+]2CCC(C3C[NH2+]C3)CC2)c1O ZINC001235339038 1098962619 /nfs/dbraw/zinc/96/26/19/1098962619.db2.gz GMAGDMJYDPVFOJ-UHFFFAOYSA-N 2 0 302.462 3.121 20 10 DGCDRP Nc1ccc(C[N@@H+]2CC[C@]3(c4ccccc4)CC[NH2+]C[C@@H]3C2)cc1 ZINC001235385196 1098989204 /nfs/dbraw/zinc/98/92/04/1098989204.db2.gz UCNPIMPMHKQSPA-CTNGQTDRSA-N 2 0 321.468 3.022 20 10 DGCDRP CCC[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235693581 1099132174 /nfs/dbraw/zinc/13/21/74/1099132174.db2.gz DGIBEWOPGXQRRJ-SFHVURJKSA-N 2 0 301.478 3.251 20 10 DGCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1c(O)ccc(F)c1Cl ZINC001235718310 1099146083 /nfs/dbraw/zinc/14/60/83/1099146083.db2.gz XMBUTNBNMMLMKU-UHFFFAOYSA-N 2 0 300.805 3.006 20 10 DGCDRP CCCC[NH+](CCCC)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001235835383 1099200711 /nfs/dbraw/zinc/20/07/11/1099200711.db2.gz URIVZPVXKIWDAF-UHFFFAOYSA-N 2 0 319.493 3.204 20 10 DGCDRP C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236071240 1099370703 /nfs/dbraw/zinc/37/07/03/1099370703.db2.gz HLMVPDIAMIJOTR-QGZVFWFLSA-N 2 0 321.468 3.043 20 10 DGCDRP CC[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236933924 1099882429 /nfs/dbraw/zinc/88/24/29/1099882429.db2.gz AXKDKRHIGYWXGV-KRWDZBQOSA-N 2 0 319.468 3.342 20 10 DGCDRP CC(C)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)CC1CC1 ZINC001236940438 1099882985 /nfs/dbraw/zinc/88/29/85/1099882985.db2.gz RCDQLNVSEYJFEP-UHFFFAOYSA-N 2 0 319.468 3.198 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@@H](C)C1 ZINC001236939660 1099883020 /nfs/dbraw/zinc/88/30/20/1099883020.db2.gz UCWBWXHQKIBNIK-CVEARBPZSA-N 2 0 319.468 3.198 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(CC3CC[NH2+]CC3)CC2)cc1 ZINC001236947130 1099886293 /nfs/dbraw/zinc/88/62/93/1099886293.db2.gz HOIOGBUBHAVGDZ-UHFFFAOYSA-N 2 0 315.505 3.354 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc1 ZINC001237379614 1100099472 /nfs/dbraw/zinc/09/94/72/1100099472.db2.gz CCGBSAIEODQGSC-IEBWSBKVSA-N 2 0 301.478 3.107 20 10 DGCDRP CC1CC[NH+](CCC[NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC001199022124 1102042045 /nfs/dbraw/zinc/04/20/45/1102042045.db2.gz VMLMLEMESJVVRW-UHFFFAOYSA-N 2 0 302.462 3.223 20 10 DGCDRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC001325743094 1103114666 /nfs/dbraw/zinc/11/46/66/1103114666.db2.gz JKGGQSGIGYSEPU-HUUCEWRRSA-N 2 0 307.457 3.322 20 10 DGCDRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC001326035746 1103189052 /nfs/dbraw/zinc/18/90/52/1103189052.db2.gz MEMAXTPTTKJAEH-WDEREUQCSA-N 2 0 315.255 3.112 20 10 DGCDRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccc3ccccc3c1O)C2 ZINC001276374322 1103697042 /nfs/dbraw/zinc/69/70/42/1103697042.db2.gz WFQJOTGXGGFWIU-FQEVSTJZSA-N 2 0 310.441 3.463 20 10 DGCDRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1C ZINC001246174306 1104420959 /nfs/dbraw/zinc/42/09/59/1104420959.db2.gz OHAKAKMESFOLER-NUJGCVRESA-N 2 0 301.478 3.011 20 10 DGCDRP Cc1cc(C)c(C[NH2+][C@@H]2CC[NH2+][C@@H](Cc3ccccc3)C2)c(O)c1 ZINC001246345244 1104500439 /nfs/dbraw/zinc/50/04/39/1104500439.db2.gz VWKMSCFEZJGYKQ-MOPGFXCFSA-N 2 0 324.468 3.462 20 10 DGCDRP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001255944376 1106346120 /nfs/dbraw/zinc/34/61/20/1106346120.db2.gz VMAPFWBJMZAMDL-KRWDZBQOSA-N 2 0 303.494 3.497 20 10 DGCDRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001319797782 1108638651 /nfs/dbraw/zinc/63/86/51/1108638651.db2.gz RZCAXXTUMILDPA-HZPDHXFCSA-N 2 0 319.468 3.055 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+](CC)CC)C2)c(O)c1 ZINC000093693578 431917682 /nfs/dbraw/zinc/91/76/82/431917682.db2.gz NKHAPYJUUSPHGL-INIZCTEOSA-N 2 0 320.477 3.345 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N(C)C)cc1 ZINC000152430717 432332209 /nfs/dbraw/zinc/33/22/09/432332209.db2.gz YDUAXUQRACYFKK-BEFAXECRSA-N 2 0 301.478 3.278 20 10 DGCDRP Cc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)c(O)c1C ZINC000278778199 432900688 /nfs/dbraw/zinc/90/06/88/432900688.db2.gz YECNSVDHBIZTHE-DOTOQJQBSA-N 2 0 320.477 3.161 20 10 DGCDRP C[NH+]1CCC2(CCC[N@H+](Cc3cc(Cl)ccc3O)C2)CC1 ZINC000376000160 433638383 /nfs/dbraw/zinc/63/83/83/433638383.db2.gz NSWVDMJKUADOAQ-UHFFFAOYSA-N 2 0 308.853 3.353 20 10 DGCDRP C[C@H](C[NH2+][C@H](C)c1ccc(Br)cc1O)C[NH+](C)C ZINC000293714115 433836624 /nfs/dbraw/zinc/83/66/24/433836624.db2.gz PBZZJOZPAABSEJ-GHMZBOCLSA-N 2 0 315.255 3.003 20 10 DGCDRP CC1CC[NH+](CCCC[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000295792559 434436487 /nfs/dbraw/zinc/43/64/87/434436487.db2.gz BRFLOBPIQCZSBS-KRWDZBQOSA-N 2 0 302.462 3.481 20 10 DGCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000743387915 575048654 /nfs/dbraw/zinc/04/86/54/575048654.db2.gz PLSNRZGUKQXPAA-HNNXBMFYSA-N 2 0 313.445 3.104 20 10 DGCDRP CCOCc1cc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)ccc1OC ZINC000747852775 575546266 /nfs/dbraw/zinc/54/62/66/575546266.db2.gz GFXBUAWMYDKMNY-KRWDZBQOSA-N 2 0 320.477 3.052 20 10 DGCDRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(C)cc(OC)c1O ZINC000894383332 618299337 /nfs/dbraw/zinc/29/93/37/618299337.db2.gz GHRDJJGJBRSWOX-HNNXBMFYSA-N 2 0 308.466 3.309 20 10 DGCDRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000925794354 618621159 /nfs/dbraw/zinc/62/11/59/618621159.db2.gz DJCJHKVHICQPCV-CKEIUWERSA-N 2 0 302.462 3.167 20 10 DGCDRP CCCC[NH+]1CCC([NH2+]Cc2cc(C)cc(OC)c2O)CC1 ZINC000894207583 618729663 /nfs/dbraw/zinc/72/96/63/618729663.db2.gz SQJZYNOXOHQSEX-UHFFFAOYSA-N 2 0 306.450 3.063 20 10 DGCDRP COc1cc(C)cc(C[N@H+](C)CCCC[NH+]2CCCCC2)c1O ZINC000895682201 618818113 /nfs/dbraw/zinc/81/81/13/618818113.db2.gz CTVQBPGLEUDLML-UHFFFAOYSA-N 2 0 320.477 3.407 20 10 DGCDRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000841028402 619165306 /nfs/dbraw/zinc/16/53/06/619165306.db2.gz DCOCLZSJOAZHMP-ZDUSSCGKSA-N 2 0 301.409 3.201 20 10 DGCDRP CC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(C(F)(F)F)cc1O ZINC000902485526 619646031 /nfs/dbraw/zinc/64/60/31/619646031.db2.gz LPTGNVDEPRVTFJ-IRUJWGPZSA-N 2 0 302.340 3.189 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903098252 619715926 /nfs/dbraw/zinc/71/59/26/619715926.db2.gz MGEPGZIDDJHQNE-XGSMCBPESA-N 2 0 313.489 3.308 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000858100268 621152852 /nfs/dbraw/zinc/15/28/52/621152852.db2.gz ASVBPFQGIUDRQR-QGZVFWFLSA-N 2 0 303.494 3.495 20 10 DGCDRP Cc1cc(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)ccc1N(C)C ZINC000923382319 621180319 /nfs/dbraw/zinc/18/03/19/621180319.db2.gz BVIWJLIWHFDXHA-INIZCTEOSA-N 2 0 301.478 3.025 20 10 DGCDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000839182837 621343822 /nfs/dbraw/zinc/34/38/22/621343822.db2.gz QCOJWVQIEADDDX-LJQANCHMSA-N 2 0 315.505 3.498 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000757640486 621730644 /nfs/dbraw/zinc/73/06/44/621730644.db2.gz XEZKOFIBLNMOGC-JSGCOSHPSA-N 2 0 306.425 3.401 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000757640490 621730665 /nfs/dbraw/zinc/73/06/65/621730665.db2.gz XEZKOFIBLNMOGC-TZMCWYRMSA-N 2 0 306.425 3.401 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000773752821 623067192 /nfs/dbraw/zinc/06/71/92/623067192.db2.gz KJMJYAYQJFNXDD-IBGZPJMESA-N 2 0 315.505 3.451 20 10 DGCDRP CC[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N(C)C)cc1 ZINC000873264788 623096671 /nfs/dbraw/zinc/09/66/71/623096671.db2.gz ROYKYXUMTWFEGF-RUENVJTFSA-N 2 0 301.478 3.324 20 10 DGCDRP CC(C)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC1CCC1 ZINC000775175940 623237555 /nfs/dbraw/zinc/23/75/55/623237555.db2.gz IBGJWMMWXBTLTG-UHFFFAOYSA-N 2 0 315.505 3.449 20 10 DGCDRP CC[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775654240 623305017 /nfs/dbraw/zinc/30/50/17/623305017.db2.gz JKYMZOQIPFGBCC-QGZVFWFLSA-N 2 0 301.478 3.060 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3C(C)(C)C)cc2)CC1 ZINC000775678994 623312748 /nfs/dbraw/zinc/31/27/48/623312748.db2.gz KVZAZOADAFUTBL-LJQANCHMSA-N 2 0 315.505 3.449 20 10 DGCDRP C[N@H+]1C[C@@H]2C[NH+](Cc3cc(-c4ccccc4)ccc3O)C[C@@H]2C1 ZINC000787305723 624999497 /nfs/dbraw/zinc/99/94/97/624999497.db2.gz NUJQOAYIPXOYRP-KDURUIRLSA-N 2 0 308.425 3.053 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000796772267 626081141 /nfs/dbraw/zinc/08/11/41/626081141.db2.gz PQWIAKNWJBEUHB-QRVBRYPASA-N 2 0 301.478 3.023 20 10 DGCDRP C[NH+]1CCC2(CCC[N@H+](Cc3c(O)cccc3Cl)C2)CC1 ZINC000798956784 626262399 /nfs/dbraw/zinc/26/23/99/626262399.db2.gz ORFGJOYOYWFJCH-UHFFFAOYSA-N 2 0 308.853 3.353 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)c(O)c1 ZINC000798957137 626262670 /nfs/dbraw/zinc/26/26/70/626262670.db2.gz WBTGLRDFFDOEQA-UHFFFAOYSA-N 2 0 318.461 3.099 20 10 DGCDRP CC[C@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000806137156 626701228 /nfs/dbraw/zinc/70/12/28/626701228.db2.gz HIGKSKZEIXDONY-WMZOPIPTSA-N 2 0 319.468 3.246 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C4CC4)C3)cc2)CC1 ZINC000809786798 626953026 /nfs/dbraw/zinc/95/30/26/626953026.db2.gz LFNDMBJHFQCFGF-LJQANCHMSA-N 2 0 313.489 3.060 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)cc1 ZINC000814178504 627547303 /nfs/dbraw/zinc/54/73/03/627547303.db2.gz SKQKYFKBJFETDF-LJQANCHMSA-N 2 0 301.478 3.060 20 10 DGCDRP Cc1cc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)ccc1N(C)C ZINC000815054067 627619969 /nfs/dbraw/zinc/61/99/69/627619969.db2.gz FXDHSKIVYHPQKP-SFHVURJKSA-N 2 0 303.494 3.367 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)ccc1N(C)C ZINC000815108129 627627409 /nfs/dbraw/zinc/62/74/09/627627409.db2.gz XVPGUXZKZZVUQK-UHFFFAOYSA-N 2 0 315.505 3.369 20 10 DGCDRP CSC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CC[NH+](C)CC1 ZINC000815627800 627692917 /nfs/dbraw/zinc/69/29/17/627692917.db2.gz JZXJSBQMZNMFMK-OAHLLOKOSA-N 2 0 322.518 3.487 20 10 DGCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)CC[C@@H]21 ZINC000816521237 627801874 /nfs/dbraw/zinc/80/18/74/627801874.db2.gz KLUPJGIADMOLFN-APWZRJJASA-N 2 0 310.441 3.462 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)c2c1c(F)ccc2O ZINC000925845997 627805249 /nfs/dbraw/zinc/80/52/49/627805249.db2.gz MXUXDABOVUUCQB-HMECXNKFSA-N 2 0 304.409 3.201 20 10 DGCDRP C[C@H]([NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1)c1ccc(N(C)C)cc1 ZINC000925887751 627812538 /nfs/dbraw/zinc/81/25/38/627812538.db2.gz LTCDGOOUPJCUIV-NBHGPNQESA-N 2 0 323.484 3.462 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000817895707 627954551 /nfs/dbraw/zinc/95/45/51/627954551.db2.gz ZPVCFOCGDWRVQS-AWEZNQCLSA-N 2 0 312.461 3.074 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N(C)C2CCCCC2)cc1)C1C[NH2+]C1 ZINC000817897182 627955671 /nfs/dbraw/zinc/95/56/71/627955671.db2.gz GQBLSVRHXYNYIH-HNNXBMFYSA-N 2 0 301.478 3.153 20 10 DGCDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817899569 627956226 /nfs/dbraw/zinc/95/62/26/627956226.db2.gz HCANJJJCZGLFSH-CQSZACIVSA-N 2 0 324.472 3.082 20 10 DGCDRP CC[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817937638 627966893 /nfs/dbraw/zinc/96/68/93/627966893.db2.gz YQWXOYPCORJSPA-ZDUSSCGKSA-N 2 0 302.340 3.204 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817945615 627970644 /nfs/dbraw/zinc/97/06/44/627970644.db2.gz HVFSSQNUBLUIQB-HZPDHXFCSA-N 2 0 319.468 3.466 20 10 DGCDRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817954824 627973697 /nfs/dbraw/zinc/97/36/97/627973697.db2.gz KVEJTMZFZXCNLH-JKSUJKDBSA-N 2 0 319.468 3.466 20 10 DGCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]C[C@H]([NH3+])C(C)C)c1O ZINC000817958767 627975075 /nfs/dbraw/zinc/97/50/75/627975075.db2.gz MHATWOARCQPWCF-MFKMUULPSA-N 2 0 315.255 3.097 20 10 DGCDRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1cc2c(cc1O)CCCC2 ZINC000817960146 627975808 /nfs/dbraw/zinc/97/58/08/627975808.db2.gz KYZSKWOMZHTCOU-OWQGQXMQSA-N 2 0 302.462 3.439 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCC2)cc1 ZINC000817976367 627980757 /nfs/dbraw/zinc/98/07/57/627980757.db2.gz KRVAEWKAZOTSGJ-QFBILLFUSA-N 2 0 313.489 3.470 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000817984836 627983423 /nfs/dbraw/zinc/98/34/23/627983423.db2.gz ASAYBCAGRJAFQQ-XOYOTBSWSA-N 2 0 301.478 3.181 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2c1c(F)ccc2O ZINC000817984882 627983512 /nfs/dbraw/zinc/98/35/12/627983512.db2.gz BITYIFDGAIQULH-DYEKYZERSA-N 2 0 304.409 3.344 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000818430889 628022699 /nfs/dbraw/zinc/02/26/99/628022699.db2.gz BABMAXNRRUYRFK-INIZCTEOSA-N 2 0 301.478 3.025 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1Cl ZINC000824933043 628708542 /nfs/dbraw/zinc/70/85/42/628708542.db2.gz ATLPQPPEKUDHKR-XJKSGUPXSA-N 2 0 308.853 3.270 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C/c2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000835026115 629828210 /nfs/dbraw/zinc/82/82/10/629828210.db2.gz QMDXNSFXYFLSPS-TVYZCSMLSA-N 2 0 315.505 3.428 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C3CC3)C3CCC3)cc2)CC1 ZINC000835068917 629843641 /nfs/dbraw/zinc/84/36/41/629843641.db2.gz JDBYHEPLTUIJLP-HXUWFJFHSA-N 2 0 313.489 3.107 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)c2c1c(F)ccc2O ZINC000840811205 630361376 /nfs/dbraw/zinc/36/13/76/630361376.db2.gz ZOPXSFSWUFGXLH-NFAWXSAZSA-N 2 0 306.425 3.401 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC(n3ccnc3)CC2)c(Cl)c1 ZINC000840912093 630376271 /nfs/dbraw/zinc/37/62/71/630376271.db2.gz GPXQDOJHMOTKSL-UHFFFAOYSA-N 2 0 305.809 3.388 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c(Cl)c1 ZINC000840920405 630378792 /nfs/dbraw/zinc/37/87/92/630378792.db2.gz GPUNFPSDPNUNJO-CZUORRHYSA-N 2 0 308.853 3.270 20 10 DGCDRP Cc1cc(Br)cc(C[NH2+][C@H](C)CCCC[NH3+])c1O ZINC000841079919 630405620 /nfs/dbraw/zinc/40/56/20/630405620.db2.gz ORNRYMHPKFJICI-LLVKDONJSA-N 2 0 315.255 3.070 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cc1 ZINC000841084227 630406016 /nfs/dbraw/zinc/40/60/16/630406016.db2.gz XQEMBNHDCHITNT-CTWCUAEASA-N 2 0 301.478 3.121 20 10 DGCDRP CCOc1cccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)c1O ZINC000841086834 630406204 /nfs/dbraw/zinc/40/62/04/630406204.db2.gz MZDIRGYCMBZXQQ-QGZVFWFLSA-N 2 0 314.429 3.361 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1F ZINC000841089395 630406655 /nfs/dbraw/zinc/40/66/55/630406655.db2.gz MKODREVFMOAZSR-INIZCTEOSA-N 2 0 319.468 3.436 20 10 DGCDRP C[C@H]([NH3+])C1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000843052160 630608946 /nfs/dbraw/zinc/60/89/46/630608946.db2.gz IRIUQYXCGPZYNF-INIZCTEOSA-N 2 0 301.478 3.236 20 10 DGCDRP CC[NH2+]CC1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000843055764 630609554 /nfs/dbraw/zinc/60/95/54/630609554.db2.gz OTLWLGUXDXZUAN-AATRIKPKSA-N 2 0 301.478 3.087 20 10 DGCDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000843129969 630617528 /nfs/dbraw/zinc/61/75/28/630617528.db2.gz VUJTWOPRHYYCRJ-GJZGRUSLSA-N 2 0 314.429 3.187 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(N(C)C)cc1 ZINC000844926415 630988085 /nfs/dbraw/zinc/98/80/85/630988085.db2.gz ZUXGVGJQPTYCJD-ZDUSSCGKSA-N 2 0 301.409 3.201 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]([NH3+])C3)cc2)CC1 ZINC000848717974 631733400 /nfs/dbraw/zinc/73/34/00/631733400.db2.gz DUXCKLHLJRMUTH-QZTJIDSGSA-N 2 0 301.478 3.282 20 10 DGCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000849350544 631901784 /nfs/dbraw/zinc/90/17/84/631901784.db2.gz PUNKVRWSFSMRFX-CQSZACIVSA-N 2 0 308.853 3.257 20 10 DGCDRP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1cc2c(cc1O)CCCC2 ZINC000184899717 660194342 /nfs/dbraw/zinc/19/43/42/660194342.db2.gz MAYIQYIBCRGEDA-HNNXBMFYSA-N 2 0 302.462 3.408 20 10 DGCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000160315496 655606006 /nfs/dbraw/zinc/60/60/06/655606006.db2.gz KNCFPCYIZHAARW-MRXNPFEDSA-N 2 0 316.489 3.435 20 10 DGCDRP Cc1cc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000172507629 659341304 /nfs/dbraw/zinc/34/13/04/659341304.db2.gz GNVIOZDCFLAKKQ-OAHLLOKOSA-N 2 0 304.478 3.382 20 10 DGCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2c(O)ccc3ccccc32)C1 ZINC000246197276 662250418 /nfs/dbraw/zinc/25/04/18/662250418.db2.gz AKRPREMIDIUEGI-QFBILLFUSA-N 2 0 310.441 3.462 20 10 DGCDRP CN(C)c1ccc(C[NH2+]CC2(C[NH+](C)C)CCCC2)cc1F ZINC001620895986 1192561232 /nfs/dbraw/zinc/56/12/32/1192561232.db2.gz VXSPWCXTBNJIBE-UHFFFAOYSA-N 2 0 307.457 3.103 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c1O ZINC001331527701 1178234302 /nfs/dbraw/zinc/23/43/02/1178234302.db2.gz CMJWNOHOJJNLNP-HNNXBMFYSA-N 2 0 306.450 3.063 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3cc4c(cc3O)CCC4)C[C@@H]2C1 ZINC001334723855 1178786392 /nfs/dbraw/zinc/78/63/92/1178786392.db2.gz HSICFGCSBPCZPY-JENIJYKNSA-N 2 0 314.473 3.043 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)cc1C ZINC001335238711 1178877727 /nfs/dbraw/zinc/87/77/27/1178877727.db2.gz TZPTXAZMEZYFCB-BQFCYCMXSA-N 2 0 302.462 3.171 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC001354234666 1180753684 /nfs/dbraw/zinc/75/36/84/1180753684.db2.gz ILRKIEAZHGJUQP-UPJWGTAASA-N 2 0 310.388 3.083 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)c1 ZINC001356057026 1181133664 /nfs/dbraw/zinc/13/36/64/1181133664.db2.gz LCIQFEAHTVFNBO-XYJFISCASA-N 2 0 302.462 3.171 20 10 DGCDRP CCOCc1cc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)ccc1OC ZINC001560358633 1189317929 /nfs/dbraw/zinc/31/79/29/1189317929.db2.gz QWGAGNAZUNBMCN-ROUUACIJSA-N 2 0 320.477 3.194 20 10 DGCDRP CC1(C)[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)[C@@H]2CCC[NH2+][C@H]21 ZINC001576389925 1191579637 /nfs/dbraw/zinc/57/96/37/1191579637.db2.gz NIZYANAQFZRDRI-GUDVDZBRSA-N 2 0 313.489 3.153 20 10 DGCDRP CC1(C)[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)[C@H]2CCC[NH2+][C@H]21 ZINC001576389932 1191580243 /nfs/dbraw/zinc/58/02/43/1191580243.db2.gz NIZYANAQFZRDRI-IPMKNSEASA-N 2 0 313.489 3.153 20 10 DGCDRP COc1cc(C)c(C[N@H+](C)CCCC[NH+]2CCCCC2)c(O)c1 ZINC001621497038 1193850734 /nfs/dbraw/zinc/85/07/34/1193850734.db2.gz UXZPPQPGDIPSOS-UHFFFAOYSA-N 2 0 320.477 3.407 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001652181230 1195558671 /nfs/dbraw/zinc/55/86/71/1195558671.db2.gz GSFNYALUCNNLST-KRWDZBQOSA-N 2 0 303.494 3.415 20 10 DGCDRP C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001656636290 1196056355 /nfs/dbraw/zinc/05/63/55/1196056355.db2.gz QVFXCOZYLSTFOO-VQIMIIECSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1ccc(C[NH2+]CC2(c3ccccc3)CC[NH+](C)CC2)c(O)c1 ZINC001660500278 1196492171 /nfs/dbraw/zinc/49/21/71/1196492171.db2.gz DAYOQOIMJZLLMD-UHFFFAOYSA-N 2 0 324.468 3.454 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC4(CC4)C3)cc2)CC1 ZINC001663353574 1196843131 /nfs/dbraw/zinc/84/31/31/1196843131.db2.gz LVMUXZKHEOKTDL-SFHVURJKSA-N 2 0 313.489 3.251 20 10 DGCDRP CC[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)C1CCCCC1 ZINC001204599221 1082637064 /nfs/dbraw/zinc/63/70/64/1082637064.db2.gz ULCWXRGDHQCVNA-UHFFFAOYSA-N 2 0 301.478 3.251 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C1CCC([NH+](C)C)CC1 ZINC001168329166 1087296179 /nfs/dbraw/zinc/29/61/79/1087296179.db2.gz NZJMGNDUVWDRTI-UHFFFAOYSA-N 2 0 303.494 3.447 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC001203935289 1090843364 /nfs/dbraw/zinc/84/33/64/1090843364.db2.gz BQFSBMNKUZXGGH-UHFFFAOYSA-N 2 0 324.472 3.250 20 10 DGCDRP CC(C)c1ccc(O)c(C[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)c1 ZINC001205406664 1091214000 /nfs/dbraw/zinc/21/40/00/1091214000.db2.gz SNIQTLFKVKRRNM-INIZCTEOSA-N 2 0 320.477 3.106 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)CC[C@@H]1C[NH3+] ZINC001205637047 1091290730 /nfs/dbraw/zinc/29/07/30/1091290730.db2.gz GHHNFOVOIVFIKK-HUUCEWRRSA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC[C@@H]1C[NH3+] ZINC001205638613 1091291880 /nfs/dbraw/zinc/29/18/80/1091291880.db2.gz PYMHIKXTIDKSDM-NWDGAFQWSA-N 2 0 316.367 3.218 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCC[C@@H]1C[NH3+] ZINC001205993488 1091440029 /nfs/dbraw/zinc/44/00/29/1091440029.db2.gz HUGBBOXACYZIFG-FUHWJXTLSA-N 2 0 301.478 3.094 20 10 DGCDRP CC[C@@H]1CCCC[N@@H+]1Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139258030 1091501491 /nfs/dbraw/zinc/50/14/91/1091501491.db2.gz KBCZQGOFHAOGRQ-MRXNPFEDSA-N 2 0 306.450 3.227 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)cc(C[NH+](C)C)c1O ZINC001139258229 1091503322 /nfs/dbraw/zinc/50/33/22/1091503322.db2.gz NBUPKHJDSSTALT-ZIAGYGMSSA-N 2 0 306.450 3.083 20 10 DGCDRP C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139404589 1091550186 /nfs/dbraw/zinc/55/01/86/1091550186.db2.gz PVWSUUJEDUMCHU-CALCHBBNSA-N 2 0 301.478 3.201 20 10 DGCDRP CCC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](C)CC ZINC001139404562 1091550213 /nfs/dbraw/zinc/55/02/13/1091550213.db2.gz OPNLBKKIANDYRN-QGZVFWFLSA-N 2 0 303.494 3.449 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)c(OC)c1 ZINC001206616794 1091690709 /nfs/dbraw/zinc/69/07/09/1091690709.db2.gz QHLBPWKIEFRXER-INIZCTEOSA-N 2 0 319.493 3.102 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c1O ZINC001140184456 1091794921 /nfs/dbraw/zinc/79/49/21/1091794921.db2.gz UXQCICGMWJCCEO-UHFFFAOYSA-N 2 0 302.462 3.317 20 10 DGCDRP CCC[NH+](CCC)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140301080 1091818459 /nfs/dbraw/zinc/81/84/59/1091818459.db2.gz YIOCKZYRUXGSEL-UHFFFAOYSA-N 2 0 303.494 3.451 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C)C[C@@H]3C)cc2)CC1 ZINC001140303832 1091819493 /nfs/dbraw/zinc/81/94/93/1091819493.db2.gz BKPBKGOCKRYNQJ-ROUUACIJSA-N 2 0 315.505 3.449 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)CC3CCCC3)cc2)CC1 ZINC001140306015 1091819735 /nfs/dbraw/zinc/81/97/35/1091819735.db2.gz KORXKLZVTLFDDF-UHFFFAOYSA-N 2 0 315.505 3.451 20 10 DGCDRP CC[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140309690 1091820208 /nfs/dbraw/zinc/82/02/08/1091820208.db2.gz QSQPGIHQTLNRQU-QGZVFWFLSA-N 2 0 301.478 3.060 20 10 DGCDRP C[C@@H](CC1CCCC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001207326579 1091925301 /nfs/dbraw/zinc/92/53/01/1091925301.db2.gz QWBAXMFLKUOKLE-KRWDZBQOSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[N@H+](CCC[NH+](C)C)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141078167 1092131586 /nfs/dbraw/zinc/13/15/86/1092131586.db2.gz NLPAOFOCXPKDHY-UHFFFAOYSA-N 2 0 315.505 3.159 20 10 DGCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc(Cl)c(OC)cc3O)(C1)CCC2 ZINC001276620455 1092674881 /nfs/dbraw/zinc/67/48/81/1092674881.db2.gz IOHGPHSYCKYXCH-DLBZAZTESA-N 2 0 324.852 3.209 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000314767421 1095065442 /nfs/dbraw/zinc/06/54/42/1095065442.db2.gz WHKOEUFBJFFAMA-YCPHGPKFSA-N 2 0 300.446 3.323 20 10 DGCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3cc4ccccc4cc3O)C[C@H]2CC1 ZINC001276812532 1095083199 /nfs/dbraw/zinc/08/31/99/1095083199.db2.gz HCVVKHDPUTVSJV-HDICACEKSA-N 2 0 310.441 3.319 20 10 DGCDRP C[N@@H+]1CCC2(C1)CC[NH+](Cc1cc3ccccc3cc1O)CC2 ZINC001276812950 1095090499 /nfs/dbraw/zinc/09/04/99/1095090499.db2.gz LMRPILCVSCNIAR-UHFFFAOYSA-N 2 0 310.441 3.463 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001337785085 1095095164 /nfs/dbraw/zinc/09/51/64/1095095164.db2.gz JMAYVYPTIRABPG-ARFHVFGLSA-N 2 0 320.477 3.195 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001337785088 1095095354 /nfs/dbraw/zinc/09/53/54/1095095354.db2.gz JMAYVYPTIRABPG-XHSDSOJGSA-N 2 0 320.477 3.195 20 10 DGCDRP CC(C)c1ccc(C[NH+]2CCC3(CC[N@H+](C)C3)CC2)c(O)c1 ZINC001276815713 1095145725 /nfs/dbraw/zinc/14/57/25/1095145725.db2.gz YIINKLPYBXXAAO-UHFFFAOYSA-N 2 0 302.462 3.433 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000316871784 1095198028 /nfs/dbraw/zinc/19/80/28/1095198028.db2.gz WNZLDZRJAGAMAG-UGUYLWEFSA-N 2 0 300.446 3.465 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c2ccccc21 ZINC001222141993 1095454145 /nfs/dbraw/zinc/45/41/45/1095454145.db2.gz UUXDUEBYLZTQTE-NRFANRHFSA-N 2 0 323.484 3.481 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222160285 1095466467 /nfs/dbraw/zinc/46/64/67/1095466467.db2.gz DSDNUALITGUMKR-HXUWFJFHSA-N 2 0 315.505 3.498 20 10 DGCDRP CC[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001173266043 1097389939 /nfs/dbraw/zinc/38/99/39/1097389939.db2.gz KLRDJHLDBJQKMS-WMZOPIPTSA-N 2 0 301.478 3.107 20 10 DGCDRP Oc1c(C[NH+]2CCN(c3cc[nH+]cc3)CC2)ccc2ccccc21 ZINC001231878784 1097878247 /nfs/dbraw/zinc/87/82/47/1097878247.db2.gz TYNWUGSCOPDLHO-UHFFFAOYSA-N 2 0 319.408 3.263 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1F ZINC001177823773 1098607525 /nfs/dbraw/zinc/60/75/25/1098607525.db2.gz ZNYQZLLPNFPXHR-KRWDZBQOSA-N 2 0 309.473 3.348 20 10 DGCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3cccc(-c4ccccc4)c3O)C[C@H]2C1 ZINC001234998299 1098741432 /nfs/dbraw/zinc/74/14/32/1098741432.db2.gz DTOCLMHYDWFBAB-RTBURBONSA-N 2 0 322.452 3.443 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[NH+]2CCC3(CC[NH2+]C3)CC2)c1 ZINC001235106996 1098806873 /nfs/dbraw/zinc/80/68/73/1098806873.db2.gz WTDQLYMBLDSNMV-UHFFFAOYSA-N 2 0 302.462 3.265 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CCCC23CC[NH2+]CC3)c(O)c1 ZINC001235144412 1098835920 /nfs/dbraw/zinc/83/59/20/1098835920.db2.gz LCDVEBCHGDGMGE-UHFFFAOYSA-N 2 0 302.462 3.408 20 10 DGCDRP Cc1cc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)ccc1N(C)C ZINC001235229643 1098903873 /nfs/dbraw/zinc/90/38/73/1098903873.db2.gz RWTAWEFHMXIAMA-LJQANCHMSA-N 2 0 315.505 3.415 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c(O)c1 ZINC001235239278 1098910734 /nfs/dbraw/zinc/91/07/34/1098910734.db2.gz UXXVAEDUFBPIHJ-GOSISDBHSA-N 2 0 318.461 3.145 20 10 DGCDRP CCc1ccc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c(O)c1 ZINC001235241124 1098914095 /nfs/dbraw/zinc/91/40/95/1098914095.db2.gz YOBGIQLWJGMJIA-SFHVURJKSA-N 2 0 302.462 3.309 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)cc1 ZINC001235269181 1098939896 /nfs/dbraw/zinc/93/98/96/1098939896.db2.gz LJSJNLKUUWYQKA-AZUAARDMSA-N 2 0 309.457 3.278 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC001235269186 1098940590 /nfs/dbraw/zinc/94/05/90/1098940590.db2.gz LJSJNLKUUWYQKA-UYAOXDASSA-N 2 0 309.457 3.278 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(C3C[NH2+]C3)CC2)c2ccccc21 ZINC001235334799 1098960498 /nfs/dbraw/zinc/96/04/98/1098960498.db2.gz HDPBFROPQPRXNH-UHFFFAOYSA-N 2 0 323.484 3.337 20 10 DGCDRP Cc1ccccc1C[N@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235663441 1099112770 /nfs/dbraw/zinc/11/27/70/1099112770.db2.gz VWOZRCJVKYZALH-UHFFFAOYSA-N 2 0 309.457 3.037 20 10 DGCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]2C1 ZINC001235680095 1099124297 /nfs/dbraw/zinc/12/42/97/1099124297.db2.gz HUKPELDRHUNEPI-IAGOWNOFSA-N 2 0 316.489 3.463 20 10 DGCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001235682902 1099125881 /nfs/dbraw/zinc/12/58/81/1099125881.db2.gz RIWRMTFOYZDTOE-ZBFHGGJFSA-N 2 0 302.462 3.073 20 10 DGCDRP CC(C)(C)c1cc(O)c(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)cc1Cl ZINC001235936104 1099270488 /nfs/dbraw/zinc/27/04/88/1099270488.db2.gz HTEBVWQSNUPRCT-JSGCOSHPSA-N 2 0 322.880 3.384 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@H+](C)[C@@H]3CCCC[C@H]3[NH3+])c2c1 ZINC001236215804 1099471976 /nfs/dbraw/zinc/47/19/76/1099471976.db2.gz IKEPUHHERFETQG-QZTJIDSGSA-N 2 0 314.429 3.256 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314341 1099528389 /nfs/dbraw/zinc/52/83/89/1099528389.db2.gz BHWUHTIHUNAJFK-KDURUIRLSA-N 2 0 313.489 3.108 20 10 DGCDRP CN(C)c1ccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c2ccccc21 ZINC001236315092 1099529779 /nfs/dbraw/zinc/52/97/79/1099529779.db2.gz VSBDCDWDPLNJBK-CALCHBBNSA-N 2 0 323.484 3.337 20 10 DGCDRP Cc1cc(F)cc(C[NH+]2CCC(CC3CC[NH2+]CC3)CC2)c1O ZINC001236963243 1099893080 /nfs/dbraw/zinc/89/30/80/1099893080.db2.gz XJRHCKVXFGOUHX-UHFFFAOYSA-N 2 0 320.452 3.441 20 10 DGCDRP CC[N@H+](CCC[NH+](C)C)Cc1cc(C(F)(F)F)ccc1O ZINC001237147011 1099996686 /nfs/dbraw/zinc/99/66/86/1099996686.db2.gz YGVUKPHHIULKCE-UHFFFAOYSA-N 2 0 304.356 3.185 20 10 DGCDRP Cc1cc(CN(C2CCC2)[C@H]2CCC[NH2+]C2)ccc1N(C)C ZINC001237156522 1100005419 /nfs/dbraw/zinc/00/54/19/1100005419.db2.gz XDBAWGZRBWTXSZ-SFHVURJKSA-N 2 0 301.478 3.168 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC001237379613 1100099624 /nfs/dbraw/zinc/09/96/24/1100099624.db2.gz CCGBSAIEODQGSC-HKUYNNGSSA-N 2 0 301.478 3.107 20 10 DGCDRP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1C ZINC001201557883 1102650989 /nfs/dbraw/zinc/65/09/89/1102650989.db2.gz NHBZWSAKPTWQDY-GOSISDBHSA-N 2 0 304.478 3.461 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201947404 1102767464 /nfs/dbraw/zinc/76/74/64/1102767464.db2.gz XUVGCJNACXVNIA-CRAIPNDOSA-N 2 0 314.473 3.364 20 10 DGCDRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC001325624827 1103085667 /nfs/dbraw/zinc/08/56/67/1103085667.db2.gz GDFMCLLOUUXXTM-HNNXBMFYSA-N 2 0 314.429 3.059 20 10 DGCDRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC001325743093 1103114521 /nfs/dbraw/zinc/11/45/21/1103114521.db2.gz JKGGQSGIGYSEPU-GJZGRUSLSA-N 2 0 307.457 3.322 20 10 DGCDRP CC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246175587 1104422334 /nfs/dbraw/zinc/42/23/34/1104422334.db2.gz UHMZZRUPHDAGPI-HXUWFJFHSA-N 2 0 323.484 3.207 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246311603 1104484160 /nfs/dbraw/zinc/48/41/60/1104484160.db2.gz QDBGZKZUKCHNON-KRWDZBQOSA-N 2 0 301.478 3.297 20 10 DGCDRP COc1ccc(C[NH2+]C2CCC3(CCC[NH2+]C3)CC2)cc1C ZINC001246346517 1104500049 /nfs/dbraw/zinc/50/00/49/1104500049.db2.gz MQDISONAFGUSRH-UHFFFAOYSA-N 2 0 302.462 3.406 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246529349 1104579859 /nfs/dbraw/zinc/57/98/59/1104579859.db2.gz GXGKQTUPBQBBHR-HBUWYVDXSA-N 2 0 302.462 3.363 20 10 DGCDRP CC(C)[C@H]1C[C@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)CC[NH2+]1 ZINC001246793612 1104679518 /nfs/dbraw/zinc/67/95/18/1104679518.db2.gz UYVXCVDBPUVOFP-WOJBJXKFSA-N 2 0 315.505 3.495 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@@H]2CC[NH2+][C@@H](C(C)(C)C)C2)cc1 ZINC001246901888 1104728468 /nfs/dbraw/zinc/72/84/68/1104728468.db2.gz PMJIIQJEUOCMFD-QZTJIDSGSA-N 2 0 303.494 3.351 20 10 DGCDRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1c(O)ccc3ccccc31)C2 ZINC001276078498 1105008946 /nfs/dbraw/zinc/00/89/46/1105008946.db2.gz QGIFDNFGHBZJOQ-FQEVSTJZSA-N 2 0 310.441 3.463 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC001256576298 1106449322 /nfs/dbraw/zinc/44/93/22/1106449322.db2.gz DXIRLZHUFCPVSS-UHFFFAOYSA-N 2 0 303.494 3.447 20 10 DGCDRP CCN(C)c1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC001320876919 1107172384 /nfs/dbraw/zinc/17/23/84/1107172384.db2.gz UAFNTGMATNLLCN-QFBILLFUSA-N 2 0 303.494 3.305 20 10 DGCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccc(N3CCCC3)cc2)C1 ZINC001261186396 1107356478 /nfs/dbraw/zinc/35/64/78/1107356478.db2.gz FWKYBICKVSEDPM-QUCCMNQESA-N 2 0 313.489 3.203 20 10 DGCDRP CN1CCCc2cc(C[NH+]3CCC4(CC[NH2+]CC4)CC3)ccc21 ZINC000391976916 1108798127 /nfs/dbraw/zinc/79/81/27/1108798127.db2.gz JVMXXFKISIAEIB-UHFFFAOYSA-N 2 0 313.489 3.035 20 10 DGCDRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001308253383 1111405400 /nfs/dbraw/zinc/40/54/00/1111405400.db2.gz RIRQGAYAUWJGNL-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@@H]4CC[C@@H](C4)C3)cc2)CC1 ZINC001308504063 1111435423 /nfs/dbraw/zinc/43/54/23/1111435423.db2.gz YOQAPVHJNVHORC-REPLKXPHSA-N 2 0 313.489 3.107 20 10 DGCDRP CC[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1O ZINC000155411962 288039217 /nfs/dbraw/zinc/03/92/17/288039217.db2.gz NFJQXTGOQOCQQT-JZXOWHBKSA-N 2 0 320.477 3.322 20 10 DGCDRP CCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)c(O)c1 ZINC000093639400 431915192 /nfs/dbraw/zinc/91/51/92/431915192.db2.gz JFGBYZKUDBPBRK-MAUKXSAKSA-N 2 0 320.477 3.343 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+](CC)CC)C2)c(O)c1 ZINC000093693576 431916761 /nfs/dbraw/zinc/91/67/61/431916761.db2.gz NKHAPYJUUSPHGL-MRXNPFEDSA-N 2 0 320.477 3.345 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2c([O-])ccc(Cl)c2F)C[C@@H]1n1ccnc1 ZINC000191442923 432265533 /nfs/dbraw/zinc/26/55/33/432265533.db2.gz SJPKRNAHUGEQES-FZMZJTMJSA-N 2 0 323.799 3.464 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)c(O)c1 ZINC000252799282 432388896 /nfs/dbraw/zinc/38/88/96/432388896.db2.gz AKBBALXAMRFFSH-YJBOKZPZSA-N 2 0 318.461 3.097 20 10 DGCDRP Cc1ccc(O)c(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000192933496 432431499 /nfs/dbraw/zinc/43/14/99/432431499.db2.gz PEBPHFNYIUOLCV-GOSISDBHSA-N 2 0 310.441 3.312 20 10 DGCDRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc2c(cc1O)CCCC2 ZINC000184997634 432454483 /nfs/dbraw/zinc/45/44/83/432454483.db2.gz VMYULVXJILNGIL-GJZGRUSLSA-N 2 0 314.473 3.406 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccccc1O)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272183375 432458296 /nfs/dbraw/zinc/45/82/96/432458296.db2.gz KNSVTZPQIHCRBO-APWZRJJASA-N 2 0 310.441 3.392 20 10 DGCDRP Cc1cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)ccc1N(C)C ZINC000293487001 433757141 /nfs/dbraw/zinc/75/71/41/433757141.db2.gz GGTBZQMTDMLVDV-JWTNVVGKSA-N 2 0 301.478 3.118 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000293836854 433887067 /nfs/dbraw/zinc/88/70/67/433887067.db2.gz XNKXTYWHQOXUQA-OAHLLOKOSA-N 2 0 306.450 3.318 20 10 DGCDRP [O-]c1cc(F)c(Cl)cc1CN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000295436027 434360113 /nfs/dbraw/zinc/36/01/13/434360113.db2.gz UDWAKAXUSWELQK-LBPRGKRZSA-N 2 0 312.816 3.102 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000556877848 435035098 /nfs/dbraw/zinc/03/50/98/435035098.db2.gz MRHVJSUCSNTFAD-RCCFBDPRSA-N 2 0 311.473 3.449 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1F ZINC000130559888 524051110 /nfs/dbraw/zinc/05/11/10/524051110.db2.gz IMVWYHKTORFPPN-UHFFFAOYSA-N 2 0 307.457 3.055 20 10 DGCDRP C[NH+](C)CC1CC[NH+](Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000738074508 574858766 /nfs/dbraw/zinc/85/87/66/574858766.db2.gz AJRSJIITNNMFQI-UHFFFAOYSA-N 2 0 320.477 3.169 20 10 DGCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000743393381 575049141 /nfs/dbraw/zinc/04/91/41/575049141.db2.gz POWXQBOPHKAMDT-HNNXBMFYSA-N 2 0 302.462 3.045 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1F ZINC000853093593 620667985 /nfs/dbraw/zinc/66/79/85/620667985.db2.gz ORMKFUFZSUYROP-KRWDZBQOSA-N 2 0 319.468 3.103 20 10 DGCDRP COc1ccc(N2CC[C@H]([NH2+][C@@H]3C[C@@H]([NH3+])c4ccccc43)C2)cc1 ZINC000854217189 620785198 /nfs/dbraw/zinc/78/51/98/620785198.db2.gz KKDCPIPQSGMKDN-VHKYSDTDSA-N 2 0 323.440 3.008 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N(C)C)cc2C)[C@@H](C)C1 ZINC000840917999 618529822 /nfs/dbraw/zinc/52/98/22/618529822.db2.gz XTOUBNMTDXREJJ-QFBILLFUSA-N 2 0 303.494 3.223 20 10 DGCDRP COc1cc(C)cc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c1O ZINC000894053765 618700443 /nfs/dbraw/zinc/70/04/43/618700443.db2.gz IMSITCGKNMAHTI-INIZCTEOSA-N 2 0 306.450 3.015 20 10 DGCDRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2cc(F)ccc2O)CC1 ZINC000896393489 618907534 /nfs/dbraw/zinc/90/75/34/618907534.db2.gz YJUAHWIYWDZTBS-UHFFFAOYSA-N 2 0 306.425 3.418 20 10 DGCDRP Cc1cccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1O ZINC000904476947 619924640 /nfs/dbraw/zinc/92/46/40/619924640.db2.gz VCDQDULWOXLYMF-XLIONFOSSA-N 2 0 324.424 3.046 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1F ZINC000841089398 620253888 /nfs/dbraw/zinc/25/38/88/620253888.db2.gz MKODREVFMOAZSR-MRXNPFEDSA-N 2 0 319.468 3.436 20 10 DGCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC000756450213 621639699 /nfs/dbraw/zinc/63/96/99/621639699.db2.gz RCEJVFWOIBZPOC-NFAWXSAZSA-N 2 0 306.425 3.401 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC34CCCC4)cc2)CC1 ZINC000758592076 621790695 /nfs/dbraw/zinc/79/06/95/621790695.db2.gz FDALPJOQOZYHKV-IBGZPJMESA-N 2 0 313.489 3.251 20 10 DGCDRP CCOc1cccc(C[NH2+]CCC2CC[NH+](C(C)C)CC2)c1O ZINC000865716636 621982105 /nfs/dbraw/zinc/98/21/05/621982105.db2.gz CEMVHCYFHLGQBY-UHFFFAOYSA-N 2 0 320.477 3.391 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1F ZINC000865765684 621991515 /nfs/dbraw/zinc/99/15/15/621991515.db2.gz HCJAFDIZUMDHCZ-UHFFFAOYSA-N 2 0 307.457 3.244 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)c1O ZINC000866516979 622131409 /nfs/dbraw/zinc/13/14/09/622131409.db2.gz FRYJTFLTISMZGY-WRSVWVKZSA-N 2 0 306.450 3.314 20 10 DGCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1)C1CC1 ZINC000765849727 622291361 /nfs/dbraw/zinc/29/13/61/622291361.db2.gz PEHCEDJOVGTEJW-GOSISDBHSA-N 2 0 319.468 3.246 20 10 DGCDRP CC(C)[N@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccc(N(C)C)cc1 ZINC000767349425 622391909 /nfs/dbraw/zinc/39/19/09/622391909.db2.gz SZSTUBPYMQGPPZ-IBGZPJMESA-N 2 0 303.494 3.447 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC000768546298 622463704 /nfs/dbraw/zinc/46/37/04/622463704.db2.gz IIHHNFLCIZKFQL-LJQANCHMSA-N 2 0 315.505 3.451 20 10 DGCDRP CCC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000773145666 622991554 /nfs/dbraw/zinc/99/15/54/622991554.db2.gz KWLFETKJZKOCNO-QGZVFWFLSA-N 2 0 315.505 3.497 20 10 DGCDRP CCCOc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1C ZINC000873130335 623043328 /nfs/dbraw/zinc/04/33/28/623043328.db2.gz BKBHMOFQUOXJNQ-AYHJJNSGSA-N 2 0 302.462 3.499 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000773766312 623070693 /nfs/dbraw/zinc/07/06/93/623070693.db2.gz RPJPIWSXUTVAEO-IEBWSBKVSA-N 2 0 301.478 3.059 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@H]([NH3+])Cc2ccccc2)c1 ZINC000873235697 623086472 /nfs/dbraw/zinc/08/64/72/623086472.db2.gz SDRFBTYJRFSWBD-HOCLYGCPSA-N 2 0 314.429 3.012 20 10 DGCDRP C[C@H]([NH2+]CC[C@@H]([NH3+])Cc1ccccc1)c1cc(F)ccc1O ZINC000873236238 623087064 /nfs/dbraw/zinc/08/70/64/623087064.db2.gz ZLPYQHQCUPWAQV-XJKSGUPXSA-N 2 0 302.393 3.142 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc2c(cc1O)CCCC2 ZINC000873263814 623096632 /nfs/dbraw/zinc/09/66/32/623096632.db2.gz KKAKNBHUFPJTMD-ZZCKCESHSA-N 2 0 314.473 3.452 20 10 DGCDRP Cc1ccccc1C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775642520 623301027 /nfs/dbraw/zinc/30/10/27/623301027.db2.gz LOAKCYHLHPLGJE-UHFFFAOYSA-N 2 0 323.484 3.379 20 10 DGCDRP Cc1ccc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775642275 623301176 /nfs/dbraw/zinc/30/11/76/623301176.db2.gz JDFIXCUGROWZFF-UHFFFAOYSA-N 2 0 323.484 3.379 20 10 DGCDRP Cc1cccc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000775650011 623303828 /nfs/dbraw/zinc/30/38/28/623303828.db2.gz WSUWFSCCIVCIPU-UHFFFAOYSA-N 2 0 323.484 3.379 20 10 DGCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](C)C(C)C ZINC000775663387 623308876 /nfs/dbraw/zinc/30/88/76/623308876.db2.gz AELYGXVGXQWWSI-QGZVFWFLSA-N 2 0 303.494 3.305 20 10 DGCDRP CC(C)C(C)(C)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000782534437 624261149 /nfs/dbraw/zinc/26/11/49/624261149.db2.gz CYCIGDBAPMIRBN-UHFFFAOYSA-N 2 0 303.494 3.210 20 10 DGCDRP C[C@H]1CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000783266081 624333119 /nfs/dbraw/zinc/33/31/19/624333119.db2.gz NEBHHIUZQXTYQE-OXJNMPFZSA-N 2 0 313.489 3.107 20 10 DGCDRP C[N@@H+]1CC[C@H]([NH2+]CCCSc2nccs2)[C@@H]2CCC[C@@H]21 ZINC000796772780 626080854 /nfs/dbraw/zinc/08/08/54/626080854.db2.gz VUMDGBSGUJPVKT-IHRRRGAJSA-N 2 0 311.520 3.088 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000796772263 626081149 /nfs/dbraw/zinc/08/11/49/626081149.db2.gz PQWIAKNWJBEUHB-IPMKNSEASA-N 2 0 301.478 3.023 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1F ZINC000798956741 626262492 /nfs/dbraw/zinc/26/24/92/626262492.db2.gz MBBKQRRGVXNYAY-UHFFFAOYSA-N 2 0 319.468 3.200 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1O ZINC000809767953 626950438 /nfs/dbraw/zinc/95/04/38/626950438.db2.gz YXBTYOWFAHCKMS-CZUORRHYSA-N 2 0 308.853 3.270 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C2CCCC2)cc1 ZINC000925512033 627744868 /nfs/dbraw/zinc/74/48/68/627744868.db2.gz YQVYUAMUFUTSMA-MOPGFXCFSA-N 2 0 301.478 3.011 20 10 DGCDRP [NH3+]C[C@@]1(c2ccccc2)C[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000925880788 627811154 /nfs/dbraw/zinc/81/11/54/627811154.db2.gz BHVJEDZVAPWISH-HLIPFELVSA-N 2 0 308.425 3.028 20 10 DGCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000816611921 627814378 /nfs/dbraw/zinc/81/43/78/627814378.db2.gz AJFHRZIIZQOHTK-XHDPSFHLSA-N 2 0 312.816 3.101 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](Cc1ccccc1)[C@H](C)[NH3+] ZINC000817894840 627954619 /nfs/dbraw/zinc/95/46/19/627954619.db2.gz QRVZSFSHBSGROH-JXFKEZNVSA-N 2 0 311.473 3.109 20 10 DGCDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817900831 627956102 /nfs/dbraw/zinc/95/61/02/627956102.db2.gz WPVASPJFHMDVFM-OAHLLOKOSA-N 2 0 324.472 3.300 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CCC[C@H]3C[NH3+])cc2)CC1 ZINC000817901238 627956790 /nfs/dbraw/zinc/95/67/90/627956790.db2.gz AFBFSGZNKUJMTB-HKUYNNGSSA-N 2 0 301.478 3.140 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)cc1F ZINC000817903190 627957061 /nfs/dbraw/zinc/95/70/61/627957061.db2.gz JOEXHFAMTHSZCH-WMLDXEAASA-N 2 0 307.457 3.150 20 10 DGCDRP c1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc2c1OCC2 ZINC000817902545 627957276 /nfs/dbraw/zinc/95/72/76/627957276.db2.gz TWERPXGPEIBYOY-RCCFBDPRSA-N 2 0 300.446 3.022 20 10 DGCDRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817945799 627970970 /nfs/dbraw/zinc/97/09/70/627970970.db2.gz MIFOOHYKRPMRNM-RISCZKNCSA-N 2 0 316.367 3.451 20 10 DGCDRP C[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)[C@H]1CCC[NH2+]C1 ZINC000817947195 627970982 /nfs/dbraw/zinc/97/09/82/627970982.db2.gz MKBZCNHCTBEGND-KEYYUXOJSA-N 2 0 302.462 3.310 20 10 DGCDRP CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817967023 627977862 /nfs/dbraw/zinc/97/78/62/627977862.db2.gz COGZYYSEATVHRW-CQSZACIVSA-N 2 0 314.351 3.371 20 10 DGCDRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000817970851 627979655 /nfs/dbraw/zinc/97/96/55/627979655.db2.gz GFQRNIGTUZQDSL-NUJGCVRESA-N 2 0 301.478 3.468 20 10 DGCDRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(Br)cc1O ZINC000817976245 627980974 /nfs/dbraw/zinc/98/09/74/627980974.db2.gz IRWSESSRMOUQMG-WDEREUQCSA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817976543 627981951 /nfs/dbraw/zinc/98/19/51/627981951.db2.gz NERKVNTXSSFJTQ-MNOVXSKESA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c2c1c(F)ccc2O ZINC000817985093 627983103 /nfs/dbraw/zinc/98/31/03/627983103.db2.gz ABZXAGCRHJYLSG-VVSAWPALSA-N 2 0 304.409 3.057 20 10 DGCDRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000817987217 627984298 /nfs/dbraw/zinc/98/42/98/627984298.db2.gz YHZSZBASKUJOGD-FUHWJXTLSA-N 2 0 301.478 3.468 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)c1O ZINC000818431790 628022201 /nfs/dbraw/zinc/02/22/01/628022201.db2.gz TVWNUPURBKUSJF-LBPRGKRZSA-N 2 0 324.852 3.018 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)cc1Cl ZINC000825935509 628811498 /nfs/dbraw/zinc/81/14/98/628811498.db2.gz WIDBZDOGJUHZRH-XJKSGUPXSA-N 2 0 308.853 3.270 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000835034419 629830304 /nfs/dbraw/zinc/83/03/04/629830304.db2.gz ANIGYISQPYKZOW-SNAWJCMRSA-N 2 0 313.489 3.372 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000835038861 629831228 /nfs/dbraw/zinc/83/12/28/629831228.db2.gz UQZYDYJYHNWCRS-PLNGDYQASA-N 2 0 301.478 3.087 20 10 DGCDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835038575 629831348 /nfs/dbraw/zinc/83/13/48/629831348.db2.gz UBTQVEJJWAEVGR-SUOMESGTSA-N 2 0 315.505 3.476 20 10 DGCDRP CN(C)c1ccc(/C=C\CN2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000835049257 629835450 /nfs/dbraw/zinc/83/54/50/629835450.db2.gz PIUQKFIJCGGTAM-LZCIBIBXSA-N 2 0 301.478 3.182 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000835052955 629837725 /nfs/dbraw/zinc/83/77/25/629837725.db2.gz IVBVXDIXBKQSPH-JBJGNSMKSA-N 2 0 313.489 3.182 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000835052953 629837906 /nfs/dbraw/zinc/83/79/06/629837906.db2.gz IVBVXDIXBKQSPH-DTRRYIFCSA-N 2 0 313.489 3.182 20 10 DGCDRP C[C@@H]1C[C@@H](C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)CC[NH2+]1 ZINC000841004175 630394304 /nfs/dbraw/zinc/39/43/04/630394304.db2.gz BNODEOJMHACPAJ-WBVHZDCISA-N 2 0 301.478 3.105 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H]1C[NH3+] ZINC000841100272 630407799 /nfs/dbraw/zinc/40/77/99/630407799.db2.gz AQYPQJARHGPTTP-AEFFLSMTSA-N 2 0 301.478 3.094 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841758044 630462806 /nfs/dbraw/zinc/46/28/06/630462806.db2.gz KBQQCFLOGYQXNT-JSGCOSHPSA-N 2 0 314.857 3.053 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)C2CCC([NH3+])CC2)cc1F ZINC000843055536 630609499 /nfs/dbraw/zinc/60/94/99/630609499.db2.gz GKKXXJZWGHJHSF-UHFFFAOYSA-N 2 0 307.457 3.374 20 10 DGCDRP C[NH2+]CCC1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000843057103 630609636 /nfs/dbraw/zinc/60/96/36/630609636.db2.gz BBWGTZODKWCCRQ-PLNGDYQASA-N 2 0 301.478 3.087 20 10 DGCDRP CCOc1ccc(C[N@H+](CCC[NH3+])Cc2ccccc2)c(O)c1 ZINC000843107167 630614704 /nfs/dbraw/zinc/61/47/04/630614704.db2.gz AQPSLAQXUMPBRD-UHFFFAOYSA-N 2 0 314.429 3.142 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)cc1F ZINC000843112648 630615226 /nfs/dbraw/zinc/61/52/26/630615226.db2.gz KHNWYVMKXDSBNA-OAHLLOKOSA-N 2 0 307.457 3.233 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc1F ZINC000843120176 630615825 /nfs/dbraw/zinc/61/58/25/630615825.db2.gz LACYSMTVBVLSPF-UHFFFAOYSA-N 2 0 319.468 3.247 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc1 ZINC000843125732 630616287 /nfs/dbraw/zinc/61/62/87/630616287.db2.gz GKKMLMPQVDXSSV-RTBURBONSA-N 2 0 315.505 3.354 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000843127020 630617319 /nfs/dbraw/zinc/61/73/19/630617319.db2.gz NXFXOVWBEVWKFW-ZRHASKPBSA-N 2 0 313.489 3.087 20 10 DGCDRP C[C@@H]([NH2+]CCCCCC[NH3+])c1cc(Br)ccc1O ZINC000843341188 630647482 /nfs/dbraw/zinc/64/74/82/630647482.db2.gz HHSHLXGQPSLEHP-LLVKDONJSA-N 2 0 315.255 3.324 20 10 DGCDRP C[C@@H]([NH2+]CCCCCC[NH3+])c1ccc(Br)cc1O ZINC000843342096 630647535 /nfs/dbraw/zinc/64/75/35/630647535.db2.gz NINZAPSFJVKXJF-LLVKDONJSA-N 2 0 315.255 3.324 20 10 DGCDRP Cc1cccc(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1O ZINC000843429577 630657425 /nfs/dbraw/zinc/65/74/25/630657425.db2.gz GYMVRJBPDJQXIW-MOPGFXCFSA-N 2 0 310.441 3.136 20 10 DGCDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000844904347 630972786 /nfs/dbraw/zinc/97/27/86/630972786.db2.gz IQTBECFXYFYWLQ-UHFFFAOYSA-N 2 0 304.821 3.363 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CCC[NH+]2CCC(C)CC2)c1O ZINC000846136295 631211476 /nfs/dbraw/zinc/21/14/76/631211476.db2.gz IEOVVQZSPXUKFQ-HNNXBMFYSA-N 2 0 306.450 3.173 20 10 DGCDRP CCCC[NH+]1CCC([NH2+][C@H](C)c2cccc(OC)c2O)CC1 ZINC000846142012 631211553 /nfs/dbraw/zinc/21/15/53/631211553.db2.gz QMKQEIGVILKLEX-CQSZACIVSA-N 2 0 306.450 3.316 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1O ZINC000846147249 631212078 /nfs/dbraw/zinc/21/20/78/631212078.db2.gz UAJYCEMGZUYFIE-CYBMUJFWSA-N 2 0 306.450 3.314 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)c1O ZINC000846146983 631212086 /nfs/dbraw/zinc/21/20/86/631212086.db2.gz UFFSPYBKHAEHAW-GJZGRUSLSA-N 2 0 306.450 3.173 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1O ZINC000848891548 631774935 /nfs/dbraw/zinc/77/49/35/631774935.db2.gz ZYOWWLUIFSRUNE-VQIMIIECSA-N 2 0 314.473 3.403 20 10 DGCDRP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)c(O)c(C(C)(C)C)c1 ZINC000850128654 632062023 /nfs/dbraw/zinc/06/20/23/632062023.db2.gz GNHWGAAYAFMQGE-CQSZACIVSA-N 2 0 320.477 3.130 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1O ZINC000850585339 632202441 /nfs/dbraw/zinc/20/24/41/632202441.db2.gz WHZZAVJOZMDHEO-AWEZNQCLSA-N 2 0 318.461 3.173 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000314965852 656546963 /nfs/dbraw/zinc/54/69/63/656546963.db2.gz VKAHSVLNPXNYOD-SFHVURJKSA-N 2 0 303.494 3.353 20 10 DGCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c1O ZINC000317473385 656619983 /nfs/dbraw/zinc/61/99/83/656619983.db2.gz CRFLJXRCKQXYSG-HNNXBMFYSA-N 2 0 324.852 3.018 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000164394918 658930626 /nfs/dbraw/zinc/93/06/26/658930626.db2.gz DSPAFAQJGNULOQ-SFHVURJKSA-N 2 0 302.462 3.459 20 10 DGCDRP CC[C@@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157715061 659093400 /nfs/dbraw/zinc/09/34/00/659093400.db2.gz XFGLFFUEDXRNIC-PKOBYXMFSA-N 2 0 301.478 3.278 20 10 DGCDRP CCc1cccc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c1O ZINC001578266230 1191935628 /nfs/dbraw/zinc/93/56/28/1191935628.db2.gz FQDVBZPBCNCKJL-QGZVFWFLSA-N 2 0 302.462 3.166 20 10 DGCDRP Cc1ccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(O)c1 ZINC001579696726 1191987753 /nfs/dbraw/zinc/98/77/53/1191987753.db2.gz BPVYAXKWNSFKGK-XLIONFOSSA-N 2 0 324.424 3.046 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH2+]CC[C@H]1CCC[NH2+]CC1 ZINC001580887734 1192043758 /nfs/dbraw/zinc/04/37/58/1192043758.db2.gz GKFSWVWBTSHOIN-KRWDZBQOSA-N 2 0 301.478 3.156 20 10 DGCDRP C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001620904385 1192570816 /nfs/dbraw/zinc/57/08/16/1192570816.db2.gz BSHAVQHJACQGGG-IEBWSBKVSA-N 2 0 315.505 3.497 20 10 DGCDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001473988416 1183843879 /nfs/dbraw/zinc/84/38/79/1183843879.db2.gz DEKWFYXMIRZUDQ-IBGZPJMESA-N 2 0 315.505 3.497 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001474025245 1183853022 /nfs/dbraw/zinc/85/30/22/1183853022.db2.gz YHECGTRYADFSNZ-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP CC[NH+](CC)CC[C@@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001474305085 1183901028 /nfs/dbraw/zinc/90/10/28/1183901028.db2.gz FLTAULBRDRIGNG-KBOKABMXSA-N 2 0 303.494 3.476 20 10 DGCDRP Cc1cc(O)c(C[NH2+]Cc2ccc3c[nH+]cn3c2)cc1Cl ZINC001621382555 1193836104 /nfs/dbraw/zinc/83/61/04/1193836104.db2.gz POQHLFVKIFXUDK-UHFFFAOYSA-N 2 0 301.777 3.292 20 10 DGCDRP C[C@H]1CCC[C@@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001656963153 1196087831 /nfs/dbraw/zinc/08/78/31/1196087831.db2.gz VAIMLKBMGIKTTO-PKOBYXMFSA-N 2 0 315.505 3.354 20 10 DGCDRP C[C@@H]1CCC[C@@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001656963151 1196087877 /nfs/dbraw/zinc/08/78/77/1196087877.db2.gz VAIMLKBMGIKTTO-IEBWSBKVSA-N 2 0 315.505 3.354 20 10 DGCDRP Cc1c2ccccc2n(C)c1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC001657886875 1196190618 /nfs/dbraw/zinc/19/06/18/1196190618.db2.gz CFMMMYMXMARETM-UHFFFAOYSA-N 2 0 311.473 3.451 20 10 DGCDRP CCC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCC1 ZINC001659915277 1196428262 /nfs/dbraw/zinc/42/82/62/1196428262.db2.gz NTIISOSXAFTBKM-HXUWFJFHSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001648815022 1081928457 /nfs/dbraw/zinc/92/84/57/1081928457.db2.gz YRPBFFCZGFEMEF-IRXDYDNUSA-N 2 0 316.489 3.469 20 10 DGCDRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001167841341 1084179607 /nfs/dbraw/zinc/17/96/07/1084179607.db2.gz KRXZBRUWJLUZOK-HNNXBMFYSA-N 2 0 320.477 3.357 20 10 DGCDRP Oc1ccccc1C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001203560833 1090756988 /nfs/dbraw/zinc/75/69/88/1090756988.db2.gz HDZOMLYEMDZSAV-UYAOXDASSA-N 2 0 322.452 3.346 20 10 DGCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001205591423 1091269904 /nfs/dbraw/zinc/26/99/04/1091269904.db2.gz MNQJAQKCTYXGIG-CQSZACIVSA-N 2 0 320.330 3.064 20 10 DGCDRP COc1cc(C[N@H+](C)Cc2ccccc2)cc(C[NH+](C)C)c1O ZINC001139253587 1091501517 /nfs/dbraw/zinc/50/15/17/1091501517.db2.gz ZLNHDXYJQRLGFL-UHFFFAOYSA-N 2 0 314.429 3.094 20 10 DGCDRP COc1cc(C[N@@H+]2CCCC[C@@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139252974 1091502198 /nfs/dbraw/zinc/50/21/98/1091502198.db2.gz HMVHXRRTRBLXKP-CQSZACIVSA-N 2 0 306.450 3.084 20 10 DGCDRP COc1cc(C[N@H+](C)CC2CCCC2)cc(C[NH+](C)C)c1O ZINC001139257814 1091502395 /nfs/dbraw/zinc/50/23/95/1091502395.db2.gz GZVCJSXXXFTRJR-UHFFFAOYSA-N 2 0 306.450 3.084 20 10 DGCDRP COc1cc(C[N@@H+]2CCCCC[C@H]2C)cc(C[NH+](C)C)c1O ZINC001139257057 1091502665 /nfs/dbraw/zinc/50/26/65/1091502665.db2.gz QBCLNMYWIJFVBJ-CQSZACIVSA-N 2 0 306.450 3.227 20 10 DGCDRP COc1cc(O)c(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)c(Cl)c1 ZINC001206572862 1091673136 /nfs/dbraw/zinc/67/31/36/1091673136.db2.gz GIJAFGVFLFPNRT-INIZCTEOSA-N 2 0 312.841 3.005 20 10 DGCDRP CCCC[N@H+](CC)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140300092 1091818949 /nfs/dbraw/zinc/81/89/49/1091818949.db2.gz MHYPGQIKVWBJAJ-UHFFFAOYSA-N 2 0 303.494 3.451 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@H](F)C3)cc2)CC1 ZINC001140302134 1091819544 /nfs/dbraw/zinc/81/95/44/1091819544.db2.gz KXTYVVQJLGTFEX-SFHVURJKSA-N 2 0 319.468 3.153 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)C2CCN(CC)CC2)c(O)c1 ZINC001140855222 1092031323 /nfs/dbraw/zinc/03/13/23/1092031323.db2.gz SFRAYVVZMABWPW-UHFFFAOYSA-N 2 0 319.493 3.155 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)CC1(C)CC[NH+](C)CC1 ZINC001208111343 1092200739 /nfs/dbraw/zinc/20/07/39/1092200739.db2.gz KLXFJNMFCVOPQU-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP Cc1c(C[N@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c2ccccc2n1C ZINC001276556544 1092201522 /nfs/dbraw/zinc/20/15/22/1092201522.db2.gz NPDCEYLVRKPUKJ-CALCHBBNSA-N 2 0 311.473 3.260 20 10 DGCDRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1cc3ccccc3cc1O)C2 ZINC001276812977 1095091305 /nfs/dbraw/zinc/09/13/05/1095091305.db2.gz LYURRFLAEDFAAD-FQEVSTJZSA-N 2 0 310.441 3.463 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000316871781 1095197918 /nfs/dbraw/zinc/19/79/18/1095197918.db2.gz WNZLDZRJAGAMAG-FPCVCCKLSA-N 2 0 300.446 3.465 20 10 DGCDRP COc1cccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1O ZINC001222161566 1095467525 /nfs/dbraw/zinc/46/75/25/1095467525.db2.gz PJNCTYXBTNSWTQ-IBGZPJMESA-N 2 0 318.461 3.147 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@]23CCC[NH2+]CC3)ccc1N(C)C ZINC001222314796 1095546535 /nfs/dbraw/zinc/54/65/35/1095546535.db2.gz IOGUWEQPFVZEQY-IBGZPJMESA-N 2 0 301.478 3.169 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1Cl ZINC001222314083 1095546690 /nfs/dbraw/zinc/54/66/90/1095546690.db2.gz BULNCUZPIZHGTE-QGZVFWFLSA-N 2 0 308.853 3.462 20 10 DGCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3cc(C)n(-c4ccccc4)c3C)C[C@H]2C1 ZINC001137858958 1095770158 /nfs/dbraw/zinc/77/01/58/1095770158.db2.gz BSDFJHXTBZRNMR-WOJBJXKFSA-N 2 0 323.484 3.478 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC001119610861 1096233082 /nfs/dbraw/zinc/23/30/82/1096233082.db2.gz IJHJXAORXUUVLL-FQEVSTJZSA-N 2 0 313.489 3.252 20 10 DGCDRP C[NH+](C)Cc1cc(F)cc(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001232149291 1097950925 /nfs/dbraw/zinc/95/09/25/1097950925.db2.gz LKSSZRDWAQDCFJ-UHFFFAOYSA-N 2 0 314.404 3.151 20 10 DGCDRP CCOCc1cc(C[NH2+]C[C@@H]2CCC[N@H+](CC)C2)ccc1OC ZINC001177542097 1098552882 /nfs/dbraw/zinc/55/28/82/1098552882.db2.gz JLFJRYCLOLAHLF-KRWDZBQOSA-N 2 0 320.477 3.053 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)c1O ZINC001234994456 1098739577 /nfs/dbraw/zinc/73/95/77/1098739577.db2.gz TZSKXFBCQSODAW-LJQANCHMSA-N 2 0 302.462 3.265 20 10 DGCDRP Cc1cccc(O)c1C[NH+]1CCC2(CC1)C[NH2+]Cc1ccccc12 ZINC001235091125 1098793557 /nfs/dbraw/zinc/79/35/57/1098793557.db2.gz ONENAQYMHWAJSS-UHFFFAOYSA-N 2 0 322.452 3.338 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCCCC23CC[NH2+]CC3)c1O ZINC001235191591 1098867639 /nfs/dbraw/zinc/86/76/39/1098867639.db2.gz SDWKKHILJBWETP-UHFFFAOYSA-N 2 0 308.853 3.462 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235230804 1098904492 /nfs/dbraw/zinc/90/44/92/1098904492.db2.gz QSWIIOIKWOQNMK-MRXNPFEDSA-N 2 0 308.853 3.400 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@H]3F)c1O ZINC001235408101 1099003842 /nfs/dbraw/zinc/00/38/42/1099003842.db2.gz UAGQBIIKYSABHH-VQIMIIECSA-N 2 0 320.452 3.213 20 10 DGCDRP Cc1cccc(CC[N@@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)c1 ZINC001235839001 1099202954 /nfs/dbraw/zinc/20/29/54/1099202954.db2.gz GKMCEOJOPINHCF-UHFFFAOYSA-N 2 0 323.484 3.079 20 10 DGCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]3CCCC[C@H]31)C[NH2+]CCO2 ZINC001235868989 1099226856 /nfs/dbraw/zinc/22/68/56/1099226856.db2.gz XWTQMIVIOHIJJS-WMLDXEAASA-N 2 0 316.445 3.029 20 10 DGCDRP COc1ccc2ccc(O)c(C[N@H+](C)[C@H]3CCCC[C@H]3[NH3+])c2c1 ZINC001236215801 1099471663 /nfs/dbraw/zinc/47/16/63/1099471663.db2.gz IKEPUHHERFETQG-MSOLQXFVSA-N 2 0 314.429 3.256 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)[C@H]2CC[C@H]([NH3+])CC2)c(OC)c1 ZINC001236223825 1099482376 /nfs/dbraw/zinc/48/23/76/1099482376.db2.gz QFTHBYAENUQKCV-QAQDUYKDSA-N 2 0 319.493 3.243 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236374086 1099561887 /nfs/dbraw/zinc/56/18/87/1099561887.db2.gz OXRHDKJJRWMESA-SFHVURJKSA-N 2 0 315.505 3.497 20 10 DGCDRP CC(C)C[NH+](Cc1ccc(N2CC[NH2+]CC2)cc1)CC(C)C ZINC000084857363 1099877497 /nfs/dbraw/zinc/87/74/97/1099877497.db2.gz TWPVVZCHYVWAJP-UHFFFAOYSA-N 2 0 303.494 3.210 20 10 DGCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236935235 1099881829 /nfs/dbraw/zinc/88/18/29/1099881829.db2.gz GUVAOLVNYZGGDX-INIZCTEOSA-N 2 0 319.468 3.200 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCCC34CC4)c(F)c2)CC1 ZINC001236942667 1099881907 /nfs/dbraw/zinc/88/19/07/1099881907.db2.gz LMNMLLYFNURFBH-UHFFFAOYSA-N 2 0 317.452 3.096 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)c(O)c1 ZINC001237415416 1100120277 /nfs/dbraw/zinc/12/02/77/1100120277.db2.gz NMAGKGIEZPMSEI-RHSMWYFYSA-N 2 0 302.462 3.264 20 10 DGCDRP Cc1cc(C)c(C[NH2+]C2CCC3(CC[NH2+]CC3)CC2)c(O)c1 ZINC001246343701 1104498747 /nfs/dbraw/zinc/49/87/47/1104498747.db2.gz OAQGTPHRRQHVRP-UHFFFAOYSA-N 2 0 302.462 3.411 20 10 DGCDRP Cc1cc(C)c(C[NH2+]C2CCC3(CCC[NH2+]C3)CC2)c(O)c1 ZINC001246341951 1104499551 /nfs/dbraw/zinc/49/95/51/1104499551.db2.gz CVQCTNQSWSFYOX-UHFFFAOYSA-N 2 0 302.462 3.411 20 10 DGCDRP Cc1cc(C)c(C[NH2+][C@@H]2CC[NH2+][C@H](Cc3ccccc3)C2)c(O)c1 ZINC001246345250 1104500672 /nfs/dbraw/zinc/50/06/72/1104500672.db2.gz VWKMSCFEZJGYKQ-RTBURBONSA-N 2 0 324.468 3.462 20 10 DGCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246523386 1104577688 /nfs/dbraw/zinc/57/76/88/1104577688.db2.gz GXGKQTUPBQBBHR-GLJUWKHASA-N 2 0 302.462 3.363 20 10 DGCDRP CC(C)[C@@H]1C[C@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)CC[NH2+]1 ZINC001246793610 1104679416 /nfs/dbraw/zinc/67/94/16/1104679416.db2.gz UYVXCVDBPUVOFP-UXHICEINSA-N 2 0 315.505 3.495 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CC[NH2+][C@H](C(C)C)C1 ZINC001246924385 1104738839 /nfs/dbraw/zinc/73/88/39/1104738839.db2.gz MFFVBEOUGYFTRE-OALUTQOASA-N 2 0 303.494 3.351 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CCC[NH+](C)C3)C2)cc1 ZINC001275833254 1104925964 /nfs/dbraw/zinc/92/59/64/1104925964.db2.gz DXJJRBAKUMSLCC-LJQANCHMSA-N 2 0 301.478 3.060 20 10 DGCDRP C[N@H+]1CC[C@H]2C[NH+](Cc3c(O)ccc4ccccc43)C[C@H]2CC1 ZINC001276077256 1105009211 /nfs/dbraw/zinc/00/92/11/1105009211.db2.gz BTZDRVZUPYGKQI-CALCHBBNSA-N 2 0 310.441 3.319 20 10 DGCDRP C[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccc(N4CCCC4)cc3)C2)C1 ZINC001261244933 1107370560 /nfs/dbraw/zinc/37/05/60/1107370560.db2.gz JHDQBKQTTZRSOM-FQEVSTJZSA-N 2 0 313.489 3.205 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H](C[NH3+])Cc2ccccc2)cc1 ZINC001262487928 1107717774 /nfs/dbraw/zinc/71/77/74/1107717774.db2.gz KFDJZOQTUDSKQA-TZIWHRDSSA-N 2 0 323.484 3.441 20 10 DGCDRP Nc1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC001262488123 1107717799 /nfs/dbraw/zinc/71/77/99/1107717799.db2.gz RDNYKTONEBGJBE-UHFFFAOYSA-N 2 0 301.478 3.357 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCCC3)cc2)[C@H](C)C1 ZINC001319717061 1108607653 /nfs/dbraw/zinc/60/76/53/1108607653.db2.gz KGKAYNOIMZDCOT-XLIONFOSSA-N 2 0 315.505 3.449 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)cc1F ZINC001308553123 1111443275 /nfs/dbraw/zinc/44/32/75/1111443275.db2.gz HETCWGRLVYBSND-LZLYRXPVSA-N 2 0 319.468 3.102 20 10 DGCDRP C[C@H]([NH2+]C1CCC(C)([NH+]2CCOCC2)CC1)c1ccccc1O ZINC001308902254 1111490310 /nfs/dbraw/zinc/49/03/10/1111490310.db2.gz LGYWHFXMPHFDHB-LYGPFTKASA-N 2 0 318.461 3.076 20 10 DGCDRP CCCOc1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)c(O)c1 ZINC000092381250 185315033 /nfs/dbraw/zinc/31/50/33/185315033.db2.gz ZEDGRZNLPICPCJ-UHFFFAOYSA-N 2 0 320.477 3.345 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000284297109 131067275 /nfs/dbraw/zinc/06/72/75/131067275.db2.gz YKELALAXAUHOJN-HOTGVXAUSA-N 2 0 308.466 3.016 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)c1 ZINC000184972765 432451293 /nfs/dbraw/zinc/45/12/93/432451293.db2.gz CQPGXPNMJANHNZ-AWEZNQCLSA-N 2 0 306.450 3.172 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cc(OC)ccc2O)CC1 ZINC000185563791 432510066 /nfs/dbraw/zinc/51/00/66/432510066.db2.gz KCJPTROESCMFQX-AWEZNQCLSA-N 2 0 306.450 3.173 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1 ZINC000193929057 432510961 /nfs/dbraw/zinc/51/09/61/432510961.db2.gz YHJNNTJOKWAEEC-CYBMUJFWSA-N 2 0 306.450 3.314 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000185670708 432522842 /nfs/dbraw/zinc/52/28/42/432522842.db2.gz ICXQCLCCOJIFPD-GXTWGEPZSA-N 2 0 314.857 3.053 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)c1 ZINC000186545763 432605457 /nfs/dbraw/zinc/60/54/57/432605457.db2.gz ZACDAZUGMJXWDO-HUUCEWRRSA-N 2 0 306.450 3.316 20 10 DGCDRP [O-]c1ccc(Cl)c(F)c1C[NH2+]Cc1cnc2n1CCCC2 ZINC000376757548 433814191 /nfs/dbraw/zinc/81/41/91/433814191.db2.gz IOVQHHYMNDYAEN-UHFFFAOYSA-N 2 0 309.772 3.007 20 10 DGCDRP Cc1cccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1O ZINC000180765603 524408606 /nfs/dbraw/zinc/40/86/06/524408606.db2.gz QQMLAXWETUJOLO-QAPCUYQASA-N 2 0 300.446 3.149 20 10 DGCDRP CCC[N@H+](Cc1ccccc1O)Cc1cccc2c1CC[NH2+]C2 ZINC000852744679 620644930 /nfs/dbraw/zinc/64/49/30/620644930.db2.gz GSZHMSPZSCSLTR-UHFFFAOYSA-N 2 0 310.441 3.450 20 10 DGCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c(O)c1 ZINC000853239283 620681114 /nfs/dbraw/zinc/68/11/14/620681114.db2.gz DHWZJFUJTWHIMY-RDJZCZTQSA-N 2 0 302.462 3.473 20 10 DGCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853241516 620681470 /nfs/dbraw/zinc/68/14/70/620681470.db2.gz WKFIPNZQQOOZBV-DOTOQJQBSA-N 2 0 302.462 3.473 20 10 DGCDRP C[C@H]([NH2+]CC1([NH3+])CCCC1)c1ccc(Br)cc1O ZINC000854224081 620785515 /nfs/dbraw/zinc/78/55/15/620785515.db2.gz VNJFQVPZAWZAOR-JTQLQIEISA-N 2 0 313.239 3.077 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCCCC[NH+]2CCCC2)c1O ZINC000894860687 618480951 /nfs/dbraw/zinc/48/09/51/618480951.db2.gz VHNSJKIURZKUBH-UHFFFAOYSA-N 2 0 306.450 3.065 20 10 DGCDRP COc1ccc(C[NH2+]C2CC[NH+](CCC(C)C)CC2)c(O)c1 ZINC000894185493 618726010 /nfs/dbraw/zinc/72/60/10/618726010.db2.gz PAJKULDHAPWOGF-UHFFFAOYSA-N 2 0 306.450 3.001 20 10 DGCDRP COc1cccc(O)c1C[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC000904412466 619921177 /nfs/dbraw/zinc/92/11/77/619921177.db2.gz UCLPADWGVIRZSV-OAHLLOKOSA-N 2 0 318.461 3.003 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000841090039 620257374 /nfs/dbraw/zinc/25/73/74/620257374.db2.gz UAEUWFHGTYEMDK-KRWDZBQOSA-N 2 0 301.478 3.297 20 10 DGCDRP C[C@H](C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)C[NH+]1CCCC1 ZINC000756422847 621637664 /nfs/dbraw/zinc/63/76/64/621637664.db2.gz MQEIWGAAAJPSOM-VNHYZAJKSA-N 2 0 306.425 3.401 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)C3CCC3)cc2F)CC1 ZINC000765853419 622291185 /nfs/dbraw/zinc/29/11/85/622291185.db2.gz RVIGVFNJDLXURC-HNNXBMFYSA-N 2 0 319.468 3.246 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)C3CCC3)cc2F)CC1 ZINC000765853420 622291230 /nfs/dbraw/zinc/29/12/30/622291230.db2.gz RVIGVFNJDLXURC-OAHLLOKOSA-N 2 0 319.468 3.246 20 10 DGCDRP COc1cc(C)cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c1O ZINC000766379178 622325729 /nfs/dbraw/zinc/32/57/29/622325729.db2.gz BHGVPIFGDAETGJ-UHFFFAOYSA-N 2 0 320.477 3.263 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1F ZINC000768304101 622449773 /nfs/dbraw/zinc/44/97/73/622449773.db2.gz WTFDHKUJXJIEPX-UHFFFAOYSA-N 2 0 321.484 3.446 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c(O)c1 ZINC000769467703 622530023 /nfs/dbraw/zinc/53/00/23/622530023.db2.gz ZRUYYRGGLIYSOG-QGZVFWFLSA-N 2 0 318.461 3.241 20 10 DGCDRP CCC[N@H+](C)C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506120 622535315 /nfs/dbraw/zinc/53/53/15/622535315.db2.gz ATVQBAWNTNGSMX-MRXNPFEDSA-N 2 0 307.457 3.055 20 10 DGCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000876810522 623712174 /nfs/dbraw/zinc/71/21/74/623712174.db2.gz ANJPUINYTUSPRM-QAPCUYQASA-N 2 0 300.446 3.149 20 10 DGCDRP C[C@@H]([NH2+]CCC[NH2+][C@H](C)c1ccccc1O)c1ccccc1O ZINC000879648821 624623054 /nfs/dbraw/zinc/62/30/54/624623054.db2.gz AVATXWZNICNRFK-HUUCEWRRSA-N 2 0 314.429 3.489 20 10 DGCDRP Cc1ccsc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883284285 626636602 /nfs/dbraw/zinc/63/66/02/626636602.db2.gz JVCNAYFELZCAKA-UHFFFAOYSA-N 2 0 315.486 3.098 20 10 DGCDRP COc1cccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1O ZINC000809738512 626943994 /nfs/dbraw/zinc/94/39/94/626943994.db2.gz YBIGTZYNNBKAMF-UHFFFAOYSA-N 2 0 314.429 3.094 20 10 DGCDRP CSC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CC[NH+](C)CC1 ZINC000810252050 626992232 /nfs/dbraw/zinc/99/22/32/626992232.db2.gz HBALBVOBXKTMCY-GFCCVEGCSA-N 2 0 312.454 3.009 20 10 DGCDRP Cc1cc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)ccc1N(C)C ZINC000815034146 627618092 /nfs/dbraw/zinc/61/80/92/627618092.db2.gz FFWBRNQZIIKRQN-UHFFFAOYSA-N 2 0 303.494 3.366 20 10 DGCDRP CC(C)[C@@H]1[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1(C)C ZINC000816624973 627816687 /nfs/dbraw/zinc/81/66/87/627816687.db2.gz NEMRPHQDVVBPBE-IBGZPJMESA-N 2 0 315.505 3.305 20 10 DGCDRP CC[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817941782 627968429 /nfs/dbraw/zinc/96/84/29/627968429.db2.gz RNLQCQPFYOCZSZ-CQSZACIVSA-N 2 0 316.367 3.451 20 10 DGCDRP C[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)[C@@H]1CCC[NH2+]C1 ZINC000817947192 627970524 /nfs/dbraw/zinc/97/05/24/627970524.db2.gz MKBZCNHCTBEGND-JKIFEVAISA-N 2 0 302.462 3.310 20 10 DGCDRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817954823 627972989 /nfs/dbraw/zinc/97/29/89/627972989.db2.gz KVEJTMZFZXCNLH-HZPDHXFCSA-N 2 0 319.468 3.466 20 10 DGCDRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817955567 627973882 /nfs/dbraw/zinc/97/38/82/627973882.db2.gz ZAPWNVLWKIJNIO-SJORKVTESA-N 2 0 301.478 3.327 20 10 DGCDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000817970463 627978748 /nfs/dbraw/zinc/97/87/48/627978748.db2.gz WHNOJOHECDPVTQ-BPNCWPANSA-N 2 0 316.367 3.450 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000817971195 627979605 /nfs/dbraw/zinc/97/96/05/627979605.db2.gz KKEHYUWFIWEFMY-GJYPPUQNSA-N 2 0 301.478 3.326 20 10 DGCDRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCC2)cc1 ZINC000817976368 627980881 /nfs/dbraw/zinc/98/08/81/627980881.db2.gz KRVAEWKAZOTSGJ-VQIMIIECSA-N 2 0 313.489 3.470 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cc2c(cc1O)CCCC2 ZINC000817977048 627981939 /nfs/dbraw/zinc/98/19/39/627981939.db2.gz ZRSVSBLIYSGKIP-UGSOOPFHSA-N 2 0 300.446 3.064 20 10 DGCDRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc2c(cc1O)CCCC2 ZINC000817979535 627981986 /nfs/dbraw/zinc/98/19/86/627981986.db2.gz BQRGSTYEFBBFFS-YOEHRIQHSA-N 2 0 302.462 3.454 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CCC(C)([NH+]3CCC3)CC2)c1 ZINC000927038831 628001790 /nfs/dbraw/zinc/00/17/90/628001790.db2.gz RASPWOQFKWYHBR-TZGCNFNXSA-N 2 0 318.461 3.458 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)cc1Cl ZINC000825935508 628811518 /nfs/dbraw/zinc/81/15/18/628811518.db2.gz WIDBZDOGJUHZRH-CZUORRHYSA-N 2 0 308.853 3.270 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](CCF)C3)cc2)CC1 ZINC000827270788 628943717 /nfs/dbraw/zinc/94/37/17/628943717.db2.gz FZHYKAXNHNFGFI-QGZVFWFLSA-N 2 0 319.468 3.010 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000840949418 630383207 /nfs/dbraw/zinc/38/32/07/630383207.db2.gz WZZPLUPXEAGXQP-LJQANCHMSA-N 2 0 315.505 3.225 20 10 DGCDRP C[C@@H]1C[C@H](C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)CC[NH2+]1 ZINC000841004173 630394324 /nfs/dbraw/zinc/39/43/24/630394324.db2.gz BNODEOJMHACPAJ-NVXWUHKLSA-N 2 0 301.478 3.105 20 10 DGCDRP CCOc1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(O)c1 ZINC000841087839 630406602 /nfs/dbraw/zinc/40/66/02/630406602.db2.gz VTHGNVLWEUUAQX-SFHVURJKSA-N 2 0 314.429 3.361 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841753184 630462346 /nfs/dbraw/zinc/46/23/46/630462346.db2.gz KXCGXXMJSUOODM-ZDUSSCGKSA-N 2 0 314.857 3.055 20 10 DGCDRP CCOc1cccc(C[N@H+](CCC[NH3+])CC2CCCC2)c1O ZINC000843124299 630615645 /nfs/dbraw/zinc/61/56/45/630615645.db2.gz XTKLOVFSAUHZGA-UHFFFAOYSA-N 2 0 306.450 3.132 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1 ZINC000843125223 630616256 /nfs/dbraw/zinc/61/62/56/630616256.db2.gz OKYAZNJCUAGJPP-LWHVHZMOSA-N 2 0 313.489 3.087 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)c(Cl)c1 ZINC000843126295 630616481 /nfs/dbraw/zinc/61/64/81/630616481.db2.gz HXNGMWCTOOXXBI-CQSZACIVSA-N 2 0 308.853 3.176 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)c1O ZINC000843127730 630616848 /nfs/dbraw/zinc/61/68/48/630616848.db2.gz SWMCUSVWEYSGNY-CQSZACIVSA-N 2 0 308.853 3.176 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cc1F ZINC000843127459 630616907 /nfs/dbraw/zinc/61/69/07/630616907.db2.gz REZKLNYHIVVWPN-IAGOWNOFSA-N 2 0 319.468 3.103 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2)c2c1c(F)ccc2O ZINC000843344082 630648209 /nfs/dbraw/zinc/64/82/09/630648209.db2.gz PPXZWBMDYRJPLI-XHDPSFHLSA-N 2 0 300.377 3.328 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1O ZINC000846147252 631212000 /nfs/dbraw/zinc/21/20/00/631212000.db2.gz UAJYCEMGZUYFIE-ZDUSSCGKSA-N 2 0 306.450 3.314 20 10 DGCDRP CCc1ccc(C)[nH+]c1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000849347425 631899559 /nfs/dbraw/zinc/89/95/59/631899559.db2.gz JAIPCFQIRQHJNJ-UHFFFAOYSA-N 2 0 324.472 3.316 20 10 DGCDRP CCOc1ccc(O)c(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c1 ZINC000849350288 631900459 /nfs/dbraw/zinc/90/04/59/631900459.db2.gz NATBSVHKRDRUJF-MRXNPFEDSA-N 2 0 318.461 3.003 20 10 DGCDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000850034830 632034651 /nfs/dbraw/zinc/03/46/51/632034651.db2.gz REIREGXTXQZYSL-CQSZACIVSA-N 2 0 320.477 3.130 20 10 DGCDRP COc1cc(C[NH2+][C@@H](C)CC[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC000850097174 632055224 /nfs/dbraw/zinc/05/52/24/632055224.db2.gz SWFHSZNXHDMSIH-ZDUSSCGKSA-N 2 0 308.466 3.128 20 10 DGCDRP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)c(O)c(C(C)(C)C)c1 ZINC000850128653 632061909 /nfs/dbraw/zinc/06/19/09/632061909.db2.gz GNHWGAAYAFMQGE-AWEZNQCLSA-N 2 0 320.477 3.130 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)cc1 ZINC000852106467 632555973 /nfs/dbraw/zinc/55/59/73/632555973.db2.gz YVDAKHGIJJCTCM-LJQANCHMSA-N 2 0 301.478 3.060 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000185471942 656126856 /nfs/dbraw/zinc/12/68/56/656126856.db2.gz KFZVRNIXLPBTBC-CXAGYDPISA-N 2 0 308.466 3.418 20 10 DGCDRP C[NH+]1CCC(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000065996767 656864466 /nfs/dbraw/zinc/86/44/66/656864466.db2.gz HQCIAKDXFHOKFS-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000246741074 662273738 /nfs/dbraw/zinc/27/37/38/662273738.db2.gz OFYVKLGKVSSKBW-QFBILLFUSA-N 2 0 314.473 3.458 20 10 DGCDRP COc1cc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])c(O)c(C(C)(C)C)c1 ZINC001579152677 1191967892 /nfs/dbraw/zinc/96/78/92/1191967892.db2.gz AAJFETRPQHBMJS-DYVFJYSZSA-N 2 0 320.477 3.305 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3cc4c(cc3O)CCC4)C[C@H]2C1 ZINC001334723856 1178786096 /nfs/dbraw/zinc/78/60/96/1178786096.db2.gz HSICFGCSBPCZPY-YQVWRLOYSA-N 2 0 314.473 3.043 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3cc4c(cc3O)CCC4)C[C@@H]2C1 ZINC001334723858 1178786272 /nfs/dbraw/zinc/78/62/72/1178786272.db2.gz HSICFGCSBPCZPY-ZIFCJYIRSA-N 2 0 314.473 3.043 20 10 DGCDRP CC1CC[NH+](C2CCC([NH2+]Cc3ccc(N)cc3)CC2)CC1 ZINC001345159340 1179535659 /nfs/dbraw/zinc/53/56/59/1179535659.db2.gz GLWRUGHCDNPTHP-UHFFFAOYSA-N 2 0 301.478 3.402 20 10 DGCDRP CC1(C)[C@@H]2[NH2+]CCC[C@H]2[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001576389939 1191581552 /nfs/dbraw/zinc/58/15/52/1191581552.db2.gz NIZYANAQFZRDRI-QRVBRYPASA-N 2 0 313.489 3.153 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1 ZINC001656181526 1196014381 /nfs/dbraw/zinc/01/43/81/1196014381.db2.gz FOJJTALKBWNRNJ-BQYQJAHWSA-N 2 0 315.505 3.477 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c1 ZINC001658028665 1196204042 /nfs/dbraw/zinc/20/40/42/1196204042.db2.gz YTDSFGCHOOQTFO-AEFFLSMTSA-N 2 0 302.462 3.432 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c1 ZINC001658192767 1196222940 /nfs/dbraw/zinc/22/29/40/1196222940.db2.gz CTROBVMJKGZHCE-IBGZPJMESA-N 2 0 302.462 3.433 20 10 DGCDRP Cc1cc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@H](C)C2)ccc1N(C)C ZINC001659975371 1196433673 /nfs/dbraw/zinc/43/36/73/1196433673.db2.gz LRTGTSBWCRSCEY-QGZVFWFLSA-N 2 0 324.472 3.167 20 10 DGCDRP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001205287715 1091165854 /nfs/dbraw/zinc/16/58/54/1091165854.db2.gz BBTOGILWCZQKOX-CQSZACIVSA-N 2 0 302.340 3.114 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)cc1 ZINC001205603493 1091273272 /nfs/dbraw/zinc/27/32/72/1091273272.db2.gz PGWXXDJFFQEEAE-AEFFLSMTSA-N 2 0 303.494 3.340 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c(O)c1 ZINC001205627405 1091286290 /nfs/dbraw/zinc/28/62/90/1091286290.db2.gz PIDHDNYEJWLQKQ-CVEARBPZSA-N 2 0 319.493 3.045 20 10 DGCDRP C[C@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCC[C@@H]1C[NH3+] ZINC001206022804 1091455050 /nfs/dbraw/zinc/45/50/50/1091455050.db2.gz CUVSZEXGRMWJPI-LSDHHAIUSA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCC[C@H]1C[NH3+] ZINC001206023162 1091455810 /nfs/dbraw/zinc/45/58/10/1091455810.db2.gz DKNXQFRCVIZMCF-CABCVRRESA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2O)CCC[C@@H]1C[NH3+] ZINC001206025410 1091457496 /nfs/dbraw/zinc/45/74/96/1091457496.db2.gz NWIHWQLIGWCXSJ-NWDGAFQWSA-N 2 0 316.367 3.218 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@H](C)[C@H]2C)cc(C[NH+](C)C)c1O ZINC001139257221 1091502775 /nfs/dbraw/zinc/50/27/75/1091502775.db2.gz UYALSHPBQZTSIZ-UONOGXRCSA-N 2 0 306.450 3.083 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)cc(C[NH+](C)C)c1O ZINC001139258054 1091504211 /nfs/dbraw/zinc/50/42/11/1091504211.db2.gz KVIFUGSSTRYAFP-WBVHZDCISA-N 2 0 318.461 3.227 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](C)C1 ZINC001139409913 1091552398 /nfs/dbraw/zinc/55/23/98/1091552398.db2.gz UZMWGBNKBAFOHV-IRXDYDNUSA-N 2 0 301.478 3.059 20 10 DGCDRP C[C@H]1CC[C@@H](C[NH3+])CN1Cc1c(O)ccc(Cl)c1Cl ZINC001206810558 1091748831 /nfs/dbraw/zinc/74/88/31/1091748831.db2.gz NYFFQMSYQRGLKF-UWVGGRQHSA-N 2 0 303.233 3.258 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3Cc4ccccc4C3)cc2)CC1 ZINC001140300609 1091817891 /nfs/dbraw/zinc/81/78/91/1091817891.db2.gz QLLOVEFNDNJVRM-UHFFFAOYSA-N 2 0 321.468 3.344 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)C[C@@H]3CC3(C)C)cc2)CC1 ZINC001140305762 1091821083 /nfs/dbraw/zinc/82/10/83/1091821083.db2.gz HGPCMIOTQHMEJS-SFHVURJKSA-N 2 0 315.505 3.306 20 10 DGCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(N(CC)CC)cc1O ZINC001140856508 1092031097 /nfs/dbraw/zinc/03/10/97/1092031097.db2.gz CWJDLIQQMUVQLS-UHFFFAOYSA-N 2 0 321.509 3.402 20 10 DGCDRP COc1ccc(C[NH2+]CCC[NH+](C(C)C)C(C)C)c(O)c1OC ZINC001336737240 1094717066 /nfs/dbraw/zinc/71/70/66/1094717066.db2.gz VPJYEZBHWFAZTA-UHFFFAOYSA-N 2 0 324.465 3.008 20 10 DGCDRP Cc1cc(C[NH+]2CCC3(CCC[NH2+]C3)CC2)ccc1N(C)C ZINC001222452163 1095621959 /nfs/dbraw/zinc/62/19/59/1095621959.db2.gz BTWRZMLGBXXOTL-UHFFFAOYSA-N 2 0 301.478 3.027 20 10 DGCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001119032633 1096122765 /nfs/dbraw/zinc/12/27/65/1096122765.db2.gz YNSBEFSADJTBIL-ARKGTOAJSA-N 2 0 300.446 3.369 20 10 DGCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]2C1 ZINC001233287094 1098276141 /nfs/dbraw/zinc/27/61/41/1098276141.db2.gz WIWWTJFPDIPAKE-CALCHBBNSA-N 2 0 316.489 3.463 20 10 DGCDRP Cc1cc(C[N@H+]2CCN(c3cc[nH+]cc3)C[C@@H]2C)ccc1N(C)C ZINC001176280716 1098298948 /nfs/dbraw/zinc/29/89/48/1098298948.db2.gz DXBONMRPYODMPN-KRWDZBQOSA-N 2 0 324.472 3.167 20 10 DGCDRP CC[N@H+](CCC[NH+](C)C)Cc1c(O)ccc2ccc(OC)cc21 ZINC001234570378 1098603996 /nfs/dbraw/zinc/60/39/96/1098603996.db2.gz ZALVEHMLFLOHHV-UHFFFAOYSA-N 2 0 316.445 3.328 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)c1O ZINC001206317075 1098710242 /nfs/dbraw/zinc/71/02/42/1098710242.db2.gz CGVDMQHPKPNXFI-MRXNPFEDSA-N 2 0 312.841 3.005 20 10 DGCDRP CN1CCCc2cc(C[N@@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)ccc21 ZINC001235042334 1098768873 /nfs/dbraw/zinc/76/88/73/1098768873.db2.gz ALQVYVFNNMYFMR-FQEVSTJZSA-N 2 0 313.489 3.177 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC001235185424 1098863891 /nfs/dbraw/zinc/86/38/91/1098863891.db2.gz TZQCTYYVIGFZDW-MOPGFXCFSA-N 2 0 309.457 3.135 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)cc1 ZINC001235269182 1098939680 /nfs/dbraw/zinc/93/96/80/1098939680.db2.gz LJSJNLKUUWYQKA-ICSRJNTNSA-N 2 0 309.457 3.278 20 10 DGCDRP CCCCC1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235432594 1099028081 /nfs/dbraw/zinc/02/80/81/1099028081.db2.gz MRVKMSIRWWVWTA-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP CCc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001179454129 1099104040 /nfs/dbraw/zinc/10/40/40/1099104040.db2.gz XTKUOJFFIASBRB-UHFFFAOYSA-N 2 0 323.484 3.291 20 10 DGCDRP C[N@@H+](Cc1cccc(-c2ccccc2)c1O)C[C@@H]1CCC[NH2+]C1 ZINC001235957064 1099290114 /nfs/dbraw/zinc/29/01/14/1099290114.db2.gz KJXXISVAVJULGF-MRXNPFEDSA-N 2 0 310.441 3.491 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])cc1 ZINC001235960529 1099293917 /nfs/dbraw/zinc/29/39/17/1099293917.db2.gz YTKRVJVNANZKJX-OPVJXMOQSA-N 2 0 309.457 3.263 20 10 DGCDRP CCc1ccc(C[N@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c(O)c1 ZINC001236549920 1099675414 /nfs/dbraw/zinc/67/54/14/1099675414.db2.gz CTCQXMJZDMARKE-IYARVYRRSA-N 2 0 302.462 3.437 20 10 DGCDRP Cc1cc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)ccc1N(C)C ZINC001236599918 1099695581 /nfs/dbraw/zinc/69/55/81/1099695581.db2.gz WZUFZTANJLUHCM-QGZVFWFLSA-N 2 0 301.478 3.025 20 10 DGCDRP CCc1ccc(CN([C@@H]2CC[NH2+]C2)C2CCCCC2)c(O)c1 ZINC001236661263 1099730151 /nfs/dbraw/zinc/73/01/51/1099730151.db2.gz AVPLMRGCLTXPQI-GOSISDBHSA-N 2 0 302.462 3.451 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)cc1 ZINC001236818147 1099806012 /nfs/dbraw/zinc/80/60/12/1099806012.db2.gz GLLCHMVSBBEHQO-YSIASYRMSA-N 2 0 309.457 3.263 20 10 DGCDRP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(OCC)cc2O)CC1 ZINC001237046883 1099941388 /nfs/dbraw/zinc/94/13/88/1099941388.db2.gz HPBKDCRTUUBTAN-UHFFFAOYSA-N 2 0 320.477 3.487 20 10 DGCDRP COc1cc(Cl)cc(CN(C2CCC2)[C@H]2CCC[NH2+]C2)c1O ZINC001237156572 1100005003 /nfs/dbraw/zinc/00/50/03/1100005003.db2.gz ONRRAGQOMMXSFE-HNNXBMFYSA-N 2 0 324.852 3.161 20 10 DGCDRP CCN(CC)c1ccc(C[NH+]2CCC3(CC[C@@H]3[NH3+])CC2)cc1 ZINC001237355923 1100093052 /nfs/dbraw/zinc/09/30/52/1100093052.db2.gz FEZRQEVSOVFXEZ-SFHVURJKSA-N 2 0 301.478 3.236 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c1 ZINC001237418591 1100121420 /nfs/dbraw/zinc/12/14/20/1100121420.db2.gz XPKLHXSQEYNDQU-PBHICJAKSA-N 2 0 302.462 3.264 20 10 DGCDRP Cc1cccc(O)c1C[NH+]1CCC(C2CC[NH+](C)CC2)CC1 ZINC001237490038 1100141816 /nfs/dbraw/zinc/14/18/16/1100141816.db2.gz PGUBQTGIYVCLOG-UHFFFAOYSA-N 2 0 302.462 3.254 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)CC[C@@H]1C[NH3+] ZINC001205626298 1100722491 /nfs/dbraw/zinc/72/24/91/1100722491.db2.gz FNAUXLQFRZFSPD-UONOGXRCSA-N 2 0 309.885 3.213 20 10 DGCDRP C[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(N3CCCC3)cc2)C[C@@H]1C[NH3+] ZINC001325701909 1103105708 /nfs/dbraw/zinc/10/57/08/1103105708.db2.gz CLIDHIRRIKLNHK-NUJGCVRESA-N 2 0 301.478 3.092 20 10 DGCDRP CC[C@H]([NH2+]CC[C@@H](C)[NH2+]C)c1ccc(C(F)(F)F)cc1O ZINC001326037083 1103188151 /nfs/dbraw/zinc/18/81/51/1103188151.db2.gz VRKHMTMTANBJCL-MFKMUULPSA-N 2 0 304.356 3.450 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC001327004272 1103497410 /nfs/dbraw/zinc/49/74/10/1103497410.db2.gz JPAGMBLRWWTSTL-IBGZPJMESA-N 2 0 313.489 3.108 20 10 DGCDRP CC(C)[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)CC[NH2+]1 ZINC001246793609 1104679936 /nfs/dbraw/zinc/67/99/36/1104679936.db2.gz UYVXCVDBPUVOFP-PMACEKPBSA-N 2 0 315.505 3.495 20 10 DGCDRP CC[C@@H]1C[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C[C@H](CC)[NH2+]1 ZINC001246901096 1104729358 /nfs/dbraw/zinc/72/93/58/1104729358.db2.gz KMARENHPUWCUSS-DZFIZOCASA-N 2 0 303.494 3.494 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246920087 1104739239 /nfs/dbraw/zinc/73/92/39/1104739239.db2.gz JDTLTEGQKPUOAF-UHFFFAOYSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001206572128 1105384394 /nfs/dbraw/zinc/38/43/94/1105384394.db2.gz BCCGRXNGDCQFNP-OAHLLOKOSA-N 2 0 316.367 3.362 20 10 DGCDRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001206572126 1105387318 /nfs/dbraw/zinc/38/73/18/1105387318.db2.gz BCCGRXNGDCQFNP-HNNXBMFYSA-N 2 0 316.367 3.362 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H](C[NH3+])Cc2ccccc2)cc1 ZINC001262487927 1107718179 /nfs/dbraw/zinc/71/81/79/1107718179.db2.gz KFDJZOQTUDSKQA-PZJWPPBQSA-N 2 0 323.484 3.441 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCCC[C@H]2[C@@H](C[NH3+])Cc2ccccc2)cc1 ZINC001262487925 1107718443 /nfs/dbraw/zinc/71/84/43/1107718443.db2.gz KFDJZOQTUDSKQA-CTNGQTDRSA-N 2 0 323.484 3.441 20 10 DGCDRP C[N@@H+](Cc1ccc(N)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000382756085 1108162775 /nfs/dbraw/zinc/16/27/75/1108162775.db2.gz INFSZWOYJGVNKL-LJQANCHMSA-N 2 0 309.457 3.223 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC34CCCCC4)cc2)CC1 ZINC001308477397 1111432700 /nfs/dbraw/zinc/43/27/00/1111432700.db2.gz FOENBROVWOIWFT-LJQANCHMSA-N 2 0 313.489 3.251 20 10 DGCDRP COc1cc(C)c(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)c(O)c1 ZINC001308719499 1111465831 /nfs/dbraw/zinc/46/58/31/1111465831.db2.gz ABRMKNUWJNLUIT-UHFFFAOYSA-N 2 0 318.461 3.017 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000284297112 131067747 /nfs/dbraw/zinc/06/77/47/131067747.db2.gz YKELALAXAUHOJN-HZPDHXFCSA-N 2 0 308.466 3.016 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CCC)C2)c(O)c1 ZINC000093742340 431917663 /nfs/dbraw/zinc/91/76/63/431917663.db2.gz BQSPBLJIZBMYDX-MRXNPFEDSA-N 2 0 320.477 3.345 20 10 DGCDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc2c(cc1O)CCCC2 ZINC000184997701 432453458 /nfs/dbraw/zinc/45/34/58/432453458.db2.gz VMYULVXJILNGIL-HUUCEWRRSA-N 2 0 314.473 3.406 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000280166362 433008377 /nfs/dbraw/zinc/00/83/77/433008377.db2.gz QYTYHOOKYAHHSD-NVXWUHKLSA-N 2 0 308.466 3.098 20 10 DGCDRP CC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(C)cc1O ZINC000280233408 433020647 /nfs/dbraw/zinc/02/06/47/433020647.db2.gz VKSXAKOCNDAMPZ-FUHWJXTLSA-N 2 0 320.477 3.242 20 10 DGCDRP Cn1ccnc1[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000373230617 433137811 /nfs/dbraw/zinc/13/78/11/433137811.db2.gz NQUGLRLGNCMCIM-GFCCVEGCSA-N 2 0 305.809 3.159 20 10 DGCDRP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(N(C)C)cc1 ZINC000363792855 332248634 /nfs/dbraw/zinc/24/86/34/332248634.db2.gz OROXUJWLBWYLLU-NEWSRXKRSA-N 2 0 301.478 3.420 20 10 DGCDRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1O ZINC000183470812 525465308 /nfs/dbraw/zinc/46/53/08/525465308.db2.gz MXVMRTVBQPAROL-HNNXBMFYSA-N 2 0 314.429 3.183 20 10 DGCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853241521 620681390 /nfs/dbraw/zinc/68/13/90/620681390.db2.gz WKFIPNZQQOOZBV-WBVHZDCISA-N 2 0 302.462 3.473 20 10 DGCDRP CSC(C)(C)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000895607711 618806381 /nfs/dbraw/zinc/80/63/81/618806381.db2.gz UOSGOVTUZBWUJL-UHFFFAOYSA-N 2 0 321.534 3.060 20 10 DGCDRP [NH3+]CCc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000841036197 619186704 /nfs/dbraw/zinc/18/67/04/619186704.db2.gz PLWPXOURVYCIEE-UHFFFAOYSA-N 2 0 323.484 3.468 20 10 DGCDRP Cc1ccc(O)c(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000904473430 619924875 /nfs/dbraw/zinc/92/48/75/619924875.db2.gz ISSWHBAVPVDONK-PXNSSMCTSA-N 2 0 324.424 3.046 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)c1O ZINC000841086224 620217313 /nfs/dbraw/zinc/21/73/13/620217313.db2.gz GCUMAVLJSYCPOA-SWLSCSKDSA-N 2 0 324.852 3.018 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000841090040 620256169 /nfs/dbraw/zinc/25/61/69/620256169.db2.gz UAEUWFHGTYEMDK-QGZVFWFLSA-N 2 0 301.478 3.297 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1F ZINC000113314604 620900387 /nfs/dbraw/zinc/90/03/87/620900387.db2.gz AWOIOXPKXYJTQD-UHFFFAOYSA-N 2 0 307.457 3.291 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000757675121 621732995 /nfs/dbraw/zinc/73/29/95/621732995.db2.gz ZYBJTKDQRPVOJV-ZFWWWQNUSA-N 2 0 324.440 3.028 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+]C2CCC(C)([NH+](C)C)CC2)c1 ZINC000865765900 621991640 /nfs/dbraw/zinc/99/16/40/621991640.db2.gz RIJPKPUCVPRUNL-UHFFFAOYSA-N 2 0 306.450 3.143 20 10 DGCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2c(O)ccc3ccccc32)C1 ZINC000129226678 625560015 /nfs/dbraw/zinc/56/00/15/625560015.db2.gz AKRPREMIDIUEGI-VQIMIIECSA-N 2 0 310.441 3.462 20 10 DGCDRP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000872251241 622867404 /nfs/dbraw/zinc/86/74/04/622867404.db2.gz ISEKJOOIPHQTIF-KRWDZBQOSA-N 2 0 301.478 3.155 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000872253977 622867934 /nfs/dbraw/zinc/86/79/34/622867934.db2.gz NZXYKJPCSQKHCU-KEGWNNHHSA-N 2 0 301.478 3.134 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000773755992 623068944 /nfs/dbraw/zinc/06/89/44/623068944.db2.gz SLIJERVIJGXVPV-IBGZPJMESA-N 2 0 315.505 3.306 20 10 DGCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)c1 ZINC000873232177 623084741 /nfs/dbraw/zinc/08/47/41/623084741.db2.gz BEODVYNJTMNTJH-GOSISDBHSA-N 2 0 318.461 3.193 20 10 DGCDRP Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCCCC12CC[NH2+]CC2 ZINC000873232171 623085287 /nfs/dbraw/zinc/08/52/87/623085287.db2.gz AYWJZTZZWRIQQR-MRXNPFEDSA-N 2 0 308.853 3.448 20 10 DGCDRP CCOc1cccc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)c1O ZINC000873232762 623085707 /nfs/dbraw/zinc/08/57/07/623085707.db2.gz LARCLIYDAJDUCY-KRWDZBQOSA-N 2 0 318.461 3.193 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000873258785 623094589 /nfs/dbraw/zinc/09/45/89/623094589.db2.gz UTXUJTDITMFRRX-DZKIICNBSA-N 2 0 305.441 3.204 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c2c1c(F)ccc2O ZINC000873263693 623096824 /nfs/dbraw/zinc/09/68/24/623096824.db2.gz KBPUHFMBMOKQLK-DKBOKBLXSA-N 2 0 304.409 3.200 20 10 DGCDRP CSCCCCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775363216 623260338 /nfs/dbraw/zinc/26/03/38/623260338.db2.gz XSQBNECTJXVJHN-UHFFFAOYSA-N 2 0 321.534 3.061 20 10 DGCDRP C[C@@H]([N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000775654010 623304399 /nfs/dbraw/zinc/30/43/99/623304399.db2.gz RCRYVPFCDVDBKG-MRXNPFEDSA-N 2 0 303.494 3.305 20 10 DGCDRP C[C@H]([N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000775654009 623305357 /nfs/dbraw/zinc/30/53/57/623305357.db2.gz RCRYVPFCDVDBKG-INIZCTEOSA-N 2 0 303.494 3.305 20 10 DGCDRP Cc1cccc(O)c1C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000877007158 623765066 /nfs/dbraw/zinc/76/50/66/623765066.db2.gz FJRMEDLTVZJEMI-IBGZPJMESA-N 2 0 324.468 3.355 20 10 DGCDRP CCc1cccc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c1O ZINC000877684519 623991029 /nfs/dbraw/zinc/99/10/29/623991029.db2.gz WKILWKRNRADANL-UHFFFAOYSA-N 2 0 302.462 3.262 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H]4CCC[C@H]43)ccc21 ZINC000796726882 626076698 /nfs/dbraw/zinc/07/66/98/626076698.db2.gz GIUFSKXTQIACGC-NLWGTHIKSA-N 2 0 313.489 3.031 20 10 DGCDRP CC[C@@H]1CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000806137155 626701246 /nfs/dbraw/zinc/70/12/46/626701246.db2.gz HIGKSKZEIXDONY-SJLPKXTDSA-N 2 0 319.468 3.246 20 10 DGCDRP CCOc1ccc(C[N@H+](CC)CCC[NH+]2CCCC2)c(O)c1 ZINC000809748967 626946068 /nfs/dbraw/zinc/94/60/68/626946068.db2.gz ADFWGBQIEJJASU-UHFFFAOYSA-N 2 0 306.450 3.099 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@@H](C)[C@H]3C)cc2F)CC1 ZINC000813858587 627516857 /nfs/dbraw/zinc/51/68/57/627516857.db2.gz ASTNSTOIYXMANF-IIDMSEBBSA-N 2 0 319.468 3.102 20 10 DGCDRP Cc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000107797473 627546081 /nfs/dbraw/zinc/54/60/81/627546081.db2.gz SANIMPGKEJYTKH-UHFFFAOYSA-N 2 0 309.457 3.037 20 10 DGCDRP Cc1cc(C[NH+]2CCC(CC[NH+](C)C)CC2)ccc1N(C)C ZINC000815020463 627616761 /nfs/dbraw/zinc/61/67/61/627616761.db2.gz AKSNBAGIBLPDLZ-UHFFFAOYSA-N 2 0 303.494 3.225 20 10 DGCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815054715 627619366 /nfs/dbraw/zinc/61/93/66/627619366.db2.gz KXBDHFSLDUXVSK-GOSISDBHSA-N 2 0 303.494 3.225 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC000815145337 627637035 /nfs/dbraw/zinc/63/70/35/627637035.db2.gz RUCZZNZJJSYSJX-IBGZPJMESA-N 2 0 301.478 3.060 20 10 DGCDRP C[N@@H+]1CCC[C@@]2(CC[NH+](Cc3c(O)ccc4ccccc43)C2)C1 ZINC000816642239 627818635 /nfs/dbraw/zinc/81/86/35/627818635.db2.gz ULGJZPMZZLYIGS-HXUWFJFHSA-N 2 0 310.441 3.463 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1F ZINC000817901172 627956083 /nfs/dbraw/zinc/95/60/83/627956083.db2.gz SVONSIRNCZUOKW-CGTJXYLNSA-N 2 0 319.468 3.292 20 10 DGCDRP CC[NH2+]CCC[NH2+][C@@H](CC)c1cc(Br)ccc1O ZINC000817943114 627969443 /nfs/dbraw/zinc/96/94/43/627969443.db2.gz IRKHNAYPWYXZME-ZDUSSCGKSA-N 2 0 315.255 3.195 20 10 DGCDRP CC[NH2+]CCC[NH2+][C@@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000817943384 627969553 /nfs/dbraw/zinc/96/95/53/627969553.db2.gz MJBDORJLRXMUNA-ZDUSSCGKSA-N 2 0 304.356 3.451 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(CC[NH3+])cc2)c2c1c(F)ccc2O ZINC000817950250 627972571 /nfs/dbraw/zinc/97/25/71/627972571.db2.gz XDFSHVSVVMAAMJ-BLLLJJGKSA-N 2 0 314.404 3.371 20 10 DGCDRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817954822 627973396 /nfs/dbraw/zinc/97/33/96/627973396.db2.gz KVEJTMZFZXCNLH-HOTGVXAUSA-N 2 0 319.468 3.466 20 10 DGCDRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817955402 627974150 /nfs/dbraw/zinc/97/41/50/627974150.db2.gz XPOFPIHWZMRAGO-FZMZJTMJSA-N 2 0 316.367 3.451 20 10 DGCDRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817968070 627978855 /nfs/dbraw/zinc/97/88/55/627978855.db2.gz NZSNURLUFYVMKJ-OAHLLOKOSA-N 2 0 317.452 3.386 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817970768 627980087 /nfs/dbraw/zinc/98/00/87/627980087.db2.gz DQZWUQGHIMECKJ-RVKKMQEKSA-N 2 0 319.468 3.465 20 10 DGCDRP C[C@H]1C[C@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c2c1c(F)ccc2O ZINC000817974811 627981183 /nfs/dbraw/zinc/98/11/83/627981183.db2.gz FRZJFALGFNGZEX-ABHRYQDASA-N 2 0 306.425 3.434 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cc2c(cc1O)CCCC2 ZINC000817977047 627981537 /nfs/dbraw/zinc/98/15/37/627981537.db2.gz ZRSVSBLIYSGKIP-SCLBCKFNSA-N 2 0 300.446 3.064 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+]C2CCC(C[NH+](C)C)CC2)cc1 ZINC000835042734 629833140 /nfs/dbraw/zinc/83/31/40/629833140.db2.gz XJVCDNIKLIXNJP-AATRIKPKSA-N 2 0 315.505 3.476 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000835052954 629837359 /nfs/dbraw/zinc/83/73/59/629837359.db2.gz IVBVXDIXBKQSPH-FTKDCLMVSA-N 2 0 313.489 3.182 20 10 DGCDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841030949 630398106 /nfs/dbraw/zinc/39/81/06/630398106.db2.gz PYDDWVPPLYRDNJ-PKOBYXMFSA-N 2 0 301.478 3.284 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC2(C)CC[NH2+]CC2)cc1F ZINC000841058377 630402909 /nfs/dbraw/zinc/40/29/09/630402909.db2.gz WQNLIDPYODENES-UHFFFAOYSA-N 2 0 307.457 3.151 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C2(C)CC[NH2+]CC2)c(C(F)(F)F)c1 ZINC000841064765 630403764 /nfs/dbraw/zinc/40/37/64/630403764.db2.gz JBKNTSNMRIPCBG-UHFFFAOYSA-N 2 0 315.383 3.003 20 10 DGCDRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841070307 630404228 /nfs/dbraw/zinc/40/42/28/630404228.db2.gz NBMITKTWFWNASP-SFHVURJKSA-N 2 0 301.478 3.155 20 10 DGCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c1O ZINC000841086054 630406165 /nfs/dbraw/zinc/40/61/65/630406165.db2.gz GCUMAVLJSYCPOA-IUODEOHRSA-N 2 0 324.852 3.018 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCCC2)cc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000843046839 630608456 /nfs/dbraw/zinc/60/84/56/630608456.db2.gz FFQCJFKSARPVIO-UFRUDQCGSA-N 2 0 313.489 3.392 20 10 DGCDRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843051924 630608743 /nfs/dbraw/zinc/60/87/43/630608743.db2.gz MWBSZPGJMBJSAD-SJLPKXTDSA-N 2 0 301.478 3.236 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)c1O ZINC000843127728 630617177 /nfs/dbraw/zinc/61/71/77/630617177.db2.gz SWMCUSVWEYSGNY-AWEZNQCLSA-N 2 0 308.853 3.176 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2)cc1F ZINC000843128490 630617305 /nfs/dbraw/zinc/61/73/05/630617305.db2.gz LOBIGNXRZHQARI-UHFFFAOYSA-N 2 0 315.436 3.420 20 10 DGCDRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000844926439 630987934 /nfs/dbraw/zinc/98/79/34/630987934.db2.gz UJJDSKOXYWSCRT-AWEZNQCLSA-N 2 0 302.462 3.311 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)c1O ZINC000846139552 631211626 /nfs/dbraw/zinc/21/16/26/631211626.db2.gz VHDQAZBGJXLOMN-AWEZNQCLSA-N 2 0 306.450 3.172 20 10 DGCDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cc2c(cc1O)CCCC2 ZINC000848557808 631692164 /nfs/dbraw/zinc/69/21/64/631692164.db2.gz LBLUUKXTESTRIN-GRDNDAEWSA-N 2 0 302.462 3.262 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)cc1F ZINC000849349534 631900304 /nfs/dbraw/zinc/90/03/04/631900304.db2.gz CDHXNRYSFGLNTF-QGZVFWFLSA-N 2 0 319.468 3.103 20 10 DGCDRP COc1cc(C[NH2+]CC2CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850118022 632060429 /nfs/dbraw/zinc/06/04/29/632060429.db2.gz DOZUEQWMYDEPFX-UHFFFAOYSA-N 2 0 320.477 3.130 20 10 DGCDRP Oc1cccc2c1[C@H]([NH2+]CC1CC[NH+](CC3CC3)CC1)CC2 ZINC000850582761 632202220 /nfs/dbraw/zinc/20/22/20/632202220.db2.gz LCFYEHMWMLILJU-QGZVFWFLSA-N 2 0 300.446 3.091 20 10 DGCDRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000068722631 655598310 /nfs/dbraw/zinc/59/83/10/655598310.db2.gz UGKDTUOAGZMADX-GOSISDBHSA-N 2 0 301.478 3.108 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000314034578 656055369 /nfs/dbraw/zinc/05/53/69/656055369.db2.gz CRNGQNYSUPTGBK-UHFFFAOYSA-N 2 0 303.494 3.498 20 10 DGCDRP COc1ccc(O)c(C[NH2+]CCC[N@H+](C)C2CCCCC2)c1 ZINC000237204062 657378057 /nfs/dbraw/zinc/37/80/57/657378057.db2.gz WCISTXYNCSPYEG-UHFFFAOYSA-N 2 0 306.450 3.145 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000174629096 659454109 /nfs/dbraw/zinc/45/41/09/659454109.db2.gz ABJHBJQANGVAIB-VQIMIIECSA-N 2 0 303.494 3.353 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CCCC2)cc1)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001578489811 1191946594 /nfs/dbraw/zinc/94/65/94/1191946594.db2.gz NMDJYXZTXUJBNL-YQQQUEKLSA-N 2 0 313.489 3.249 20 10 DGCDRP Cc1cc(C[N@@H+]2CC[C@H](CC[NH3+])C2)ccc1N1CCCCC1 ZINC001579598289 1191981801 /nfs/dbraw/zinc/98/18/01/1191981801.db2.gz NKRYDZIENSQIGM-KRWDZBQOSA-N 2 0 301.478 3.156 20 10 DGCDRP [NH3+][C@@H]1CC[C@H](C[N@H+](Cc2ccco2)Cc2ccccc2O)C1 ZINC001580387583 1192024845 /nfs/dbraw/zinc/02/48/45/1192024845.db2.gz NVGHHIRJMGHREV-GOEBONIOSA-N 2 0 300.402 3.115 20 10 DGCDRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC001657306417 1196129177 /nfs/dbraw/zinc/12/91/77/1196129177.db2.gz VHPYTCFEBTTYMR-UHFFFAOYSA-N 2 0 307.457 3.103 20 10 DGCDRP C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001657481159 1196148084 /nfs/dbraw/zinc/14/80/84/1196148084.db2.gz WOVAWPOKYQRPHL-FXAWDEMLSA-N 2 0 315.505 3.497 20 10 DGCDRP c1cc(N2CCC([NH2+]Cc3ccc4c(c3)CCCO4)CC2)cc[nH+]1 ZINC001658757151 1196296727 /nfs/dbraw/zinc/29/67/27/1196296727.db2.gz YFUXWFWWHSYSJF-UHFFFAOYSA-N 2 0 323.440 3.165 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC34CCC4)cc2)CC1 ZINC001660588015 1196501322 /nfs/dbraw/zinc/50/13/22/1196501322.db2.gz LMXXNXJKKLTZOH-IBGZPJMESA-N 2 0 313.489 3.251 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC34CCC4)cc2)CC1 ZINC001660588016 1196501499 /nfs/dbraw/zinc/50/14/99/1196501499.db2.gz LMXXNXJKKLTZOH-LJQANCHMSA-N 2 0 313.489 3.251 20 10 DGCDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccc(Cl)cc3O)C[C@@H]2C1 ZINC001660892232 1196538930 /nfs/dbraw/zinc/53/89/30/1196538930.db2.gz HYPKSQGEPBRNOZ-IVMMDQJWSA-N 2 0 308.853 3.208 20 10 DGCDRP CCCC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001661896028 1196660554 /nfs/dbraw/zinc/66/05/54/1196660554.db2.gz KZMFMTRPLTVKIS-UHFFFAOYSA-N 2 0 301.478 3.108 20 10 DGCDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccccc1O ZINC001167968187 1085894429 /nfs/dbraw/zinc/89/44/29/1085894429.db2.gz NTXCPFOFBKEIIC-LNRIEFBSSA-N 2 0 300.446 3.448 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)c2ccccc21 ZINC001204240304 1090931838 /nfs/dbraw/zinc/93/18/38/1090931838.db2.gz NZFGBPHCGRDRAA-NRFANRHFSA-N 2 0 323.484 3.433 20 10 DGCDRP C[NH+](C)CC1CC[NH+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143110546 1090937455 /nfs/dbraw/zinc/93/74/55/1090937455.db2.gz ISKHKNTXXBPTRB-UHFFFAOYSA-N 2 0 304.478 3.463 20 10 DGCDRP C[C@H]1C[N@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C[C@H]1C[NH3+] ZINC001205156123 1091114448 /nfs/dbraw/zinc/11/44/48/1091114448.db2.gz PDFNIJPIRULVGI-WCQYABFASA-N 2 0 310.869 3.370 20 10 DGCDRP C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001205164404 1091116546 /nfs/dbraw/zinc/11/65/46/1091116546.db2.gz FKZNKXRBMDICLJ-QGZVFWFLSA-N 2 0 321.468 3.216 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)CC[C@@H]1C[NH3+] ZINC001205638467 1091292042 /nfs/dbraw/zinc/29/20/42/1091292042.db2.gz OGRFWSGNYOTUFI-LSDHHAIUSA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001205903492 1091401314 /nfs/dbraw/zinc/40/13/14/1091401314.db2.gz PQYCXAYHRRMMIU-AEFFLSMTSA-N 2 0 301.478 3.236 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCC[C@@H]1C[NH3+] ZINC001206023165 1091455476 /nfs/dbraw/zinc/45/54/76/1091455476.db2.gz DKNXQFRCVIZMCF-HUUCEWRRSA-N 2 0 304.478 3.497 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCC[C@@H]1C[NH3+] ZINC001206023166 1091455724 /nfs/dbraw/zinc/45/57/24/1091455724.db2.gz DKNXQFRCVIZMCF-LSDHHAIUSA-N 2 0 304.478 3.497 20 10 DGCDRP COc1cc(C[NH+]2CCC(C)(C)CC2)cc(C[NH+](C)C)c1O ZINC001139257621 1091502800 /nfs/dbraw/zinc/50/28/00/1091502800.db2.gz ZNCQEBMTEUCYSF-UHFFFAOYSA-N 2 0 306.450 3.084 20 10 DGCDRP COc1cc(C[NH+]2CC3(C2)CCCCC3)cc(C[NH+](C)C)c1O ZINC001139259276 1091503300 /nfs/dbraw/zinc/50/33/00/1091503300.db2.gz PDXINYJXYBIVSY-UHFFFAOYSA-N 2 0 318.461 3.229 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)C3CC(C)C3)cc2)CC1 ZINC001140301833 1091818623 /nfs/dbraw/zinc/81/86/23/1091818623.db2.gz ASJCALVXEMSHLZ-UHFFFAOYSA-N 2 0 301.478 3.059 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC4(CCC4)C3)cc2)CC1 ZINC001140305951 1091821013 /nfs/dbraw/zinc/82/10/13/1091821013.db2.gz IVTIEQLGDFMSBJ-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169143173 1092559357 /nfs/dbraw/zinc/55/93/57/1092559357.db2.gz YSKDZHZCLOARRS-PMOLBWCYSA-N 2 0 313.489 3.344 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154429 1092567286 /nfs/dbraw/zinc/56/72/86/1092567286.db2.gz QOKVQZIHLCQZCX-REPLKXPHSA-N 2 0 301.478 3.200 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)cc1 ZINC001209516973 1092805728 /nfs/dbraw/zinc/80/57/28/1092805728.db2.gz VHFIBACOIOLSOC-UXHICEINSA-N 2 0 323.484 3.478 20 10 DGCDRP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccc(N)cc3)C2)CC1 ZINC001337834381 1095110745 /nfs/dbraw/zinc/11/07/45/1095110745.db2.gz RFICMHOWIHJYNA-GOSISDBHSA-N 2 0 301.478 3.213 20 10 DGCDRP Cc1c(C[N@@H+]2CCC[C@]3(CCC[NH2+]C3)C2)c2ccccc2n1C ZINC001222264517 1095520516 /nfs/dbraw/zinc/52/05/16/1095520516.db2.gz CYUMJGGUPHMYCN-FQEVSTJZSA-N 2 0 311.473 3.452 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@]23CCC[NH2+]CC3)c1O ZINC001222321211 1095551426 /nfs/dbraw/zinc/55/14/26/1095551426.db2.gz RZGXWVMKPLHZEL-QGZVFWFLSA-N 2 0 308.853 3.462 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2CCC(F)(C[NH3+])CC2)cc1 ZINC001222532567 1095653725 /nfs/dbraw/zinc/65/37/25/1095653725.db2.gz NHSIXJYNKKYZHP-UHFFFAOYSA-N 2 0 315.436 3.357 20 10 DGCDRP CC(C)(C)c1cccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c1O ZINC001222629453 1095699801 /nfs/dbraw/zinc/69/98/01/1095699801.db2.gz HPIJYAOIPYUSHA-GASCZTMLSA-N 2 0 302.462 3.121 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@H]2C[C@H]3CCC[C@@H](C2)N3C)cc1 ZINC001172127752 1097047574 /nfs/dbraw/zinc/04/75/74/1097047574.db2.gz KEJDTJPOFKHQKZ-BWTSREIZSA-N 2 0 301.478 3.200 20 10 DGCDRP CC[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001173266039 1097390227 /nfs/dbraw/zinc/39/02/27/1097390227.db2.gz KLRDJHLDBJQKMS-SJLPKXTDSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC([NH+]3CCCCC3)CC2)c(O)c1 ZINC001231842658 1097860779 /nfs/dbraw/zinc/86/07/79/1097860779.db2.gz WUKCLBSAMGVEQA-UHFFFAOYSA-N 2 0 302.462 3.459 20 10 DGCDRP CC(C)(C)c1ccc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)c(O)c1 ZINC001235092259 1098796011 /nfs/dbraw/zinc/79/60/11/1098796011.db2.gz JSRWBKCEBUNFES-UHFFFAOYSA-N 2 0 302.462 3.265 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001235092264 1098796185 /nfs/dbraw/zinc/79/61/85/1098796185.db2.gz JWKIEBUEAAGPMG-UHFFFAOYSA-N 2 0 302.462 3.265 20 10 DGCDRP CC(C)(C)c1cccc(C[NH+]2CCC3(CC[NH2+]C3)CC2)c1O ZINC001235104891 1098805762 /nfs/dbraw/zinc/80/57/62/1098805762.db2.gz WLVCXNXDQQXYCF-UHFFFAOYSA-N 2 0 302.462 3.265 20 10 DGCDRP Cc1cc(CN2CC[C@@H]3C[NH2+]C[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001235193448 1098870945 /nfs/dbraw/zinc/87/09/45/1098870945.db2.gz LTKXIIOTKJSOHR-IEBWSBKVSA-N 2 0 309.457 3.135 20 10 DGCDRP COc1cc(C)c(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c(O)c1 ZINC001235241117 1098914252 /nfs/dbraw/zinc/91/42/52/1098914252.db2.gz YLHLJJAZTBYUKG-GOSISDBHSA-N 2 0 318.461 3.063 20 10 DGCDRP CC(C)(C)c1cc(O)c(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1Cl ZINC001235936103 1099270554 /nfs/dbraw/zinc/27/05/54/1099270554.db2.gz HTEBVWQSNUPRCT-GXTWGEPZSA-N 2 0 322.880 3.384 20 10 DGCDRP C[N@@H+](Cc1cccc(-c2ccccc2)c1O)C[C@H]1CCC[NH2+]C1 ZINC001235957063 1099288332 /nfs/dbraw/zinc/28/83/32/1099288332.db2.gz KJXXISVAVJULGF-INIZCTEOSA-N 2 0 310.441 3.491 20 10 DGCDRP CC(C)c1ccc(O)c(C[NH+]2CCC(OCC[NH+](C)C)CC2)c1 ZINC001180288855 1099372162 /nfs/dbraw/zinc/37/21/62/1099372162.db2.gz NAEDIDMQLRGCTC-UHFFFAOYSA-N 2 0 320.477 3.058 20 10 DGCDRP [O-]c1ccc(F)c(F)c1C[NH+]1CCC(CC2CC[NH2+]CC2)CC1 ZINC001236962229 1099891169 /nfs/dbraw/zinc/89/11/69/1099891169.db2.gz LHHRJMDVKSFOOO-UHFFFAOYSA-N 2 0 324.415 3.272 20 10 DGCDRP [O-]c1cc(F)cc(F)c1C[NH+]1CCC(CC2CC[NH2+]CC2)CC1 ZINC001236962066 1099891547 /nfs/dbraw/zinc/89/15/47/1099891547.db2.gz TZMAEJRZIZAROX-UHFFFAOYSA-N 2 0 324.415 3.272 20 10 DGCDRP Cc1cc(CN(C2CCC2)[C@@H]2CCC[NH2+]C2)ccc1N(C)C ZINC001237156518 1100004885 /nfs/dbraw/zinc/00/48/85/1100004885.db2.gz XDBAWGZRBWTXSZ-GOSISDBHSA-N 2 0 301.478 3.168 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC001237379616 1100099068 /nfs/dbraw/zinc/09/90/68/1100099068.db2.gz CCGBSAIEODQGSC-PKOBYXMFSA-N 2 0 301.478 3.107 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c2ccccc21 ZINC001237384423 1100102236 /nfs/dbraw/zinc/10/22/36/1100102236.db2.gz WRJGEBHPUWNRHG-XLIONFOSSA-N 2 0 323.484 3.480 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c1O ZINC001237408156 1100115773 /nfs/dbraw/zinc/11/57/73/1100115773.db2.gz YYZOSOIEPIIHDK-PBHICJAKSA-N 2 0 302.462 3.264 20 10 DGCDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001201557094 1102651107 /nfs/dbraw/zinc/65/11/07/1102651107.db2.gz DIEPLQPSLGCNKU-SFHVURJKSA-N 2 0 316.489 3.469 20 10 DGCDRP Cc1cc(C)c(C[NH+]2CCC[C@]3(CCC[N@@H+](C)C3)C2)c(O)c1 ZINC001276366070 1103576129 /nfs/dbraw/zinc/57/61/29/1103576129.db2.gz YLUGUAWYJRGVNW-IBGZPJMESA-N 2 0 302.462 3.317 20 10 DGCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CC(C)(C)C1 ZINC001246172959 1104421047 /nfs/dbraw/zinc/42/10/47/1104421047.db2.gz JBZAHMKSKODDGH-AEFFLSMTSA-N 2 0 315.505 3.401 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246924890 1104739745 /nfs/dbraw/zinc/73/97/45/1104739745.db2.gz NKLDCNRBXSHGLR-SFHVURJKSA-N 2 0 301.478 3.249 20 10 DGCDRP C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001275960467 1104968011 /nfs/dbraw/zinc/96/80/11/1104968011.db2.gz WAVUEYRXJSKUSR-UHFFFAOYSA-N 2 0 313.489 3.205 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC[C@]3(CCC[N@@H+](C)C3)C2)c1O ZINC001275965331 1104970245 /nfs/dbraw/zinc/97/02/45/1104970245.db2.gz BIULXYLBPXVHPC-IBGZPJMESA-N 2 0 302.462 3.317 20 10 DGCDRP C[N@@H+]1CCC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001254501032 1106083177 /nfs/dbraw/zinc/08/31/77/1106083177.db2.gz PELCACYYHRIBBB-SFHVURJKSA-N 2 0 301.478 3.251 20 10 DGCDRP COc1ccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1C ZINC001256852994 1106498307 /nfs/dbraw/zinc/49/83/07/1106498307.db2.gz VBJKNPMIMIMVEB-UHFFFAOYSA-N 2 0 311.429 3.157 20 10 DGCDRP CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001319707752 1108603230 /nfs/dbraw/zinc/60/32/30/1108603230.db2.gz XSRWGKHNYBYMFY-DOTOQJQBSA-N 2 0 319.468 3.198 20 10 DGCDRP CC(C)[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001308920128 1111493271 /nfs/dbraw/zinc/49/32/71/1111493271.db2.gz ZWKMLGMQTHXQRB-VQTJNVASSA-N 2 0 315.505 3.353 20 10 DGCDRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cc(Br)ccc1O ZINC000273555434 130136494 /nfs/dbraw/zinc/13/64/94/130136494.db2.gz GURBNJHNYRYZBD-LLVKDONJSA-N 2 0 315.255 3.147 20 10 DGCDRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cc(Br)ccc1O ZINC000273555439 130137145 /nfs/dbraw/zinc/13/71/45/130137145.db2.gz GURBNJHNYRYZBD-NSHDSACASA-N 2 0 315.255 3.147 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273566833 130138637 /nfs/dbraw/zinc/13/86/37/130138637.db2.gz JTAWMMFLZAPNSS-CVEARBPZSA-N 2 0 308.466 3.016 20 10 DGCDRP C[NH+](CCC[N@@H+](C)Cc1ccccc1O)Cc1ccccc1O ZINC000077284302 431581856 /nfs/dbraw/zinc/58/18/56/431581856.db2.gz CPEVUSCRQYVXCK-UHFFFAOYSA-N 2 0 314.429 3.052 20 10 DGCDRP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N(C)C)cc1 ZINC000152430631 432332752 /nfs/dbraw/zinc/33/27/52/432332752.db2.gz YDUAXUQRACYFKK-HNAYVOBHSA-N 2 0 301.478 3.278 20 10 DGCDRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cc(F)ccc1O ZINC000185207102 432477198 /nfs/dbraw/zinc/47/71/98/432477198.db2.gz DFKKSPCJDHUVNU-ZNMIVQPWSA-N 2 0 324.440 3.071 20 10 DGCDRP CC(C)[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCCN3C)CC1 ZINC000236603702 432749900 /nfs/dbraw/zinc/74/99/00/432749900.db2.gz KKSPJXJZTOXUMX-UHFFFAOYSA-N 2 0 301.478 3.031 20 10 DGCDRP CCCC[NH+]1CCC([NH2+]Cc2cccc(OCC)c2O)CC1 ZINC000236760128 432763576 /nfs/dbraw/zinc/76/35/76/432763576.db2.gz MJOZTKFSYULSCF-UHFFFAOYSA-N 2 0 306.450 3.145 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)c1 ZINC000276592016 432821445 /nfs/dbraw/zinc/82/14/45/432821445.db2.gz AAKJWZJORPYEEL-AWEZNQCLSA-N 2 0 306.450 3.173 20 10 DGCDRP Oc1cccc2c1[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CC2 ZINC000296960350 432942588 /nfs/dbraw/zinc/94/25/88/432942588.db2.gz RCBNPSVIAOWUQL-SFHVURJKSA-N 2 0 323.440 3.281 20 10 DGCDRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000295828955 434440168 /nfs/dbraw/zinc/44/01/68/434440168.db2.gz DUXTXSUYVVCXKO-RDJZCZTQSA-N 2 0 302.462 3.481 20 10 DGCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cc(Cl)ccc3O)C2)CC1 ZINC000367687037 434554264 /nfs/dbraw/zinc/55/42/64/434554264.db2.gz NBMQULYEDZCNLH-AWEZNQCLSA-N 2 0 308.853 3.209 20 10 DGCDRP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(N(C)C)cc1 ZINC000363792858 332248617 /nfs/dbraw/zinc/24/86/17/332248617.db2.gz OROXUJWLBWYLLU-WDSOQIARSA-N 2 0 301.478 3.420 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)c1 ZINC000185358111 534204537 /nfs/dbraw/zinc/20/45/37/534204537.db2.gz VRNFCQFVBSHSEP-LSDHHAIUSA-N 2 0 306.450 3.172 20 10 DGCDRP CN(C)c1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1F ZINC000853093595 620668077 /nfs/dbraw/zinc/66/80/77/620668077.db2.gz ORMKFUFZSUYROP-QGZVFWFLSA-N 2 0 319.468 3.103 20 10 DGCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000853241519 620681404 /nfs/dbraw/zinc/68/14/04/620681404.db2.gz WKFIPNZQQOOZBV-RDJZCZTQSA-N 2 0 302.462 3.473 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000894939894 618502170 /nfs/dbraw/zinc/50/21/70/618502170.db2.gz ORJLYBYGXOGWGT-XIHRNRATSA-N 2 0 315.505 3.207 20 10 DGCDRP CC[NH+](CC)CC1CC[NH+](Cc2cc(F)cc(F)c2[O-])CC1 ZINC000893939711 618679359 /nfs/dbraw/zinc/67/93/59/618679359.db2.gz GDZZNNOXKKLTQI-UHFFFAOYSA-N 2 0 312.404 3.224 20 10 DGCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)cc(OC)c2O)C[C@@H]1C ZINC000894044003 618698480 /nfs/dbraw/zinc/69/84/80/618698480.db2.gz HPYDSVDCAQGCFT-GOEBONIOSA-N 2 0 306.450 3.014 20 10 DGCDRP CC1([NH+]2CCC2)CCC([NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000927037280 619259738 /nfs/dbraw/zinc/25/97/38/619259738.db2.gz MLLXXJFBPLSHOR-WUJZJPHMSA-N 2 0 300.446 3.376 20 10 DGCDRP CC(C)([NH3+])CC[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000903938747 619837953 /nfs/dbraw/zinc/83/79/53/619837953.db2.gz IXVBGYFRADNGCI-UHFFFAOYSA-N 2 0 314.429 3.188 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000841086258 620225315 /nfs/dbraw/zinc/22/53/15/620225315.db2.gz GRTMPRZDJRSMQZ-VQIMIIECSA-N 2 0 301.478 3.025 20 10 DGCDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)CC1(C)C ZINC000858094767 621151779 /nfs/dbraw/zinc/15/17/79/621151779.db2.gz RVDKFTJZHQNULA-KRWDZBQOSA-N 2 0 301.478 3.249 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000838952315 621302404 /nfs/dbraw/zinc/30/24/04/621302404.db2.gz VIBULIFPAURFSD-UHFFFAOYSA-N 2 0 324.472 3.215 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000839182145 621343684 /nfs/dbraw/zinc/34/36/84/621343684.db2.gz LDCNNMVTALGMEH-GOSISDBHSA-N 2 0 303.494 3.354 20 10 DGCDRP C[C@H](C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)C[NH+]1CCCC1 ZINC000756422844 621637628 /nfs/dbraw/zinc/63/76/28/621637628.db2.gz MQEIWGAAAJPSOM-IPYPFGDCSA-N 2 0 306.425 3.401 20 10 DGCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756639784 621655214 /nfs/dbraw/zinc/65/52/14/621655214.db2.gz FAIHJBLLEOFNCT-GZBFAFLISA-N 2 0 324.440 3.026 20 10 DGCDRP C[C@H](c1ccncc1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000757881356 621744694 /nfs/dbraw/zinc/74/46/94/621744694.db2.gz FYSHCGXJGOUGJF-QGZVFWFLSA-N 2 0 324.472 3.026 20 10 DGCDRP CC(C)[NH+]1CCC(CC[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000866468257 622123352 /nfs/dbraw/zinc/12/33/52/622123352.db2.gz DFBBMQFVZBYYCB-KRWDZBQOSA-N 2 0 302.462 3.480 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CC[C@H]2CCC[NH+]2C)cc1 ZINC000767359217 622393123 /nfs/dbraw/zinc/39/31/23/622393123.db2.gz GEFXFXQZFIXNRD-GOSISDBHSA-N 2 0 303.494 3.449 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(O)cc1C ZINC000768466155 622458643 /nfs/dbraw/zinc/45/86/43/622458643.db2.gz NAQZUZJQSIYFNX-MRXNPFEDSA-N 2 0 318.461 3.017 20 10 DGCDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000768926808 622485572 /nfs/dbraw/zinc/48/55/72/622485572.db2.gz OAUMTROPTJPPDS-UHFFFAOYSA-N 2 0 321.484 3.444 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1F ZINC000769499922 622534650 /nfs/dbraw/zinc/53/46/50/622534650.db2.gz XTCFTINXSRSIEL-UHFFFAOYSA-N 2 0 321.484 3.446 20 10 DGCDRP CC1CCC(C)([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000771842257 622802002 /nfs/dbraw/zinc/80/20/02/622802002.db2.gz GAHCZOGCGFHDGI-UHFFFAOYSA-N 2 0 315.505 3.497 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000872253976 622868349 /nfs/dbraw/zinc/86/83/49/622868349.db2.gz NZXYKJPCSQKHCU-FUTAKVPZSA-N 2 0 301.478 3.134 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000773766313 623070559 /nfs/dbraw/zinc/07/05/59/623070559.db2.gz RPJPIWSXUTVAEO-MJGOQNOKSA-N 2 0 301.478 3.059 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N(C)C)cc1 ZINC000873264787 623096753 /nfs/dbraw/zinc/09/67/53/623096753.db2.gz ROYKYXUMTWFEGF-NOCIGQNYSA-N 2 0 301.478 3.324 20 10 DGCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCCC1 ZINC000775638224 623300602 /nfs/dbraw/zinc/30/06/02/623300602.db2.gz CONGJMFOKPVUHI-UHFFFAOYSA-N 2 0 301.478 3.203 20 10 DGCDRP C[C@@H]1CCC[C@@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775649404 623303551 /nfs/dbraw/zinc/30/35/51/623303551.db2.gz QXLBPWLPOXOHJF-YLJYHZDGSA-N 2 0 315.505 3.449 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3C3CCC3)cc2)CC1 ZINC000775669574 623310049 /nfs/dbraw/zinc/31/00/49/623310049.db2.gz LVFUASFCLXQFNG-FQEVSTJZSA-N 2 0 313.489 3.203 20 10 DGCDRP Cc1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c(O)c1 ZINC000876811575 623713731 /nfs/dbraw/zinc/71/37/31/623713731.db2.gz LIILZWLXWIVCGA-MAUKXSAKSA-N 2 0 300.446 3.149 20 10 DGCDRP Cc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000877486948 623907604 /nfs/dbraw/zinc/90/76/04/623907604.db2.gz ONGMDDVJJDMDHH-GOSISDBHSA-N 2 0 310.441 3.312 20 10 DGCDRP COc1cccc(C[N@H+](CC(C)C)CC2CC[NH+](C)CC2)c1O ZINC000877767576 624028387 /nfs/dbraw/zinc/02/83/87/624028387.db2.gz OLZKWHMWBGTFML-UHFFFAOYSA-N 2 0 320.477 3.201 20 10 DGCDRP C[C@H]([NH2+]Cc1cc(F)cc(F)c1[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000883085168 625922077 /nfs/dbraw/zinc/92/20/77/625922077.db2.gz KGOKKKSHFVCPSP-QWHCGFSZSA-N 2 0 324.415 3.413 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H]4CCC[C@@H]43)ccc21 ZINC000796726888 626076686 /nfs/dbraw/zinc/07/66/86/626076686.db2.gz GIUFSKXTQIACGC-QWFCFKBJSA-N 2 0 313.489 3.031 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N(C)C)c(C)c2)C[C@H]1C ZINC000815057646 627620574 /nfs/dbraw/zinc/62/05/74/627620574.db2.gz WHZDQAACGPYWBQ-AEFFLSMTSA-N 2 0 303.494 3.366 20 10 DGCDRP COc1cc(Cl)cc(C[NH2+]C2CCC([NH+](C)C)CC2)c1O ZINC000817416120 627897070 /nfs/dbraw/zinc/89/70/70/627897070.db2.gz JTGAQQSGDABSOS-UHFFFAOYSA-N 2 0 312.841 3.017 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1F ZINC000817901177 627956024 /nfs/dbraw/zinc/95/60/24/627956024.db2.gz SVONSIRNCZUOKW-RYQLBKOJSA-N 2 0 319.468 3.292 20 10 DGCDRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817935065 627966899 /nfs/dbraw/zinc/96/68/99/627966899.db2.gz FKNLIOPRXUOHHR-MRXNPFEDSA-N 2 0 301.478 3.470 20 10 DGCDRP CC[NH2+]CCC[NH2+][C@H](CC)c1cc(Br)ccc1O ZINC000817943112 627969784 /nfs/dbraw/zinc/96/97/84/627969784.db2.gz IRKHNAYPWYXZME-CYBMUJFWSA-N 2 0 315.255 3.195 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(Br)cc1O ZINC000817970428 627978859 /nfs/dbraw/zinc/97/88/59/627978859.db2.gz VDZGTFXEUCMYKY-MVWJERBFSA-N 2 0 313.239 3.075 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817970766 627979868 /nfs/dbraw/zinc/97/98/68/627979868.db2.gz DQZWUQGHIMECKJ-MPGHIAIKSA-N 2 0 319.468 3.465 20 10 DGCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817970769 627980016 /nfs/dbraw/zinc/98/00/16/627980016.db2.gz DQZWUQGHIMECKJ-VKJFTORMSA-N 2 0 319.468 3.465 20 10 DGCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000817987534 627984332 /nfs/dbraw/zinc/98/43/32/627984332.db2.gz UCMQDCTWTFDFDN-OKDNKWQNSA-N 2 0 314.473 3.310 20 10 DGCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000817987410 627984411 /nfs/dbraw/zinc/98/44/11/627984411.db2.gz YTVRVDFYVKRYJK-NVXWUHKLSA-N 2 0 301.478 3.468 20 10 DGCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1O ZINC000817985691 627984449 /nfs/dbraw/zinc/98/44/49/627984449.db2.gz GYHNMPYSLSBXPV-PWNZVWSESA-N 2 0 308.853 3.393 20 10 DGCDRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817987164 627984506 /nfs/dbraw/zinc/98/45/06/627984506.db2.gz WZGMLJFFXDSJDV-CQSZACIVSA-N 2 0 300.446 3.231 20 10 DGCDRP C[C@@H]1CC2(C[N@@H+]1C/C=C/c1ccc(N(C)C)cc1)CC[NH2+]CC2 ZINC000818431713 628022544 /nfs/dbraw/zinc/02/25/44/628022544.db2.gz RIHCJXNPGNPKAD-LAQIPUCWSA-N 2 0 313.489 3.230 20 10 DGCDRP CCC1([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCC1 ZINC000824650112 628680066 /nfs/dbraw/zinc/68/00/66/628680066.db2.gz IULFYDSVBDNOTL-UHFFFAOYSA-N 2 0 301.478 3.251 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC000825283943 628746331 /nfs/dbraw/zinc/74/63/31/628746331.db2.gz AGHUKHHGUDUEJV-INIZCTEOSA-N 2 0 301.478 3.107 20 10 DGCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000835030458 629829621 /nfs/dbraw/zinc/82/96/21/629829621.db2.gz YEHVCRBYEANRCM-XLKJWTSGSA-N 2 0 313.489 3.182 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCCC23CC[NH+](C)CC3)cc1 ZINC000835045397 629833746 /nfs/dbraw/zinc/83/37/46/629833746.db2.gz LNDBQJDXJCTMEB-XQRVVYSFSA-N 2 0 313.489 3.326 20 10 DGCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840918286 630377966 /nfs/dbraw/zinc/37/79/66/630377966.db2.gz ZEMIRBLZVYMQHG-KRWDZBQOSA-N 2 0 303.494 3.225 20 10 DGCDRP Cc1cc(O)c(CN2CC[C@@H](C[NH+]3CCCC3)C2)c(Cl)c1 ZINC000840918236 630378024 /nfs/dbraw/zinc/37/80/24/630378024.db2.gz QJQXAHMNLQNQGP-AWEZNQCLSA-N 2 0 308.853 3.272 20 10 DGCDRP CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000841005048 630394330 /nfs/dbraw/zinc/39/43/30/630394330.db2.gz DDURHFPVERAAJD-AEFFLSMTSA-N 2 0 303.494 3.351 20 10 DGCDRP C[C@H]1C[C@@H](C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH2+]1 ZINC000841003261 630394385 /nfs/dbraw/zinc/39/43/85/630394385.db2.gz PDVJFGZHKCAUQH-HKUYNNGSSA-N 2 0 315.505 3.497 20 10 DGCDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841030946 630398567 /nfs/dbraw/zinc/39/85/67/630398567.db2.gz PYDDWVPPLYRDNJ-HKUYNNGSSA-N 2 0 301.478 3.284 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@H]1CCC[NH2+]C1 ZINC000841033487 630399351 /nfs/dbraw/zinc/39/93/51/630399351.db2.gz OZKZBUTVMAWIDA-AEFFLSMTSA-N 2 0 301.478 3.155 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cc1F ZINC000841032234 630399382 /nfs/dbraw/zinc/39/93/82/630399382.db2.gz AEQVSWBACUPVFD-GOEBONIOSA-N 2 0 307.457 3.150 20 10 DGCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC[NH2+]1 ZINC000841064093 630403739 /nfs/dbraw/zinc/40/37/39/630403739.db2.gz XWHDGOOFQMVIOA-AAEUAGOBSA-N 2 0 315.383 3.002 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)cc1 ZINC000843043650 630607430 /nfs/dbraw/zinc/60/74/30/630607430.db2.gz ATECCGBFYCKNLD-BBIZLLLXSA-N 2 0 313.489 3.230 20 10 DGCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)cc1 ZINC000843127017 630616277 /nfs/dbraw/zinc/61/62/77/630616277.db2.gz NXFXOVWBEVWKFW-RTLBZRNLSA-N 2 0 313.489 3.087 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)c(Cl)c1 ZINC000843126294 630616282 /nfs/dbraw/zinc/61/62/82/630616282.db2.gz HXNGMWCTOOXXBI-AWEZNQCLSA-N 2 0 308.853 3.176 20 10 DGCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126044 630616360 /nfs/dbraw/zinc/61/63/60/630616360.db2.gz FFULDVJIRJXCNT-KGLIPLIRSA-N 2 0 308.853 3.257 20 10 DGCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126108 630616553 /nfs/dbraw/zinc/61/65/53/630616553.db2.gz GOBXQBFZQUKBRU-KGLIPLIRSA-N 2 0 308.853 3.257 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1O ZINC000843127250 630617066 /nfs/dbraw/zinc/61/70/66/630617066.db2.gz PBTIIIGFNADPBC-HOTGVXAUSA-N 2 0 318.461 3.003 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1O ZINC000843127248 630617329 /nfs/dbraw/zinc/61/73/29/630617329.db2.gz PBTIIIGFNADPBC-CVEARBPZSA-N 2 0 318.461 3.003 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1F ZINC000843341231 630647749 /nfs/dbraw/zinc/64/77/49/630647749.db2.gz SOVPXAWLERQCBI-IXDOHACOSA-N 2 0 319.468 3.150 20 10 DGCDRP C[NH2+]CCC1CC[NH+](Cc2cc(Cl)cc(C(C)=O)c2O)CC1 ZINC000843363492 630649911 /nfs/dbraw/zinc/64/99/11/630649911.db2.gz NDJBGNNFFJQLAW-UHFFFAOYSA-N 2 0 324.852 3.070 20 10 DGCDRP C[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000844221347 630712969 /nfs/dbraw/zinc/71/29/69/630712969.db2.gz WVEJGPFYVSEFEA-KRWDZBQOSA-N 2 0 301.478 3.108 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)c1O ZINC000846143232 631211901 /nfs/dbraw/zinc/21/19/01/631211901.db2.gz CWAYKMOVKWXOHJ-CABCVRRESA-N 2 0 306.450 3.172 20 10 DGCDRP CCc1cccc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)c1O ZINC000848908096 631781713 /nfs/dbraw/zinc/78/17/13/631781713.db2.gz NIKUHWGZOLFBDO-UHFFFAOYSA-N 2 0 302.462 3.262 20 10 DGCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1 ZINC000849349772 631901059 /nfs/dbraw/zinc/90/10/59/631901059.db2.gz HAGVVTOPMDNZKX-INIZCTEOSA-N 2 0 318.461 3.003 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)cc1C ZINC000849350743 631901893 /nfs/dbraw/zinc/90/18/93/631901893.db2.gz UTUZQWDLBBWDLE-KRWDZBQOSA-N 2 0 302.462 3.221 20 10 DGCDRP CC(C)CC1([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000850404356 632141591 /nfs/dbraw/zinc/14/15/91/632141591.db2.gz IVSFOCSIGPYOGH-UHFFFAOYSA-N 2 0 301.478 3.107 20 10 DGCDRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1cc2c(cc1O)CCCC2 ZINC000184899732 660194329 /nfs/dbraw/zinc/19/43/29/660194329.db2.gz MAYIQYIBCRGEDA-OAHLLOKOSA-N 2 0 302.462 3.408 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000378951311 685146132 /nfs/dbraw/zinc/14/61/32/685146132.db2.gz HTXCXOPWJQOVRI-MJGOQNOKSA-N 2 0 301.478 3.249 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000388820053 685190748 /nfs/dbraw/zinc/19/07/48/685190748.db2.gz BJNFMYMJAKKFEQ-UHFFFAOYSA-N 2 0 303.494 3.354 20 10 DGCDRP C[C@@H]1C[C@@H](C[N@H+](C)Cc2ccc(N3CCCC3)cc2)CC[NH2+]1 ZINC001576597016 1191851977 /nfs/dbraw/zinc/85/19/77/1191851977.db2.gz CRJNNKMACDDRAZ-AEFFLSMTSA-N 2 0 301.478 3.107 20 10 DGCDRP Cc1cc(C[N@@H+](C)C2CC[NH2+]CC2)ccc1N1CCCCC1 ZINC001579593126 1191981038 /nfs/dbraw/zinc/98/10/38/1191981038.db2.gz VTQNFDNOAILFFH-UHFFFAOYSA-N 2 0 301.478 3.169 20 10 DGCDRP CC[C@@H](C)C[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001620812737 1192107516 /nfs/dbraw/zinc/10/75/16/1192107516.db2.gz QUDHYHBSMWROIW-SJORKVTESA-N 2 0 303.494 3.353 20 10 DGCDRP [O-]c1c(F)cc(Cl)cc1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001461068377 1182762664 /nfs/dbraw/zinc/76/26/64/1182762664.db2.gz UHEBNBMLPGWWJN-UHFFFAOYSA-N 2 0 312.816 3.149 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC3(C)C)cc2)CC1 ZINC001461269680 1182790134 /nfs/dbraw/zinc/79/01/34/1182790134.db2.gz SDUKHJPNLKPBQE-GOSISDBHSA-N 2 0 301.478 3.107 20 10 DGCDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001473988417 1183844224 /nfs/dbraw/zinc/84/42/24/1183844224.db2.gz DEKWFYXMIRZUDQ-LJQANCHMSA-N 2 0 315.505 3.497 20 10 DGCDRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001473994024 1183845982 /nfs/dbraw/zinc/84/59/82/1183845982.db2.gz IQBMEWJVMFKGCY-SAABIXHNSA-N 2 0 301.478 3.107 20 10 DGCDRP CCC1([NH+](C)C)CC[NH+](Cc2c(C)cc(OC)cc2O)CC1 ZINC001560957756 1189411283 /nfs/dbraw/zinc/41/12/83/1189411283.db2.gz GBBZCWWEQMMZOA-UHFFFAOYSA-N 2 0 306.450 3.015 20 10 DGCDRP C[C@H]1CCCC[C@]1(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001657481160 1196147560 /nfs/dbraw/zinc/14/75/60/1196147560.db2.gz WOVAWPOKYQRPHL-PXNSSMCTSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[NH+]1CCC(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)CC1 ZINC001659472322 1196386377 /nfs/dbraw/zinc/38/63/77/1196386377.db2.gz RQCOTOZRIQHLGE-QGZVFWFLSA-N 2 0 317.521 3.314 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc1 ZINC001204727529 1084861833 /nfs/dbraw/zinc/86/18/33/1084861833.db2.gz CADQCZIWOUQINK-UHFFFAOYSA-N 2 0 315.505 3.498 20 10 DGCDRP CC[NH+](CC)Cc1cc(N(CCC[NH3+])C(C)C)ccc1OC ZINC001164129102 1090350996 /nfs/dbraw/zinc/35/09/96/1090350996.db2.gz XZVQCJOUWFKADP-UHFFFAOYSA-N 2 0 307.482 3.101 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)c2ccccc21 ZINC001204240305 1090931234 /nfs/dbraw/zinc/93/12/34/1090931234.db2.gz NZFGBPHCGRDRAA-OAQYLSRUSA-N 2 0 323.484 3.433 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)Cc2ccccc21 ZINC001205164957 1091116739 /nfs/dbraw/zinc/11/67/39/1091116739.db2.gz YCGGARDOQRMFDJ-QGZVFWFLSA-N 2 0 321.468 3.216 20 10 DGCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]2C1 ZINC001138216964 1091118805 /nfs/dbraw/zinc/11/88/05/1091118805.db2.gz REJCOKDLPNLYKM-MOPGFXCFSA-N 2 0 313.489 3.060 20 10 DGCDRP C[C@@H]1[C@H]([NH3+])CCN1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001205203027 1091129226 /nfs/dbraw/zinc/12/92/26/1091129226.db2.gz YLXBPPQRGFCSHC-SJKOYZFVSA-N 2 0 300.377 3.120 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c1O ZINC001205571601 1091260101 /nfs/dbraw/zinc/26/01/01/1091260101.db2.gz VVPQUQBRJRFYEV-SFHVURJKSA-N 2 0 308.441 3.343 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC[C@H]1C[NH3+] ZINC001205638612 1091292320 /nfs/dbraw/zinc/29/23/20/1091292320.db2.gz PYMHIKXTIDKSDM-NEPJUHHUSA-N 2 0 316.367 3.218 20 10 DGCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CC1(C)C ZINC001202870062 1091357915 /nfs/dbraw/zinc/35/79/15/1091357915.db2.gz QVLMECRGUKZHQW-RBUKOAKNSA-N 2 0 315.505 3.353 20 10 DGCDRP C[C@@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001205903494 1091401356 /nfs/dbraw/zinc/40/13/56/1091401356.db2.gz PQYCXAYHRRMMIU-SJLPKXTDSA-N 2 0 301.478 3.236 20 10 DGCDRP C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCC[C@H]1C[NH3+] ZINC001206023164 1091454706 /nfs/dbraw/zinc/45/47/06/1091454706.db2.gz DKNXQFRCVIZMCF-GJZGRUSLSA-N 2 0 304.478 3.497 20 10 DGCDRP COc1cc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)cc(C[NH+](C)C)c1O ZINC001139257223 1091501354 /nfs/dbraw/zinc/50/13/54/1091501354.db2.gz UYALSHPBQZTSIZ-ZIAGYGMSSA-N 2 0 306.450 3.083 20 10 DGCDRP CC[C@H]1CCC[N@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139257559 1091502046 /nfs/dbraw/zinc/50/20/46/1091502046.db2.gz FEABJCQUNUTDNS-AWEZNQCLSA-N 2 0 306.450 3.084 20 10 DGCDRP COc1cc(C[NH+]2CCC(C(C)C)CC2)cc(C[NH+](C)C)c1O ZINC001139258830 1091504529 /nfs/dbraw/zinc/50/45/29/1091504529.db2.gz XQCSLPZPOYIJQZ-UHFFFAOYSA-N 2 0 320.477 3.330 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001139408068 1091551230 /nfs/dbraw/zinc/55/12/30/1091551230.db2.gz JHDGNYRVFGIJKE-QZTJIDSGSA-N 2 0 315.505 3.306 20 10 DGCDRP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC001206362729 1091600303 /nfs/dbraw/zinc/60/03/03/1091600303.db2.gz QDWPORNOAQJADO-SFHVURJKSA-N 2 0 302.393 3.198 20 10 DGCDRP C[C@@H]1CC[C@H](C[NH3+])C[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001206770071 1091732951 /nfs/dbraw/zinc/73/29/51/1091732951.db2.gz QIJDBNRHYAFBGI-HZPDHXFCSA-N 2 0 311.473 3.465 20 10 DGCDRP Cc1ccc(C)c(C[NH+]2CCC([NH+]3CCCCC3)CC2)c1O ZINC001140181033 1091793881 /nfs/dbraw/zinc/79/38/81/1091793881.db2.gz UGFTXAOMISBHLU-UHFFFAOYSA-N 2 0 302.462 3.459 20 10 DGCDRP Cc1ccc(C)c(C[N@H+]2CC[C@H](Oc3ccncc3C)C2)c1O ZINC001140185033 1091795569 /nfs/dbraw/zinc/79/55/69/1091795569.db2.gz OPHGXQKUZBNVEJ-INIZCTEOSA-N 2 0 312.413 3.366 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C)[C@H](F)C3)cc2)CC1 ZINC001140302038 1091818853 /nfs/dbraw/zinc/81/88/53/1091818853.db2.gz IGZVEHCPQSSOQX-VQIMIIECSA-N 2 0 319.468 3.008 20 10 DGCDRP Cc1ccc(O)c(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c1 ZINC001140621272 1091935073 /nfs/dbraw/zinc/93/50/73/1091935073.db2.gz SVROHXPPCRMWFA-UHFFFAOYSA-N 2 0 302.462 3.254 20 10 DGCDRP CCCCN(CCCC)c1ccc(C[NH+]2CC(C[NH3+])C2)c(O)c1 ZINC001210545917 1093202715 /nfs/dbraw/zinc/20/27/15/1093202715.db2.gz SWFJVOXQNPRCAC-UHFFFAOYSA-N 2 0 319.493 3.189 20 10 DGCDRP CCc1cccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)c1O ZINC001336888808 1094774208 /nfs/dbraw/zinc/77/42/08/1094774208.db2.gz MKOHYARODVEMEL-RYQLBKOJSA-N 2 0 302.462 3.117 20 10 DGCDRP CC[C@@]1(C)CC[N@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001337043040 1094828464 /nfs/dbraw/zinc/82/84/64/1094828464.db2.gz XERMKPDEHHRKAR-IBGZPJMESA-N 2 0 319.468 3.200 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c1 ZINC001222149034 1095458852 /nfs/dbraw/zinc/45/88/52/1095458852.db2.gz VIXQQFINDKSHRW-LJQANCHMSA-N 2 0 302.462 3.265 20 10 DGCDRP Cc1ccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c(O)c1 ZINC001222167829 1095474078 /nfs/dbraw/zinc/47/40/78/1095474078.db2.gz SKNVQYKPVLFORL-LJQANCHMSA-N 2 0 302.462 3.446 20 10 DGCDRP Cc1c(O)ccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1O ZINC001222168273 1095475934 /nfs/dbraw/zinc/47/59/34/1095475934.db2.gz ZHYHODATRMLFHW-LJQANCHMSA-N 2 0 318.461 3.152 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2CCC3(C[NH2+]C3)CC2)cc1 ZINC001222203073 1095491297 /nfs/dbraw/zinc/49/12/97/1095491297.db2.gz GMWOETFGRJQBDP-UHFFFAOYSA-N 2 0 309.457 3.280 20 10 DGCDRP CC(C)(C)c1cccc(CN2CC[C@@]3(C2)CCCC[NH2+]3)c1O ZINC001222426321 1095607486 /nfs/dbraw/zinc/60/74/86/1095607486.db2.gz APPFBPDBZVRNCX-LJQANCHMSA-N 2 0 302.462 3.408 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCC3(CCC[NH2+]C3)CC2)c1O ZINC001222461379 1095625094 /nfs/dbraw/zinc/62/50/94/1095625094.db2.gz RNGRWANFGRIONE-UHFFFAOYSA-N 2 0 308.853 3.320 20 10 DGCDRP Cc1ccc(C)c(C[N@@H+]2C[C@H](c3ccccc3)C3(C[NH2+]C3)C2)c1O ZINC001222602522 1095686869 /nfs/dbraw/zinc/68/68/69/1095686869.db2.gz SEYOOAFAZARUMG-LJQANCHMSA-N 2 0 322.452 3.198 20 10 DGCDRP C[NH+]1CCC(C2CC[NH+](Cc3cccc(F)c3[O-])CC2)CC1 ZINC001138127426 1095901003 /nfs/dbraw/zinc/90/10/03/1095901003.db2.gz AVMWMWWCSYGELA-UHFFFAOYSA-N 2 0 306.425 3.085 20 10 DGCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001119032636 1096122595 /nfs/dbraw/zinc/12/25/95/1096122595.db2.gz YNSBEFSADJTBIL-QMHWVQJVSA-N 2 0 300.446 3.369 20 10 DGCDRP CC[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001173266034 1097389932 /nfs/dbraw/zinc/38/99/32/1097389932.db2.gz KLRDJHLDBJQKMS-FUHWJXTLSA-N 2 0 301.478 3.107 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001234997699 1098740585 /nfs/dbraw/zinc/74/05/85/1098740585.db2.gz DOSZYFMSCPTTAP-IBGZPJMESA-N 2 0 302.462 3.265 20 10 DGCDRP CC(C)(C)c1cccc(CN2CCCC[C@]23CC[NH2+]C3)c1O ZINC001235118681 1098817492 /nfs/dbraw/zinc/81/74/92/1098817492.db2.gz GWDXXRDZCCQWJR-LJQANCHMSA-N 2 0 302.462 3.408 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC3(CC[NH2+]CC3)CC2)c(Cl)c1 ZINC001235133651 1098830905 /nfs/dbraw/zinc/83/09/05/1098830905.db2.gz TYYVILIVRWGICW-UHFFFAOYSA-N 2 0 321.896 3.372 20 10 DGCDRP Oc1cc2c(cc1C[NH+]1CCC3(CCCC3)CC1)C[NH2+]CCO2 ZINC001235152856 1098840233 /nfs/dbraw/zinc/84/02/33/1098840233.db2.gz BVDJDJGLGYBPQB-UHFFFAOYSA-N 2 0 316.445 3.030 20 10 DGCDRP Cc1ccc(C)c(C[N@@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1O ZINC001235155292 1098842126 /nfs/dbraw/zinc/84/21/26/1098842126.db2.gz OAWCTKILCUEAFB-GOSISDBHSA-N 2 0 302.462 3.363 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@]3(C2)C[NH2+]CC[C@H]3F)cc1 ZINC001235403697 1099001891 /nfs/dbraw/zinc/00/18/91/1099001891.db2.gz LVFIAPALVAMNIJ-RTBURBONSA-N 2 0 319.468 3.056 20 10 DGCDRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@@]3(C2)C[NH2+]CC[C@@H]3F)c1O ZINC001235408098 1099004707 /nfs/dbraw/zinc/00/47/07/1099004707.db2.gz UAGQBIIKYSABHH-LPHOPBHVSA-N 2 0 320.452 3.213 20 10 DGCDRP Cc1cc(F)cc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1O ZINC001235420606 1099012596 /nfs/dbraw/zinc/01/25/96/1099012596.db2.gz ACUVUDXPKXIJRE-CABCVRRESA-N 2 0 306.425 3.051 20 10 DGCDRP CCCCC1CC[NH+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001235432063 1099029005 /nfs/dbraw/zinc/02/90/05/1099029005.db2.gz GXOYUILLSVMPPO-UHFFFAOYSA-N 2 0 318.461 3.276 20 10 DGCDRP Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235432912 1099031686 /nfs/dbraw/zinc/03/16/86/1099031686.db2.gz ZILYUHLFPOIYSI-ZIAGYGMSSA-N 2 0 308.853 3.257 20 10 DGCDRP Cc1ccc(C[N@@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235663693 1099112544 /nfs/dbraw/zinc/11/25/44/1099112544.db2.gz JPJZOLIJTKGEJA-UHFFFAOYSA-N 2 0 309.457 3.037 20 10 DGCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001235680126 1099124976 /nfs/dbraw/zinc/12/49/76/1099124976.db2.gz ILZRRLTUAJLAFS-IYBDPMFKSA-N 2 0 302.462 3.073 20 10 DGCDRP C[N@H+](CC[C@H]1CCCC[NH2+]1)Cc1ccc(N2CCCC2)cc1 ZINC001235694726 1099132199 /nfs/dbraw/zinc/13/21/99/1099132199.db2.gz RTFZTVNNYVVCIO-GOSISDBHSA-N 2 0 301.478 3.251 20 10 DGCDRP Oc1c(C[N@@H+]2CCCC3(C[NH2+]C3)C2)cccc1-c1ccccc1 ZINC001235713739 1099141337 /nfs/dbraw/zinc/14/13/37/1099141337.db2.gz OPIAKUIVTFRMRV-UHFFFAOYSA-N 2 0 308.425 3.245 20 10 DGCDRP C[NH2+]C1CCC([N@H+](C)Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001236214369 1099469630 /nfs/dbraw/zinc/46/96/30/1099469630.db2.gz BXUQBGXYBSDOGN-UHFFFAOYSA-N 2 0 316.367 3.373 20 10 DGCDRP Oc1ccc(F)cc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374160 1099559003 /nfs/dbraw/zinc/55/90/03/1099559003.db2.gz PHZXREKKXCVAOK-CQSZACIVSA-N 2 0 306.425 3.276 20 10 DGCDRP CCOc1cccc(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1O ZINC001236458810 1099623731 /nfs/dbraw/zinc/62/37/31/1099623731.db2.gz YVSWGXIPKUMNOB-UHFFFAOYSA-N 2 0 320.477 3.391 20 10 DGCDRP Cc1cc(Cl)cc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c1O ZINC001236602548 1099697628 /nfs/dbraw/zinc/69/76/28/1099697628.db2.gz XDSREZDMOFSLRB-CYBMUJFWSA-N 2 0 308.853 3.318 20 10 DGCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@H](C)C1 ZINC001236939668 1099881769 /nfs/dbraw/zinc/88/17/69/1099881769.db2.gz UCWBWXHQKIBNIK-HZPDHXFCSA-N 2 0 319.468 3.198 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C[C@@H]1CC1(C)C ZINC001236943016 1099884863 /nfs/dbraw/zinc/88/48/63/1099884863.db2.gz PANKBJXUUYUJNU-INIZCTEOSA-N 2 0 319.468 3.055 20 10 DGCDRP Cc1cc(Cl)cc(C[NH+]2CCN(c3cc[nH+]cc3)CC2)c1O ZINC001237681429 1100212886 /nfs/dbraw/zinc/21/28/86/1100212886.db2.gz PUKUWMZRBYSWPB-UHFFFAOYSA-N 2 0 317.820 3.071 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCN(c3cc[nH+]cc3)CC2)ccc1N(C)C ZINC001195535327 1101156050 /nfs/dbraw/zinc/15/60/50/1101156050.db2.gz IORPZUSSFYNJRH-UHFFFAOYSA-N 2 0 324.472 3.168 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201947405 1102767371 /nfs/dbraw/zinc/76/73/71/1102767371.db2.gz XUVGCJNACXVNIA-MAUKXSAKSA-N 2 0 314.473 3.364 20 10 DGCDRP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001328783371 1104068830 /nfs/dbraw/zinc/06/88/30/1104068830.db2.gz LLNQUIRFHFEFSB-SFHVURJKSA-N 2 0 301.478 3.108 20 10 DGCDRP c1cc(C[NH2+]C2CCC3(CCC[NH2+]C3)CC2)cc2c1OCC2 ZINC001246199503 1104433662 /nfs/dbraw/zinc/43/36/62/1104433662.db2.gz LZAPSEXUAWMBCS-UHFFFAOYSA-N 2 0 300.446 3.024 20 10 DGCDRP c1cc(C[NH2+]C2CCC3(CC[NH2+]CC3)CC2)cc2c1OCC2 ZINC001246201710 1104435872 /nfs/dbraw/zinc/43/58/72/1104435872.db2.gz WXHHRMLYRFTOLW-UHFFFAOYSA-N 2 0 300.446 3.024 20 10 DGCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246917389 1104736693 /nfs/dbraw/zinc/73/66/93/1104736693.db2.gz CQWYGHVUNNOFQJ-IBGZPJMESA-N 2 0 315.505 3.497 20 10 DGCDRP CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001319707753 1108602927 /nfs/dbraw/zinc/60/29/27/1108602927.db2.gz XSRWGKHNYBYMFY-NVXWUHKLSA-N 2 0 319.468 3.198 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1O ZINC000093563844 193268023 /nfs/dbraw/zinc/26/80/23/193268023.db2.gz WVRQIQYWBBXSCW-QGZVFWFLSA-N 2 0 318.461 3.241 20 10 DGCDRP CC[C@H]([NH2+]CCC[NH+](C)C)c1cc(Br)ccc1O ZINC000019958821 182170264 /nfs/dbraw/zinc/17/02/64/182170264.db2.gz HTFAQLZYKWYVDT-ZDUSSCGKSA-N 2 0 315.255 3.147 20 10 DGCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000185206446 432477255 /nfs/dbraw/zinc/47/72/55/432477255.db2.gz NBPPNTJKIWOKNP-BBWFWOEESA-N 2 0 320.477 3.241 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)cc2)CC1 ZINC000157493458 432622216 /nfs/dbraw/zinc/62/22/16/432622216.db2.gz NUGQZINKDMDWMR-MJGOQNOKSA-N 2 0 315.505 3.495 20 10 DGCDRP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000178254481 432712128 /nfs/dbraw/zinc/71/21/28/432712128.db2.gz BAGBICGNSUNGJJ-OAHLLOKOSA-N 2 0 301.478 3.278 20 10 DGCDRP C[C@@H](C[NH2+][C@@H](C)c1ccc(Br)cc1O)C[NH+](C)C ZINC000293714128 433836336 /nfs/dbraw/zinc/83/63/36/433836336.db2.gz PBZZJOZPAABSEJ-QWRGUYRKSA-N 2 0 315.255 3.003 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1 ZINC000366956848 434532624 /nfs/dbraw/zinc/53/26/24/434532624.db2.gz WYEOESIHTQYVQT-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP CCCOc1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c(O)c1 ZINC000156096110 520352870 /nfs/dbraw/zinc/35/28/70/520352870.db2.gz AKBBALXAMRFFSH-CRAIPNDOSA-N 2 0 318.461 3.097 20 10 DGCDRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000731041542 574541789 /nfs/dbraw/zinc/54/17/89/574541789.db2.gz FYQLMYCJYFCCND-INIZCTEOSA-N 2 0 310.441 3.491 20 10 DGCDRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(F)cc(C(C)=O)c2O)C[C@@H]1C ZINC000750827074 575753888 /nfs/dbraw/zinc/75/38/88/575753888.db2.gz VJTVNYCWBRCLNJ-BLLLJJGKSA-N 2 0 322.424 3.039 20 10 DGCDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000854230452 620786683 /nfs/dbraw/zinc/78/66/83/620786683.db2.gz QJNPUFVTOIJRHB-GXFFZTMASA-N 2 0 315.255 3.179 20 10 DGCDRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000925780797 618618251 /nfs/dbraw/zinc/61/82/51/618618251.db2.gz GZLCINGRXBCCJU-DOMZBBRYSA-N 2 0 324.415 3.166 20 10 DGCDRP COc1ccc(O)c(C[NH+]2CCC([C@H]3CCC[NH2+]CC3)CC2)c1 ZINC000904416155 619920816 /nfs/dbraw/zinc/92/08/16/619920816.db2.gz IGGDRABSRDJJHF-HNNXBMFYSA-N 2 0 318.461 3.003 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1C[NH3+] ZINC000904412075 619920828 /nfs/dbraw/zinc/92/08/28/619920828.db2.gz PEZOXMNYTGUUFV-SJLPKXTDSA-N 2 0 301.478 3.094 20 10 DGCDRP COc1ccc(O)c(C[NH+]2CCC([C@@H]3CCC[NH2+]CC3)CC2)c1 ZINC000904416156 619921082 /nfs/dbraw/zinc/92/10/82/619921082.db2.gz IGGDRABSRDJJHF-OAHLLOKOSA-N 2 0 318.461 3.003 20 10 DGCDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921688739 620934332 /nfs/dbraw/zinc/93/43/32/620934332.db2.gz DICHBQVDQZKRBJ-KRWDZBQOSA-N 2 0 302.462 3.222 20 10 DGCDRP COc1cccc(O)c1C[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC000922510042 621048879 /nfs/dbraw/zinc/04/88/79/621048879.db2.gz SEDLQUXLMAZVNN-UHFFFAOYSA-N 2 0 318.461 3.288 20 10 DGCDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000922848466 621108473 /nfs/dbraw/zinc/10/84/73/621108473.db2.gz SOWBTOQBCYJEOZ-UHFFFAOYSA-N 2 0 300.446 3.118 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC(F)(F)CC3)cc2)CC1 ZINC000862467479 621592905 /nfs/dbraw/zinc/59/29/05/621592905.db2.gz WRDRFHOQWBOCPH-UHFFFAOYSA-N 2 0 323.431 3.060 20 10 DGCDRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2c1c(F)ccc2O ZINC000756402615 621635553 /nfs/dbraw/zinc/63/55/53/621635553.db2.gz VXDCMCHNEQGYNF-TYNCELHUSA-N 2 0 304.409 3.154 20 10 DGCDRP C[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)C[NH+]1CCCC1 ZINC000756422845 621637713 /nfs/dbraw/zinc/63/77/13/621637713.db2.gz MQEIWGAAAJPSOM-NFAWXSAZSA-N 2 0 306.425 3.401 20 10 DGCDRP COc1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(O)cc1C ZINC000768466154 622458741 /nfs/dbraw/zinc/45/87/41/622458741.db2.gz NAQZUZJQSIYFNX-INIZCTEOSA-N 2 0 318.461 3.017 20 10 DGCDRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(OCC)cc2O)CC1 ZINC000768920213 622485344 /nfs/dbraw/zinc/48/53/44/622485344.db2.gz IVCYBLOLOUFVOR-UHFFFAOYSA-N 2 0 306.450 3.097 20 10 DGCDRP CCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)c(O)c1 ZINC000769470749 622531017 /nfs/dbraw/zinc/53/10/17/622531017.db2.gz OTNBYTGUMINLNU-ZBFHGGJFSA-N 2 0 306.450 3.096 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC4CCC3CC4)cc2)CC1 ZINC000771848947 622803645 /nfs/dbraw/zinc/80/36/45/622803645.db2.gz VQDAEEIICVFHTC-NLPFYKDJSA-N 2 0 313.489 3.107 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC4CCC3CC4)cc2)CC1 ZINC000771848950 622803850 /nfs/dbraw/zinc/80/38/50/622803850.db2.gz VQDAEEIICVFHTC-OUNSHVDWSA-N 2 0 313.489 3.107 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC(F)(F)C3)cc2)CC1 ZINC000771848930 622803881 /nfs/dbraw/zinc/80/38/81/622803881.db2.gz VLTKWUXTDOTDPC-INIZCTEOSA-N 2 0 323.431 3.106 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCC(F)(F)CC3)cc2)CC1 ZINC000771864050 622806193 /nfs/dbraw/zinc/80/61/93/622806193.db2.gz IREHFAOMNPJCJB-UHFFFAOYSA-N 2 0 323.431 3.106 20 10 DGCDRP CCN(C)c1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1 ZINC000773746702 623066635 /nfs/dbraw/zinc/06/66/35/623066635.db2.gz OEIITGQYDBGHNY-UHFFFAOYSA-N 2 0 303.494 3.306 20 10 DGCDRP Cc1cc(O)c(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)cc1C ZINC000873232198 623085137 /nfs/dbraw/zinc/08/51/37/623085137.db2.gz BNHMYTLQNDXQJM-GOSISDBHSA-N 2 0 302.462 3.411 20 10 DGCDRP C[C@@H]([NH2+]CC[C@H]([NH3+])Cc1ccccc1)c1cc(F)ccc1O ZINC000873236236 623086884 /nfs/dbraw/zinc/08/68/84/623086884.db2.gz ZLPYQHQCUPWAQV-CJNGLKHVSA-N 2 0 302.393 3.142 20 10 DGCDRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1O ZINC000873249320 623091323 /nfs/dbraw/zinc/09/13/23/623091323.db2.gz KWGSCKACCPAQTI-SUZMYJTESA-N 2 0 302.340 3.189 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000775023486 623217919 /nfs/dbraw/zinc/21/79/19/623217919.db2.gz KYIYWYKFTGZUOF-UHFFFAOYSA-N 2 0 315.505 3.497 20 10 DGCDRP CCC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC1CC1 ZINC000775632874 623299881 /nfs/dbraw/zinc/29/98/81/623299881.db2.gz CKNPMVKUKREUGG-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C ZINC000775669173 623309568 /nfs/dbraw/zinc/30/95/68/623309568.db2.gz TVXKLQOKJXQTTE-IAGOWNOFSA-N 2 0 301.478 3.059 20 10 DGCDRP COc1cccc(O)c1C[N@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC000877767666 624028445 /nfs/dbraw/zinc/02/84/45/624028445.db2.gz SCLMAFZOCBFGJL-UHFFFAOYSA-N 2 0 320.477 3.201 20 10 DGCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1O ZINC000808675593 626847764 /nfs/dbraw/zinc/84/77/64/626847764.db2.gz MNJPYPMPXMDGQZ-OLZOCXBDSA-N 2 0 308.853 3.489 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@H](C)[C@H]3C)cc2F)CC1 ZINC000813858585 627516704 /nfs/dbraw/zinc/51/67/04/627516704.db2.gz ASTNSTOIYXMANF-HDMKZQKVSA-N 2 0 319.468 3.102 20 10 DGCDRP Cc1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)ccc1N(C)C ZINC000815020436 627617058 /nfs/dbraw/zinc/61/70/58/627617058.db2.gz YKBUNSYLFQYXBP-UHFFFAOYSA-N 2 0 315.505 3.369 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC(C(C)(C)C)C3)cc2)CC1 ZINC000815146441 627637460 /nfs/dbraw/zinc/63/74/60/627637460.db2.gz HPEKGTUITXFPRX-UHFFFAOYSA-N 2 0 315.505 3.353 20 10 DGCDRP CC(=O)c1cc(Cl)cc(CN2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c1O ZINC000817880394 627952780 /nfs/dbraw/zinc/95/27/80/627952780.db2.gz RNAHNRIXWXZKJN-WDMOLILDSA-N 2 0 324.852 3.053 20 10 DGCDRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817898591 627955896 /nfs/dbraw/zinc/95/58/96/627955896.db2.gz JNDGDXOZNSQFKH-LAUBAEHRSA-N 2 0 323.484 3.335 20 10 DGCDRP c1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc2c1OCC2 ZINC000817902543 627956878 /nfs/dbraw/zinc/95/68/78/627956878.db2.gz TWERPXGPEIBYOY-KZNAEPCWSA-N 2 0 300.446 3.022 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C1CCC(C[NH3+])CC1 ZINC000817934493 627965934 /nfs/dbraw/zinc/96/59/34/627965934.db2.gz JSTUAIWNZBXGSH-KLHKWILBSA-N 2 0 303.494 3.099 20 10 DGCDRP CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000817948911 627971539 /nfs/dbraw/zinc/97/15/39/627971539.db2.gz MGSQEFBJFKQXTQ-MRXNPFEDSA-N 2 0 311.473 3.495 20 10 DGCDRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1cc(Br)ccc1O ZINC000818615030 628043141 /nfs/dbraw/zinc/04/31/41/628043141.db2.gz KTMIYGRDTZEWNY-OASPWFOLSA-N 2 0 313.239 3.075 20 10 DGCDRP CC[N@@H+]1CCC[C@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835035246 629830271 /nfs/dbraw/zinc/83/02/71/629830271.db2.gz FADIEOGVTHEURB-SUQGKYDKSA-N 2 0 301.478 3.087 20 10 DGCDRP C[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)C[NH+]1CCCC1 ZINC000835034829 629830453 /nfs/dbraw/zinc/83/04/53/629830453.db2.gz FKLFJUZNUATPEZ-JTGQJZMRSA-N 2 0 301.478 3.087 20 10 DGCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835052295 629836853 /nfs/dbraw/zinc/83/68/53/629836853.db2.gz BZSDSOCFRKMSGC-XFHJGTJQSA-N 2 0 301.478 3.086 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000840911676 630376356 /nfs/dbraw/zinc/37/63/56/630376356.db2.gz MKBFSZHUGWYXMA-UHFFFAOYSA-N 2 0 303.494 3.225 20 10 DGCDRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000841033880 630398984 /nfs/dbraw/zinc/39/89/84/630398984.db2.gz CSEZILQTKKIYCD-OXQOHEQNSA-N 2 0 315.505 3.444 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000841036653 630399833 /nfs/dbraw/zinc/39/98/33/630399833.db2.gz RORVUWYRXWCMBS-UHFFFAOYSA-N 2 0 311.473 3.324 20 10 DGCDRP CCCN(CCC)c1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000841035494 630400071 /nfs/dbraw/zinc/40/00/71/630400071.db2.gz HJYQXRJRICGUAF-GOSISDBHSA-N 2 0 303.494 3.402 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000843043924 630607789 /nfs/dbraw/zinc/60/77/89/630607789.db2.gz QHRDJNMZCOXSFL-IBGZPJMESA-N 2 0 301.478 3.025 20 10 DGCDRP C[NH2+]CCC1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000843057104 630609619 /nfs/dbraw/zinc/60/96/19/630609619.db2.gz BBWGTZODKWCCRQ-SNAWJCMRSA-N 2 0 301.478 3.087 20 10 DGCDRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC000843058027 630610144 /nfs/dbraw/zinc/61/01/44/630610144.db2.gz LMVDYHYGRKWAIU-MISYRCLQSA-N 2 0 313.489 3.236 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000843123698 630615668 /nfs/dbraw/zinc/61/56/68/630615668.db2.gz NSAXQRWZHXONPF-FQEVSTJZSA-N 2 0 313.489 3.252 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000843123697 630615887 /nfs/dbraw/zinc/61/58/87/630615887.db2.gz NRRQBBDVHAHOKX-LJQANCHMSA-N 2 0 301.478 3.108 20 10 DGCDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000844904394 630973225 /nfs/dbraw/zinc/97/32/25/630973225.db2.gz KMCBGHBCNAMOMP-UHFFFAOYSA-N 2 0 304.821 3.363 20 10 DGCDRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)c1O ZINC000846143234 631211932 /nfs/dbraw/zinc/21/19/32/631211932.db2.gz CWAYKMOVKWXOHJ-GJZGRUSLSA-N 2 0 306.450 3.172 20 10 DGCDRP CCc1cccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1O ZINC000848888480 631772854 /nfs/dbraw/zinc/77/28/54/631772854.db2.gz UZHGLJIUXCWNON-SFHVURJKSA-N 2 0 302.462 3.405 20 10 DGCDRP CCc1cccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1O ZINC000848891546 631774559 /nfs/dbraw/zinc/77/45/59/631774559.db2.gz ZYOWWLUIFSRUNE-LPHOPBHVSA-N 2 0 314.473 3.403 20 10 DGCDRP CCOc1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c(O)c1 ZINC000849349565 631900434 /nfs/dbraw/zinc/90/04/34/631900434.db2.gz DFAHMRDYJPOALD-INIZCTEOSA-N 2 0 318.461 3.003 20 10 DGCDRP CCOc1ccc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c(O)c1 ZINC000849350796 631901394 /nfs/dbraw/zinc/90/13/94/631901394.db2.gz WSLJPAUVTOGLCP-INIZCTEOSA-N 2 0 318.461 3.003 20 10 DGCDRP Cc1cc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000172507633 659340758 /nfs/dbraw/zinc/34/07/58/659340758.db2.gz GNVIOZDCFLAKKQ-HNNXBMFYSA-N 2 0 304.478 3.382 20 10 DGCDRP C[C@H]1C[C@H](C[N@H+](C)Cc2ccc(N3CCCC3)cc2)CC[NH2+]1 ZINC001576597018 1191851992 /nfs/dbraw/zinc/85/19/92/1191851992.db2.gz CRJNNKMACDDRAZ-FUHWJXTLSA-N 2 0 301.478 3.107 20 10 DGCDRP C[NH2+]CC1CC[NH+](Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC001578664430 1191950595 /nfs/dbraw/zinc/95/05/95/1191950595.db2.gz XMAMNIQVRZZAAL-UHFFFAOYSA-N 2 0 320.477 3.130 20 10 DGCDRP Cc1cc(C[N@H+]2CCC[C@@H](C)[C@H]2CCC[NH3+])ccc1N(C)C ZINC001579598122 1191981441 /nfs/dbraw/zinc/98/14/41/1191981441.db2.gz CWKVLIVDGNODFY-DNVCBOLYSA-N 2 0 303.494 3.400 20 10 DGCDRP CCCC[NH+](CCCC)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC000084857407 1176175965 /nfs/dbraw/zinc/17/59/65/1176175965.db2.gz UVQNPRPRXNIXAD-UHFFFAOYSA-N 2 0 303.494 3.498 20 10 DGCDRP COc1cc(C)cc(C[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c1O ZINC001331527703 1178234749 /nfs/dbraw/zinc/23/47/49/1178234749.db2.gz CMJWNOHOJJNLNP-OAHLLOKOSA-N 2 0 306.450 3.063 20 10 DGCDRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc(N)cc2)C1 ZINC001334753951 1178791801 /nfs/dbraw/zinc/79/18/01/1178791801.db2.gz KBWPDRMYWWFJJA-WMZOPIPTSA-N 2 0 301.478 3.355 20 10 DGCDRP CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001474013218 1183850053 /nfs/dbraw/zinc/85/00/53/1183850053.db2.gz DPFPNOOJXKZFGC-PKOBYXMFSA-N 2 0 315.505 3.497 20 10 DGCDRP CC[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001560476520 1189332407 /nfs/dbraw/zinc/33/24/07/1189332407.db2.gz LNIVZTDEYDWPFW-RBUKOAKNSA-N 2 0 315.505 3.354 20 10 DGCDRP CCN(C)c1ccc(C[N@@H+]2CCN(c3cc[nH+]cc3)C[C@H]2C)cc1 ZINC001654837237 1195845155 /nfs/dbraw/zinc/84/51/55/1195845155.db2.gz AXQZAZZUWANPMP-QGZVFWFLSA-N 2 0 324.472 3.248 20 10 DGCDRP C[C@H]1CCC[C@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001656963150 1196087683 /nfs/dbraw/zinc/08/76/83/1196087683.db2.gz VAIMLKBMGIKTTO-HKUYNNGSSA-N 2 0 315.505 3.354 20 10 DGCDRP CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)c1 ZINC001658028666 1196204411 /nfs/dbraw/zinc/20/44/11/1196204411.db2.gz YTDSFGCHOOQTFO-FUHWJXTLSA-N 2 0 302.462 3.432 20 10 DGCDRP COc1cc(C)c(C[NH2+]CC[C@@H](C)[NH+]2CCCCC2)c(O)c1 ZINC001664270311 1196985181 /nfs/dbraw/zinc/98/51/81/1196985181.db2.gz QQCNVBXNTAKEFC-OAHLLOKOSA-N 2 0 306.450 3.063 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]Cc2cnccc2N(C)C)cc1 ZINC001648832791 1081938185 /nfs/dbraw/zinc/93/81/85/1081938185.db2.gz MOHFBOWKEJLJSW-UHFFFAOYSA-N 2 0 312.461 3.284 20 10 DGCDRP [NH3+]CCN(c1ccc2c(c1)C[NH2+]C2)C12CC3CC(CC(C3)C1)C2 ZINC001170627443 1082976957 /nfs/dbraw/zinc/97/69/57/1082976957.db2.gz RNEFYSDGVGPAEC-UHFFFAOYSA-N 2 0 311.473 3.024 20 10 DGCDRP COc1ccc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c(O)c1 ZINC001203629349 1090769103 /nfs/dbraw/zinc/76/91/03/1090769103.db2.gz XJRRMWQDHKLRJX-IRXDYDNUSA-N 2 0 318.461 3.240 20 10 DGCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(N4CCCC4)cc3)C[C@@H]2C1 ZINC001204328531 1090950619 /nfs/dbraw/zinc/95/06/19/1090950619.db2.gz INJNHPMGRSGJQF-KDURUIRLSA-N 2 0 313.489 3.060 20 10 DGCDRP C[NH+](C)CC1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204327492 1090950717 /nfs/dbraw/zinc/95/07/17/1090950717.db2.gz VWWHSOHKTDTUKR-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP CC[N@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)C1CCCCC1 ZINC001204597988 1091004477 /nfs/dbraw/zinc/00/44/77/1091004477.db2.gz DZFHVFBEIRICBB-UHFFFAOYSA-N 2 0 304.434 3.029 20 10 DGCDRP CC(C)(C)C1CC[NH+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001205164205 1091116708 /nfs/dbraw/zinc/11/67/08/1091116708.db2.gz AHXIMIXZKGMGOL-UHFFFAOYSA-N 2 0 318.461 3.132 20 10 DGCDRP Cc1c(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)c2ccccc2n1C ZINC001138258425 1091127747 /nfs/dbraw/zinc/12/77/47/1091127747.db2.gz SBAOIMBOWDBVTO-UHFFFAOYSA-N 2 0 311.473 3.404 20 10 DGCDRP C[C@]1([NH3+])CCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001205289610 1091167580 /nfs/dbraw/zinc/16/75/80/1091167580.db2.gz ZPHMLIFBIXUMSG-AWEZNQCLSA-N 2 0 302.340 3.114 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C[C@H]1C[NH3+] ZINC001205296192 1091169607 /nfs/dbraw/zinc/16/96/07/1091169607.db2.gz IRBFHQLHAHWXCU-DOTOQJQBSA-N 2 0 311.473 3.323 20 10 DGCDRP C[C@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C[C@@H]1C[NH3+] ZINC001205319350 1091184267 /nfs/dbraw/zinc/18/42/67/1091184267.db2.gz ZGMARCAKMSEVSN-YJBOKZPZSA-N 2 0 310.441 3.476 20 10 DGCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC001205570981 1091259060 /nfs/dbraw/zinc/25/90/60/1091259060.db2.gz RCQBVUIHCQXXIX-SFHVURJKSA-N 2 0 302.393 3.198 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)cc1Cl ZINC001205571783 1091260236 /nfs/dbraw/zinc/26/02/36/1091260236.db2.gz XQWXKKGIXQRXCZ-OAHLLOKOSA-N 2 0 300.805 3.007 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2Cl)CCC[C@@H]1C[NH3+] ZINC001206005651 1091445320 /nfs/dbraw/zinc/44/53/20/1091445320.db2.gz YXXUAPOUWMTZLR-ZIAGYGMSSA-N 2 0 309.885 3.213 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c(O)c1 ZINC001206003470 1091446672 /nfs/dbraw/zinc/44/66/72/1091446672.db2.gz IIGJHMLRQWHGEH-CVEARBPZSA-N 2 0 319.493 3.045 20 10 DGCDRP C[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2O)CCC[C@@H]1C[NH3+] ZINC001206025414 1091457521 /nfs/dbraw/zinc/45/75/21/1091457521.db2.gz NWIHWQLIGWCXSJ-VXGBXAGGSA-N 2 0 316.367 3.218 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)c(O)c1 ZINC001206311820 1091573066 /nfs/dbraw/zinc/57/30/66/1091573066.db2.gz VKPKUZNKGWBKBQ-IBGZPJMESA-N 2 0 319.493 3.189 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C[NH3+])CC[C@H]2C)c(OC)c1 ZINC001206769776 1091732916 /nfs/dbraw/zinc/73/29/16/1091732916.db2.gz QGFPXQXBFULJOR-HZPDHXFCSA-N 2 0 319.493 3.101 20 10 DGCDRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cc(F)ccc1O ZINC001140058507 1091752663 /nfs/dbraw/zinc/75/26/63/1091752663.db2.gz DJQMZJFNOAMCIB-IRXDYDNUSA-N 2 0 306.425 3.370 20 10 DGCDRP CCCCC[N@H+](C)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140299600 1091818151 /nfs/dbraw/zinc/81/81/51/1091818151.db2.gz BIXAOXWJZJFWRA-UHFFFAOYSA-N 2 0 303.494 3.451 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(C)CC3)cc2)CC1 ZINC001140299754 1091818704 /nfs/dbraw/zinc/81/87/04/1091818704.db2.gz FBYCHEUDAPMNSU-UHFFFAOYSA-N 2 0 301.478 3.060 20 10 DGCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@](C)(CF)C3)cc2)CC1 ZINC001140302646 1091819977 /nfs/dbraw/zinc/81/99/77/1091819977.db2.gz WTELZVKYNLLVMM-LJQANCHMSA-N 2 0 319.468 3.010 20 10 DGCDRP COc1cc(C)cc(C[N@@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)c1O ZINC001207835745 1092111145 /nfs/dbraw/zinc/11/11/45/1092111145.db2.gz DREXFGHNZQHDSP-UHFFFAOYSA-N 2 0 306.450 3.062 20 10 DGCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2C[C@H]3C[N@H+](C)C[C@H]3C2)cc1 ZINC001209517189 1092805939 /nfs/dbraw/zinc/80/59/39/1092805939.db2.gz AEZNIUZYHCRQAS-KDURUIRLSA-N 2 0 309.457 3.088 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000314767418 1095065506 /nfs/dbraw/zinc/06/55/06/1095065506.db2.gz WHKOEUFBJFFAMA-FMKPAKJESA-N 2 0 300.446 3.323 20 10 DGCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000316871786 1095198272 /nfs/dbraw/zinc/19/82/72/1095198272.db2.gz WNZLDZRJAGAMAG-WCVJEAGWSA-N 2 0 300.446 3.465 20 10 DGCDRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(N3CCCC3)cc2)CC1 ZINC001338881287 1095422898 /nfs/dbraw/zinc/42/28/98/1095422898.db2.gz KNQRCEOBPDDDPC-UHFFFAOYSA-N 2 0 313.489 3.347 20 10 DGCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3c(O)ccc(F)c3Cl)(C1)CCC2 ZINC001276836941 1095748815 /nfs/dbraw/zinc/74/88/15/1095748815.db2.gz CLYCHOZTBUGWBO-JKSUJKDBSA-N 2 0 312.816 3.339 20 10 DGCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC001118016081 1095922424 /nfs/dbraw/zinc/92/24/24/1095922424.db2.gz TURIBAFLHHTUCO-AZUAARDMSA-N 2 0 313.489 3.251 20 10 DGCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc1 ZINC001118243724 1095967399 /nfs/dbraw/zinc/96/73/99/1095967399.db2.gz ZPDQGLXQTJBOSF-HYXAFXHYSA-N 2 0 313.489 3.231 20 10 DGCDRP CN(C)c1ccc(C[N@H+](C)[C@@H]2C[C@H]3CCC[C@@H](C2)N3C)cc1 ZINC001172127753 1097048147 /nfs/dbraw/zinc/04/81/47/1097048147.db2.gz KEJDTJPOFKHQKZ-REPLKXPHSA-N 2 0 301.478 3.200 20 10 DGCDRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(N3CCCC3)cc1)C2 ZINC001172102928 1097052158 /nfs/dbraw/zinc/05/21/58/1097052158.db2.gz QWVLYTPQLYUURF-FNLKRUPLSA-N 2 0 313.489 3.392 20 10 DGCDRP CC(C)(C)c1cccc(C[NH+]2CCC3(CCC[NH2+]3)CC2)c1O ZINC001228556346 1097141726 /nfs/dbraw/zinc/14/17/26/1097141726.db2.gz OJPWNWDWJBGWAQ-UHFFFAOYSA-N 2 0 302.462 3.408 20 10 DGCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3c(O)ccc4ccccc43)C[C@@H]2C1 ZINC001231589331 1097786160 /nfs/dbraw/zinc/78/61/60/1097786160.db2.gz GMLNFKGSRNZSGR-IRXDYDNUSA-N 2 0 310.441 3.319 20 10 DGCDRP Cc1cc(C[N@H+]2CCN(c3cc[nH+]cc3)C[C@H]2C)ccc1N(C)C ZINC001176280734 1098298429 /nfs/dbraw/zinc/29/84/29/1098298429.db2.gz DXBONMRPYODMPN-QGZVFWFLSA-N 2 0 324.472 3.167 20 10 DGCDRP Oc1ccc(F)c(Cl)c1C[NH+]1CCC2(CC[NH2+]CC2)CC1 ZINC001235134206 1098829970 /nfs/dbraw/zinc/82/99/70/1098829970.db2.gz VLUGIXVORHCKQV-UHFFFAOYSA-N 2 0 312.816 3.150 20 10 DGCDRP CN(C)c1ccc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC001235232555 1098905363 /nfs/dbraw/zinc/90/53/63/1098905363.db2.gz YLDSENUECUUAHI-IBGZPJMESA-N 2 0 301.478 3.107 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c2ccccc21 ZINC001235270904 1098939184 /nfs/dbraw/zinc/93/91/84/1098939184.db2.gz NTBUSHNVBBLLEZ-QFBILLFUSA-N 2 0 309.457 3.090 20 10 DGCDRP CC(C)(C)c1ccc(O)c(C[NH+]2CCC(C3C[NH2+]C3)CC2)c1 ZINC001235338995 1098963167 /nfs/dbraw/zinc/96/31/67/1098963167.db2.gz FPKOHMPGUKXWHT-UHFFFAOYSA-N 2 0 302.462 3.121 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)ccc1N(C)C ZINC001235421687 1099012767 /nfs/dbraw/zinc/01/27/67/1099012767.db2.gz BXSRGNLZTFLFSK-MOPGFXCFSA-N 2 0 315.505 3.273 20 10 DGCDRP Cc1cc(C)c(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235426376 1099018933 /nfs/dbraw/zinc/01/89/33/1099018933.db2.gz KQGZKXIHJILPPY-SJORKVTESA-N 2 0 302.462 3.221 20 10 DGCDRP CN1CCC[C@@H]2C[N@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]21 ZINC001235678081 1099119916 /nfs/dbraw/zinc/11/99/16/1099119916.db2.gz ADYPRGVBONWUPI-PBHICJAKSA-N 2 0 302.462 3.216 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(C)C(C)(C)C3(C)C)cc2)CC1 ZINC001179739473 1099189423 /nfs/dbraw/zinc/18/94/23/1099189423.db2.gz BVVIKCMXTVFDCC-UHFFFAOYSA-N 2 0 315.505 3.353 20 10 DGCDRP Cc1ccc(CC[N@@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235839957 1099203392 /nfs/dbraw/zinc/20/33/92/1099203392.db2.gz DLRQOZJSEGXGFZ-UHFFFAOYSA-N 2 0 323.484 3.079 20 10 DGCDRP C[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)C[C@@H]1CCC[NH2+]C1 ZINC001235960533 1099293406 /nfs/dbraw/zinc/29/34/06/1099293406.db2.gz YVAMVPQZHTUOGB-CQSZACIVSA-N 2 0 316.445 3.008 20 10 DGCDRP Cc1ccc(O)c(C[N@@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)c1 ZINC001235973729 1099304683 /nfs/dbraw/zinc/30/46/83/1099304683.db2.gz ONIKTZQTUPCYAK-UHFFFAOYSA-N 2 0 322.452 3.338 20 10 DGCDRP CCc1ccc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c(O)c1 ZINC001236791425 1099788467 /nfs/dbraw/zinc/78/84/67/1099788467.db2.gz HIPBNBHCQPESGD-UHFFFAOYSA-N 2 0 302.462 3.262 20 10 DGCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)CC1CCCC1 ZINC001236942399 1099882862 /nfs/dbraw/zinc/88/28/62/1099882862.db2.gz JHHNPYPTTXWPCW-UHFFFAOYSA-N 2 0 319.468 3.200 20 10 DGCDRP [NH3+]C[C@@H]1Cc2ccccc2CN1Cc1c(O)ccc2ccccc21 ZINC001237026992 1099931454 /nfs/dbraw/zinc/93/14/54/1099931454.db2.gz CSEGEZDHVATNEK-SFHVURJKSA-N 2 0 318.420 3.431 20 10 DGCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)c2ccccc21 ZINC001237384421 1100103595 /nfs/dbraw/zinc/10/35/95/1100103595.db2.gz WRJGEBHPUWNRHG-FXAWDEMLSA-N 2 0 323.484 3.480 20 10 DGCDRP Cc1cccc(O)c1C[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001237488493 1100141096 /nfs/dbraw/zinc/14/10/96/1100141096.db2.gz ZBHSZYCPLGVKMK-KDURUIRLSA-N 2 0 322.452 3.264 20 10 DGCDRP C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccc3ccccc3c1O)CC2 ZINC001276374032 1103696011 /nfs/dbraw/zinc/69/60/11/1103696011.db2.gz PLIVHSMNJBXOAF-UHFFFAOYSA-N 2 0 310.441 3.463 20 10 DGCDRP CC(C)=CCC[C@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246172256 1104419353 /nfs/dbraw/zinc/41/93/53/1104419353.db2.gz HDSVOJAQDQGMIA-KRWDZBQOSA-N 2 0 301.478 3.321 20 10 DGCDRP C[N@@H+]1CCCC2(CC[NH+](Cc3c(O)cccc3Cl)CC2)C1 ZINC001275217409 1104681038 /nfs/dbraw/zinc/68/10/38/1104681038.db2.gz MFKVBKQUQOAMPO-UHFFFAOYSA-N 2 0 308.853 3.353 20 10 DGCDRP CCCC[C@H]1C[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)CC[NH2+]1 ZINC001246902302 1104728068 /nfs/dbraw/zinc/72/80/68/1104728068.db2.gz RBNMWMLQLUHKLB-HKUYNNGSSA-N 2 0 303.494 3.495 20 10 DGCDRP Cc1cc(C[N@@H+]2CCC[C@@]3(CCC[NH+](C)C3)C2)ccc1N(C)C ZINC001275360700 1104736576 /nfs/dbraw/zinc/73/65/76/1104736576.db2.gz HHAWHTYDILOTGQ-HXUWFJFHSA-N 2 0 315.505 3.369 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)cc1 ZINC001275833167 1104926066 /nfs/dbraw/zinc/92/60/66/1104926066.db2.gz ANKVAMZUSNPQKD-HXUWFJFHSA-N 2 0 315.505 3.451 20 10 DGCDRP CN(C)c1ccc(C[N@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c(Cl)c1 ZINC001276155453 1105032742 /nfs/dbraw/zinc/03/27/42/1105032742.db2.gz ICEHQPHSSBHQQE-GASCZTMLSA-N 2 0 321.896 3.180 20 10 DGCDRP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001320905420 1107184407 /nfs/dbraw/zinc/18/44/07/1107184407.db2.gz HWNUVBKJSFLIBH-SFHVURJKSA-N 2 0 301.478 3.203 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)cc1F ZINC001308553125 1111443238 /nfs/dbraw/zinc/44/32/38/1111443238.db2.gz HETCWGRLVYBSND-SOLBZPMBSA-N 2 0 319.468 3.102 20 10 DGCDRP CCCOc1ccc(C[NH2+]C[C@H]2C[NH+]3CCC2CC3)cc1C ZINC001308965025 1111501569 /nfs/dbraw/zinc/50/15/69/1111501569.db2.gz BJFFNCKPHNEHSQ-SFHVURJKSA-N 2 0 302.462 3.215 20 10 DGCDRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000278374076 287020362 /nfs/dbraw/zinc/02/03/62/287020362.db2.gz DQAJBATVNPCFCZ-OAHLLOKOSA-N 2 0 301.478 3.278 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1C ZINC000270050777 432228291 /nfs/dbraw/zinc/22/82/91/432228291.db2.gz MEGZOLPRRHYGGH-QGZVFWFLSA-N 2 0 302.462 3.173 20 10 DGCDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000296954250 277392390 /nfs/dbraw/zinc/39/23/90/277392390.db2.gz QWOXWCUVQFUNJB-DOTOQJQBSA-N 2 0 302.462 3.337 20 10 DGCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000185670691 279761593 /nfs/dbraw/zinc/76/15/93/279761593.db2.gz ICXQCLCCOJIFPD-JSGCOSHPSA-N 2 0 314.857 3.053 20 10 DGCDRP CCCn1ccnc1CCC[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000193583373 432483690 /nfs/dbraw/zinc/48/36/90/432483690.db2.gz SGDYCTPVJQTVBZ-UHFFFAOYSA-N 2 0 314.477 3.424 20 10 DGCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)c1 ZINC000186545708 432605216 /nfs/dbraw/zinc/60/52/16/432605216.db2.gz ZACDAZUGMJXWDO-GJZGRUSLSA-N 2 0 306.450 3.316 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000370675775 434618858 /nfs/dbraw/zinc/61/88/58/434618858.db2.gz FBZQVDYKSJHZAK-WDYCEAGBSA-N 2 0 301.478 3.420 20 10 DGCDRP CCOCc1cc(C[NH2+]CC2(C)CC[NH+](C)CC2)ccc1OC ZINC000272505072 529034122 /nfs/dbraw/zinc/03/41/22/529034122.db2.gz GZGHUOQIDYNXFZ-UHFFFAOYSA-N 2 0 320.477 3.053 20 10 DGCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CCC(C)(C)[NH3+])c1O ZINC000925738074 618590851 /nfs/dbraw/zinc/59/08/51/618590851.db2.gz MXQWZMNQWFZYOD-SNVBAGLBSA-N 2 0 315.255 3.241 20 10 DGCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)cc1F ZINC000841100818 620450815 /nfs/dbraw/zinc/45/08/15/620450815.db2.gz KXAPIIJVYUAAKJ-HOCLYGCPSA-N 2 0 307.457 3.089 20 10 DGCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@H](C)CCC[NH3+])c1O ZINC000817977871 620897276 /nfs/dbraw/zinc/89/72/76/620897276.db2.gz QWDZLAWUDXIJAQ-MNOVXSKESA-N 2 0 315.255 3.241 20 10 DGCDRP c1cc2c(cc1C[NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)CCCO2 ZINC000922268368 621015365 /nfs/dbraw/zinc/01/53/65/621015365.db2.gz FCNKFSIOFDZRMF-GOSISDBHSA-N 2 0 314.473 3.223 20 10 DGCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)ccc21 ZINC000858116010 621154309 /nfs/dbraw/zinc/15/43/09/621154309.db2.gz HYLPOEDJLYBVCO-QGZVFWFLSA-N 2 0 301.478 3.031 20 10 DGCDRP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000858245034 621167643 /nfs/dbraw/zinc/16/76/43/621167643.db2.gz BADONDJGYYXMJF-LLVKDONJSA-N 2 0 300.805 3.006 20 10 DGCDRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)ccc1N(C)C ZINC000923365138 621179016 /nfs/dbraw/zinc/17/90/16/621179016.db2.gz UALFGMBVYOKIOP-PKOBYXMFSA-N 2 0 301.478 3.025 20 10 DGCDRP CC[NH+](CC)CCOCC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000757674780 621733010 /nfs/dbraw/zinc/73/30/10/621733010.db2.gz WDXVBQZGLWBUSY-MRXNPFEDSA-N 2 0 308.466 3.018 20 10 DGCDRP C[C@H](c1cccnc1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000757892323 621745291 /nfs/dbraw/zinc/74/52/91/621745291.db2.gz RPGJZQQFAGZEAJ-QGZVFWFLSA-N 2 0 324.472 3.026 20 10 DGCDRP C[C@H]1CC2(CCC2)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000763646144 622156718 /nfs/dbraw/zinc/15/67/18/622156718.db2.gz JDQUYBFLKUTLNT-KRWDZBQOSA-N 2 0 313.489 3.203 20 10 DGCDRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000768302550 622449251 /nfs/dbraw/zinc/44/92/51/622449251.db2.gz IBVZLQUTLXAQQM-UHFFFAOYSA-N 2 0 321.484 3.446 20 10 DGCDRP CCOc1cccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)c1O ZINC000769470052 622531106 /nfs/dbraw/zinc/53/11/06/622531106.db2.gz JIDRSGLZVGVYHW-HOCLYGCPSA-N 2 0 306.450 3.096 20 10 DGCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N(C)C)c(F)c2)[C@@H](C)C1 ZINC000769488803 622533497 /nfs/dbraw/zinc/53/34/97/622533497.db2.gz ZOUALUIBYYBDRT-YOEHRIQHSA-N 2 0 307.457 3.054 20 10 DGCDRP CN(C)c1ccc(/C=C\C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000872253978 622868575 /nfs/dbraw/zinc/86/85/75/622868575.db2.gz NZXYKJPCSQKHCU-OSJSJHBBSA-N 2 0 301.478 3.134 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H]3[C@H](CC[NH+]3C)C2)cc1C(C)C ZINC000872725334 622960325 /nfs/dbraw/zinc/96/03/25/622960325.db2.gz RSLOWICQZYQYLT-CRAIPNDOSA-N 2 0 302.462 3.350 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@H]3[C@@H](CC[NH+]3C)C2)cc1C(C)C ZINC000872725337 622960712 /nfs/dbraw/zinc/96/07/12/622960712.db2.gz RSLOWICQZYQYLT-YJBOKZPZSA-N 2 0 302.462 3.350 20 10 DGCDRP CCCOc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1C ZINC000873012211 623017110 /nfs/dbraw/zinc/01/71/10/623017110.db2.gz DHZPPOSNTHMXTK-KRWDZBQOSA-N 2 0 302.462 3.358 20 10 DGCDRP Cc1cc(O)c(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)cc1C ZINC000873232200 623084289 /nfs/dbraw/zinc/08/42/89/623084289.db2.gz BNHMYTLQNDXQJM-SFHVURJKSA-N 2 0 302.462 3.411 20 10 DGCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)cc1 ZINC000873233069 623085628 /nfs/dbraw/zinc/08/56/28/623085628.db2.gz YKRQMGICOHPVPT-GOSISDBHSA-N 2 0 301.478 3.155 20 10 DGCDRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000873268888 623098436 /nfs/dbraw/zinc/09/84/36/623098436.db2.gz IYJWZVAIWHAVEN-ZIAGYGMSSA-N 2 0 302.462 3.310 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCCCCCC3)cc2)CC1 ZINC000775638822 623301065 /nfs/dbraw/zinc/30/10/65/623301065.db2.gz IGWCTLSRLQYHOD-UHFFFAOYSA-N 2 0 301.478 3.205 20 10 DGCDRP CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775652576 623304602 /nfs/dbraw/zinc/30/46/02/623304602.db2.gz NFRIEHWVLJZWLI-IBGZPJMESA-N 2 0 301.478 3.059 20 10 DGCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C ZINC000775669175 623309996 /nfs/dbraw/zinc/30/99/96/623309996.db2.gz TVXKLQOKJXQTTE-IRXDYDNUSA-N 2 0 301.478 3.059 20 10 DGCDRP Cc1cccc(O)c1C[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000876990354 623761399 /nfs/dbraw/zinc/76/13/99/623761399.db2.gz ZNCHTWBSQHVQCC-UHFFFAOYSA-N 2 0 302.462 3.445 20 10 DGCDRP CN(C)c1ccc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1F ZINC000791011099 625737250 /nfs/dbraw/zinc/73/72/50/625737250.db2.gz NWLJLFKESHMTFS-UHFFFAOYSA-N 2 0 307.457 3.103 20 10 DGCDRP CCC1([NH+]2CCC2)CC[NH+](Cc2cc(C)cc(C)c2O)CC1 ZINC000884474490 626886518 /nfs/dbraw/zinc/88/65/18/626886518.db2.gz BNGMHVOWLZJQJL-UHFFFAOYSA-N 2 0 302.462 3.459 20 10 DGCDRP CCOCc1cc(C[NH2+]C2CCC([NH+](C)C)CC2)ccc1OC ZINC000817415961 627897331 /nfs/dbraw/zinc/89/73/31/627897331.db2.gz CHNCBPBYMSHIPV-UHFFFAOYSA-N 2 0 320.477 3.194 20 10 DGCDRP CC(=O)c1cc(Cl)cc(CN2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)c1O ZINC000817880391 627952609 /nfs/dbraw/zinc/95/26/09/627952609.db2.gz RNAHNRIXWXZKJN-GYSYKLTISA-N 2 0 324.852 3.053 20 10 DGCDRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817898593 627955956 /nfs/dbraw/zinc/95/59/56/627955956.db2.gz JNDGDXOZNSQFKH-UWJYYQICSA-N 2 0 323.484 3.335 20 10 DGCDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817899560 627956477 /nfs/dbraw/zinc/95/64/77/627956477.db2.gz HCANJJJCZGLFSH-AWEZNQCLSA-N 2 0 324.472 3.082 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CC[NH2+]CC[C@@H]3C)cc2)CC1 ZINC000817902383 627957168 /nfs/dbraw/zinc/95/71/68/627957168.db2.gz PAXUKAJZPJKRNC-PXNSSMCTSA-N 2 0 315.505 3.401 20 10 DGCDRP c1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc2c1OCC2 ZINC000817902544 627957455 /nfs/dbraw/zinc/95/74/55/627957455.db2.gz TWERPXGPEIBYOY-OKZBNKHCSA-N 2 0 300.446 3.022 20 10 DGCDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]C1CC[NH2+]CC1 ZINC000817937537 627966333 /nfs/dbraw/zinc/96/63/33/627966333.db2.gz XLXOFIIFIBFESK-LJQANCHMSA-N 2 0 310.441 3.408 20 10 DGCDRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817935064 627966579 /nfs/dbraw/zinc/96/65/79/627966579.db2.gz FKNLIOPRXUOHHR-INIZCTEOSA-N 2 0 301.478 3.470 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000817948908 627971506 /nfs/dbraw/zinc/97/15/06/627971506.db2.gz MGSQEFBJFKQXTQ-INIZCTEOSA-N 2 0 311.473 3.495 20 10 DGCDRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817965393 627977397 /nfs/dbraw/zinc/97/73/97/627977397.db2.gz TULLQYZTONAHLP-CQSZACIVSA-N 2 0 302.462 3.311 20 10 DGCDRP CC[C@H]([NH2+]CC1([NH3+])CCC1)c1cc(Br)ccc1O ZINC000817965516 627977497 /nfs/dbraw/zinc/97/74/97/627977497.db2.gz WJIRDBULUMACHD-LBPRGKRZSA-N 2 0 313.239 3.077 20 10 DGCDRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000817976542 627981677 /nfs/dbraw/zinc/98/16/77/627981677.db2.gz NERKVNTXSSFJTQ-GHMZBOCLSA-N 2 0 315.255 3.323 20 10 DGCDRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cc2c(cc1O)CCCC2 ZINC000817977045 627981966 /nfs/dbraw/zinc/98/19/66/627981966.db2.gz ZRSVSBLIYSGKIP-ACJLOTCBSA-N 2 0 300.446 3.064 20 10 DGCDRP C[C@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1cc(F)ccc1O ZINC000817984333 627983591 /nfs/dbraw/zinc/98/35/91/627983591.db2.gz QOKNRUGBVUPFTQ-SYTRPRECSA-N 2 0 318.436 3.336 20 10 DGCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000817987412 627984143 /nfs/dbraw/zinc/98/41/43/627984143.db2.gz YTVRVDFYVKRYJK-RDJZCZTQSA-N 2 0 301.478 3.468 20 10 DGCDRP COc1cccc([C@@H](C)[NH2+]C2CCC(C)([NH+]3CCC3)CC2)c1O ZINC000927039301 628001571 /nfs/dbraw/zinc/00/15/71/628001571.db2.gz UIUSMYPQAHTDKK-TZGCNFNXSA-N 2 0 318.461 3.458 20 10 DGCDRP Cc1cc(Cl)cc(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)c1O ZINC000818431971 628022138 /nfs/dbraw/zinc/02/21/38/628022138.db2.gz YOSJBJMTJICLGU-ZDUSSCGKSA-N 2 0 308.853 3.318 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)c(Cl)c1 ZINC000818431811 628022633 /nfs/dbraw/zinc/02/26/33/628022633.db2.gz UDGXJCXKDIPMBO-CYBMUJFWSA-N 2 0 308.853 3.318 20 10 DGCDRP C[C@H]1CC2(C[N@@H+]1C/C=C\c1ccc(N(C)C)cc1)CC[NH2+]CC2 ZINC000818431711 628022651 /nfs/dbraw/zinc/02/26/51/628022651.db2.gz RIHCJXNPGNPKAD-CHYADLBTSA-N 2 0 313.489 3.230 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000827844736 628996343 /nfs/dbraw/zinc/99/63/43/628996343.db2.gz NOEHDAVWLNNHKL-UHFFFAOYSA-N 2 0 315.505 3.273 20 10 DGCDRP CCc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000827951103 629006868 /nfs/dbraw/zinc/00/68/68/629006868.db2.gz WLLSHAROKCGFMC-INIZCTEOSA-N 2 0 302.462 3.166 20 10 DGCDRP CN(C)c1ccc(/C=C\CN(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000835053138 629837861 /nfs/dbraw/zinc/83/78/61/629837861.db2.gz KUDHNRZZTGNBMC-HDJSNOHJSA-N 2 0 313.489 3.323 20 10 DGCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000840895492 630374548 /nfs/dbraw/zinc/37/45/48/630374548.db2.gz YUQZXTAIXZYMOS-HQRMLTQVSA-N 2 0 315.505 3.208 20 10 DGCDRP Cc1cc(O)c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c(Cl)c1 ZINC000840920403 630378871 /nfs/dbraw/zinc/37/88/71/630378871.db2.gz GPUNFPSDPNUNJO-CJNGLKHVSA-N 2 0 308.853 3.270 20 10 DGCDRP C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC000841033488 630398975 /nfs/dbraw/zinc/39/89/75/630398975.db2.gz OZKZBUTVMAWIDA-FUHWJXTLSA-N 2 0 301.478 3.155 20 10 DGCDRP C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC000841033489 630399336 /nfs/dbraw/zinc/39/93/36/630399336.db2.gz OZKZBUTVMAWIDA-SJLPKXTDSA-N 2 0 301.478 3.155 20 10 DGCDRP Oc1ccccc1C[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000841073307 630404902 /nfs/dbraw/zinc/40/49/02/630404902.db2.gz NSRBCQRHPUKRLI-FUHWJXTLSA-N 2 0 314.404 3.014 20 10 DGCDRP C[N@@H+]1C[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)[C@H](c2ccccc2)C1 ZINC000842763614 630573383 /nfs/dbraw/zinc/57/33/83/630573383.db2.gz AFZCLPKXTNAONW-UXHICEINSA-N 2 0 322.452 3.057 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1F ZINC000843046892 630608401 /nfs/dbraw/zinc/60/84/01/630608401.db2.gz HURQLFHWPVYGQO-SJPCQFCGSA-N 2 0 319.468 3.387 20 10 DGCDRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC000843058026 630609776 /nfs/dbraw/zinc/60/97/76/630609776.db2.gz LMVDYHYGRKWAIU-DFQSSKMNSA-N 2 0 313.489 3.236 20 10 DGCDRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843112573 630615164 /nfs/dbraw/zinc/61/51/64/630615164.db2.gz HVNHKEGGMFDGPB-KRWDZBQOSA-N 2 0 301.478 3.238 20 10 DGCDRP Cc1cc(Br)cc(C[NH2+]CCCCCC[NH3+])c1O ZINC000843126899 630616339 /nfs/dbraw/zinc/61/63/39/630616339.db2.gz KWJSVMOSVKVNAN-UHFFFAOYSA-N 2 0 315.255 3.072 20 10 DGCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c1O ZINC000843125242 630616398 /nfs/dbraw/zinc/61/63/98/630616398.db2.gz OXOOBJMCVOLCEY-KBPBESRZSA-N 2 0 308.853 3.176 20 10 DGCDRP c1cc(N2CCCCC2)ccc1C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000843126313 630616713 /nfs/dbraw/zinc/61/67/13/630616713.db2.gz IWQIYYORDXWXGE-UHFFFAOYSA-N 2 0 313.489 3.252 20 10 DGCDRP CC[NH2+]CC1CC[NH+](Cc2cc(Cl)cc(C(C)=O)c2O)CC1 ZINC000843352576 630648886 /nfs/dbraw/zinc/64/88/86/630648886.db2.gz NVRPGNDOJWAQQV-UHFFFAOYSA-N 2 0 324.852 3.070 20 10 DGCDRP CCN(CC)c1ccc(C[N@H+](C)CC[C@H]2CCC[NH2+]C2)cc1 ZINC000844220678 630712705 /nfs/dbraw/zinc/71/27/05/630712705.db2.gz JLGYFPINFAURMF-QGZVFWFLSA-N 2 0 303.494 3.354 20 10 DGCDRP [NH3+]CCC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000844912030 630977131 /nfs/dbraw/zinc/97/71/31/630977131.db2.gz QSNAFNHSAQOITC-UHFFFAOYSA-N 2 0 301.478 3.238 20 10 DGCDRP Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)c(O)c1 ZINC000844922947 630986062 /nfs/dbraw/zinc/98/60/62/630986062.db2.gz FIZXOIUEXSVKIM-ZDUSSCGKSA-N 2 0 302.393 3.458 20 10 DGCDRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(N2CCCCC2)cc1 ZINC000844923072 630986278 /nfs/dbraw/zinc/98/62/78/630986278.db2.gz PTRXNDJEGFHQAY-MRXNPFEDSA-N 2 0 301.478 3.457 20 10 DGCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]([NH3+])C3)cc2)CC1 ZINC000848717976 631733336 /nfs/dbraw/zinc/73/33/36/631733336.db2.gz DUXCKLHLJRMUTH-ZWKOTPCHSA-N 2 0 301.478 3.282 20 10 DGCDRP CCOc1cccc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1O ZINC000849350168 631900464 /nfs/dbraw/zinc/90/04/64/631900464.db2.gz LLKMFBZNPFWHRK-MRXNPFEDSA-N 2 0 318.461 3.003 20 10 DGCDRP Cc1cc(O)c(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)cc1C(C)C ZINC000793743189 661055265 /nfs/dbraw/zinc/05/52/65/661055265.db2.gz HTTUDJNKGCXELA-IBGZPJMESA-N 2 0 302.462 3.352 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000314965849 656547158 /nfs/dbraw/zinc/54/71/58/656547158.db2.gz VKAHSVLNPXNYOD-GOSISDBHSA-N 2 0 303.494 3.353 20 10 DGCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000246028671 662246216 /nfs/dbraw/zinc/24/62/16/662246216.db2.gz ABJHBJQANGVAIB-LPHOPBHVSA-N 2 0 303.494 3.353 20 10 DGCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000248531605 662351713 /nfs/dbraw/zinc/35/17/13/662351713.db2.gz PBBMCDCJHNLBLE-LSDHHAIUSA-N 2 0 306.450 3.316 20 10 DGCDRP COc1cc(C[NH2+]CCC[NH2+]C(C)C)c(O)c(C(C)(C)C)c1 ZINC001579153024 1191967948 /nfs/dbraw/zinc/96/79/48/1191967948.db2.gz OWOKHCXUQOMGAK-UHFFFAOYSA-N 2 0 308.466 3.176 20 10 DGCDRP CC[C@@H](C)C[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001620812735 1192107308 /nfs/dbraw/zinc/10/73/08/1192107308.db2.gz QUDHYHBSMWROIW-IAGOWNOFSA-N 2 0 303.494 3.353 20 10 DGCDRP CCC(C)(C)[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001621003732 1192779467 /nfs/dbraw/zinc/77/94/67/1192779467.db2.gz VNCDDWKYFCKVAW-INIZCTEOSA-N 2 0 303.494 3.353 20 10 DGCDRP COc1cc(C)cc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)c1O ZINC001333720065 1178659971 /nfs/dbraw/zinc/65/99/71/1178659971.db2.gz UKVZIEGLCBJFMU-UHFFFAOYSA-N 2 0 318.461 3.017 20 10 DGCDRP Cc1cc(O)c(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)cc1C ZINC001335238720 1178877396 /nfs/dbraw/zinc/87/73/96/1178877396.db2.gz TZPTXAZMEZYFCB-XYJFISCASA-N 2 0 302.462 3.171 20 10 DGCDRP C[N@H+](CCCC[NH2+]Cc1ccc(N2CCCC2)cc1)C1CC1 ZINC001344439048 1179432889 /nfs/dbraw/zinc/43/28/89/1179432889.db2.gz RVBYMLSNEASTQI-UHFFFAOYSA-N 2 0 301.478 3.251 20 10 DGCDRP Cc1ccc(C)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001621048087 1192960691 /nfs/dbraw/zinc/96/06/91/1192960691.db2.gz SUYBDBOSIWFYOG-UHFFFAOYSA-N 2 0 323.484 3.345 20 10 DGCDRP Nc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001356083631 1181138938 /nfs/dbraw/zinc/13/89/38/1181138938.db2.gz WDQSPBQNEHCUQT-SFHVURJKSA-N 2 0 301.478 3.357 20 10 DGCDRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC001461047392 1182761613 /nfs/dbraw/zinc/76/16/13/1182761613.db2.gz WKTRBFAEAFZCIF-UHFFFAOYSA-N 2 0 321.484 3.493 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@@H]3CC=CCC3)cc2)CC1 ZINC001560559490 1189340075 /nfs/dbraw/zinc/34/00/75/1189340075.db2.gz ZEWNCMGJMQUIRP-GOSISDBHSA-N 2 0 313.489 3.274 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@@H]4CCC[C@@H]43)cc2)CC1 ZINC001560987742 1189416263 /nfs/dbraw/zinc/41/62/63/1189416263.db2.gz WJMNXNXHZTZUSB-IHPCNDPISA-N 2 0 313.489 3.107 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCCC(C)(C)C)cc2)CC1 ZINC001650173829 1195360099 /nfs/dbraw/zinc/36/00/99/1195360099.db2.gz JGLSFRSZTMQFQL-UHFFFAOYSA-N 2 0 303.494 3.354 20 10 DGCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCCC3(C)C)cc2)CC1 ZINC001658016319 1196203015 /nfs/dbraw/zinc/20/30/15/1196203015.db2.gz QBHWGXMKVDMUOQ-SFHVURJKSA-N 2 0 315.505 3.354 20 10 DGCDRP CC(C)C[N@H+](C)CCC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001658230284 1196228657 /nfs/dbraw/zinc/22/86/57/1196228657.db2.gz XYUQDVUZUKRWFP-VURMDHGXSA-N 2 0 303.494 3.333 20 10 DGCDRP