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(=C/c1ccccc1)C[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000160631696 261220587 /nfs/dbraw/zinc/22/05/87/261220587.db2.gz ICUKKJCDPLPDJW-SYCZXOQXSA-N 1 0 259.393 3.637 20 70 CHIDRO CCS[C@H]1CCC[C@H]([NH2+][C@@H](C)c2cncc(F)c2)C1 ZINC000159432816 261186249 /nfs/dbraw/zinc/18/62/49/261186249.db2.gz ZIIQDPKRCRIHIC-CQDKDKBSSA-N 1 0 282.428 3.936 20 70 CHIDRO C[C@H](C1CC1)[N@H+](Cc1cncs1)Cc1ccccc1 ZINC000159672780 261191569 /nfs/dbraw/zinc/19/15/69/261191569.db2.gz ZVBVVWHZGBAUPT-CYBMUJFWSA-N 1 0 272.417 3.944 20 70 CHIDRO CC[C@@H]([NH2+]CCO)c1ccc(Oc2ccccc2)cc1 ZINC000159694145 261192193 /nfs/dbraw/zinc/19/21/93/261192193.db2.gz XUPKPXCSRHDCQD-QGZVFWFLSA-N 1 0 271.360 3.512 20 70 CHIDRO CC[C@H]([NH2+]C[C@@](C)(O)c1ccsc1)c1ccccc1 ZINC000159929613 261199081 /nfs/dbraw/zinc/19/90/81/261199081.db2.gz OZSZSGFJIWBLIU-JKSUJKDBSA-N 1 0 275.417 3.697 20 70 CHIDRO COc1ccc(C[N@H+](C)Cc2sc(C)nc2C)cc1C ZINC000160504379 261216146 /nfs/dbraw/zinc/21/61/46/261216146.db2.gz VTKWZLCYXXTKNS-UHFFFAOYSA-N 1 0 290.432 3.709 20 70 CHIDRO Cc1ncc([C@H](C)[NH2+]CCSc2ccccc2)c(C)n1 ZINC000160515931 261216900 /nfs/dbraw/zinc/21/69/00/261216900.db2.gz SSXDNWNWWHHWKD-LBPRGKRZSA-N 1 0 287.432 3.536 20 70 CHIDRO CC[C@@H]([NH2+]CCc1ccccn1)c1ccc(F)cc1F ZINC000160655704 261221405 /nfs/dbraw/zinc/22/14/05/261221405.db2.gz SEVWZZLXYFQDQJ-MRXNPFEDSA-N 1 0 276.330 3.643 20 70 CHIDRO CC(C)[N@H+](Cc1noc(-c2ccsc2)n1)C1CCCC1 ZINC000160818804 261226921 /nfs/dbraw/zinc/22/69/21/261226921.db2.gz RUTJZGXYNPJADB-UHFFFAOYSA-N 1 0 291.420 3.951 20 70 CHIDRO Cc1ccc(C[NH2+][C@H](C)c2ccc([S@@](C)=O)cc2)s1 ZINC000160930040 261231802 /nfs/dbraw/zinc/23/18/02/261231802.db2.gz XBOGVRAOECWVHQ-BLVKFPJESA-N 1 0 293.457 3.645 20 70 CHIDRO C[C@H]([NH2+][C@H](CCO)c1ccccc1)c1cccs1 ZINC000160979576 261233396 /nfs/dbraw/zinc/23/33/96/261233396.db2.gz FRCXUGOAYQUIRL-GXTWGEPZSA-N 1 0 261.390 3.522 20 70 CHIDRO Cc1ccc([C@@H](C)C[NH2+][C@@H](C)c2cccnc2)cc1 ZINC000161052176 261235130 /nfs/dbraw/zinc/23/51/30/261235130.db2.gz CTKFEXDCMWPURP-GJZGRUSLSA-N 1 0 254.377 3.844 20 70 CHIDRO CC(C)[C@H](C)[NH2+]CCCc1nc2c(s1)CCCC2 ZINC000160592857 327630148 /nfs/dbraw/zinc/63/01/48/327630148.db2.gz JJDNRIBFHUEPAE-LBPRGKRZSA-N 1 0 266.454 3.589 20 70 CHIDRO C[N@H+](Cc1cccc2c[nH]nc21)Cc1ccccc1Cl ZINC000160818539 328087652 /nfs/dbraw/zinc/08/76/52/328087652.db2.gz VAQMVZBTAYXZOE-UHFFFAOYSA-N 1 0 285.778 3.848 20 70 CHIDRO C[C@@H]([NH2+]CC(=O)Nc1ccccc1)C(C)(C)c1ccccc1 ZINC000160785056 328085521 /nfs/dbraw/zinc/08/55/21/328085521.db2.gz JYZZWGDMNBXZCQ-OAHLLOKOSA-N 1 0 296.414 3.581 20 70 CHIDRO C[C@@H]([NH2+][C@H](CCO)c1ccccc1)[C@H](C)c1ccccc1 ZINC000160972842 328104783 /nfs/dbraw/zinc/10/47/83/328104783.db2.gz HULPAPSLCLUSLR-FRQCXROJSA-N 1 0 283.415 3.892 20 70 CHIDRO COc1ccc(C)cc1[C@H](C)N[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000161062600 328124174 /nfs/dbraw/zinc/12/41/74/328124174.db2.gz BWAWULQXDKNTQJ-JYJNAYRXSA-N 1 0 290.451 3.527 20 70 CHIDRO COc1ccc(COCCC[NH2+][C@@H](C(C)C)C2CC2)cc1 ZINC000161101206 328129522 /nfs/dbraw/zinc/12/95/22/328129522.db2.gz CPLJENWKLRIKLF-SFHVURJKSA-N 1 0 291.435 3.626 20 70 CHIDRO CCOc1ccccc1[C@H](C)N[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000161116978 328132841 /nfs/dbraw/zinc/13/28/41/328132841.db2.gz OROUPYUCIJKJER-XHSDSOJGSA-N 1 0 290.451 3.609 20 70 CHIDRO CC[C@H]([NH2+]C[C@H]1CCCCN1CC)c1cccs1 ZINC000161177752 328151151 /nfs/dbraw/zinc/15/11/51/328151151.db2.gz APQXAVVBTYXGBS-KGLIPLIRSA-N 1 0 266.454 3.663 20 70 CHIDRO CSC[C@@H](CCO)[NH2+][C@H](C)c1ccc(C(C)C)cc1 ZINC000160151782 327596538 /nfs/dbraw/zinc/59/65/38/327596538.db2.gz PTIFZTSODAXVBO-CZUORRHYSA-N 1 0 281.465 3.575 20 70 CHIDRO CCC[C@@H](C(=O)NC[C@@H](c1cccs1)[NH+](C)C)C(C)C ZINC000161274448 329922762 /nfs/dbraw/zinc/92/27/62/329922762.db2.gz UGUNKBYMHWYUMY-KGLIPLIRSA-N 1 0 296.480 3.539 20 70 CHIDRO Cc1c2ccccc2oc1[C@@H](C)[NH2+]CCC(C)(C)O ZINC000159799872 330851504 /nfs/dbraw/zinc/85/15/04/330851504.db2.gz ANJHZAJBDQZXGO-GFCCVEGCSA-N 1 0 261.365 3.553 20 70 CHIDRO CC1(C)C[C@H]([NH2+][C@@H]2CCc3cc(Cl)ccc32)CCO1 ZINC000159963425 330855305 /nfs/dbraw/zinc/85/53/05/330855305.db2.gz BPODXHCPLOZYGJ-UKRRQHHQSA-N 1 0 279.811 3.875 20 70 CHIDRO CCOC(CC[NH2+][C@H](C)c1ccc(Cl)cc1)OCC ZINC000159979842 330855978 /nfs/dbraw/zinc/85/59/78/330855978.db2.gz XWDVZJFFPXFHEZ-GFCCVEGCSA-N 1 0 285.815 3.780 20 70 CHIDRO CCOC(CC[NH2+][C@@H](C)c1ccc(Cl)cc1)OCC ZINC000159987158 330856441 /nfs/dbraw/zinc/85/64/41/330856441.db2.gz XWDVZJFFPXFHEZ-LBPRGKRZSA-N 1 0 285.815 3.780 20 70 CHIDRO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(C)c2)cn1 ZINC000160209189 330861255 /nfs/dbraw/zinc/86/12/55/330861255.db2.gz KKIVZJKNZSLLOA-UONOGXRCSA-N 1 0 257.381 3.623 20 70 CHIDRO COCCCCC[NH+]1CCC2(CCCCC2)CC1 ZINC000216818164 333118207 /nfs/dbraw/zinc/11/82/07/333118207.db2.gz LSIZETLFVNROMF-UHFFFAOYSA-N 1 0 253.430 3.849 20 70 CHIDRO Clc1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1Cl ZINC000217643248 333122250 /nfs/dbraw/zinc/12/22/50/333122250.db2.gz ZXGBOJKXNRPUAS-GJZGRUSLSA-N 1 0 299.245 3.710 20 70 CHIDRO Cn1c2ccccc2nc1C[NH2+]CCCC1CCCC1 ZINC000218085443 333126841 /nfs/dbraw/zinc/12/68/41/333126841.db2.gz VXRWXGQCCMLPJR-UHFFFAOYSA-N 1 0 271.408 3.633 20 70 CHIDRO Clc1cc(Cl)cc(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)c1 ZINC000218478684 333132494 /nfs/dbraw/zinc/13/24/94/333132494.db2.gz MGXDPZRQDYHPIV-GJZGRUSLSA-N 1 0 299.245 3.710 20 70 CHIDRO CCOc1ccccc1[C@@H](C)[NH2+][C@H](CCO)c1ccccc1 ZINC000161076307 521572605 /nfs/dbraw/zinc/57/26/05/521572605.db2.gz HRHJPELTZSPGKY-CRAIPNDOSA-N 1 0 299.414 3.860 20 70 CHIDRO CC[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1OC ZINC000161118938 522714189 /nfs/dbraw/zinc/71/41/89/522714189.db2.gz BGOFVSHJUGRCOK-VYDXJSESSA-N 1 0 290.451 3.609 20 70 CHIDRO Cc1ccc(C)c([C@@H](C)N(C)C(=O)c2ccc(C[NH3+])cc2)c1 ZINC000161307503 524200720 /nfs/dbraw/zinc/20/07/20/524200720.db2.gz SMZZWXHCCXFECK-OAHLLOKOSA-N 1 0 296.414 3.595 20 70 CHIDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)nc1)C1(C)CC1 ZINC000160503909 525445038 /nfs/dbraw/zinc/44/50/38/525445038.db2.gz MRARURVJXUZWRA-HNNXBMFYSA-N 1 0 287.451 3.596 20 70 CHIDRO CCS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cncc(F)c2)C1 ZINC000159432945 261186256 /nfs/dbraw/zinc/18/62/56/261186256.db2.gz ZIIQDPKRCRIHIC-NILFDRSVSA-N 1 0 282.428 3.936 20 70 CHIDRO Fc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCSC1)CCCO2 ZINC000159549237 261188283 /nfs/dbraw/zinc/18/82/83/261188283.db2.gz NZYOKUFGLDOLFM-TZMCWYRMSA-N 1 0 281.396 3.525 20 70 CHIDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1cn(C)nc1C(F)(F)F ZINC000159784650 261194031 /nfs/dbraw/zinc/19/40/31/261194031.db2.gz CMCRTUSOYUECSS-LLVKDONJSA-N 1 0 297.324 3.598 20 70 CHIDRO CC[C@H]([NH2+]C[C@](C)(O)c1ccsc1)c1ccccc1 ZINC000159929332 261199083 /nfs/dbraw/zinc/19/90/83/261199083.db2.gz OZSZSGFJIWBLIU-HOTGVXAUSA-N 1 0 275.417 3.697 20 70 CHIDRO CC[C@H]([NH2+]CCc1c(C)noc1C)c1ccc(F)cc1F ZINC000160896508 261231349 /nfs/dbraw/zinc/23/13/49/261231349.db2.gz ZAPBVABKZRGXRR-INIZCTEOSA-N 1 0 294.345 3.853 20 70 CHIDRO Cc1ccc(C[NH2+][C@H](C)c2ccc([S@](C)=O)cc2)s1 ZINC000160929781 261231886 /nfs/dbraw/zinc/23/18/86/261231886.db2.gz XBOGVRAOECWVHQ-CWTRNNRKSA-N 1 0 293.457 3.645 20 70 CHIDRO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)CC1=CCCOC1 ZINC000161140098 261238549 /nfs/dbraw/zinc/23/85/49/261238549.db2.gz QRIZYMUUURVHOC-UHFFFAOYSA-N 1 0 286.202 3.772 20 70 CHIDRO Cc1ccc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)cn1 ZINC000161281798 261242984 /nfs/dbraw/zinc/24/29/84/261242984.db2.gz JGZAPSIRKVKFOP-OAHLLOKOSA-N 1 0 270.376 3.786 20 70 CHIDRO OC[C@H](C[NH2+][C@H]1CCSc2ccccc21)c1ccccc1 ZINC000161453139 261246995 /nfs/dbraw/zinc/24/69/95/261246995.db2.gz ABOZSSDSJKTXSS-RDJZCZTQSA-N 1 0 299.439 3.589 20 70 CHIDRO CC1(C)C[C@@H](Nc2cc[nH+]c3cc(F)ccc23)CCO1 ZINC000160696843 264256149 /nfs/dbraw/zinc/25/61/49/264256149.db2.gz KPSFPDZWXMAUBW-LBPRGKRZSA-N 1 0 274.339 3.743 20 70 CHIDRO COc1ccc(C)cc1[C@H](C)N[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000161062324 328124192 /nfs/dbraw/zinc/12/41/92/328124192.db2.gz BWAWULQXDKNTQJ-XHSDSOJGSA-N 1 0 290.451 3.527 20 70 CHIDRO CC[N@H+](Cc1ccc(C(=O)Nc2ccccn2)cc1)C(C)C ZINC000159442480 327194842 /nfs/dbraw/zinc/19/48/42/327194842.db2.gz SAIKJRBXZZIZEK-UHFFFAOYSA-N 1 0 297.402 3.564 20 70 CHIDRO CC(C)C(=O)NCCC[NH2+][C@@H](C)c1ccc2ccccc2c1 ZINC000159991929 327585178 /nfs/dbraw/zinc/58/51/78/327585178.db2.gz UNCOJXPIOQHYKZ-HNNXBMFYSA-N 1 0 298.430 3.653 20 70 CHIDRO CCNC(=O)c1cccc(C[NH2+][C@@H](C)CCC=C(C)C)c1 ZINC000160171449 327598373 /nfs/dbraw/zinc/59/83/73/327598373.db2.gz AHOJNDISXPELRV-HNNXBMFYSA-N 1 0 288.435 3.661 20 70 CHIDRO C[C@@H]([NH2+]C[C@H](CO)c1ccccc1)C(C)(C)c1ccccc1 ZINC000161420929 329931673 /nfs/dbraw/zinc/93/16/73/329931673.db2.gz NWEQOUZVFBFTPI-SJLPKXTDSA-N 1 0 297.442 3.718 20 70 CHIDRO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)c1 ZINC000159943550 330854725 /nfs/dbraw/zinc/85/47/25/330854725.db2.gz OQURYYXYKQFQFP-GDBMZVCRSA-N 1 0 261.409 3.912 20 70 CHIDRO CC(C)Oc1ccc([C@@H](C)[NH2+]CC2(CO)CCCC2)cc1 ZINC000160117969 330859470 /nfs/dbraw/zinc/85/94/70/330859470.db2.gz YVEXBGMDVWLDGR-OAHLLOKOSA-N 1 0 291.435 3.677 20 70 CHIDRO CCn1cc([C@H](C)[NH2+][C@@H](C)c2cccc(C)c2)cn1 ZINC000160209312 330861295 /nfs/dbraw/zinc/86/12/95/330861295.db2.gz KKIVZJKNZSLLOA-KBPBESRZSA-N 1 0 257.381 3.623 20 70 CHIDRO C[C@H]([NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)c1cccnc1 ZINC000160882088 330878755 /nfs/dbraw/zinc/87/87/55/330878755.db2.gz UQRMNJSLNPDLTR-UHTWSYAYSA-N 1 0 272.314 3.853 20 70 CHIDRO Cc1cc(C)c([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1C ZINC000217626500 333122396 /nfs/dbraw/zinc/12/23/96/333122396.db2.gz WOYMQABJYPSSRM-UHOSZYNNSA-N 1 0 286.463 3.889 20 70 CHIDRO C[C@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)[C@@H]1CCCO1 ZINC000217968790 333125403 /nfs/dbraw/zinc/12/54/03/333125403.db2.gz NTDAVBOCEOGRLF-YUTCNCBUSA-N 1 0 287.325 3.837 20 70 CHIDRO CCOc1cccc(C[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000218113356 333127112 /nfs/dbraw/zinc/12/71/12/333127112.db2.gz UPKWLJJYFDEQMH-UHFFFAOYSA-N 1 0 280.371 3.856 20 70 CHIDRO Cc1cccc(CC[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000218171022 333128461 /nfs/dbraw/zinc/12/84/61/333128461.db2.gz PSECLZIWXMTVSS-UHFFFAOYSA-N 1 0 264.372 3.809 20 70 CHIDRO CCC(CC)[C@H](O)C[NH2+][C@@H](C)c1ccc(Cl)c(F)c1 ZINC000218247356 333129741 /nfs/dbraw/zinc/12/97/41/333129741.db2.gz GUIMIHMLNPCEFC-ZUZCIYMTSA-N 1 0 287.806 3.927 20 70 CHIDRO CC(C)C[N@H+](C)C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC000160522157 519708825 /nfs/dbraw/zinc/70/88/25/519708825.db2.gz UKKXHGIRVYDFOU-YIONKMFJSA-N 1 0 296.455 3.505 20 70 CHIDRO CC[C@@H]([NH2+]C1CCC(O)CC1)c1cccc(Cl)c1F ZINC000161477201 522809083 /nfs/dbraw/zinc/80/90/83/522809083.db2.gz RWQIRBDMIDVKHS-QIMFLAQGSA-N 1 0 285.790 3.823 20 70 CHIDRO COCc1ccccc1C[NH2+]Cc1ccc(Cl)cc1F ZINC000160769292 523103251 /nfs/dbraw/zinc/10/32/51/523103251.db2.gz SAWDJJIEJIYPDN-UHFFFAOYSA-N 1 0 293.769 3.915 20 70 CHIDRO C[C@H]1CC[N@H+](Cc2cnc3ccccn23)[C@H](c2ccco2)C1 ZINC000160906148 524296788 /nfs/dbraw/zinc/29/67/88/524296788.db2.gz PODAFVGEIJHLLY-HOCLYGCPSA-N 1 0 295.386 3.901 20 70 CHIDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)cn1 ZINC000161285355 524596071 /nfs/dbraw/zinc/59/60/71/524596071.db2.gz KFPYYYQLNHOGKO-QZTJIDSGSA-N 1 0 266.388 3.816 20 70 CHIDRO Cc1cccc2c1CC[C@@H]2[NH2+][C@H](CCO)c1ccccc1 ZINC000160960512 524942897 /nfs/dbraw/zinc/94/28/97/524942897.db2.gz DTHOFRCPXQWLHB-MOPGFXCFSA-N 1 0 281.399 3.696 20 70 CHIDRO C[C@H](O)C(C)(C)[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000161119386 525695450 /nfs/dbraw/zinc/69/54/50/525695450.db2.gz ZODQFYRBTRLUML-LBPRGKRZSA-N 1 0 275.417 3.664 20 70 CHIDRO Cc1nccn1CCCC[N@@H+](C)[C@H](C)c1ccccc1F ZINC000161426812 527392095 /nfs/dbraw/zinc/39/20/95/527392095.db2.gz LININKGEDUZXPA-CQSZACIVSA-N 1 0 289.398 3.804 20 70 CHIDRO Cc1cc(C)cc(CC[NH2+][C@H](C)c2cncs2)c1 ZINC000159470518 261186771 /nfs/dbraw/zinc/18/67/71/261186771.db2.gz BZSKFNXCYABNFP-CYBMUJFWSA-N 1 0 260.406 3.653 20 70 CHIDRO C[C@@H]([NH2+][C@@H]1CCCc2cc(F)ccc21)c1cccnc1 ZINC000159536771 261188321 /nfs/dbraw/zinc/18/83/21/261188321.db2.gz CBHAIDGDEWRYAB-SJKOYZFVSA-N 1 0 270.351 3.949 20 70 CHIDRO COc1cc([C@@H](C)[NH2+][C@@H]2CCCSC2)ccc1SC ZINC000159616568 261189679 /nfs/dbraw/zinc/18/96/79/261189679.db2.gz QLOUFOISUXYZKW-DGCLKSJQSA-N 1 0 297.489 3.963 20 70 CHIDRO COc1ccc([C@@H]2CCCCC[N@@H+]2CCn2ccnc2)cc1 ZINC000159717166 261192464 /nfs/dbraw/zinc/19/24/64/261192464.db2.gz IPLLFVIFOIKYBS-SFHVURJKSA-N 1 0 299.418 3.509 20 70 CHIDRO C[C@@H](C[NH2+]C1CCC2(CCCC2)CC1)N(C)C1CC1 ZINC000217538670 261281055 /nfs/dbraw/zinc/28/10/55/261281055.db2.gz LSTDZTOSTTUCFE-AWEZNQCLSA-N 1 0 264.457 3.562 20 70 CHIDRO CSC[C@@H](CCO)[NH2+][C@H](CC(C)C)c1cccs1 ZINC000160311386 261365532 /nfs/dbraw/zinc/36/55/32/261365532.db2.gz PKVLEPRVYOPOLA-CHWSQXEVSA-N 1 0 287.494 3.539 20 70 CHIDRO CCCn1ccc2ccc(NC(=O)C3([NH3+])CCCCC3)cc21 ZINC000161282370 264281483 /nfs/dbraw/zinc/28/14/83/264281483.db2.gz LQQXPSPATVFPCI-UHFFFAOYSA-N 1 0 299.418 3.651 20 70 CHIDRO CC1(C)C[C@H]([NH2+]Cc2cccc(-c3ccncc3)c2)CCO1 ZINC000160592003 327630766 /nfs/dbraw/zinc/63/07/66/327630766.db2.gz JSDBFDZJHKTCBP-GOSISDBHSA-N 1 0 296.414 3.796 20 70 CHIDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)C(C)C)cc1OC ZINC000159946802 327653246 /nfs/dbraw/zinc/65/32/46/327653246.db2.gz WSZSMGUWYBKARR-STQMWFEESA-N 1 0 265.397 3.789 20 70 CHIDRO O=C(C[NH2+][C@@H]1CCC[C@H]1c1ccccc1)Nc1ccccc1 ZINC000160788664 328085496 /nfs/dbraw/zinc/08/54/96/328085496.db2.gz WAAWTHJNTVFCHR-ZWKOTPCHSA-N 1 0 294.398 3.551 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2ccccc2F)o1 ZINC000160859488 328089365 /nfs/dbraw/zinc/08/93/65/328089365.db2.gz NDENBSIGGSJMFP-UHFFFAOYSA-N 1 0 299.349 3.749 20 70 CHIDRO Cc1ccc(CN(C)Cc2cnc(C(C)(C)C)s2)o1 ZINC000160867338 328090683 /nfs/dbraw/zinc/09/06/83/328090683.db2.gz UOVHISIYXHOLCX-UHFFFAOYSA-N 1 0 278.421 3.974 20 70 CHIDRO CC[C@@H](C)C[N@H+](CC)Cc1c(C)nc2ccccn21 ZINC000160953542 328097180 /nfs/dbraw/zinc/09/71/80/328097180.db2.gz JEOCLUWENWZPJJ-CYBMUJFWSA-N 1 0 259.397 3.511 20 70 CHIDRO COc1ccc([C@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)cc1F ZINC000159362113 327175454 /nfs/dbraw/zinc/17/54/54/327175454.db2.gz PYIAYKLRODAHPU-GUYCJALGSA-N 1 0 297.414 3.672 20 70 CHIDRO CCSc1ccc([C@H](C)[NH2+]C[C@](C)(O)CC)cc1 ZINC000159432189 327189480 /nfs/dbraw/zinc/18/94/80/327189480.db2.gz LKFQWCKPEBXKIX-SWLSCSKDSA-N 1 0 267.438 3.610 20 70 CHIDRO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccco1 ZINC000160198570 327528915 /nfs/dbraw/zinc/52/89/15/327528915.db2.gz YYCKJVZKVVZJQN-RISCZKNCSA-N 1 0 257.333 3.626 20 70 CHIDRO COc1cc(C)c([C@H](C)[NH2+][C@H]2CCCSC2)cc1OC ZINC000159538199 327532350 /nfs/dbraw/zinc/53/23/50/327532350.db2.gz AZTXIAZXSUQPFZ-STQMWFEESA-N 1 0 295.448 3.558 20 70 CHIDRO C[C@H]([NH2+][C@@H]1CCCc2cc(F)ccc21)c1ccncc1 ZINC000159552697 327534359 /nfs/dbraw/zinc/53/43/59/327534359.db2.gz ZUECOQFNVUBFRF-YVEFUNNKSA-N 1 0 270.351 3.949 20 70 CHIDRO Fc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CCCSC2)cc1 ZINC000159609107 327546320 /nfs/dbraw/zinc/54/63/20/327546320.db2.gz KINGNBVXZLSADL-PMPSAXMXSA-N 1 0 279.424 3.947 20 70 CHIDRO CCCC(=O)Nc1cccc(C[NH2+][C@@H](C)C(C)(C)C)c1 ZINC000159924298 327578836 /nfs/dbraw/zinc/57/88/36/327578836.db2.gz HMWPUUNUSGPGEB-ZDUSSCGKSA-N 1 0 276.424 3.949 20 70 CHIDRO CCCC(=O)Nc1cccc(C[NH2+][C@@H](C(C)C)C2CC2)c1 ZINC000159936091 327579761 /nfs/dbraw/zinc/57/97/61/327579761.db2.gz SDCUFZWNESRDNL-SFHVURJKSA-N 1 0 288.435 3.949 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1ccc(C)cc1 ZINC000218725835 329078208 /nfs/dbraw/zinc/07/82/08/329078208.db2.gz DQYSHEVTSAFZPI-OALUTQOASA-N 1 0 283.415 3.639 20 70 CHIDRO CCC[C@H](C(=O)NC[C@@H](c1cccs1)[NH+](C)C)C(C)C ZINC000161274342 329922733 /nfs/dbraw/zinc/92/27/33/329922733.db2.gz UGUNKBYMHWYUMY-KBPBESRZSA-N 1 0 296.480 3.539 20 70 CHIDRO CCC[C@@H](CCO)C[NH2+][C@@H](C)c1ccc(Cl)c(F)c1 ZINC000218264563 330439237 /nfs/dbraw/zinc/43/92/37/330439237.db2.gz PGWCFIMXSJTJHB-RYUDHWBXSA-N 1 0 287.806 3.928 20 70 CHIDRO CC(C)Oc1ccc([C@H](C)[NH2+]CC2(CO)CCCC2)cc1 ZINC000160118087 330859476 /nfs/dbraw/zinc/85/94/76/330859476.db2.gz YVEXBGMDVWLDGR-HNNXBMFYSA-N 1 0 291.435 3.677 20 70 CHIDRO Cc1cccc([C@H](C)[NH2+]Cc2cncn2C(C)C)c1 ZINC000160188981 330860538 /nfs/dbraw/zinc/86/05/38/330860538.db2.gz YHXUUBTWDLWXAQ-AWEZNQCLSA-N 1 0 257.381 3.623 20 70 CHIDRO CC1(C)CC[C@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2)O1 ZINC000160279989 330862411 /nfs/dbraw/zinc/86/24/11/330862411.db2.gz CTGJDOIZKHUFRN-CYBMUJFWSA-N 1 0 287.325 3.753 20 70 CHIDRO C[C@@H](CC[NH2+]CC1(N(C)C)CCCC1)c1ccccc1 ZINC000160717045 330873930 /nfs/dbraw/zinc/87/39/30/330873930.db2.gz AWSASSNDZZYNHB-INIZCTEOSA-N 1 0 274.452 3.644 20 70 CHIDRO OC1(C[NH2+]Cc2ccc(Cl)cc2F)CCCCCC1 ZINC000160843326 330877500 /nfs/dbraw/zinc/87/75/00/330877500.db2.gz XSKRHLJOEREGCT-UHFFFAOYSA-N 1 0 285.790 3.654 20 70 CHIDRO C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(Cl)cc1 ZINC000217655705 333122711 /nfs/dbraw/zinc/12/27/11/333122711.db2.gz JVDVZEQNDMISBO-MAZHCROVSA-N 1 0 278.827 3.617 20 70 CHIDRO COc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCC[C@@H](C)C1)CCO2 ZINC000218003383 333125545 /nfs/dbraw/zinc/12/55/45/333125545.db2.gz NHMJVADSLGIOTG-WWGRRREGSA-N 1 0 275.392 3.687 20 70 CHIDRO CC[N@H+](Cc1c(C)nc2ccccn21)[C@H](C)C(C)C ZINC000160435302 521274852 /nfs/dbraw/zinc/27/48/52/521274852.db2.gz HYYYTJAAERMZED-CQSZACIVSA-N 1 0 259.397 3.509 20 70 CHIDRO CCO[C@H]1C[C@H]([NH2+][C@@H](C)c2cnn(CC)c2)C1(CC)CC ZINC000161305726 520578860 /nfs/dbraw/zinc/57/88/60/520578860.db2.gz DBMDORLRVYRYLW-BPUTZDHNSA-N 1 0 293.455 3.537 20 70 CHIDRO CC[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1OC ZINC000161119162 522752204 /nfs/dbraw/zinc/75/22/04/522752204.db2.gz BGOFVSHJUGRCOK-ZOBUZTSGSA-N 1 0 290.451 3.609 20 70 CHIDRO C[C@@H]1CCCC[N@@H+]1CCCNCc1coc2ccccc12 ZINC000161063394 524106586 /nfs/dbraw/zinc/10/65/86/524106586.db2.gz QLCXWHVWAQSKKB-OAHLLOKOSA-N 1 0 286.419 3.787 20 70 CHIDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)c1 ZINC000160343043 525940527 /nfs/dbraw/zinc/94/05/27/525940527.db2.gz VLJUKOHXZDJFCE-GOSISDBHSA-N 1 0 282.387 3.736 20 70 CHIDRO CCCOc1cccc(C[NH2+][C@H](C)CC(F)(F)F)c1 ZINC000160480189 260013087 /nfs/dbraw/zinc/01/30/87/260013087.db2.gz BUDKTLNDRLZXKG-LLVKDONJSA-N 1 0 275.314 3.906 20 70 CHIDRO CC[C@@H]1CC[N@H+](CCCC(=O)c2ccc(F)cc2)C1 ZINC000160785225 260124329 /nfs/dbraw/zinc/12/43/29/260124329.db2.gz NUDQZPFOPLDRDS-CYBMUJFWSA-N 1 0 263.356 3.521 20 70 CHIDRO Cc1c(C[NH2+][C@H](C)c2ccccc2C(F)(F)F)cnn1C ZINC000160862993 260137567 /nfs/dbraw/zinc/13/75/67/260137567.db2.gz TUHWTWNFQQFKPH-SNVBAGLBSA-N 1 0 297.324 3.598 20 70 CHIDRO OCC[NH2+][C@H](CCc1ccccc1Cl)c1ccccc1 ZINC000159704221 260926213 /nfs/dbraw/zinc/92/62/13/260926213.db2.gz FZJMSERXZGTWKA-QGZVFWFLSA-N 1 0 289.806 3.596 20 70 CHIDRO C[C@H]([NH2+]C[C@](C)(O)c1ccccc1)c1cccc(F)c1F ZINC000159482408 261186573 /nfs/dbraw/zinc/18/65/73/261186573.db2.gz AZHUVXBQKQOYOD-SJCJKPOMSA-N 1 0 291.341 3.523 20 70 CHIDRO CC(C)C[C@@H]([NH2+]CCC(C)(C)O)c1cccs1 ZINC000159651164 261190010 /nfs/dbraw/zinc/19/00/10/261190010.db2.gz YGYKHFBECQDHGA-GFCCVEGCSA-N 1 0 255.427 3.586 20 70 CHIDRO Cc1n[nH]cc1C[N@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000159685778 261191433 /nfs/dbraw/zinc/19/14/33/261191433.db2.gz RYYYLJLUFSJCRK-AWEZNQCLSA-N 1 0 269.392 3.519 20 70 CHIDRO Cc1ccsc1[C@@H](C)[NH2+]C[C@](C)(O)c1ccsc1 ZINC000159981859 261201378 /nfs/dbraw/zinc/20/13/78/261201378.db2.gz AKJYDMHBJKBBIS-RISCZKNCSA-N 1 0 281.446 3.676 20 70 CHIDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)nc1)c1ccco1 ZINC000160504776 261216308 /nfs/dbraw/zinc/21/63/08/261216308.db2.gz AZJXWNXVLFLDGI-HNNXBMFYSA-N 1 0 299.418 3.762 20 70 CHIDRO CC(C)(O)C[NH2+][C@H]1CCCSc2ccc(Cl)cc21 ZINC000160632981 261220816 /nfs/dbraw/zinc/22/08/16/261220816.db2.gz CVTFBHYTZKBZLZ-LBPRGKRZSA-N 1 0 285.840 3.628 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@@H](C)c2cncs2)n1 ZINC000160662284 261222207 /nfs/dbraw/zinc/22/22/07/261222207.db2.gz MQLJUSBZNIRYOZ-NSHDSACASA-N 1 0 281.450 3.582 20 70 CHIDRO Cc1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1ccc(C)nc1 ZINC000161275908 261241798 /nfs/dbraw/zinc/24/17/98/261241798.db2.gz YFZSESATOLRXHL-QGZVFWFLSA-N 1 0 282.387 3.702 20 70 CHIDRO CC[C@@H]([NH2+]CCCn1ccnc1)c1cccc(Cl)c1F ZINC000161473967 261247746 /nfs/dbraw/zinc/24/77/46/261247746.db2.gz SVSSXMYJVQZPRC-CQSZACIVSA-N 1 0 295.789 3.807 20 70 CHIDRO CCCCN(C(=O)C[C@@H]1CCC[NH2+]1)[C@H](C)c1ccccc1 ZINC000160186043 264234758 /nfs/dbraw/zinc/23/47/58/264234758.db2.gz WFDFTJQJYXRLBS-WBVHZDCISA-N 1 0 288.435 3.518 20 70 CHIDRO CC[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)nc1)C1CC1 ZINC000160509242 327617670 /nfs/dbraw/zinc/61/76/70/327617670.db2.gz LIVLRTTUJJRDLW-KRWDZBQOSA-N 1 0 287.451 3.596 20 70 CHIDRO C[C@@H]([NH2+]CC(C)(C)O)c1ccc(-c2ccccc2F)s1 ZINC000160607134 327631590 /nfs/dbraw/zinc/63/15/90/327631590.db2.gz JBPXOSQCCNHHPM-LLVKDONJSA-N 1 0 293.407 3.976 20 70 CHIDRO CC[C@H]([NH2+][C@@H](C)CSC)c1ccc(F)cc1F ZINC000160940270 328096113 /nfs/dbraw/zinc/09/61/13/328096113.db2.gz IWEQPMZHRPEMRX-ZANVPECISA-N 1 0 259.365 3.757 20 70 CHIDRO CC(C)n1cc([C@@H](C)[NH2+]C[C@@H]2CCc3ccccc32)cn1 ZINC000161000224 328116287 /nfs/dbraw/zinc/11/62/87/328116287.db2.gz FLJUPNJUWKZPNB-ZBFHGGJFSA-N 1 0 283.419 3.845 20 70 CHIDRO CC[C@@H]1CCCN(C(C)(C)C[NH2+][C@@H](C)c2cncs2)C1 ZINC000161015854 328118095 /nfs/dbraw/zinc/11/80/95/328118095.db2.gz DANNSOONEHIHND-UONOGXRCSA-N 1 0 295.496 3.694 20 70 CHIDRO OCC[C@@H]([NH2+][C@H]1CCC[C@@H](C2CC2)C1)c1ccccc1 ZINC000161067081 328124105 /nfs/dbraw/zinc/12/41/05/328124105.db2.gz YCRAWGZIBIVPOC-FGTMMUONSA-N 1 0 273.420 3.669 20 70 CHIDRO COc1ccc(COCCC[NH2+][C@@H](C)C(C)(C)C)cc1 ZINC000161094838 328129438 /nfs/dbraw/zinc/12/94/38/328129438.db2.gz QPAQBQOMWZTTRD-AWEZNQCLSA-N 1 0 279.424 3.626 20 70 CHIDRO COc1ccc(COCCC[NH2+][C@H](C)C(C)(C)C)cc1 ZINC000161094975 328129447 /nfs/dbraw/zinc/12/94/47/328129447.db2.gz QPAQBQOMWZTTRD-CQSZACIVSA-N 1 0 279.424 3.626 20 70 CHIDRO Cc1ccc(-c2n[nH]cc2C[N@@H+](C)Cc2ccc(F)cc2)o1 ZINC000161142939 328136671 /nfs/dbraw/zinc/13/66/71/328136671.db2.gz RVUJFDBDGXPZON-UHFFFAOYSA-N 1 0 299.349 3.749 20 70 CHIDRO COCc1ccccc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000218088125 328183591 /nfs/dbraw/zinc/18/35/91/328183591.db2.gz DXIDOXQFIDHSQY-UHFFFAOYSA-N 1 0 280.371 3.604 20 70 CHIDRO CC[N@H+](Cc1ccccn1)[C@@H]1CCCc2ccccc21 ZINC000161185137 328214987 /nfs/dbraw/zinc/21/49/87/328214987.db2.gz DZXHTSOMASGFFT-GOSISDBHSA-N 1 0 266.388 3.981 20 70 CHIDRO COc1ccccc1[C@H](C)[NH2+]C[C@@](C)(O)CCC(C)C ZINC000159368676 327174968 /nfs/dbraw/zinc/17/49/68/327174968.db2.gz PKFKNAGYLBHVRD-YOEHRIQHSA-N 1 0 279.424 3.533 20 70 CHIDRO COc1ccccc1[C@H](C)[NH2+]C[C@](C)(O)CCC(C)C ZINC000159368824 327175002 /nfs/dbraw/zinc/17/50/02/327175002.db2.gz PKFKNAGYLBHVRD-WMLDXEAASA-N 1 0 279.424 3.533 20 70 CHIDRO COc1ccc([C@@H](C)[NH2+]C[C@](C)(O)CCC(C)C)cc1F ZINC000159362553 327175540 /nfs/dbraw/zinc/17/55/40/327175540.db2.gz PYIAYKLRODAHPU-CXAGYDPISA-N 1 0 297.414 3.672 20 70 CHIDRO CC[N@H+](CCSc1ccccc1)CCc1nccs1 ZINC000159379829 327175931 /nfs/dbraw/zinc/17/59/31/327175931.db2.gz LXYMNEYXOJAIFK-UHFFFAOYSA-N 1 0 292.473 3.800 20 70 CHIDRO COc1ccc(CC[NH2+][C@H](C)c2ccccn2)c(Cl)c1 ZINC000159377730 327176066 /nfs/dbraw/zinc/17/60/66/327176066.db2.gz UIOBVASGAQPLHS-GFCCVEGCSA-N 1 0 290.794 3.637 20 70 CHIDRO C[C@H]([NH2+][C@H]1CCCc2cc(F)ccc21)c1ccncc1 ZINC000159552962 327534366 /nfs/dbraw/zinc/53/43/66/327534366.db2.gz ZUECOQFNVUBFRF-SJCJKPOMSA-N 1 0 270.351 3.949 20 70 CHIDRO CCc1cnc(CC[NH2+][C@H](C)c2ccccc2C)s1 ZINC000159707418 327555757 /nfs/dbraw/zinc/55/57/57/327555757.db2.gz URWVBXXSMMBGQQ-CYBMUJFWSA-N 1 0 274.433 3.907 20 70 CHIDRO c1ccc(CSCC[NH2+]CCOc2ccccc2)cc1 ZINC000216707922 329299495 /nfs/dbraw/zinc/29/94/95/329299495.db2.gz DSUSZQOVPAPTCZ-UHFFFAOYSA-N 1 0 287.428 3.588 20 70 CHIDRO CCSCC[C@H](C)[NH2+][C@@H]1CCc2ccc(OC)cc2C1 ZINC000159565985 330849019 /nfs/dbraw/zinc/84/90/19/330849019.db2.gz YPXDTHQDARVXCJ-XJKSGUPXSA-N 1 0 293.476 3.674 20 70 CHIDRO C[C@H]([NH2+][C@@H](C)C1CCOCC1)c1cc2ccccc2o1 ZINC000159965575 330855270 /nfs/dbraw/zinc/85/52/70/330855270.db2.gz WRIWVCGTOHVBSR-STQMWFEESA-N 1 0 273.376 3.899 20 70 CHIDRO COc1ccc([C@@H]([NH2+][C@@H]2CCOC(C)(C)C2)C2CC2)cc1 ZINC000159980756 330855988 /nfs/dbraw/zinc/85/59/88/330855988.db2.gz LNDFBTZRDWPOLD-WBVHZDCISA-N 1 0 289.419 3.694 20 70 CHIDRO C[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc2c(c1)CCC2 ZINC000159987922 330856426 /nfs/dbraw/zinc/85/64/26/330856426.db2.gz DZZKRKMFQUTXAT-SUMWQHHRSA-N 1 0 273.420 3.784 20 70 CHIDRO CCCOc1ccc([C@H](C)[NH2+]CC2(CO)CCCC2)cc1 ZINC000160082751 330858652 /nfs/dbraw/zinc/85/86/52/330858652.db2.gz HKEYMIJIDYFEOD-HNNXBMFYSA-N 1 0 291.435 3.679 20 70 CHIDRO C[C@]1([NH2+]Cc2cccc(Oc3ccccc3)c2)CCOC1 ZINC000160179991 330860225 /nfs/dbraw/zinc/86/02/25/330860225.db2.gz VHTLWGPBBJYIQU-SFHVURJKSA-N 1 0 283.371 3.748 20 70 CHIDRO CC1(C)CC[C@@H](C[NH2+]Cc2cccc3ccccc32)O1 ZINC000160273693 330862320 /nfs/dbraw/zinc/86/23/20/330862320.db2.gz HISIWCNZLRIVSS-INIZCTEOSA-N 1 0 269.388 3.887 20 70 CHIDRO c1ccc2cc(CN[C@H]3CC[N@@H+]4CCCC[C@@H]34)ccc2c1 ZINC000217640298 333122255 /nfs/dbraw/zinc/12/22/55/333122255.db2.gz LOUNHFOHRSKILE-OALUTQOASA-N 1 0 280.415 3.556 20 70 CHIDRO Cc1cc([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)s1 ZINC000217629078 333122294 /nfs/dbraw/zinc/12/22/94/333122294.db2.gz AMUZHDNYEXBXGX-MAZHCROVSA-N 1 0 278.465 3.642 20 70 CHIDRO C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1cc2ccccc2o1 ZINC000217663711 333122639 /nfs/dbraw/zinc/12/26/39/333122639.db2.gz VCFDLVYDTLGVAS-BPUTZDHNSA-N 1 0 284.403 3.710 20 70 CHIDRO c1cc2cccc(C[NH2+][C@H]3CCc4ccccc4C3)c2[nH]1 ZINC000218071466 333126226 /nfs/dbraw/zinc/12/62/26/333126226.db2.gz ABMAUIRFNMMJAZ-SFHVURJKSA-N 1 0 276.383 3.815 20 70 CHIDRO c1cc2cccc(C[NH2+][C@@H]3CCCc4occc43)c2[nH]1 ZINC000218103895 333126849 /nfs/dbraw/zinc/12/68/49/333126849.db2.gz WPYNGIWSBBMJKE-OAHLLOKOSA-N 1 0 266.344 3.928 20 70 CHIDRO Cc1nc(CC[NH2+][C@H](c2ccccc2)C(C)C)cs1 ZINC000218095342 333126906 /nfs/dbraw/zinc/12/69/06/333126906.db2.gz OMHZQHUYTBSJAQ-INIZCTEOSA-N 1 0 274.433 3.981 20 70 CHIDRO CCC(CC)[C@H](O)C[NH2+][C@H](C)c1ccc(Cl)c(F)c1 ZINC000218247482 333129876 /nfs/dbraw/zinc/12/98/76/333129876.db2.gz GUIMIHMLNPCEFC-MEBBXXQBSA-N 1 0 287.806 3.927 20 70 CHIDRO CC[C@H]([NH2+][C@H](C)COC)c1cccc(Cl)c1F ZINC000161469439 522734338 /nfs/dbraw/zinc/73/43/38/522734338.db2.gz QQPDQLBMZAOKCX-SKDRFNHKSA-N 1 0 259.752 3.555 20 70 CHIDRO C[N@H+](CCCCc1ccccc1)Cc1cccc(N)c1 ZINC000160985108 522740867 /nfs/dbraw/zinc/74/08/67/522740867.db2.gz SSSJKAZJYXAYMN-UHFFFAOYSA-N 1 0 268.404 3.724 20 70 CHIDRO CC[C@H]([NH2+][C@H](CCO)c1ccccc1)c1cccc(OC)c1 ZINC000160971858 522747235 /nfs/dbraw/zinc/74/72/35/522747235.db2.gz JATXGEDXFKTRIU-RBUKOAKNSA-N 1 0 299.414 3.860 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H]1CCCCO1)c1ccc(F)cc1F ZINC000160825174 522853673 /nfs/dbraw/zinc/85/36/73/522853673.db2.gz VOPXVMZANYHBMI-SWLSCSKDSA-N 1 0 269.335 3.575 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H]1CCCCO1)c1ccc(F)cc1F ZINC000160825421 522863937 /nfs/dbraw/zinc/86/39/37/522863937.db2.gz VOPXVMZANYHBMI-IUODEOHRSA-N 1 0 269.335 3.575 20 70 CHIDRO COCc1cccc(C[NH2+]Cc2cc(F)cc(Cl)c2)c1 ZINC000160904811 523054090 /nfs/dbraw/zinc/05/40/90/523054090.db2.gz AAEAHSHBEZONSA-UHFFFAOYSA-N 1 0 293.769 3.915 20 70 CHIDRO Cc1cccn2c(C[NH2+][C@H]3CCCc4sccc43)cnc12 ZINC000160959211 525468188 /nfs/dbraw/zinc/46/81/88/525468188.db2.gz ZZFVRELEVCQATL-HNNXBMFYSA-N 1 0 297.427 3.871 20 70 CHIDRO C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1cncc(F)c1 ZINC000160992563 525504119 /nfs/dbraw/zinc/50/41/19/525504119.db2.gz RKNQUYDZTAATDQ-TZMCWYRMSA-N 1 0 270.351 3.601 20 70 CHIDRO C[C@H]([NH2+][C@H](CCO)c1ccccc1)c1ccc2c(c1)CCC2 ZINC000160985735 525593110 /nfs/dbraw/zinc/59/31/10/525593110.db2.gz VLTNQNZTKMDLHQ-MGPUTAFESA-N 1 0 295.426 3.950 20 70 CHIDRO Cc1ccc(-c2nnc([C@H](C)[NH+]3CCCC3)o2)cc1C ZINC000160467620 525860936 /nfs/dbraw/zinc/86/09/36/525860936.db2.gz PJKZOVBTENVLKU-ZDUSSCGKSA-N 1 0 271.364 3.510 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@@H](C)C(C)(C)C)n1 ZINC000160696948 526338745 /nfs/dbraw/zinc/33/87/45/526338745.db2.gz SVKVEWIRESKMSX-LBPRGKRZSA-N 1 0 254.443 3.798 20 70 CHIDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)CC(F)(F)F)c1 ZINC000160008274 260941213 /nfs/dbraw/zinc/94/12/13/260941213.db2.gz YMCRMXSFNRBAKD-VHSXEESVSA-N 1 0 291.313 3.695 20 70 CHIDRO COc1cc([C@H](C)[NH2+][C@H]2CCCSC2)ccc1SC ZINC000159616693 261189789 /nfs/dbraw/zinc/18/97/89/261189789.db2.gz QLOUFOISUXYZKW-AAEUAGOBSA-N 1 0 297.489 3.963 20 70 CHIDRO C[C@H]([NH2+]CCC1Cc2ccccc2C1)c1cccnc1 ZINC000159729350 261193302 /nfs/dbraw/zinc/19/33/02/261193302.db2.gz ZWDYFYIHXNANMZ-AWEZNQCLSA-N 1 0 266.388 3.537 20 70 CHIDRO Cc1ccccc1[C@H](C)[NH2+][C@H]1CCC[C@H]2OCC[C@@H]21 ZINC000159816227 261194902 /nfs/dbraw/zinc/19/49/02/261194902.db2.gz LWEYICIQNMAVPD-PQEBFOHHSA-N 1 0 259.393 3.603 20 70 CHIDRO C[C@@H]([NH2+]CCSc1ccc(Cl)cc1)c1cnn(C)c1 ZINC000160065053 261203475 /nfs/dbraw/zinc/20/34/75/261203475.db2.gz JFVZXRFXSVJTDC-LLVKDONJSA-N 1 0 295.839 3.516 20 70 CHIDRO CCn1cc([C@H](C)[NH2+]CCSc2ccc(C)cc2)cn1 ZINC000160742915 261225090 /nfs/dbraw/zinc/22/50/90/261225090.db2.gz INELWUDHHDHRIH-AWEZNQCLSA-N 1 0 289.448 3.654 20 70 CHIDRO Cc1ccc(SCC[NH2+][C@@H](C)c2cncs2)cc1 ZINC000160780810 261226524 /nfs/dbraw/zinc/22/65/24/261226524.db2.gz GDEGVZCENDLJCI-LBPRGKRZSA-N 1 0 278.446 3.894 20 70 CHIDRO Cc1ccc([C@@H](C)[NH2+][C@H](CCCO)c2ccccc2)o1 ZINC000160889409 261230236 /nfs/dbraw/zinc/23/02/36/261230236.db2.gz IWVZBUCEYSQXGX-GDBMZVCRSA-N 1 0 273.376 3.752 20 70 CHIDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc([S@@](C)=O)cc2)s1 ZINC000160929911 261232025 /nfs/dbraw/zinc/23/20/25/261232025.db2.gz XBOGVRAOECWVHQ-BUXKBTBVSA-N 1 0 293.457 3.645 20 70 CHIDRO Cc1ccc(C[NH2+][C@@H]2CSCCc3ccccc32)cn1 ZINC000161313009 261242988 /nfs/dbraw/zinc/24/29/88/261242988.db2.gz XSZABYWKALXPIA-QGZVFWFLSA-N 1 0 284.428 3.510 20 70 CHIDRO COc1ccc([C@H](C)[NH2+]C2CCN(C)CC2)c2ccccc12 ZINC000161448437 261247093 /nfs/dbraw/zinc/24/70/93/261247093.db2.gz VQPAIYCPVVEZJR-AWEZNQCLSA-N 1 0 298.430 3.593 20 70 CHIDRO Cc1cccc2nc(C[NH2+][C@@H]3CCc4cc(F)ccc43)cn21 ZINC000160289404 261275256 /nfs/dbraw/zinc/27/52/56/261275256.db2.gz OFXPOHDWOZNQIQ-QGZVFWFLSA-N 1 0 295.361 3.559 20 70 CHIDRO CSC[C@H](CCO)[NH2+][C@H](CC(C)C)c1cccs1 ZINC000160311106 261358620 /nfs/dbraw/zinc/35/86/20/261358620.db2.gz PKVLEPRVYOPOLA-QWHCGFSZSA-N 1 0 287.494 3.539 20 70 CHIDRO CC(=O)Nc1ccc(CC[NH2+][C@H](C)c2ccccc2C)cc1 ZINC000159451736 327644102 /nfs/dbraw/zinc/64/41/02/327644102.db2.gz YBJWNVIKCLXAKO-OAHLLOKOSA-N 1 0 296.414 3.847 20 70 CHIDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]CC[S@@](=O)c1ccccc1 ZINC000160777490 328084009 /nfs/dbraw/zinc/08/40/09/328084009.db2.gz UOXFTLYVEDAYKC-QKLQHJQFSA-N 1 0 293.476 3.599 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2ccc(F)cc2)o1 ZINC000160862094 328090480 /nfs/dbraw/zinc/09/04/80/328090480.db2.gz JQXGMISVUQMXKB-UHFFFAOYSA-N 1 0 299.349 3.749 20 70 CHIDRO CC(C)n1cc([C@H](C)[NH2+]C[C@H]2CCc3ccccc32)cn1 ZINC000161000561 328116312 /nfs/dbraw/zinc/11/63/12/328116312.db2.gz FLJUPNJUWKZPNB-GOEBONIOSA-N 1 0 283.419 3.845 20 70 CHIDRO Cn1cc(C[N@H+](C)C2c3ccccc3-c3ccccc32)cn1 ZINC000161057647 328123940 /nfs/dbraw/zinc/12/39/40/328123940.db2.gz VXIHUBYADCKASZ-UHFFFAOYSA-N 1 0 289.382 3.622 20 70 CHIDRO OCC[C@@H]([NH2+][C@@H]1CCC[C@@H](C2CC2)C1)c1ccccc1 ZINC000161067009 328124220 /nfs/dbraw/zinc/12/42/20/328124220.db2.gz YCRAWGZIBIVPOC-KZNAEPCWSA-N 1 0 273.420 3.669 20 70 CHIDRO CCSCC[N@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000159364518 327174682 /nfs/dbraw/zinc/17/46/82/327174682.db2.gz NFZVVBRUJRCGJF-SNVBAGLBSA-N 1 0 259.365 3.711 20 70 CHIDRO CC1([NH2+]Cc2csc(-c3ccc(F)cc3)n2)CCC1 ZINC000159915931 327578285 /nfs/dbraw/zinc/57/82/85/327578285.db2.gz YCZOPMXIEAAQBY-UHFFFAOYSA-N 1 0 276.380 3.981 20 70 CHIDRO CCOc1cc(C[NH2+]C2(C)CCC2)ccc1OC(F)F ZINC000159924317 327578886 /nfs/dbraw/zinc/57/88/86/327578886.db2.gz NRGHSDKWORYWNB-UHFFFAOYSA-N 1 0 285.334 3.719 20 70 CHIDRO CSC[C@H](CCO)[NH2+][C@H](C)c1ccc(C(C)C)cc1 ZINC000160151508 327596279 /nfs/dbraw/zinc/59/62/79/327596279.db2.gz PTIFZTSODAXVBO-CJNGLKHVSA-N 1 0 281.465 3.575 20 70 CHIDRO Fc1ccccc1OCC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000218200611 329468919 /nfs/dbraw/zinc/46/89/19/329468919.db2.gz LMYJKDRMHSEGRB-SFHVURJKSA-N 1 0 285.362 3.945 20 70 CHIDRO C[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc(Cl)c1 ZINC000161500121 329942904 /nfs/dbraw/zinc/94/29/04/329942904.db2.gz OQSKTIDFXXTYAT-CJNGLKHVSA-N 1 0 289.806 3.767 20 70 CHIDRO Cc1cccc([C@@H](C)[NH2+]C2Cc3ccccc3C2)c1 ZINC000160167637 330859997 /nfs/dbraw/zinc/85/99/97/330859997.db2.gz ARKSIZAWPTWHIX-CQSZACIVSA-N 1 0 251.373 3.813 20 70 CHIDRO CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H](C)C2CCOCC2)cc1 ZINC000160876178 330878516 /nfs/dbraw/zinc/87/85/16/330878516.db2.gz QUNUPSQZKDTXHF-CABCVRRESA-N 1 0 291.435 3.940 20 70 CHIDRO C[C@H]([NH2+]CCCOCc1ccccc1)c1ccccc1 ZINC000216774755 333117657 /nfs/dbraw/zinc/11/76/57/333117657.db2.gz JHANEMNBKYVZLG-INIZCTEOSA-N 1 0 269.388 3.944 20 70 CHIDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)cc1F ZINC000217618087 333121985 /nfs/dbraw/zinc/12/19/85/333121985.db2.gz KUQTZFJOOMQICE-SLEUVZQESA-N 1 0 265.372 3.749 20 70 CHIDRO Clc1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c(Cl)c1 ZINC000217652021 333122578 /nfs/dbraw/zinc/12/25/78/333122578.db2.gz GDBLIUAEURIKKO-CABCVRRESA-N 1 0 299.245 3.710 20 70 CHIDRO COc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCCC[C@@H]1C)CCO2 ZINC000217863646 333124616 /nfs/dbraw/zinc/12/46/16/333124616.db2.gz SPXDFJGQDYZACR-RCBQFDQVSA-N 1 0 275.392 3.687 20 70 CHIDRO Cc1nc(CC[NH2+][C@@H](c2ccccc2)C(C)C)cs1 ZINC000218095274 333126750 /nfs/dbraw/zinc/12/67/50/333126750.db2.gz OMHZQHUYTBSJAQ-MRXNPFEDSA-N 1 0 274.433 3.981 20 70 CHIDRO CC[NH+](CC)[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1 ZINC000160570225 520858352 /nfs/dbraw/zinc/85/83/52/520858352.db2.gz YBDMFERHPZTUSL-CYBMUJFWSA-N 1 0 273.380 3.756 20 70 CHIDRO CCC[C@H](C)C(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000161488128 520996740 /nfs/dbraw/zinc/99/67/40/520996740.db2.gz GCRKLIQWKJIXNA-GTPINHCMSA-N 1 0 294.483 3.582 20 70 CHIDRO CC[C@H]([NH2+]CCCCc1nc(C)cs1)C1CC1 ZINC000160707031 522580965 /nfs/dbraw/zinc/58/09/65/522580965.db2.gz PYMCBBJYQRKJSX-ZDUSSCGKSA-N 1 0 252.427 3.552 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H]1CCCC[C@@H]1O)c1cc(F)ccc1F ZINC000160506854 522853833 /nfs/dbraw/zinc/85/38/33/522853833.db2.gz WKUYLPULVHJZDZ-XZJROXQQSA-N 1 0 283.362 3.557 20 70 CHIDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccc(NC(C)=O)c1 ZINC000161411743 523198372 /nfs/dbraw/zinc/19/83/72/523198372.db2.gz IMLFEOKSEJGRKM-WBVHZDCISA-N 1 0 274.408 3.703 20 70 CHIDRO CCc1ccc([C@H](C)NC2CC[NH+](C3CCCC3)CC2)o1 ZINC000160512879 524045413 /nfs/dbraw/zinc/04/54/13/524045413.db2.gz FUEUYFBWWCSVMT-AWEZNQCLSA-N 1 0 290.451 3.900 20 70 CHIDRO Cc1ccc(C(=O)CC[N@@H+](C)[C@@H](C)c2ccncc2)cc1 ZINC000161186584 526042739 /nfs/dbraw/zinc/04/27/39/526042739.db2.gz NWXNNDZJJNBUSD-HNNXBMFYSA-N 1 0 282.387 3.656 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@H](C)C2(C)CC2)n1 ZINC000160697671 526339877 /nfs/dbraw/zinc/33/98/77/526339877.db2.gz YBLYHEXHSIJWMU-GFCCVEGCSA-N 1 0 252.427 3.552 20 70 CHIDRO Clc1ncccc1C[NH2+][C@H]1CCCc2sccc21 ZINC000160974517 261232595 /nfs/dbraw/zinc/23/25/95/261232595.db2.gz FOZDLQLSUAIEHH-LBPRGKRZSA-N 1 0 278.808 3.964 20 70 CHIDRO C[C@@H](C1CC1)[N@H+](Cc1ccc(CO)o1)Cc1ccccc1 ZINC000159678056 261191509 /nfs/dbraw/zinc/19/15/09/261191509.db2.gz HXTBRXFLMGLICO-AWEZNQCLSA-N 1 0 285.387 3.573 20 70 CHIDRO CC(C)OCCC[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000159825915 261195135 /nfs/dbraw/zinc/19/51/35/261195135.db2.gz NSPCLKSFBUZMAL-OAHLLOKOSA-N 1 0 290.432 3.637 20 70 CHIDRO C[C@H]([NH2+]CCSc1ccc(Cl)cc1)C1CCOCC1 ZINC000160088048 261204122 /nfs/dbraw/zinc/20/41/22/261204122.db2.gz ZNXJUEZFHNKXIE-LBPRGKRZSA-N 1 0 299.867 3.837 20 70 CHIDRO C[C@H]([NH2+]CCOc1cccc(Cl)c1)c1cncc(F)c1 ZINC000160259096 261209295 /nfs/dbraw/zinc/20/92/95/261209295.db2.gz QMVDFTRDUZNTHI-NSHDSACASA-N 1 0 294.757 3.604 20 70 CHIDRO CC1(C)C[C@@H]([NH2+]Cc2cccc(-c3cccnc3)c2)CCO1 ZINC000160460641 261214590 /nfs/dbraw/zinc/21/45/90/261214590.db2.gz YBRQGOVQYOJJNS-SFHVURJKSA-N 1 0 296.414 3.796 20 70 CHIDRO CC(C)c1ccc(C[N@H+](C)CC2=CCCOC2)cc1 ZINC000160668465 261222684 /nfs/dbraw/zinc/22/26/84/261222684.db2.gz HWDMJCOFVBQAHS-UHFFFAOYSA-N 1 0 259.393 3.589 20 70 CHIDRO C[C@@H]([NH2+][C@H](CCCO)c1ccccc1)C1CCCC1 ZINC000160877086 261229456 /nfs/dbraw/zinc/22/94/56/261229456.db2.gz DIKNJGZPSJPVMN-RHSMWYFYSA-N 1 0 261.409 3.669 20 70 CHIDRO CC[C@H]([NH3+])C(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000160983110 261233846 /nfs/dbraw/zinc/23/38/46/261233846.db2.gz XOQZINMOJYHATJ-LSDHHAIUSA-N 1 0 294.826 3.521 20 70 CHIDRO Cc1ccc([C@H](C)C[NH2+][C@H](C)c2cccnc2)cc1 ZINC000161052529 261235107 /nfs/dbraw/zinc/23/51/07/261235107.db2.gz CTKFEXDCMWPURP-HUUCEWRRSA-N 1 0 254.377 3.844 20 70 CHIDRO C[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccc(Cl)s1 ZINC000161448462 261247074 /nfs/dbraw/zinc/24/70/74/261247074.db2.gz ANMSOVPLBVMVNJ-AAEUAGOBSA-N 1 0 295.835 3.828 20 70 CHIDRO CSC[C@@H](CCO)[NH2+][C@@H](CC(C)C)c1cccs1 ZINC000160311242 261359136 /nfs/dbraw/zinc/35/91/36/261359136.db2.gz PKVLEPRVYOPOLA-OLZOCXBDSA-N 1 0 287.494 3.539 20 70 CHIDRO CSC[C@@H](C)[NH2+]Cc1cc(Cl)ccc1Cl ZINC000159637461 262363996 /nfs/dbraw/zinc/36/39/96/262363996.db2.gz ONMIYWJDDGLOOH-MRVPVSSYSA-N 1 0 264.221 3.835 20 70 CHIDRO CCCCN(C(=O)C[C@H]1CCC[NH2+]1)[C@@H](C)c1ccccc1 ZINC000160186159 264234832 /nfs/dbraw/zinc/23/48/32/264234832.db2.gz WFDFTJQJYXRLBS-DOTOQJQBSA-N 1 0 288.435 3.518 20 70 CHIDRO CCCCN(C(=O)C[C@H]1CCC[NH2+]1)[C@H](C)c1ccccc1 ZINC000160186316 264235017 /nfs/dbraw/zinc/23/50/17/264235017.db2.gz WFDFTJQJYXRLBS-NVXWUHKLSA-N 1 0 288.435 3.518 20 70 CHIDRO Cc1nn(C)cc1C[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000161406766 327678985 /nfs/dbraw/zinc/67/89/85/327678985.db2.gz PZWLXAVYQAGNRZ-UHFFFAOYSA-N 1 0 289.810 3.551 20 70 CHIDRO CCc1ccc([C@@H](CO)[NH2+]Cc2ccc(C)cc2C)cc1 ZINC000160796932 328086389 /nfs/dbraw/zinc/08/63/89/328086389.db2.gz YSHSQUCPTGXIQP-LJQANCHMSA-N 1 0 283.415 3.689 20 70 CHIDRO CCn1nc(C)c(C[N@H+](C)Cc2ccc(Cl)cc2)c1C ZINC000160808620 328087100 /nfs/dbraw/zinc/08/71/00/328087100.db2.gz ASDQEJHNLJKJKK-UHFFFAOYSA-N 1 0 291.826 3.805 20 70 CHIDRO O=C(C[NH2+][C@H]1CCC[C@H]1c1ccccc1)Nc1ccccc1 ZINC000160788413 328085500 /nfs/dbraw/zinc/08/55/00/328085500.db2.gz WAAWTHJNTVFCHR-ROUUACIJSA-N 1 0 294.398 3.551 20 70 CHIDRO CCCCOc1cccc(C[NH2+][C@H](CC)[C@H]2CCOC2)c1 ZINC000160830545 328088465 /nfs/dbraw/zinc/08/84/65/328088465.db2.gz SSJULHQFDRUCIJ-FUHWJXTLSA-N 1 0 291.435 3.770 20 70 CHIDRO COc1ccccc1/C=C/C[N@H+](C)Cc1ccc(C)o1 ZINC000160860826 328089474 /nfs/dbraw/zinc/08/94/74/328089474.db2.gz FDOOUOZTGAIVTK-SOFGYWHQSA-N 1 0 271.360 3.742 20 70 CHIDRO Cc1noc(C)c1CC[NH2+][C@@H](C)c1cc(C)ccc1C ZINC000160896385 328093375 /nfs/dbraw/zinc/09/33/75/328093375.db2.gz JAQMWTOJOBLWQL-ZDUSSCGKSA-N 1 0 272.392 3.802 20 70 CHIDRO CC1CC[NH+](C2CCC(NC(=O)OC(C)(C)C)CC2)CC1 ZINC000160957540 328097454 /nfs/dbraw/zinc/09/74/54/328097454.db2.gz XZLKCBLODYZNBZ-UHFFFAOYSA-N 1 0 296.455 3.554 20 70 CHIDRO C[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Cl)s1 ZINC000161034003 328120214 /nfs/dbraw/zinc/12/02/14/328120214.db2.gz NJGHDIDZJIHRAU-TUAOUCFPSA-N 1 0 286.872 3.925 20 70 CHIDRO COc1ccccc1[C@@H](C)[NH2+]C[C@@](C)(O)CCC(C)C ZINC000159368965 327174998 /nfs/dbraw/zinc/17/49/98/327174998.db2.gz PKFKNAGYLBHVRD-PBHICJAKSA-N 1 0 279.424 3.533 20 70 CHIDRO CCOCCC1(C[NH2+][C@H](C)c2ccccn2)CCCC1 ZINC000159376868 327175917 /nfs/dbraw/zinc/17/59/17/327175917.db2.gz MTKLOQZBCAASOU-OAHLLOKOSA-N 1 0 276.424 3.719 20 70 CHIDRO C[C@H]([NH2+]Cc1cn2ccccc2n1)c1cc2c(s1)CCC2 ZINC000159422766 327186209 /nfs/dbraw/zinc/18/62/09/327186209.db2.gz ZKDOGCHALRULMG-LBPRGKRZSA-N 1 0 297.427 3.735 20 70 CHIDRO CC[N@H+](CCc1nccs1)Cc1cc(C)ccc1C ZINC000159431697 327189591 /nfs/dbraw/zinc/18/95/91/327189591.db2.gz TUMRCEOXPQOWFH-UHFFFAOYSA-N 1 0 274.433 3.825 20 70 CHIDRO C[C@@H]([NH2+][C@H]1CCCSC1)c1cc2c(s1)CCC2 ZINC000159591416 327544730 /nfs/dbraw/zinc/54/47/30/327544730.db2.gz ZPHDSISATZTYNN-PWSUYJOCSA-N 1 0 267.463 3.783 20 70 CHIDRO C[C@H]([NH2+]CCCc1cccc(F)c1)c1cncs1 ZINC000159763932 327561907 /nfs/dbraw/zinc/56/19/07/327561907.db2.gz GIJYBTXIJNGTJW-NSHDSACASA-N 1 0 264.369 3.566 20 70 CHIDRO C[C@H](CCC(C)(C)C)NC(=O)CC[C@H]([NH3+])c1ccccc1 ZINC000159768777 327562365 /nfs/dbraw/zinc/56/23/65/327562365.db2.gz DOOXMJZBYUEJEU-ZBFHGGJFSA-N 1 0 290.451 3.798 20 70 CHIDRO C[C@H](CCC(C)(C)C)NC(=O)CC[C@@H]([NH3+])c1ccccc1 ZINC000159769040 327562390 /nfs/dbraw/zinc/56/23/90/327562390.db2.gz DOOXMJZBYUEJEU-GDBMZVCRSA-N 1 0 290.451 3.798 20 70 CHIDRO CC[C@H]([NH2+]CCC1CCN(CC(F)(F)F)CC1)C(C)C ZINC000160013560 327586557 /nfs/dbraw/zinc/58/65/57/327586557.db2.gz KMVGXRFYCCKOIG-AWEZNQCLSA-N 1 0 294.405 3.675 20 70 CHIDRO C[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc(Cl)c1 ZINC000161500013 329943026 /nfs/dbraw/zinc/94/30/26/329943026.db2.gz OQSKTIDFXXTYAT-BBRMVZONSA-N 1 0 289.806 3.767 20 70 CHIDRO Cc1ccccc1C1CC([NH2+][C@H]2CCOC(C)(C)C2)C1 ZINC000159964365 330855310 /nfs/dbraw/zinc/85/53/10/330855310.db2.gz AIDRLYPIPZKMDT-PCKAHOCUSA-N 1 0 273.420 3.788 20 70 CHIDRO CC(C)OCC[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000160032467 330857227 /nfs/dbraw/zinc/85/72/27/330857227.db2.gz GFOOKEPTLXJTNP-MRXNPFEDSA-N 1 0 272.392 3.560 20 70 CHIDRO CCCCOc1ccc(C[NH2+]CC2(CO)CCCC2)cc1 ZINC000160067165 330858054 /nfs/dbraw/zinc/85/80/54/330858054.db2.gz YCPRZLFBWOWBTF-UHFFFAOYSA-N 1 0 291.435 3.508 20 70 CHIDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)cc1F ZINC000160319082 330862977 /nfs/dbraw/zinc/86/29/77/330862977.db2.gz IJOHZACTWUCROD-TZMCWYRMSA-N 1 0 265.372 3.742 20 70 CHIDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccccc1F ZINC000160355860 330863313 /nfs/dbraw/zinc/86/33/13/330863313.db2.gz IFDIIELABGIOPC-HIFRSBDPSA-N 1 0 292.398 3.569 20 70 CHIDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cccnc1 ZINC000160881970 330878688 /nfs/dbraw/zinc/87/86/88/330878688.db2.gz UQRMNJSLNPDLTR-CYZMBNFOSA-N 1 0 272.314 3.853 20 70 CHIDRO C[C@@H]([NH2+]CCCOCc1ccccc1)c1ccccc1 ZINC000216774706 333117684 /nfs/dbraw/zinc/11/76/84/333117684.db2.gz JHANEMNBKYVZLG-MRXNPFEDSA-N 1 0 269.388 3.944 20 70 CHIDRO Clc1cccc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c1Cl ZINC000217638553 333122277 /nfs/dbraw/zinc/12/22/77/333122277.db2.gz BMWWXECHSJTAOP-KGLIPLIRSA-N 1 0 299.245 3.710 20 70 CHIDRO CC(C)c1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000217654705 333122559 /nfs/dbraw/zinc/12/25/59/333122559.db2.gz NSNUHDKMVLWVTK-MSOLQXFVSA-N 1 0 272.436 3.526 20 70 CHIDRO C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(Cl)cc1 ZINC000217655876 333122723 /nfs/dbraw/zinc/12/27/23/333122723.db2.gz JVDVZEQNDMISBO-RCBQFDQVSA-N 1 0 278.827 3.617 20 70 CHIDRO Cc1ccc([C@H](C)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)c1 ZINC000217679957 333122925 /nfs/dbraw/zinc/12/29/25/333122925.db2.gz BDFINFGRKQCJSI-SZMVWBNQSA-N 1 0 272.436 3.581 20 70 CHIDRO COc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCC[C@@H](C)C1)CCO2 ZINC000218003290 333125551 /nfs/dbraw/zinc/12/55/51/333125551.db2.gz NHMJVADSLGIOTG-IOASZLSFSA-N 1 0 275.392 3.687 20 70 CHIDRO Cc1ccc(C[NH2+]CC2(C)CC2)cc1Br ZINC000218119898 333127093 /nfs/dbraw/zinc/12/70/93/333127093.db2.gz CNFXXGHKXGVJDU-UHFFFAOYSA-N 1 0 268.198 3.647 20 70 CHIDRO CC[C@@H](C)[N@H+](C)Cc1nc2cc(Br)ccc2[nH]1 ZINC000160497305 522062584 /nfs/dbraw/zinc/06/25/84/522062584.db2.gz TYTOFQLESMMNTN-SECBINFHSA-N 1 0 296.212 3.556 20 70 CHIDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cnn(CC)c2)C1(CC)CC ZINC000161305850 520373047 /nfs/dbraw/zinc/37/30/47/520373047.db2.gz DBMDORLRVYRYLW-NUEKZKHPSA-N 1 0 293.455 3.537 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccccc1 ZINC000161446978 522610108 /nfs/dbraw/zinc/61/01/08/522610108.db2.gz UOZBFKXBBJQIBO-ROUUACIJSA-N 1 0 269.388 3.503 20 70 CHIDRO CC[C@H]([NH2+][C@@H]1CCCSC1)c1cccc(OC)c1 ZINC000159544751 522713025 /nfs/dbraw/zinc/71/30/25/522713025.db2.gz LKRVYTUIRVJZPP-HIFRSBDPSA-N 1 0 265.422 3.632 20 70 CHIDRO COCc1ccc(C[NH2+][C@@H]2CCCc3sccc32)o1 ZINC000160985995 522994328 /nfs/dbraw/zinc/99/43/28/522994328.db2.gz PLYUOTUDJXXPNS-CQSZACIVSA-N 1 0 277.389 3.655 20 70 CHIDRO C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1cncc(F)c1 ZINC000160992438 525421698 /nfs/dbraw/zinc/42/16/98/525421698.db2.gz RKNQUYDZTAATDQ-GXTWGEPZSA-N 1 0 270.351 3.601 20 70 CHIDRO Cc1ccc2c(c1)OCCC[C@H]2[NH2+][C@H]1CCCSC1 ZINC000159550168 526175921 /nfs/dbraw/zinc/17/59/21/526175921.db2.gz QHDIIAXZJJIRSY-DZGCQCFKSA-N 1 0 277.433 3.694 20 70 CHIDRO CC[N@H+](CCCCC(F)(F)F)CCc1nccs1 ZINC000159441331 261186195 /nfs/dbraw/zinc/18/61/95/261186195.db2.gz AKUSNQPQOHOJCZ-UHFFFAOYSA-N 1 0 280.359 3.740 20 70 CHIDRO CC(C)C[C@H]([NH2+][C@H]1CCCSC1)c1ccccn1 ZINC000159530825 261188192 /nfs/dbraw/zinc/18/81/92/261188192.db2.gz JDEPWKOKPONOFL-ZFWWWQNUSA-N 1 0 264.438 3.654 20 70 CHIDRO C[C@@H]([NH2+]CCOc1ccc(Cl)cc1)c1cncc(F)c1 ZINC000159640314 261190273 /nfs/dbraw/zinc/19/02/73/261190273.db2.gz SKLYDRCSOYILPB-LLVKDONJSA-N 1 0 294.757 3.604 20 70 CHIDRO C[C@H](C1CC1)[N@H+](Cc1ccc(CO)o1)Cc1ccccc1 ZINC000159678183 261191451 /nfs/dbraw/zinc/19/14/51/261191451.db2.gz HXTBRXFLMGLICO-CQSZACIVSA-N 1 0 285.387 3.573 20 70 CHIDRO COc1ccc([C@H]2CCCCC[N@@H+]2CCn2ccnc2)cc1 ZINC000159717296 261192296 /nfs/dbraw/zinc/19/22/96/261192296.db2.gz IPLLFVIFOIKYBS-GOSISDBHSA-N 1 0 299.418 3.509 20 70 CHIDRO Cc1ccc([C@@H](C)[NH2+][C@H](CCO)c2ccccc2)s1 ZINC000160932628 261232110 /nfs/dbraw/zinc/23/21/10/261232110.db2.gz IZCFFCTZBAIWKX-UKRRQHHQSA-N 1 0 275.417 3.831 20 70 CHIDRO OC[C@@H](C[NH2+][C@H]1CCSc2ccccc21)c1ccccc1 ZINC000161453249 261246666 /nfs/dbraw/zinc/24/66/66/261246666.db2.gz ABOZSSDSJKTXSS-WBVHZDCISA-N 1 0 299.439 3.589 20 70 CHIDRO CC(C)[C@@H](C)[NH2+]Cc1ccc(N2CCCCCC2)nc1 ZINC000160525725 327618781 /nfs/dbraw/zinc/61/87/81/327618781.db2.gz UNZUGEASONVVFG-OAHLLOKOSA-N 1 0 275.440 3.596 20 70 CHIDRO C[C@H]([NH2+]CC(C)(C)O)c1cccc(-c2ccccc2)c1 ZINC000160587332 327630146 /nfs/dbraw/zinc/63/01/46/327630146.db2.gz AARZOYUAZSZPQN-AWEZNQCLSA-N 1 0 269.388 3.775 20 70 CHIDRO CC[C@@H]([NH2+][C@@H]1CCCSC1)c1cc(F)ccc1F ZINC000159553920 327645750 /nfs/dbraw/zinc/64/57/50/327645750.db2.gz LSNZMSARYOOMBX-BXUZGUMPSA-N 1 0 271.376 3.901 20 70 CHIDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)C(C)C)cc1OC ZINC000159947000 327653278 /nfs/dbraw/zinc/65/32/78/327653278.db2.gz WSZSMGUWYBKARR-OLZOCXBDSA-N 1 0 265.397 3.789 20 70 CHIDRO CCc1ccc([C@H](CO)[NH2+]Cc2cccc(Cl)c2)cc1 ZINC000160811425 328086981 /nfs/dbraw/zinc/08/69/81/328086981.db2.gz QSNCXSZTBFFFHN-KRWDZBQOSA-N 1 0 289.806 3.726 20 70 CHIDRO C[C@@H]1C[N@H+](Cc2cnc3ccccn23)[C@@H]1c1ccccc1 ZINC000160875487 328091064 /nfs/dbraw/zinc/09/10/64/328091064.db2.gz DBXUZARVDGOOLW-KDOFPFPSSA-N 1 0 277.371 3.527 20 70 CHIDRO Cc1ccc(-c2nnc([C@@H](C)[N@H+](C)CC3CC3)o2)cc1C ZINC000160911146 328093983 /nfs/dbraw/zinc/09/39/83/328093983.db2.gz KWWQNEBKJXQUEF-CYBMUJFWSA-N 1 0 285.391 3.756 20 70 CHIDRO CC(C)[C@H](C)[NH2+][C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000161128783 328135529 /nfs/dbraw/zinc/13/55/29/328135529.db2.gz CZCUGSOKZOGTPY-SJCJKPOMSA-N 1 0 275.392 3.543 20 70 CHIDRO CCC[C@@H]([NH2+]CCc1nc(C)c(C)s1)c1ccccn1 ZINC000159387730 327176541 /nfs/dbraw/zinc/17/65/41/327176541.db2.gz HOYHBDXZQWMNBJ-CQSZACIVSA-N 1 0 289.448 3.828 20 70 CHIDRO COc1ccc([C@H](C)[NH2+]C[C@](C)(O)CCC(C)C)cc1 ZINC000159419534 327183914 /nfs/dbraw/zinc/18/39/14/327183914.db2.gz QXCRESYWPXOQDW-WMLDXEAASA-N 1 0 279.424 3.533 20 70 CHIDRO CCSc1ccc([C@@H](C)[NH2+]C[C@](C)(O)CC)cc1 ZINC000159432424 327189564 /nfs/dbraw/zinc/18/95/64/327189564.db2.gz LKFQWCKPEBXKIX-IUODEOHRSA-N 1 0 267.438 3.610 20 70 CHIDRO C[C@H](CCc1cccc(F)c1)[NH2+][C@@H]1CCCSC1 ZINC000159573644 327539972 /nfs/dbraw/zinc/53/99/72/327539972.db2.gz FGWXHQJQPSQMRM-IUODEOHRSA-N 1 0 267.413 3.632 20 70 CHIDRO CCCC(=O)Nc1cccc(C[NH2+][C@H](C)C2(C)CC2)c1 ZINC000159924706 327578821 /nfs/dbraw/zinc/57/88/21/327578821.db2.gz WNJNPEWFSGHHRU-CYBMUJFWSA-N 1 0 274.408 3.703 20 70 CHIDRO CCCc1ccccc1NC(=O)c1ccc(C[NH+](C)C)cc1 ZINC000160028642 327587286 /nfs/dbraw/zinc/58/72/86/327587286.db2.gz XINMWOQNJLXIBR-UHFFFAOYSA-N 1 0 296.414 3.953 20 70 CHIDRO Cc1cccc2c1CC[C@H]2[NH2+]Cc1ccc(OC(C)C)nc1 ZINC000160043286 327588578 /nfs/dbraw/zinc/58/85/78/327588578.db2.gz QOMPUBNMCDTUIT-GOSISDBHSA-N 1 0 296.414 3.954 20 70 CHIDRO CCC(CC)C[NH2+][C@H]1CCc2ccc(OC)cc2C1 ZINC000159557269 330848877 /nfs/dbraw/zinc/84/88/77/330848877.db2.gz NPWLFFOVRLUNAM-INIZCTEOSA-N 1 0 261.409 3.578 20 70 CHIDRO CCc1c2ccccc2oc1[C@H](C)[NH2+]CCc1cnn(C)c1 ZINC000159761326 330851097 /nfs/dbraw/zinc/85/10/97/330851097.db2.gz ZUNSWYQGIQGBAA-ZDUSSCGKSA-N 1 0 297.402 3.622 20 70 CHIDRO CCO[C@H]1C[C@H]([NH2+][C@H](C)c2ccccc2)C12CCC2 ZINC000159796310 330851511 /nfs/dbraw/zinc/85/15/11/330851511.db2.gz GVVDXFFSLBYMJC-KBMXLJTQSA-N 1 0 259.393 3.685 20 70 CHIDRO Cc1c2ccccc2oc1[C@H](C)[NH2+]CCC(C)(C)O ZINC000159799993 330851561 /nfs/dbraw/zinc/85/15/61/330851561.db2.gz ANJHZAJBDQZXGO-LBPRGKRZSA-N 1 0 261.365 3.553 20 70 CHIDRO CCCCO[C@H]1C[C@@H]([NH2+][C@@H](C)c2cncc(F)c2)C1(C)C ZINC000159795448 330851587 /nfs/dbraw/zinc/85/15/87/330851587.db2.gz UIPOYTWBSZYHKZ-MAZHCROVSA-N 1 0 294.414 3.855 20 70 CHIDRO CC1(C)C[C@H]([NH2+]C2CC(c3ccccc3F)C2)CCO1 ZINC000159926074 330854432 /nfs/dbraw/zinc/85/44/32/330854432.db2.gz WIMTWTJGDBZRAF-ROKHWSDSSA-N 1 0 277.383 3.619 20 70 CHIDRO CC[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(F)cc1 ZINC000159979032 330856057 /nfs/dbraw/zinc/85/60/57/330856057.db2.gz LODOBQDJWDIGOM-HUUCEWRRSA-N 1 0 265.372 3.824 20 70 CHIDRO C[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cnc2ccsc2c1 ZINC000159991864 330856625 /nfs/dbraw/zinc/85/66/25/330856625.db2.gz TWGYUIDWWPDACA-YPMHNXCESA-N 1 0 290.432 3.905 20 70 CHIDRO OCC1(C[NH2+]C2CC(c3ccccc3Cl)C2)CCCC1 ZINC000160078037 330858378 /nfs/dbraw/zinc/85/83/78/330858378.db2.gz HNRQRMZDJGGLMB-UHFFFAOYSA-N 1 0 293.838 3.728 20 70 CHIDRO CCCCCOc1ccc(C[NH2+][C@@]2(C)CCOC2)cc1 ZINC000160183428 330860367 /nfs/dbraw/zinc/86/03/67/330860367.db2.gz NLBIGNNWTZGXIM-KRWDZBQOSA-N 1 0 277.408 3.524 20 70 CHIDRO C[C@H]([NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccncc1 ZINC000160946681 330880736 /nfs/dbraw/zinc/88/07/36/330880736.db2.gz KSGSMZSSTOMERD-UHTWSYAYSA-N 1 0 272.314 3.853 20 70 CHIDRO CC[C@@H](C)N(C)CC[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000217836183 333124319 /nfs/dbraw/zinc/12/43/19/333124319.db2.gz MEZMBKAICMDTOP-WLYUNCDWSA-N 1 0 294.870 3.906 20 70 CHIDRO C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cccc2cc[nH]c21 ZINC000218077881 333126657 /nfs/dbraw/zinc/12/66/57/333126657.db2.gz ZZILQELHFNPOJW-HNNXBMFYSA-N 1 0 285.435 3.522 20 70 CHIDRO CCN(CCC[NH+]1CCCCC1)[C@H](C)c1cccc(O)c1 ZINC000161397506 521014578 /nfs/dbraw/zinc/01/45/78/521014578.db2.gz BUAVJBUXJZKTPQ-MRXNPFEDSA-N 1 0 290.451 3.651 20 70 CHIDRO CCS[C@H]1CCC[C@H]([NH2+][C@H](CC)c2cnn(C)c2)C1 ZINC000159377165 521731930 /nfs/dbraw/zinc/73/19/30/521731930.db2.gz UBPQVXQTFAUOBS-SOUVJXGZSA-N 1 0 281.469 3.525 20 70 CHIDRO CC[C@@H]([NH2+][C@@H](C)COC)c1cccc(Cl)c1F ZINC000161469353 522909665 /nfs/dbraw/zinc/90/96/65/522909665.db2.gz QQPDQLBMZAOKCX-JOYOIKCWSA-N 1 0 259.752 3.555 20 70 CHIDRO C[C@@H]1CCC[C@@H](C)C1[NH2+][C@@H](CCCO)c1ccccc1 ZINC000160822752 524271518 /nfs/dbraw/zinc/27/15/18/524271518.db2.gz QRYPHCNYPWYUDI-INMHGKMJSA-N 1 0 275.436 3.915 20 70 CHIDRO CC(C)C[C@H]([NH2+]CCC(C)(C)O)c1cccs1 ZINC000159651042 261190391 /nfs/dbraw/zinc/19/03/91/261190391.db2.gz YGYKHFBECQDHGA-LBPRGKRZSA-N 1 0 255.427 3.586 20 70 CHIDRO CC(C)Oc1ccc(C[NH2+][C@H]2CCc3ccccc32)cn1 ZINC000160048882 261202569 /nfs/dbraw/zinc/20/25/69/261202569.db2.gz FWGACJUNJZMLKA-KRWDZBQOSA-N 1 0 282.387 3.646 20 70 CHIDRO C[C@H]([NH2+]CCSc1ccc(Cl)cc1)c1cnccn1 ZINC000160063249 261203540 /nfs/dbraw/zinc/20/35/40/261203540.db2.gz BINZYSMIZAEEMS-NSHDSACASA-N 1 0 293.823 3.573 20 70 CHIDRO c1ccc2c(N[C@@H]3CCO[C@H](C4CC4)C3)cc[nH+]c2c1 ZINC000160319214 261210988 /nfs/dbraw/zinc/21/09/88/261210988.db2.gz MKVPZVQONRPXCO-DYVFJYSZSA-N 1 0 268.360 3.604 20 70 CHIDRO Cc1ccc(OC(F)F)c(C[NH2+][C@@H]2CCOC(C)(C)C2)c1 ZINC000160432287 261214597 /nfs/dbraw/zinc/21/45/97/261214597.db2.gz SDWSLJPVYHMHLE-CYBMUJFWSA-N 1 0 299.361 3.644 20 70 CHIDRO CCCOc1cccc(C[NH2+][C@H](C)c2cnn(CC)c2)c1 ZINC000160476978 261215258 /nfs/dbraw/zinc/21/52/58/261215258.db2.gz BRLKOLIHAYNXEQ-CQSZACIVSA-N 1 0 287.407 3.543 20 70 CHIDRO C/C(=C/c1ccccc1)C[NH2+][C@H]1CCOC(C)(C)C1 ZINC000160631819 261220635 /nfs/dbraw/zinc/22/06/35/261220635.db2.gz ICUKKJCDPLPDJW-QBOMHBFWSA-N 1 0 259.393 3.637 20 70 CHIDRO OCCC[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000160671856 261222109 /nfs/dbraw/zinc/22/21/09/261222109.db2.gz ZNBALKLUXYKURO-MOPGFXCFSA-N 1 0 299.389 3.916 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@@H](C)c2cncc(F)c2)n1 ZINC000160693929 261223248 /nfs/dbraw/zinc/22/32/48/261223248.db2.gz QVSCGQYKRPMBGK-LBPRGKRZSA-N 1 0 293.411 3.659 20 70 CHIDRO OCCC[C@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1 ZINC000160732479 261224929 /nfs/dbraw/zinc/22/49/29/261224929.db2.gz VUARVEZDMGQGTB-OALUTQOASA-N 1 0 281.399 3.777 20 70 CHIDRO Cc1ccc([C@H](C)[NH2+][C@H](CCCO)c2ccccc2)o1 ZINC000160889539 261230408 /nfs/dbraw/zinc/23/04/08/261230408.db2.gz IWVZBUCEYSQXGX-GOEBONIOSA-N 1 0 273.376 3.752 20 70 CHIDRO Cc1ccc([C@H](C)C[NH2+][C@@H](C)c2cccnc2)cc1 ZINC000161052287 261235286 /nfs/dbraw/zinc/23/52/86/261235286.db2.gz CTKFEXDCMWPURP-CABCVRRESA-N 1 0 254.377 3.844 20 70 CHIDRO CC(C)CCn1cccc1C[NH2+][C@H]1CCOC(C)(C)C1 ZINC000160485398 327615232 /nfs/dbraw/zinc/61/52/32/327615232.db2.gz XPAOPLYQOFPHMO-HNNXBMFYSA-N 1 0 278.440 3.581 20 70 CHIDRO CCc1nc(C)c([C@@H](C)[NH2+]C[C@@H]2CCCCN2CC)s1 ZINC000161163160 327915974 /nfs/dbraw/zinc/91/59/74/327915974.db2.gz KSWAXPPLZMOWKY-OCCSQVGLSA-N 1 0 295.496 3.539 20 70 CHIDRO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccc(NC(N)=O)cc2)c1 ZINC000160704734 327974306 /nfs/dbraw/zinc/97/43/06/327974306.db2.gz QOKIMXNDXYGAIU-CQSZACIVSA-N 1 0 297.402 3.645 20 70 CHIDRO CCCCOc1cccc(C[NH2+][C@@H](C)C2CCOCC2)c1 ZINC000160837451 328088089 /nfs/dbraw/zinc/08/80/89/328088089.db2.gz GOJMUQKIQSGNPE-HNNXBMFYSA-N 1 0 291.435 3.770 20 70 CHIDRO Cc1nc2ccccn2c1C[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000160875820 328090978 /nfs/dbraw/zinc/09/09/78/328090978.db2.gz RGEGFOKMHLXBIJ-IFXJQAMLSA-N 1 0 291.398 3.836 20 70 CHIDRO COc1ccc(COCCC[NH2+][C@H](C(C)C)C2CC2)cc1 ZINC000161101312 328129589 /nfs/dbraw/zinc/12/95/89/328129589.db2.gz CPLJENWKLRIKLF-GOSISDBHSA-N 1 0 291.435 3.626 20 70 CHIDRO C[N@H+](Cc1cccc(Cl)c1)Cc1cccc2c[nH]nc21 ZINC000161129819 328135484 /nfs/dbraw/zinc/13/54/84/328135484.db2.gz WRTHKVYMDVSSJA-UHFFFAOYSA-N 1 0 285.778 3.848 20 70 CHIDRO CN(C)[C@@H](C[NH2+]Cc1cccc2cc[nH]c21)c1cccs1 ZINC000218070128 328179849 /nfs/dbraw/zinc/17/98/49/328179849.db2.gz PVBCPFUACRNBHI-HNNXBMFYSA-N 1 0 299.443 3.622 20 70 CHIDRO COc1ccc([C@H](C)[C@@H](C)[NH2+][C@@H]2CCCSC2)cc1 ZINC000159605645 327546472 /nfs/dbraw/zinc/54/64/72/327546472.db2.gz LWAJDNKMDKUWEZ-UMVBOHGHSA-N 1 0 279.449 3.672 20 70 CHIDRO CC(C)Oc1ccc(C[NH2+][C@H]2c3ccccc3C[C@H]2C)cn1 ZINC000160056629 327590044 /nfs/dbraw/zinc/59/00/44/327590044.db2.gz XPJPAYLIGXTJDO-AUUYWEPGSA-N 1 0 296.414 3.892 20 70 CHIDRO CC[C@H]([NH2+]CCOc1ccc(C(C)C)cc1)[C@H]1CCOC1 ZINC000160341351 327606163 /nfs/dbraw/zinc/60/61/63/327606163.db2.gz GJBCCNYYYKYANK-WMZOPIPTSA-N 1 0 291.435 3.594 20 70 CHIDRO Cc1cc([C@H](C)[NH2+]C[C@H](CO)c2ccccc2)c(C)s1 ZINC000161430089 329933686 /nfs/dbraw/zinc/93/36/86/329933686.db2.gz JQXBECJLHDFKDO-XJKSGUPXSA-N 1 0 289.444 3.792 20 70 CHIDRO Cc1cccc([C@@H](C)[NH2+]C[C@H](CO)c2ccccc2)c1C ZINC000161439564 329934319 /nfs/dbraw/zinc/93/43/19/329934319.db2.gz DOWQZRVSFWCEKG-SJLPKXTDSA-N 1 0 283.415 3.730 20 70 CHIDRO CCOC(CC[NH2+]Cc1cccc2ccccc21)OCC ZINC000159544195 330848766 /nfs/dbraw/zinc/84/87/66/330848766.db2.gz BYKFSFOVZDTEMO-UHFFFAOYSA-N 1 0 287.403 3.719 20 70 CHIDRO CCSCC[C@@H](C)[NH2+][C@H]1CCc2ccc(OC)cc2C1 ZINC000159566121 330849020 /nfs/dbraw/zinc/84/90/20/330849020.db2.gz YPXDTHQDARVXCJ-CJNGLKHVSA-N 1 0 293.476 3.674 20 70 CHIDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2)C12CCC2 ZINC000159796193 330851503 /nfs/dbraw/zinc/85/15/03/330851503.db2.gz GVVDXFFSLBYMJC-VNQPRFMTSA-N 1 0 259.393 3.685 20 70 CHIDRO Cc1cc(C)cc([C@H](C)[NH2+][C@H]2CCOC(C)(C)C2)c1 ZINC000159943949 330854733 /nfs/dbraw/zinc/85/47/33/330854733.db2.gz OQURYYXYKQFQFP-HOCLYGCPSA-N 1 0 261.409 3.912 20 70 CHIDRO C[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1cc(F)cc(F)c1 ZINC000159944666 330854773 /nfs/dbraw/zinc/85/47/73/330854773.db2.gz PALSPLXMPYTQRM-IINYFYTJSA-N 1 0 269.335 3.573 20 70 CHIDRO CC[C@H]([NH2+][C@@H](C)c1cc2ccccc2o1)[C@H]1CCOC1 ZINC000159951168 330854902 /nfs/dbraw/zinc/85/49/02/330854902.db2.gz CLFHYUJGTXBMNS-QEJZJMRPSA-N 1 0 273.376 3.899 20 70 CHIDRO C[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(OC(F)F)cc1 ZINC000159951935 330855060 /nfs/dbraw/zinc/85/50/60/330855060.db2.gz FMUSBLRSSNHUKX-DGCLKSJQSA-N 1 0 299.361 3.896 20 70 CHIDRO CN(C)C1(C[NH2+]C2CC(c3ccccc3F)C2)CCCC1 ZINC000160671051 330873475 /nfs/dbraw/zinc/87/34/75/330873475.db2.gz DQOGONAVJVDBOY-UHFFFAOYSA-N 1 0 290.426 3.536 20 70 CHIDRO Clc1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)c(Cl)c1 ZINC000217652104 333122478 /nfs/dbraw/zinc/12/24/78/333122478.db2.gz GDBLIUAEURIKKO-GJZGRUSLSA-N 1 0 299.245 3.710 20 70 CHIDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cccc(OC(F)F)c1 ZINC000218049271 333126070 /nfs/dbraw/zinc/12/60/70/333126070.db2.gz QZJCQWARZVBCGP-NILFDRSVSA-N 1 0 299.361 3.896 20 70 CHIDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000218059050 333126374 /nfs/dbraw/zinc/12/63/74/333126374.db2.gz BKDOHBDNVLHQKS-COLVAYQJSA-N 1 0 269.335 3.573 20 70 CHIDRO C[C@H](CCc1ccco1)[NH2+]Cc1cccc2cc[nH]c21 ZINC000218073461 333126628 /nfs/dbraw/zinc/12/66/28/333126628.db2.gz DAUIWEDIHQGESM-CYBMUJFWSA-N 1 0 268.360 3.872 20 70 CHIDRO COc1cccc(CC[NH2+]Cc2cccc3[nH]ccc32)c1 ZINC000218112840 333127022 /nfs/dbraw/zinc/12/70/22/333127022.db2.gz MZFVYJQPGFCEQL-UHFFFAOYSA-N 1 0 280.371 3.509 20 70 CHIDRO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]Cc1cn2ccccc2n1 ZINC000218581322 333133419 /nfs/dbraw/zinc/13/34/19/333133419.db2.gz BLNAJHRCVKDEDS-PVAVHDDUSA-N 1 0 285.435 3.885 20 70 CHIDRO CCOc1ccccc1[C@H](C)[NH2+][C@H](CCO)c1ccccc1 ZINC000161076446 521585398 /nfs/dbraw/zinc/58/53/98/521585398.db2.gz HRHJPELTZSPGKY-MAUKXSAKSA-N 1 0 299.414 3.860 20 70 CHIDRO CCc1nc(C)c([C@@H](C)N[C@@H]2CCC[C@H]([NH+](C)C)C2)s1 ZINC000161012002 522225924 /nfs/dbraw/zinc/22/59/24/522225924.db2.gz HNAAZHSHGACBCJ-BNOWGMLFSA-N 1 0 295.496 3.537 20 70 CHIDRO CCc1nnc(C[NH2+][C@@H](c2cccs2)C(CC)CC)[nH]1 ZINC000160378164 522349102 /nfs/dbraw/zinc/34/91/02/522349102.db2.gz IDTRFLYZWRXUJQ-OAHLLOKOSA-N 1 0 292.452 3.696 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H]1CCCC[C@@H]1O)c1cc(F)ccc1F ZINC000160506743 522617198 /nfs/dbraw/zinc/61/71/98/522617198.db2.gz WKUYLPULVHJZDZ-UVBJJODRSA-N 1 0 283.362 3.557 20 70 CHIDRO CC[C@H]([NH2+]C[C@H]1CCCO1)c1cccc(Cl)c1F ZINC000161485592 522633304 /nfs/dbraw/zinc/63/33/04/522633304.db2.gz JCEDKWIIYXBWES-MFKMUULPSA-N 1 0 271.763 3.699 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccccc1 ZINC000161447337 522860555 /nfs/dbraw/zinc/86/05/55/522860555.db2.gz UOZBFKXBBJQIBO-QZTJIDSGSA-N 1 0 269.388 3.503 20 70 CHIDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1cccc(NC(C)=O)c1 ZINC000161412123 523060859 /nfs/dbraw/zinc/06/08/59/523060859.db2.gz IMLFEOKSEJGRKM-DOTOQJQBSA-N 1 0 274.408 3.703 20 70 CHIDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CCCCn1ccnc1C ZINC000161425295 523196032 /nfs/dbraw/zinc/19/60/32/523196032.db2.gz PORRTESZQROWBW-CVEARBPZSA-N 1 0 263.429 3.530 20 70 CHIDRO C[C@@H]([NH2+]CCCc1nc2c(s1)CCCC2)c1ccco1 ZINC000160620338 525444466 /nfs/dbraw/zinc/44/44/66/525444466.db2.gz LYDREKBUYWEGQH-GFCCVEGCSA-N 1 0 290.432 3.898 20 70 CHIDRO COc1ccc(CC[NH2+]Cc2coc3ccccc23)cc1 ZINC000161062536 260821597 /nfs/dbraw/zinc/82/15/97/260821597.db2.gz HUBOMHNPLNEHDZ-UHFFFAOYSA-N 1 0 281.355 3.774 20 70 CHIDRO CCC(CC)(CO)C[NH2+][C@@H](C)c1cc(C)ccc1C ZINC000161463270 260976431 /nfs/dbraw/zinc/97/64/31/260976431.db2.gz MXILBHVNLOYWLQ-HNNXBMFYSA-N 1 0 263.425 3.753 20 70 CHIDRO C[C@H]([NH2+][C@H]1CCCc2cc(F)ccc21)c1cccnc1 ZINC000159536867 261188200 /nfs/dbraw/zinc/18/82/00/261188200.db2.gz CBHAIDGDEWRYAB-SJCJKPOMSA-N 1 0 270.351 3.949 20 70 CHIDRO CC[C@H]([NH2+]Cc1cn(C)nc1C(F)(F)F)c1ccccc1 ZINC000159783009 261194119 /nfs/dbraw/zinc/19/41/19/261194119.db2.gz GIDDCTKARVZGLU-ZDUSSCGKSA-N 1 0 297.324 3.680 20 70 CHIDRO Brc1cc2cccnc2c(C[NH+]2CCCC2)c1 ZINC000161078729 261235996 /nfs/dbraw/zinc/23/59/96/261235996.db2.gz LLSFVTPQTYRKBC-UHFFFAOYSA-N 1 0 291.192 3.593 20 70 CHIDRO Cc1ncc([C@H](C)[NH2+]CC2(c3ccc(F)cc3)CC2)c(C)n1 ZINC000161358070 261245577 /nfs/dbraw/zinc/24/55/77/261245577.db2.gz NHOVBXKMIPFBCJ-LBPRGKRZSA-N 1 0 299.393 3.615 20 70 CHIDRO CCCCOc1ccc(CC[NH2+][C@@H](C)c2cnccn2)cc1 ZINC000161390098 261246034 /nfs/dbraw/zinc/24/60/34/261246034.db2.gz NCWAWGFNFYJPRW-HNNXBMFYSA-N 1 0 299.418 3.549 20 70 CHIDRO Fc1ccc2c(N[C@H]3CCO[C@@H](C4CC4)C3)cc[nH+]c2c1 ZINC000160444046 264244052 /nfs/dbraw/zinc/24/40/52/264244052.db2.gz MJOJVVLFYYIRII-SUMWQHHRSA-N 1 0 286.350 3.743 20 70 CHIDRO C[C@H]([NH2+]CC(C)(C)O)c1ccc(-c2cccs2)cc1 ZINC000160595513 327630650 /nfs/dbraw/zinc/63/06/50/327630650.db2.gz AEALHZPZNBKOTI-LBPRGKRZSA-N 1 0 275.417 3.837 20 70 CHIDRO CCc1ccc([C@H](CO)[NH2+]Cc2cc(C)ccc2C)cc1 ZINC000160787048 328085396 /nfs/dbraw/zinc/08/53/96/328085396.db2.gz DHLZWOLRWSEEAP-IBGZPJMESA-N 1 0 283.415 3.689 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2cccc(C)c2)o1 ZINC000160858161 328089276 /nfs/dbraw/zinc/08/92/76/328089276.db2.gz SOYQYYGEZBVVEU-UHFFFAOYSA-N 1 0 295.386 3.919 20 70 CHIDRO CC[N@H+](Cc1ccccn1)[C@H](C)c1cccc(C)c1 ZINC000161042808 328121560 /nfs/dbraw/zinc/12/15/60/328121560.db2.gz URPVWSNVDBJEIO-OAHLLOKOSA-N 1 0 254.377 3.973 20 70 CHIDRO CC[C@@H]([NH2+]Cc1cccc(C(=O)N[C@@H](C)CC)c1)C(C)C ZINC000161103062 328131872 /nfs/dbraw/zinc/13/18/72/328131872.db2.gz VGXQIOPCSOZFGQ-WMLDXEAASA-N 1 0 290.451 3.739 20 70 CHIDRO CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@@H](CC)C(C)C)c1 ZINC000161102865 328131900 /nfs/dbraw/zinc/13/19/00/328131900.db2.gz VGXQIOPCSOZFGQ-YOEHRIQHSA-N 1 0 290.451 3.739 20 70 CHIDRO CC[N@H+](CCCc1ccccc1C)CCc1nccs1 ZINC000159373359 327175306 /nfs/dbraw/zinc/17/53/06/327175306.db2.gz KWSXKYNTJIXAHE-UHFFFAOYSA-N 1 0 288.460 3.949 20 70 CHIDRO CCC[C@H]([NH2+]CCc1nc(C)c(C)s1)c1ccccn1 ZINC000159387609 327176451 /nfs/dbraw/zinc/17/64/51/327176451.db2.gz HOYHBDXZQWMNBJ-AWEZNQCLSA-N 1 0 289.448 3.828 20 70 CHIDRO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccco1 ZINC000160198433 327528922 /nfs/dbraw/zinc/52/89/22/327528922.db2.gz YYCKJVZKVVZJQN-FZMZJTMJSA-N 1 0 257.333 3.626 20 70 CHIDRO CCc1ccc([C@@H](C)NC2CC(C)(C)[NH2+]C(C)(C)C2)o1 ZINC000159641458 327548822 /nfs/dbraw/zinc/54/88/22/327548822.db2.gz RFDOOFPDVRTLQU-GFCCVEGCSA-N 1 0 278.440 3.802 20 70 CHIDRO CCCC(=O)Nc1cccc(C[NH2+][C@H](CC)C(C)C)c1 ZINC000159915038 327578319 /nfs/dbraw/zinc/57/83/19/327578319.db2.gz RAEHZPXRLSBVBH-MRXNPFEDSA-N 1 0 276.424 3.949 20 70 CHIDRO CCCOc1ccc([C@@H](C)[NH2+][C@@H](C)CC)cc1OC ZINC000159999398 327585736 /nfs/dbraw/zinc/58/57/36/327585736.db2.gz IQNLNBGLHYDYGK-QWHCGFSZSA-N 1 0 265.397 3.933 20 70 CHIDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)cn1 ZINC000161432648 329934062 /nfs/dbraw/zinc/93/40/62/329934062.db2.gz HVKDZGXUFYNRQB-BXUZGUMPSA-N 1 0 252.789 3.793 20 70 CHIDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H](O)C1)c1ccc(Cl)c(F)c1 ZINC000218258668 330439999 /nfs/dbraw/zinc/43/99/99/330439999.db2.gz QDWGAHLTTNZQBD-GMXVVIOVSA-N 1 0 285.790 3.681 20 70 CHIDRO COc1ccc([C@@H]([NH2+][C@H]2CCOC(C)(C)C2)C2CC2)cc1 ZINC000159980857 330855926 /nfs/dbraw/zinc/85/59/26/330855926.db2.gz LNDFBTZRDWPOLD-RDJZCZTQSA-N 1 0 289.419 3.694 20 70 CHIDRO COc1ccc([C@H]([NH2+][C@@H]2CCOC(C)(C)C2)C2CC2)cc1 ZINC000159980499 330856064 /nfs/dbraw/zinc/85/60/64/330856064.db2.gz LNDFBTZRDWPOLD-NVXWUHKLSA-N 1 0 289.419 3.694 20 70 CHIDRO CCn1cc([C@@H](C)[NH2+][C@H](C)c2cccc(C)c2)cn1 ZINC000160165223 330859924 /nfs/dbraw/zinc/85/99/24/330859924.db2.gz KKIVZJKNZSLLOA-ZIAGYGMSSA-N 1 0 257.381 3.623 20 70 CHIDRO C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)[C@@H]1CCCO1 ZINC000217964724 333125250 /nfs/dbraw/zinc/12/52/50/333125250.db2.gz YUCMSQBXCSLXQD-UVBJJODRSA-N 1 0 279.811 3.948 20 70 CHIDRO COc1ccc([C@@H]([NH2+]CCOc2ccccc2)C2CC2)cc1 ZINC000218197015 333129345 /nfs/dbraw/zinc/12/93/45/333129345.db2.gz LSBQLLSPNJBOSS-IBGZPJMESA-N 1 0 297.398 3.815 20 70 CHIDRO Cn1cccc1[C@@H]1CCC[N@@H+]1C/C=C/c1ccccc1 ZINC000218754905 333135770 /nfs/dbraw/zinc/13/57/70/333135770.db2.gz DTSDPEUERGBHMB-DNXKIMQPSA-N 1 0 266.388 3.875 20 70 CHIDRO CCCCCC[C@@H](C)CC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000161389257 520113521 /nfs/dbraw/zinc/11/35/21/520113521.db2.gz DKYDNEWVXYNHLO-VPSFDDGASA-N 1 0 294.483 3.724 20 70 CHIDRO CC[C@H]([NH2+]C[C@H]1CCO[C@@H]1C(C)C)c1ccccc1OC ZINC000160889838 522633239 /nfs/dbraw/zinc/63/32/39/522633239.db2.gz SOFNDOOHMFCFMU-UWWQBHOKSA-N 1 0 291.435 3.797 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1F ZINC000160560189 522852596 /nfs/dbraw/zinc/85/25/96/522852596.db2.gz JVYAQTDVXINURF-XZJROXQQSA-N 1 0 283.362 3.557 20 70 CHIDRO CC[C@@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1OC ZINC000161119275 522948335 /nfs/dbraw/zinc/94/83/35/522948335.db2.gz BGOFVSHJUGRCOK-YQQAZPJKSA-N 1 0 290.451 3.609 20 70 CHIDRO CC[C@H]1CCC[N@H+](Cc2csc(C3CC3)n2)C1 ZINC000161400514 523092698 /nfs/dbraw/zinc/09/26/98/523092698.db2.gz WEYWKNGWALNBHW-NSHDSACASA-N 1 0 250.411 3.643 20 70 CHIDRO CCc1ccc([C@@H](C)[NH2+]CCCc2nc(C(C)C)no2)o1 ZINC000160827061 524025047 /nfs/dbraw/zinc/02/50/47/524025047.db2.gz JDELUSRQCOHDRC-GFCCVEGCSA-N 1 0 291.395 3.632 20 70 CHIDRO CCc1ccc([C@H](C)[NH2+]CCCc2nc(C(C)C)no2)o1 ZINC000160827205 524045342 /nfs/dbraw/zinc/04/53/42/524045342.db2.gz JDELUSRQCOHDRC-LBPRGKRZSA-N 1 0 291.395 3.632 20 70 CHIDRO C[C@H](C[C@H]1CCCO1)[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000161269733 524650698 /nfs/dbraw/zinc/65/06/98/524650698.db2.gz LBLLXLVOTWTEBO-XNRPHZJLSA-N 1 0 293.382 3.587 20 70 CHIDRO C[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1ccc2c(c1)CCC2 ZINC000160985869 525668592 /nfs/dbraw/zinc/66/85/92/525668592.db2.gz VLTNQNZTKMDLHQ-FOIQADDNSA-N 1 0 295.426 3.950 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@H](C)C2CCCC2)n1 ZINC000160703057 526340197 /nfs/dbraw/zinc/34/01/97/526340197.db2.gz UFVXWUZBHDGTGT-CYBMUJFWSA-N 1 0 266.454 3.943 20 70 CHIDRO Cc1nc(-c2cc([C@@H](C)[NH2+]CC(C)(C)O)cs2)cs1 ZINC000160617044 526562290 /nfs/dbraw/zinc/56/22/90/526562290.db2.gz SBXQZVGWUZJXGG-SECBINFHSA-N 1 0 296.461 3.602 20 70 CHIDRO C[C@@H]([NH2+][C@@H]1CCCSC1)c1cc(F)c(F)c(F)c1 ZINC000159570931 261188895 /nfs/dbraw/zinc/18/88/95/261188895.db2.gz AMJOLWBAVPKWQN-PSASIEDQSA-N 1 0 275.339 3.650 20 70 CHIDRO Cc1nn(C)cc1C[N@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000159671175 261190954 /nfs/dbraw/zinc/19/09/54/261190954.db2.gz COWKGCHFMHPSHE-HNNXBMFYSA-N 1 0 283.419 3.529 20 70 CHIDRO C[C@@H]([NH2+]CCSc1ccc(Cl)cc1)c1cnccn1 ZINC000160063393 261203775 /nfs/dbraw/zinc/20/37/75/261203775.db2.gz BINZYSMIZAEEMS-LLVKDONJSA-N 1 0 293.823 3.573 20 70 CHIDRO C[C@@H]([NH2+]CCOc1cccc(Cl)c1)c1cncc(F)c1 ZINC000160259250 261209318 /nfs/dbraw/zinc/20/93/18/261209318.db2.gz QMVDFTRDUZNTHI-LLVKDONJSA-N 1 0 294.757 3.604 20 70 CHIDRO O[C@H]1CCCC[C@@H]1C[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000160443905 261213966 /nfs/dbraw/zinc/21/39/66/261213966.db2.gz WJJMGAPBTVKRCJ-DFBGVHRSSA-N 1 0 295.423 3.503 20 70 CHIDRO OCCC[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000160671982 261222643 /nfs/dbraw/zinc/22/26/43/261222643.db2.gz ZNBALKLUXYKURO-OALUTQOASA-N 1 0 299.389 3.916 20 70 CHIDRO CCn1cc([C@@H](C)[NH2+]CCSc2ccc(C)cc2)cn1 ZINC000160742796 261225199 /nfs/dbraw/zinc/22/51/99/261225199.db2.gz INELWUDHHDHRIH-CQSZACIVSA-N 1 0 289.448 3.654 20 70 CHIDRO Fc1ccc2c(N[C@H]3CCO[C@H](C4CC4)C3)cc[nH+]c2c1 ZINC000160443787 264244270 /nfs/dbraw/zinc/24/42/70/264244270.db2.gz MJOJVVLFYYIRII-GUYCJALGSA-N 1 0 286.350 3.743 20 70 CHIDRO CC[C@H]([NH2+]CCCCc1nc(C)cs1)C(C)C ZINC000160687622 327971760 /nfs/dbraw/zinc/97/17/60/327971760.db2.gz ZAPDUIGAXQOAKV-ZDUSSCGKSA-N 1 0 254.443 3.798 20 70 CHIDRO C[N@H+](Cc1ccc(Cl)cc1)Cc1cccc2c[nH]nc21 ZINC000160808331 328087052 /nfs/dbraw/zinc/08/70/52/328087052.db2.gz VKQQSBAMQSWCTP-UHFFFAOYSA-N 1 0 285.778 3.848 20 70 CHIDRO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)nc1 ZINC000160781612 328084022 /nfs/dbraw/zinc/08/40/22/328084022.db2.gz DKCZZULQNPZJJT-CYBMUJFWSA-N 1 0 258.340 3.722 20 70 CHIDRO Cc1ccccc1C[C@H](C)[NH2+][C@H](C)CC(F)(F)F ZINC000160774817 328084077 /nfs/dbraw/zinc/08/40/77/328084077.db2.gz NKMFTMORGGLIBY-NWDGAFQWSA-N 1 0 259.315 3.857 20 70 CHIDRO CC(C)=CCC[C@H](C)[NH2+][C@H](CCO)c1ccccc1 ZINC000160987715 328113824 /nfs/dbraw/zinc/11/38/24/328113824.db2.gz NUYKAOGLCFLBNL-DOTOQJQBSA-N 1 0 261.409 3.835 20 70 CHIDRO C[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Cl)s1 ZINC000161034288 328120142 /nfs/dbraw/zinc/12/01/42/328120142.db2.gz NJGHDIDZJIHRAU-SRVKXCTJSA-N 1 0 286.872 3.925 20 70 CHIDRO Cc1ccccc1C[C@H](C)[NH2+][C@H](CCO)c1ccccc1 ZINC000161044924 328121616 /nfs/dbraw/zinc/12/16/16/328121616.db2.gz PBVHZVLONKNLDA-QFBILLFUSA-N 1 0 283.415 3.639 20 70 CHIDRO c1ccc(-c2ccccc2OCC[NH2+][C@@H]2CCSC2)cc1 ZINC000161090170 328128714 /nfs/dbraw/zinc/12/87/14/328128714.db2.gz IUCOTCDLKDQNPO-MRXNPFEDSA-N 1 0 299.439 3.828 20 70 CHIDRO CC[C@@H](C)[NH2+]CCc1ccc(OC(F)(F)F)cc1 ZINC000161163428 328138257 /nfs/dbraw/zinc/13/82/57/328138257.db2.gz GMVUZZVSOAHADA-SNVBAGLBSA-N 1 0 261.287 3.516 20 70 CHIDRO CCOCCC1(C[NH2+][C@@H](C)c2ccccn2)CCCC1 ZINC000159376728 327175946 /nfs/dbraw/zinc/17/59/46/327175946.db2.gz MTKLOQZBCAASOU-HNNXBMFYSA-N 1 0 276.424 3.719 20 70 CHIDRO Cc1cc(C)cc(CC[NH2+][C@@H](C)c2cnn(C(C)C)c2)c1 ZINC000159506605 327391465 /nfs/dbraw/zinc/39/14/65/327391465.db2.gz NZTUPZZTCWEAOJ-INIZCTEOSA-N 1 0 285.435 3.974 20 70 CHIDRO CCc1ccc([C@H](C)[NH2+]CC(CC)(CC)CO)cc1 ZINC000161398084 327541381 /nfs/dbraw/zinc/54/13/81/327541381.db2.gz AETGYXYAESDBNH-AWEZNQCLSA-N 1 0 263.425 3.698 20 70 CHIDRO CC[C@@H]([NH2+]CCSc1ccc(Cl)cc1)[C@@H]1CCOC1 ZINC000160081208 327591709 /nfs/dbraw/zinc/59/17/09/327591709.db2.gz PAZOSRQLXSUPGX-IUODEOHRSA-N 1 0 299.867 3.837 20 70 CHIDRO C[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccc(Cl)c1 ZINC000161500342 329942943 /nfs/dbraw/zinc/94/29/43/329942943.db2.gz OQSKTIDFXXTYAT-CZUORRHYSA-N 1 0 289.806 3.767 20 70 CHIDRO COc1ccc([C@H]([NH2+][C@H]2CCOC(C)(C)C2)C2CC2)cc1 ZINC000159980627 330855964 /nfs/dbraw/zinc/85/59/64/330855964.db2.gz LNDFBTZRDWPOLD-DOTOQJQBSA-N 1 0 289.419 3.694 20 70 CHIDRO Fc1cc(Cl)cc(C[NH2+]CCOc2ccccc2)c1 ZINC000160918198 330879331 /nfs/dbraw/zinc/87/93/31/330879331.db2.gz PPYBBBPZGUVYDT-UHFFFAOYSA-N 1 0 279.742 3.648 20 70 CHIDRO CCc1ccc([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000217668283 333122482 /nfs/dbraw/zinc/12/24/82/333122482.db2.gz FYWAVYUZVAJWCB-QGTPRVQTSA-N 1 0 272.436 3.526 20 70 CHIDRO Cc1ccc([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1C ZINC000217662093 333122728 /nfs/dbraw/zinc/12/27/28/333122728.db2.gz HENHVGIBNBVROP-JQHSSLGASA-N 1 0 272.436 3.581 20 70 CHIDRO CC[C@@H]([NH2+]Cc1cccc2cc[nH]c21)c1nccs1 ZINC000217821804 333124008 /nfs/dbraw/zinc/12/40/08/333124008.db2.gz SAIGEPRREFBANE-CYBMUJFWSA-N 1 0 271.389 3.865 20 70 CHIDRO C[C@@H](CCc1ccco1)[NH2+]Cc1cccc2cc[nH]c21 ZINC000218073372 333126470 /nfs/dbraw/zinc/12/64/70/333126470.db2.gz DAUIWEDIHQGESM-ZDUSSCGKSA-N 1 0 268.360 3.872 20 70 CHIDRO CCC[C@@H](C)C(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000161488006 520608968 /nfs/dbraw/zinc/60/89/68/520608968.db2.gz GCRKLIQWKJIXNA-KLAILNCOSA-N 1 0 294.483 3.582 20 70 CHIDRO CC[NH+](CC)[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1 ZINC000160570097 520830845 /nfs/dbraw/zinc/83/08/45/520830845.db2.gz YBDMFERHPZTUSL-ZDUSSCGKSA-N 1 0 273.380 3.756 20 70 CHIDRO CC[C@@H]([NH2+]CC(C)(C)O)c1ccc2cc(OC)ccc2c1 ZINC000160614440 522818496 /nfs/dbraw/zinc/81/84/96/522818496.db2.gz GDLCHIXJHDAPFC-QGZVFWFLSA-N 1 0 287.403 3.660 20 70 CHIDRO C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1cncs1 ZINC000160969791 525421347 /nfs/dbraw/zinc/42/13/47/525421347.db2.gz BORNZYQHDFIJHJ-WCQYABFASA-N 1 0 258.390 3.524 20 70 CHIDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)nc1)C1(C)CC1 ZINC000160504014 525526304 /nfs/dbraw/zinc/52/63/04/525526304.db2.gz MRARURVJXUZWRA-OAHLLOKOSA-N 1 0 287.451 3.596 20 70 CHIDRO COc1ccc2cc(C[NH2+][C@@H]3CCOC(C)(C)C3)ccc2c1 ZINC000160474180 525632102 /nfs/dbraw/zinc/63/21/02/525632102.db2.gz FMCFRDGVHFIZBY-QGZVFWFLSA-N 1 0 299.414 3.896 20 70 CHIDRO CCC(CC)C[NH2+][C@@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000159430249 261186310 /nfs/dbraw/zinc/18/63/10/261186310.db2.gz UEYQBBHUELEKQN-ZDUSSCGKSA-N 1 0 297.464 3.567 20 70 CHIDRO C[C@@H]([NH2+]CCC1Cc2ccccc2C1)c1ccncc1 ZINC000159739351 261193103 /nfs/dbraw/zinc/19/31/03/261193103.db2.gz VHHKVYOTEPOJHJ-CQSZACIVSA-N 1 0 266.388 3.537 20 70 CHIDRO Cc1ccccc1[C@@H](C)[NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000159815830 261194977 /nfs/dbraw/zinc/19/49/77/261194977.db2.gz LWEYICIQNMAVPD-MWQQHZPXSA-N 1 0 259.393 3.603 20 70 CHIDRO Cc1ccc(OC(F)F)c(C[NH2+][C@H]2CCOC(C)(C)C2)c1 ZINC000160432388 261214582 /nfs/dbraw/zinc/21/45/82/261214582.db2.gz SDWSLJPVYHMHLE-ZDUSSCGKSA-N 1 0 299.361 3.644 20 70 CHIDRO Cc1ccc([C@@H](C)[NH2+][C@@H](CCCO)c2ccccc2)o1 ZINC000160889129 261230370 /nfs/dbraw/zinc/23/03/70/261230370.db2.gz IWVZBUCEYSQXGX-ZBFHGGJFSA-N 1 0 273.376 3.752 20 70 CHIDRO COc1ccc(COCCC[NH2+][C@H](C)c2ccco2)cc1 ZINC000161091392 261235981 /nfs/dbraw/zinc/23/59/81/261235981.db2.gz WJQTWZVJDSRXPG-CQSZACIVSA-N 1 0 289.375 3.546 20 70 CHIDRO CCCCOc1ccc(CC[NH2+][C@H](C)c2cnccn2)cc1 ZINC000161390236 261246149 /nfs/dbraw/zinc/24/61/49/261246149.db2.gz NCWAWGFNFYJPRW-OAHLLOKOSA-N 1 0 299.418 3.549 20 70 CHIDRO CC[C@H]([NH2+]CCCn1ccnc1)c1cccc(Cl)c1F ZINC000161473852 261247480 /nfs/dbraw/zinc/24/74/80/261247480.db2.gz SVSSXMYJVQZPRC-AWEZNQCLSA-N 1 0 295.789 3.807 20 70 CHIDRO CCCCC[N@H+](Cc1cnn(C)c1)Cc1ccc(F)cc1 ZINC000216721511 262046749 /nfs/dbraw/zinc/04/67/49/262046749.db2.gz YKCOZENSOPTIAA-UHFFFAOYSA-N 1 0 289.398 3.752 20 70 CHIDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccccc1OC(F)F ZINC000218203278 263088344 /nfs/dbraw/zinc/08/83/44/263088344.db2.gz HIXMQLGFUWWCQZ-NJZAAPMLSA-N 1 0 299.361 3.896 20 70 CHIDRO C[C@@H]([NH3+])C(=O)Nc1cccc(CSC2CCCCC2)c1 ZINC000161030169 264269732 /nfs/dbraw/zinc/26/97/32/264269732.db2.gz GBWORMQCQMKXSJ-GFCCVEGCSA-N 1 0 292.448 3.538 20 70 CHIDRO CCC(CC)(C[NH3+])C(=O)Nc1ccc(OC(C)(C)C)cc1 ZINC000161195416 264272546 /nfs/dbraw/zinc/27/25/46/264272546.db2.gz UNNKTCZQAKPRDM-UHFFFAOYSA-N 1 0 292.423 3.568 20 70 CHIDRO CC[C@H]([NH2+]CC1(Sc2ccccc2)CC1)[C@H]1CCOC1 ZINC000160499958 327616173 /nfs/dbraw/zinc/61/61/73/327616173.db2.gz JPKFALAOWHYWGU-HOCLYGCPSA-N 1 0 291.460 3.716 20 70 CHIDRO CC1(C)C[C@@H]([NH2+]Cc2ccccc2OCC2CC2)CCO1 ZINC000160574699 327626826 /nfs/dbraw/zinc/62/68/26/327626826.db2.gz PSSOWWKTWCCCIE-INIZCTEOSA-N 1 0 289.419 3.523 20 70 CHIDRO Cc1ccsc1[C@H](C)[NH2+]Cc1cn2ccccc2n1 ZINC000159418241 327643539 /nfs/dbraw/zinc/64/35/39/327643539.db2.gz BSIWBAQPSPXDOH-LBPRGKRZSA-N 1 0 271.389 3.555 20 70 CHIDRO CC(=O)Nc1ccc(CC[NH2+][C@@H](C)c2ccccc2C)cc1 ZINC000159451853 327644058 /nfs/dbraw/zinc/64/40/58/327644058.db2.gz YBJWNVIKCLXAKO-HNNXBMFYSA-N 1 0 296.414 3.847 20 70 CHIDRO C[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CCC(C)(C)O1 ZINC000160259875 327992670 /nfs/dbraw/zinc/99/26/70/327992670.db2.gz BVNXBVXFNQFKLL-ZBFHGGJFSA-N 1 0 261.409 3.555 20 70 CHIDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]CC[S@@](=O)c1ccccc1 ZINC000160777223 328084012 /nfs/dbraw/zinc/08/40/12/328084012.db2.gz UOXFTLYVEDAYKC-ZWOKBUDYSA-N 1 0 293.476 3.599 20 70 CHIDRO CCc1ccc([C@@H](CO)[NH2+]Cc2cc(C)ccc2C)cc1 ZINC000160786925 328085491 /nfs/dbraw/zinc/08/54/91/328085491.db2.gz DHLZWOLRWSEEAP-LJQANCHMSA-N 1 0 283.415 3.689 20 70 CHIDRO CCOc1cccc(C[N@H+](C)Cc2ccc(C)o2)c1 ZINC000160841391 328088008 /nfs/dbraw/zinc/08/80/08/328088008.db2.gz JMJGUAZNYJMNNX-UHFFFAOYSA-N 1 0 259.349 3.619 20 70 CHIDRO CCCCOc1cccc(C[NH2+][C@@H](CC)[C@@H]2CCOC2)c1 ZINC000160830162 328088460 /nfs/dbraw/zinc/08/84/60/328088460.db2.gz SSJULHQFDRUCIJ-AEFFLSMTSA-N 1 0 291.435 3.770 20 70 CHIDRO CC(C)n1cc([C@@H](C)[NH2+]C[C@H]2CCc3ccccc32)cn1 ZINC000161000448 328116310 /nfs/dbraw/zinc/11/63/10/328116310.db2.gz FLJUPNJUWKZPNB-GDBMZVCRSA-N 1 0 283.419 3.845 20 70 CHIDRO CC(C)[C@@H](C)[NH2+][C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000161128419 328135623 /nfs/dbraw/zinc/13/56/23/328135623.db2.gz CZCUGSOKZOGTPY-SJKOYZFVSA-N 1 0 275.392 3.543 20 70 CHIDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc1 ZINC000161126283 328134235 /nfs/dbraw/zinc/13/42/35/328134235.db2.gz WZTRFVSULVPTKM-XIRDDKMYSA-N 1 0 260.425 3.518 20 70 CHIDRO COCc1ccc(C[N@H+](C)Cc2ccc(F)cc2)cc1 ZINC000161145024 328136900 /nfs/dbraw/zinc/13/69/00/328136900.db2.gz VTFKWJWLGWDXIG-UHFFFAOYSA-N 1 0 273.351 3.604 20 70 CHIDRO c1cc2cccc(C[NH2+]CCOC3CCCCC3)c2[nH]1 ZINC000218156728 328216848 /nfs/dbraw/zinc/21/68/48/328216848.db2.gz MUJGFTYDVXNWDA-UHFFFAOYSA-N 1 0 272.392 3.607 20 70 CHIDRO Cc1c(C[NH2+]C2c3ccccc3-c3ccccc32)cnn1C ZINC000159607327 330849534 /nfs/dbraw/zinc/84/95/34/330849534.db2.gz ORMMDIZYVOVYII-UHFFFAOYSA-N 1 0 289.382 3.588 20 70 CHIDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CCOC(C)(C)C1)CC2 ZINC000159962639 330855262 /nfs/dbraw/zinc/85/52/62/330855262.db2.gz OYAICVDGDCHINO-GOEBONIOSA-N 1 0 259.393 3.530 20 70 CHIDRO Cc1c2ccccc2oc1[C@H](C)[NH2+]CC1(CO)CCCC1 ZINC000160072859 330858416 /nfs/dbraw/zinc/85/84/16/330858416.db2.gz FNWVXCUMGPASKC-AWEZNQCLSA-N 1 0 287.403 3.945 20 70 CHIDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)cc1F ZINC000160318947 330862930 /nfs/dbraw/zinc/86/29/30/330862930.db2.gz IJOHZACTWUCROD-JSGCOSHPSA-N 1 0 265.372 3.742 20 70 CHIDRO C[C@H](CC[NH2+]CC1(N(C)C)CCCC1)c1ccccc1 ZINC000160717177 330873935 /nfs/dbraw/zinc/87/39/35/330873935.db2.gz AWSASSNDZZYNHB-MRXNPFEDSA-N 1 0 274.452 3.644 20 70 CHIDRO Cc1ccccc1C[C@H](C)[NH2+][C@@H](C)c1cncc(F)c1 ZINC000160769419 330874481 /nfs/dbraw/zinc/87/44/81/330874481.db2.gz CAWHGVWSGFFFBN-KBPBESRZSA-N 1 0 272.367 3.811 20 70 CHIDRO Cc1cc([C@H](C)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)s1 ZINC000217629255 333122229 /nfs/dbraw/zinc/12/22/29/333122229.db2.gz AMUZHDNYEXBXGX-RCBQFDQVSA-N 1 0 278.465 3.642 20 70 CHIDRO Cn1ncc2c1CCC[C@@H]2[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000217995115 333125554 /nfs/dbraw/zinc/12/55/54/333125554.db2.gz HKLLHMQTGYNSOO-JYJNAYRXSA-N 1 0 289.467 3.992 20 70 CHIDRO C[C@@H](Cc1cccs1)[NH2+]Cc1cccc2cc[nH]c21 ZINC000218090247 333126815 /nfs/dbraw/zinc/12/68/15/333126815.db2.gz OACCKSHXJLRDQK-LBPRGKRZSA-N 1 0 270.401 3.950 20 70 CHIDRO CCC1CCC([NH2+]CCc2ccccc2OC)CC1 ZINC000218594499 333133653 /nfs/dbraw/zinc/13/36/53/333133653.db2.gz ZUCQTHQKJZVEHR-UHFFFAOYSA-N 1 0 261.409 3.796 20 70 CHIDRO CC(=O)Nc1ccccc1C[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC000160352831 519750451 /nfs/dbraw/zinc/75/04/51/519750451.db2.gz OXTYKXDEVYNPNO-ZFWWWQNUSA-N 1 0 274.408 3.561 20 70 CHIDRO CCC[C@@H](CC)[NH2+]Cc1cncc(Br)c1 ZINC000160572625 520686965 /nfs/dbraw/zinc/68/69/65/520686965.db2.gz XOSMWAXPWMDGCV-GFCCVEGCSA-N 1 0 271.202 3.512 20 70 CHIDRO CC[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1F ZINC000160560301 522633013 /nfs/dbraw/zinc/63/30/13/522633013.db2.gz JVYAQTDVXINURF-RLCCDNCMSA-N 1 0 283.362 3.557 20 70 CHIDRO CC[C@@H]([NH2+]CCCCc1nc(C)cs1)C1CC1 ZINC000160707158 522825542 /nfs/dbraw/zinc/82/55/42/522825542.db2.gz PYMCBBJYQRKJSX-CYBMUJFWSA-N 1 0 252.427 3.552 20 70 CHIDRO CC[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1ccccc1OC ZINC000161081254 522943233 /nfs/dbraw/zinc/94/32/33/522943233.db2.gz KXTNUNIBOWYFGD-QZTJIDSGSA-N 1 0 299.414 3.860 20 70 CHIDRO CC[C@H]1CCCC[C@@H]1[NH2+]CCCCn1ccnc1C ZINC000161425426 523042119 /nfs/dbraw/zinc/04/21/19/523042119.db2.gz PORRTESZQROWBW-HOTGVXAUSA-N 1 0 263.429 3.530 20 70 CHIDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000161427158 523062000 /nfs/dbraw/zinc/06/20/00/523062000.db2.gz NFWKTSZISWXZAM-MBNYWOFBSA-N 1 0 282.453 3.909 20 70 CHIDRO CN1CCC([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000161480164 523778493 /nfs/dbraw/zinc/77/84/93/523778493.db2.gz OEQYWJFINBMSRL-QGZVFWFLSA-N 1 0 292.854 3.791 20 70 CHIDRO COc1ccc([C@H](CCC(C)C)[NH2+]CC(C)(C)O)cc1 ZINC000160592000 525349725 /nfs/dbraw/zinc/34/97/25/525349725.db2.gz MKVRFFJCOIFQQG-INIZCTEOSA-N 1 0 279.424 3.533 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@H](C)C(C)(C)C)n1 ZINC000160697104 526339692 /nfs/dbraw/zinc/33/96/92/526339692.db2.gz SVKVEWIRESKMSX-GFCCVEGCSA-N 1 0 254.443 3.798 20 70 CHIDRO Cc1ccsc1[C@@H](C)[NH2+]C[C@@](C)(O)c1ccsc1 ZINC000159982092 261201264 /nfs/dbraw/zinc/20/12/64/261201264.db2.gz AKJYDMHBJKBBIS-BXUZGUMPSA-N 1 0 281.446 3.676 20 70 CHIDRO CC1(C)C[C@H]([NH2+]Cc2ccc(-c3ccccc3)o2)CCO1 ZINC000160597195 261218938 /nfs/dbraw/zinc/21/89/38/261218938.db2.gz ZIZLSSFLBBYNSM-OAHLLOKOSA-N 1 0 285.387 3.994 20 70 CHIDRO CC(C)(O)C[NH2+][C@@H]1CCCSc2ccc(Cl)cc21 ZINC000160632847 261220864 /nfs/dbraw/zinc/22/08/64/261220864.db2.gz CVTFBHYTZKBZLZ-GFCCVEGCSA-N 1 0 285.840 3.628 20 70 CHIDRO COCc1ccc(CN(C)Cc2ccccc2Cl)o1 ZINC000160815782 261227008 /nfs/dbraw/zinc/22/70/08/261227008.db2.gz JTMIJUCQSZPMJB-UHFFFAOYSA-N 1 0 279.767 3.711 20 70 CHIDRO Cc1ccc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)cn1 ZINC000161281920 261243116 /nfs/dbraw/zinc/24/31/16/261243116.db2.gz JGZAPSIRKVKFOP-HNNXBMFYSA-N 1 0 270.376 3.786 20 70 CHIDRO CC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000159986088 262459113 /nfs/dbraw/zinc/45/91/13/262459113.db2.gz JSWDHENCHUMZBL-JKSUJKDBSA-N 1 0 261.409 3.555 20 70 CHIDRO Cc1ccc2[nH+]ccc(N[C@H]3CCO[C@@H](C4CC4)C3)c2c1 ZINC000160394512 264243437 /nfs/dbraw/zinc/24/34/37/264243437.db2.gz XYEYPLMNFGCMER-KBXCAEBGSA-N 1 0 282.387 3.913 20 70 CHIDRO Cc1cc(N[C@H]2CCO[C@H](C3CC3)C2)c2ccccc2[nH+]1 ZINC000160418180 264243906 /nfs/dbraw/zinc/24/39/06/264243906.db2.gz RLFVEOVMRGBUJY-KSSFIOAISA-N 1 0 282.387 3.913 20 70 CHIDRO CC1(C)C[C@H](Nc2cc[nH+]c3cc(F)ccc23)CCO1 ZINC000160696727 264256138 /nfs/dbraw/zinc/25/61/38/264256138.db2.gz KPSFPDZWXMAUBW-GFCCVEGCSA-N 1 0 274.339 3.743 20 70 CHIDRO Cc1ccn2c(C[NH2+][C@@H]3CCCc4sccc43)cnc2c1 ZINC000160982564 328113428 /nfs/dbraw/zinc/11/34/28/328113428.db2.gz MCDKZYFCIXGDIH-OAHLLOKOSA-N 1 0 297.427 3.871 20 70 CHIDRO CCSc1ccc([C@H](C)[NH2+]C[C@@](C)(O)CC)cc1 ZINC000159432059 327189364 /nfs/dbraw/zinc/18/93/64/327189364.db2.gz LKFQWCKPEBXKIX-WFASDCNBSA-N 1 0 267.438 3.610 20 70 CHIDRO C[C@@H](CCc1ccccc1F)[NH2+][C@@H]1CCCSC1 ZINC000159580564 327542276 /nfs/dbraw/zinc/54/22/76/327542276.db2.gz YUBFBPVFHWYMJD-GXTWGEPZSA-N 1 0 267.413 3.632 20 70 CHIDRO COc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H]1CCCSC1 ZINC000159633780 327548295 /nfs/dbraw/zinc/54/82/95/327548295.db2.gz QKBQFOSORUWFPG-CMPLNLGQSA-N 1 0 285.840 3.895 20 70 CHIDRO c1sc2ccccc2c1C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000159682863 327554171 /nfs/dbraw/zinc/55/41/71/327554171.db2.gz PNSKUOYCPHWJEG-UAGQMJEPSA-N 1 0 299.439 3.949 20 70 CHIDRO CC(C)n1cc([C@H](C)[NH2+]CCCc2cccc(F)c2)cn1 ZINC000159805578 327566402 /nfs/dbraw/zinc/56/64/02/327566402.db2.gz MTEIHPLIDRSTSM-AWEZNQCLSA-N 1 0 289.398 3.887 20 70 CHIDRO Cc1ccccc1OCC[NH2+][C@@H](C)c1ccccc1F ZINC000216625079 329295390 /nfs/dbraw/zinc/29/53/90/329295390.db2.gz DVYKWQDSGJVFGE-AWEZNQCLSA-N 1 0 273.351 3.864 20 70 CHIDRO CCC[C@H](CCO)C[NH2+][C@@H](C)c1ccc(Cl)c(F)c1 ZINC000218264622 330439266 /nfs/dbraw/zinc/43/92/66/330439266.db2.gz PGWCFIMXSJTJHB-NWDGAFQWSA-N 1 0 287.806 3.928 20 70 CHIDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C)cc1C ZINC000218717203 330459465 /nfs/dbraw/zinc/45/94/65/330459465.db2.gz VEQRDFDOSWWUFQ-JLJPHGGASA-N 1 0 288.435 3.799 20 70 CHIDRO CCSc1ccc([C@@H](C)[NH2+][C@H]2CCCC[C@@H]2O)cc1 ZINC000159514012 330848534 /nfs/dbraw/zinc/84/85/34/330848534.db2.gz SDVPMCNAAIDBPM-KCXAZCMYSA-N 1 0 279.449 3.753 20 70 CHIDRO CCC(CC)C[NH2+][C@@H]1CCc2ccc(OC)cc2C1 ZINC000159557135 330849007 /nfs/dbraw/zinc/84/90/07/330849007.db2.gz NPWLFFOVRLUNAM-MRXNPFEDSA-N 1 0 261.409 3.578 20 70 CHIDRO CC[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc2c(c1)CCO2 ZINC000159921910 330854300 /nfs/dbraw/zinc/85/43/00/330854300.db2.gz DCOSJBTWWGZORB-JKSUJKDBSA-N 1 0 289.419 3.620 20 70 CHIDRO CC(C)OCC[NH2+][C@H]1CCCc2c3ccccc3[nH]c21 ZINC000160032616 330857312 /nfs/dbraw/zinc/85/73/12/330857312.db2.gz GFOOKEPTLXJTNP-INIZCTEOSA-N 1 0 272.392 3.560 20 70 CHIDRO CC1(C)CC[C@H](C[NH2+][C@H]2CCCc3ccccc32)O1 ZINC000160217641 330861500 /nfs/dbraw/zinc/86/15/00/330861500.db2.gz YTLRRLPCDLDCAA-ZBFHGGJFSA-N 1 0 259.393 3.611 20 70 CHIDRO CCCCCC[C@@H](C)[NH2+][C@H]1CCCc2[nH]c(=O)ccc21 ZINC000160983571 330882526 /nfs/dbraw/zinc/88/25/26/330882526.db2.gz OSQQOODNXCTASF-HIFRSBDPSA-N 1 0 276.424 3.701 20 70 CHIDRO CCc1ccc([C@H](C)[NH2+][C@H]2CCN3CCCC[C@@H]23)s1 ZINC000217775273 333123495 /nfs/dbraw/zinc/12/34/95/333123495.db2.gz NYDVDAPFLDYGOX-QEJZJMRPSA-N 1 0 278.465 3.588 20 70 CHIDRO c1cc2cccc(C[NH2+]CCCOC3CCCCC3)c2[nH]1 ZINC000218080580 333126642 /nfs/dbraw/zinc/12/66/42/333126642.db2.gz ITEBCMZKCCEWNI-UHFFFAOYSA-N 1 0 286.419 3.997 20 70 CHIDRO CN(C)C1(C[NH2+]Cc2cccc3cc[nH]c32)CCCCC1 ZINC000218072452 333126644 /nfs/dbraw/zinc/12/66/44/333126644.db2.gz PHBREKCBQQNHQN-UHFFFAOYSA-N 1 0 285.435 3.522 20 70 CHIDRO CCC(CC)[C@H](C[NH2+]Cc1cccc2cc[nH]c21)N(C)C ZINC000218100866 333126864 /nfs/dbraw/zinc/12/68/64/333126864.db2.gz MDKHMKSVKLNONW-KRWDZBQOSA-N 1 0 287.451 3.624 20 70 CHIDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccco2)C12CCCC2 ZINC000160765787 520376308 /nfs/dbraw/zinc/37/63/08/520376308.db2.gz KCWAHDBUUNJHMW-BPLDGKMQSA-N 1 0 263.381 3.668 20 70 CHIDRO CCC[C@@H]([NH2+]CC(CC)(CC)CO)c1ccccc1 ZINC000161440072 520770669 /nfs/dbraw/zinc/77/06/69/520770669.db2.gz HJIKAKNYOYYUOT-MRXNPFEDSA-N 1 0 263.425 3.916 20 70 CHIDRO CC[N@H+](Cc1cnc2ccccn12)[C@@H](C)c1cccc(O)c1 ZINC000160531187 521434068 /nfs/dbraw/zinc/43/40/68/521434068.db2.gz VMDCWUSBQXPVEA-AWEZNQCLSA-N 1 0 295.386 3.623 20 70 CHIDRO CC[C@H](Cc1ccccc1)[NH2+][C@H](CCO)c1ccccc1 ZINC000161054353 522316503 /nfs/dbraw/zinc/31/65/03/522316503.db2.gz XTMFVMBNUZUKJZ-RTBURBONSA-N 1 0 283.415 3.721 20 70 CHIDRO CC[C@H]([NH2+]CC(C)(C)O)c1ccc2cc(OC)ccc2c1 ZINC000160614329 522568664 /nfs/dbraw/zinc/56/86/64/522568664.db2.gz GDLCHIXJHDAPFC-KRWDZBQOSA-N 1 0 287.403 3.660 20 70 CHIDRO CN1CCC([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000161480271 523778372 /nfs/dbraw/zinc/77/83/72/523778372.db2.gz OEQYWJFINBMSRL-KRWDZBQOSA-N 1 0 292.854 3.791 20 70 CHIDRO Cc1ccc(C[NH2+][C@H]2CCC[C@H]2c2ccccc2)cn1 ZINC000161285727 524609395 /nfs/dbraw/zinc/60/93/95/524609395.db2.gz KFPYYYQLNHOGKO-ROUUACIJSA-N 1 0 266.388 3.816 20 70 CHIDRO C[C@@H]([NH2+]CCCc1nc2c(s1)CCCC2)C1(C)CC1 ZINC000160624591 525444428 /nfs/dbraw/zinc/44/44/28/525444428.db2.gz YOBWJPXUVBXQPV-GFCCVEGCSA-N 1 0 278.465 3.733 20 70 CHIDRO Cc1ccc(C)c(OCC[N@H+](Cc2cccnc2)C2CC2)c1 ZINC000216711104 227380506 /nfs/dbraw/zinc/38/05/06/227380506.db2.gz YDLFFACPWXUGDH-UHFFFAOYSA-N 1 0 296.414 3.742 20 70 CHIDRO CC(C)[C@@H](c1ccccc1Cl)[N@H+](C)CCn1cccn1 ZINC000217181661 260077857 /nfs/dbraw/zinc/07/78/57/260077857.db2.gz HAZYHXLMNQKBMB-INIZCTEOSA-N 1 0 291.826 3.866 20 70 CHIDRO Fc1ccc2c(c1)[C@H]([NH2+][C@H]1CCCSC1)CCCO2 ZINC000159549507 261188186 /nfs/dbraw/zinc/18/81/86/261188186.db2.gz NZYOKUFGLDOLFM-GXTWGEPZSA-N 1 0 281.396 3.525 20 70 CHIDRO C[C@H]([NH2+][C@@H]1CCCc2cc(F)ccc21)c1cccnc1 ZINC000159536673 261188188 /nfs/dbraw/zinc/18/81/88/261188188.db2.gz CBHAIDGDEWRYAB-YVEFUNNKSA-N 1 0 270.351 3.949 20 70 CHIDRO C[C@H]([NH2+][C@@H]1CCCSC1)c1cc(F)c(F)c(F)c1 ZINC000159570814 261188957 /nfs/dbraw/zinc/18/89/57/261188957.db2.gz AMJOLWBAVPKWQN-WCBMZHEXSA-N 1 0 275.339 3.650 20 70 CHIDRO COc1cc([C@H](C)[NH2+][C@@H]2CCCSC2)ccc1SC ZINC000159616438 261189655 /nfs/dbraw/zinc/18/96/55/261189655.db2.gz QLOUFOISUXYZKW-WCQYABFASA-N 1 0 297.489 3.963 20 70 CHIDRO CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc(C[NH3+])cc1 ZINC000159756270 261192992 /nfs/dbraw/zinc/19/29/92/261192992.db2.gz WRRUOMOOUGBOHX-SFHVURJKSA-N 1 0 296.414 3.615 20 70 CHIDRO CCOc1cccc2cc([C@@H](C)[NH2+]CCC(C)(C)O)oc21 ZINC000159775261 261194109 /nfs/dbraw/zinc/19/41/09/261194109.db2.gz CLKGZPHZALXGCP-GFCCVEGCSA-N 1 0 291.391 3.643 20 70 CHIDRO Cc1ccsc1[C@H](C)[NH2+]C[C@@](C)(O)c1ccsc1 ZINC000159982163 261201379 /nfs/dbraw/zinc/20/13/79/261201379.db2.gz AKJYDMHBJKBBIS-SMDDNHRTSA-N 1 0 281.446 3.676 20 70 CHIDRO Cc1ccccc1[C@H](C)[NH2+]C[C@](C)(O)c1ccsc1 ZINC000160049522 261202886 /nfs/dbraw/zinc/20/28/86/261202886.db2.gz BYYGIRBWRVJKOG-BBRMVZONSA-N 1 0 275.417 3.615 20 70 CHIDRO Cc1cccc(C)c1CC[NH2+][C@@H](C)c1cccnc1 ZINC000160612287 261220218 /nfs/dbraw/zinc/22/02/18/261220218.db2.gz TXTMDIAWGMUWHZ-HNNXBMFYSA-N 1 0 254.377 3.592 20 70 CHIDRO OCCC[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000160671749 261222338 /nfs/dbraw/zinc/22/23/38/261222338.db2.gz ZNBALKLUXYKURO-RBUKOAKNSA-N 1 0 299.389 3.916 20 70 CHIDRO C[C@H]([NH2+][C@H](CCCO)c1ccccc1)C1CCCC1 ZINC000160876948 261229442 /nfs/dbraw/zinc/22/94/42/261229442.db2.gz DIKNJGZPSJPVMN-WMLDXEAASA-N 1 0 261.409 3.669 20 70 CHIDRO CC[C@@H]([NH2+]Cc1scnc1C)c1ccc(F)cc1F ZINC000160887230 261230080 /nfs/dbraw/zinc/23/00/80/261230080.db2.gz AOKZCTMCAQCJHW-CYBMUJFWSA-N 1 0 282.359 3.971 20 70 CHIDRO CC(C)Cn1cc(C[NH2+][C@H]2CCCc3sccc32)cn1 ZINC000160973129 261232388 /nfs/dbraw/zinc/23/23/88/261232388.db2.gz WKRGJXCTQPRVJB-HNNXBMFYSA-N 1 0 289.448 3.768 20 70 CHIDRO COc1ccc([C@@H](C)[NH2+]C2CCN(C)CC2)c2ccccc12 ZINC000161448562 261246735 /nfs/dbraw/zinc/24/67/35/261246735.db2.gz VQPAIYCPVVEZJR-CQSZACIVSA-N 1 0 298.430 3.593 20 70 CHIDRO OC[C@H](C[NH2+][C@@H]1CCSc2ccccc21)c1ccccc1 ZINC000161452898 261246879 /nfs/dbraw/zinc/24/68/79/261246879.db2.gz ABOZSSDSJKTXSS-DOTOQJQBSA-N 1 0 299.439 3.589 20 70 CHIDRO CCc1nnc(C[NH2+][C@H](c2ccccc2)C(CC)CC)[nH]1 ZINC000160328076 262076008 /nfs/dbraw/zinc/07/60/08/262076008.db2.gz WTSQRWFGZROGCE-KRWDZBQOSA-N 1 0 286.423 3.634 20 70 CHIDRO CCc1nnc(C[NH2+][C@@H](c2ccccc2)C(CC)CC)[nH]1 ZINC000160327945 262077146 /nfs/dbraw/zinc/07/71/46/262077146.db2.gz WTSQRWFGZROGCE-QGZVFWFLSA-N 1 0 286.423 3.634 20 70 CHIDRO Cc1cc(N[C@@H]2CCO[C@@H](C3CC3)C2)c2ccccc2[nH+]1 ZINC000160418302 264244000 /nfs/dbraw/zinc/24/40/00/264244000.db2.gz RLFVEOVMRGBUJY-RDTXWAMCSA-N 1 0 282.387 3.913 20 70 CHIDRO Cc1cccc([C@H](C)[NH2+]C[C@@H]2CCCC[C@@H]2O)c1C ZINC000160486975 327615418 /nfs/dbraw/zinc/61/54/18/327615418.db2.gz ZFVMDYGXRGHEAR-ZOBUZTSGSA-N 1 0 261.409 3.505 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2ccc(C)o2)o1 ZINC000160846748 328088013 /nfs/dbraw/zinc/08/80/13/328088013.db2.gz BIFMUZVRSIIYFJ-UHFFFAOYSA-N 1 0 285.347 3.512 20 70 CHIDRO c1cc2c(s1)CCC[C@H]2[NH2+]Cc1cccc2c[nH]nc21 ZINC000160970196 328101209 /nfs/dbraw/zinc/10/12/09/328101209.db2.gz YBJFDZKEHVMBLA-CQSZACIVSA-N 1 0 283.400 3.792 20 70 CHIDRO CCS[C@H]1CCC[C@H]([NH2+]C(C2CC2)C2CC2)C1 ZINC000159392118 327177447 /nfs/dbraw/zinc/17/74/47/327177447.db2.gz DCAJNCUYDGSVCH-KBPBESRZSA-N 1 0 253.455 3.829 20 70 CHIDRO CC(C)=CCC[C@@H](C)[NH2+]Cc1cn2ccccc2n1 ZINC000159412531 327183154 /nfs/dbraw/zinc/18/31/54/327183154.db2.gz QQHFJTKQXXHATL-CQSZACIVSA-N 1 0 257.381 3.559 20 70 CHIDRO CC[N@H+](CCO[C@@H]1CCCC[C@@H]1C)CCc1nccs1 ZINC000159432354 327189606 /nfs/dbraw/zinc/18/96/06/327189606.db2.gz RXWQAGULVFZEMX-LSDHHAIUSA-N 1 0 296.480 3.603 20 70 CHIDRO Cc1cc(C)cc(CC[NH2+][C@H](C)c2cncc(F)c2)c1 ZINC000159498586 327208559 /nfs/dbraw/zinc/20/85/59/327208559.db2.gz ZNOIOFDKCPJNAG-CQSZACIVSA-N 1 0 272.367 3.731 20 70 CHIDRO C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@@H]1CCCO1 ZINC000159880009 327573504 /nfs/dbraw/zinc/57/35/04/327573504.db2.gz BBRMBPCWNQHSMZ-LMRWQKIVSA-N 1 0 265.784 3.512 20 70 CHIDRO Fc1ccccc1OCC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000218200689 329468928 /nfs/dbraw/zinc/46/89/28/329468928.db2.gz LMYJKDRMHSEGRB-GOSISDBHSA-N 1 0 285.362 3.945 20 70 CHIDRO Cc1cc(C)cc([C@H](C)[NH2+]C[C@@H](CO)c2ccccc2)c1 ZINC000161406721 329933161 /nfs/dbraw/zinc/93/31/61/329933161.db2.gz CKCFDOVKSRTEHK-LPHOPBHVSA-N 1 0 283.415 3.730 20 70 CHIDRO Cc1cccc([C@H](C)[NH2+]C[C@H](CO)c2ccccc2)c1C ZINC000161439688 329934377 /nfs/dbraw/zinc/93/43/77/329934377.db2.gz DOWQZRVSFWCEKG-FUHWJXTLSA-N 1 0 283.415 3.730 20 70 CHIDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H]2CCOC(C)(C)C2)C12CCCCC2 ZINC000159924203 330854420 /nfs/dbraw/zinc/85/44/20/330854420.db2.gz ADVREPGUOUQPLD-BZUAXINKSA-N 1 0 295.467 3.662 20 70 CHIDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)CC2 ZINC000159962773 330855317 /nfs/dbraw/zinc/85/53/17/330855317.db2.gz OYAICVDGDCHINO-HOCLYGCPSA-N 1 0 259.393 3.530 20 70 CHIDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc(C)c2)C1(C)C ZINC000160193519 330860874 /nfs/dbraw/zinc/86/08/74/330860874.db2.gz VIAFEFBJDOKYOO-CWRNSKLLSA-N 1 0 261.409 3.849 20 70 CHIDRO CC1(C)CC[C@H](C[NH2+]Cc2cccc3ccccc32)O1 ZINC000160273558 330862328 /nfs/dbraw/zinc/86/23/28/330862328.db2.gz HISIWCNZLRIVSS-MRXNPFEDSA-N 1 0 269.388 3.887 20 70 CHIDRO OC1(C[NH2+]Cc2cc(F)cc(Cl)c2)CCCCCC1 ZINC000160951757 330881123 /nfs/dbraw/zinc/88/11/23/330881123.db2.gz VKMKNAAOYJFPDP-UHFFFAOYSA-N 1 0 285.790 3.654 20 70 CHIDRO C1CC1N1CCC([NH2+][C@H]2CC[C@H]3CCCC[C@@H]3C2)CC1 ZINC000217791110 333123890 /nfs/dbraw/zinc/12/38/90/333123890.db2.gz XFPZYZCNZNNMGR-INMHGKMJSA-N 1 0 276.468 3.562 20 70 CHIDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)CCc1ccccc1 ZINC000217938355 333125412 /nfs/dbraw/zinc/12/54/12/333125412.db2.gz LLWFUKHKAVFPGZ-USXIJHARSA-N 1 0 261.409 3.555 20 70 CHIDRO c1cc2cccc(C[NH2+]CCCOc3ccccc3)c2[nH]1 ZINC000218082158 333126467 /nfs/dbraw/zinc/12/64/67/333126467.db2.gz NKURWQSRWVQJMR-UHFFFAOYSA-N 1 0 280.371 3.727 20 70 CHIDRO CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1ccc(Cl)c(F)c1 ZINC000218247422 333129793 /nfs/dbraw/zinc/12/97/93/333129793.db2.gz GUIMIHMLNPCEFC-BMIGLBTASA-N 1 0 287.806 3.927 20 70 CHIDRO CCC[N@@H+](Cc1ccccc1)C[C@H](O)Cc1ccccc1 ZINC000218685702 333135015 /nfs/dbraw/zinc/13/50/15/333135015.db2.gz KEKVNDKUSQQOEI-LJQANCHMSA-N 1 0 283.415 3.502 20 70 CHIDRO CC(C)C[C@H]([NH2+]CC(=O)NC(C)C)c1ccc(Cl)cc1 ZINC000161008765 519393879 /nfs/dbraw/zinc/39/38/79/519393879.db2.gz WYFORMZDTAGJPG-HNNXBMFYSA-N 1 0 296.842 3.541 20 70 CHIDRO CC(C)c1noc(CCC[NH2+][C@H]2CCCc3ccccc32)n1 ZINC000160816106 519903149 /nfs/dbraw/zinc/90/31/49/519903149.db2.gz IKENDMQQWWTJTI-INIZCTEOSA-N 1 0 299.418 3.793 20 70 CHIDRO CCc1nc(C)c([C@@H](C)N[C@H]2CCC[C@H]([NH+](C)C)C2)s1 ZINC000161012266 522225542 /nfs/dbraw/zinc/22/55/42/522225542.db2.gz HNAAZHSHGACBCJ-XBFCOCLRSA-N 1 0 295.496 3.537 20 70 CHIDRO COCCCCC[NH2+]Cc1ccc(F)c(C(F)(F)F)c1 ZINC000161334788 523133457 /nfs/dbraw/zinc/13/34/57/523133457.db2.gz BVXDNNJCCRPHLH-UHFFFAOYSA-N 1 0 293.304 3.751 20 70 CHIDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2cccc(C)n2)c1 ZINC000160342914 525942050 /nfs/dbraw/zinc/94/20/50/525942050.db2.gz VLJUKOHXZDJFCE-SFHVURJKSA-N 1 0 282.387 3.736 20 70 CHIDRO Cc1oc2ccccc2c1C[NH2+]CC1CCSCC1 ZINC000160794620 526788844 /nfs/dbraw/zinc/78/88/44/526788844.db2.gz WNISUJBFNHZRIH-UHFFFAOYSA-N 1 0 275.417 3.974 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H]1CCCCO1)c1ccc(F)cc1F ZINC000160825035 522618738 /nfs/dbraw/zinc/61/87/38/522618738.db2.gz VOPXVMZANYHBMI-WFASDCNBSA-N 1 0 269.335 3.575 20 70 CHIDRO Cc1cccc([C@H](C)[NH2+]Cc2cn(C)nc2C(F)(F)F)c1 ZINC000159783716 261194054 /nfs/dbraw/zinc/19/40/54/261194054.db2.gz BSMKLMYRSCJQDV-NSHDSACASA-N 1 0 297.324 3.598 20 70 CHIDRO Cc1ccccc1[C@@H](C)[NH2+][C@H]1CCC[C@H]2OCC[C@@H]21 ZINC000159816092 261195032 /nfs/dbraw/zinc/19/50/32/261195032.db2.gz LWEYICIQNMAVPD-MXASKKJJSA-N 1 0 259.393 3.603 20 70 CHIDRO CC(C)CSCCC[NH2+][C@H](C)c1cccnc1 ZINC000160019828 261201921 /nfs/dbraw/zinc/20/19/21/261201921.db2.gz WOKMGMYKFZOIKP-CYBMUJFWSA-N 1 0 252.427 3.512 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@H](C)c2cncs2)n1 ZINC000160662396 261222302 /nfs/dbraw/zinc/22/23/02/261222302.db2.gz MQLJUSBZNIRYOZ-LLVKDONJSA-N 1 0 281.450 3.582 20 70 CHIDRO C[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccc(Cl)s1 ZINC000161448856 261246533 /nfs/dbraw/zinc/24/65/33/261246533.db2.gz ANMSOVPLBVMVNJ-DGCLKSJQSA-N 1 0 295.835 3.828 20 70 CHIDRO Cc1ccccc1C[C@@H](C)[NH2+][C@H](C)CC(F)(F)F ZINC000160774712 327668067 /nfs/dbraw/zinc/66/80/67/327668067.db2.gz NKMFTMORGGLIBY-VXGBXAGGSA-N 1 0 259.315 3.857 20 70 CHIDRO Cc1ccc([C@H](C)[NH2+]CCOc2ccccc2Cl)o1 ZINC000216743891 329299808 /nfs/dbraw/zinc/29/98/08/329299808.db2.gz NTXXHYYDJFANCJ-LBPRGKRZSA-N 1 0 279.767 3.971 20 70 CHIDRO Fc1cc(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)ccc1Cl ZINC000159496664 327208232 /nfs/dbraw/zinc/20/82/32/327208232.db2.gz XOUSHKQLZIHJLZ-GLQYFDAESA-N 1 0 295.785 3.526 20 70 CHIDRO CCC[NH+]1CCC(NC(=O)C[C@H]2CCCC(C)(C)C2)CC1 ZINC000159747698 327560699 /nfs/dbraw/zinc/56/06/99/327560699.db2.gz VIUHDXOURDLXQP-OAHLLOKOSA-N 1 0 294.483 3.584 20 70 CHIDRO CCCC(=O)Nc1cccc(C[NH2+][C@H](C)C(C)(C)C)c1 ZINC000159924417 327578831 /nfs/dbraw/zinc/57/88/31/327578831.db2.gz HMWPUUNUSGPGEB-CYBMUJFWSA-N 1 0 276.424 3.949 20 70 CHIDRO C/C(=C/c1ccc(Cl)cc1)C[NH2+]CCCn1cccn1 ZINC000159942347 327580430 /nfs/dbraw/zinc/58/04/30/327580430.db2.gz JILKKFFUPOXAQB-OWBHPGMISA-N 1 0 289.810 3.620 20 70 CHIDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ccccc2Cl)o1 ZINC000216743845 329299903 /nfs/dbraw/zinc/29/99/03/329299903.db2.gz NTXXHYYDJFANCJ-GFCCVEGCSA-N 1 0 279.767 3.971 20 70 CHIDRO C[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)C(C)(C)c1ccccc1 ZINC000161420669 329931641 /nfs/dbraw/zinc/93/16/41/329931641.db2.gz NWEQOUZVFBFTPI-AEFFLSMTSA-N 1 0 297.442 3.718 20 70 CHIDRO Cc1ccccc1OCC[NH2+][C@@H](C)c1cccc(F)c1 ZINC000216625194 330408460 /nfs/dbraw/zinc/40/84/60/330408460.db2.gz KZFWJNCWOAVTDO-AWEZNQCLSA-N 1 0 273.351 3.864 20 70 CHIDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2)C12CCC2 ZINC000159796431 330851602 /nfs/dbraw/zinc/85/16/02/330851602.db2.gz GVVDXFFSLBYMJC-FVQBIDKESA-N 1 0 259.393 3.685 20 70 CHIDRO CC[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(F)cc1 ZINC000159979260 330855927 /nfs/dbraw/zinc/85/59/27/330855927.db2.gz LODOBQDJWDIGOM-LSDHHAIUSA-N 1 0 265.372 3.824 20 70 CHIDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(C)c2)C1(C)C ZINC000160148632 330859691 /nfs/dbraw/zinc/85/96/91/330859691.db2.gz VIAFEFBJDOKYOO-VNQPRFMTSA-N 1 0 261.409 3.849 20 70 CHIDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)cc1F ZINC000160319205 330862949 /nfs/dbraw/zinc/86/29/49/330862949.db2.gz IJOHZACTWUCROD-GXTWGEPZSA-N 1 0 265.372 3.742 20 70 CHIDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1cc2ccccc2[nH]c1=O ZINC000160340336 330863188 /nfs/dbraw/zinc/86/31/88/330863188.db2.gz KDANMAOCQDRAJC-FUHWJXTLSA-N 1 0 298.430 3.833 20 70 CHIDRO CC1(C)C[C@@H](Nc2cc[nH+]c3ccccc23)CCO1 ZINC000160695497 330873628 /nfs/dbraw/zinc/87/36/28/330873628.db2.gz BEYKAKNOOHAVSI-LBPRGKRZSA-N 1 0 256.349 3.604 20 70 CHIDRO CO[C@@H]1CCCC[C@H]1[NH2+]CC[C@@H](C)c1ccccc1 ZINC000217473263 333120987 /nfs/dbraw/zinc/12/09/87/333120987.db2.gz CKTYLROFLBLUFV-DJIMGWMZSA-N 1 0 261.409 3.727 20 70 CHIDRO CC(C)c1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000217654806 333122519 /nfs/dbraw/zinc/12/25/19/333122519.db2.gz NSNUHDKMVLWVTK-ROUUACIJSA-N 1 0 272.436 3.526 20 70 CHIDRO C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cccc2cc[nH]c21 ZINC000218077799 333126609 /nfs/dbraw/zinc/12/66/09/333126609.db2.gz ZZILQELHFNPOJW-OAHLLOKOSA-N 1 0 285.435 3.522 20 70 CHIDRO CCc1nc(C)c([C@H](C)N[C@H]2CCC[C@H]([NH+](C)C)C2)s1 ZINC000161012406 522234387 /nfs/dbraw/zinc/23/43/87/522234387.db2.gz HNAAZHSHGACBCJ-UBHSHLNASA-N 1 0 295.496 3.537 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@@H]1C(C)C)c1ccccc1OC ZINC000160889578 522615965 /nfs/dbraw/zinc/61/59/65/522615965.db2.gz SOFNDOOHMFCFMU-QILLFSRXSA-N 1 0 291.435 3.797 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc(OC)c1 ZINC000161440122 522850577 /nfs/dbraw/zinc/85/05/77/522850577.db2.gz MVOFWEHZKJYCGD-PKOBYXMFSA-N 1 0 299.414 3.512 20 70 CHIDRO CC[C@@H]([NH2+][C@@H]1CCCSC1)c1cccc(OC)c1 ZINC000159544908 522925747 /nfs/dbraw/zinc/92/57/47/522925747.db2.gz LKRVYTUIRVJZPP-UKRRQHHQSA-N 1 0 265.422 3.632 20 70 CHIDRO C[C@@H](O)C(C)(C)[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000161119514 525745100 /nfs/dbraw/zinc/74/51/00/525745100.db2.gz ZODQFYRBTRLUML-GFCCVEGCSA-N 1 0 275.417 3.664 20 70 CHIDRO c1coc(C[NH+]2CCC(c3nc4ccccc4o3)CC2)c1 ZINC000161062686 526566401 /nfs/dbraw/zinc/56/64/01/526566401.db2.gz QQXHIDFEJIGZAG-UHFFFAOYSA-N 1 0 282.343 3.800 20 70 CHIDRO CC(C)C[C@@H]([NH2+][C@@H]1CCCSC1)c1ccccn1 ZINC000159530701 261188310 /nfs/dbraw/zinc/18/83/10/261188310.db2.gz JDEPWKOKPONOFL-UKRRQHHQSA-N 1 0 264.438 3.654 20 70 CHIDRO CCS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cnc(C)nc2C)C1 ZINC000159399974 261185587 /nfs/dbraw/zinc/18/55/87/261185587.db2.gz VMMVYSDIYOPQQT-AEGPPILISA-N 1 0 293.480 3.808 20 70 CHIDRO Cc1ccccc1[C@H](C)[NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000159815958 261194972 /nfs/dbraw/zinc/19/49/72/261194972.db2.gz LWEYICIQNMAVPD-RKTXRCNFSA-N 1 0 259.393 3.603 20 70 CHIDRO C[C@H]1C[C@H]([NH2+]CCSc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000160047044 261202864 /nfs/dbraw/zinc/20/28/64/261202864.db2.gz YIEHLRMYFULKNR-GXTWGEPZSA-N 1 0 298.883 3.504 20 70 CHIDRO CC(=O)Nc1ccccc1C[N@H+](C)Cc1ccccc1C ZINC000160527911 261217257 /nfs/dbraw/zinc/21/72/57/261217257.db2.gz JRIQHWRIWCWZMO-UHFFFAOYSA-N 1 0 282.387 3.585 20 70 CHIDRO CC1(C)C[C@@H]([NH2+]Cc2cccc(-c3ccccn3)c2)CCO1 ZINC000160563936 261218109 /nfs/dbraw/zinc/21/81/09/261218109.db2.gz FKAJWZCTZRWNIN-KRWDZBQOSA-N 1 0 296.414 3.796 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@H](C)c2ccco2)n1 ZINC000160688001 261222582 /nfs/dbraw/zinc/22/25/82/261222582.db2.gz WFGIGEJZNADJPA-GFCCVEGCSA-N 1 0 264.394 3.718 20 70 CHIDRO Cc1ccc(C[NH2+][C@H](C)c2cccnc2Cl)s1 ZINC000160919644 261230932 /nfs/dbraw/zinc/23/09/32/261230932.db2.gz BLNBRTLEAVIBGY-SNVBAGLBSA-N 1 0 266.797 3.956 20 70 CHIDRO Cc1ccc([C@H](C)[NH2+][C@H](CCO)c2ccccc2)s1 ZINC000160932748 261231912 /nfs/dbraw/zinc/23/19/12/261231912.db2.gz IZCFFCTZBAIWKX-DZGCQCFKSA-N 1 0 275.417 3.831 20 70 CHIDRO c1cc2c(s1)CCC[C@@H]2[NH2+]Cc1ccc2c[nH]nc2c1 ZINC000160957624 261232527 /nfs/dbraw/zinc/23/25/27/261232527.db2.gz KRNYJXNNPADZBQ-AWEZNQCLSA-N 1 0 283.400 3.792 20 70 CHIDRO CC[NH+](CC)CCC[C@@H](C)NC(=O)C(C)(C)C1CCCC1 ZINC000160647168 327635047 /nfs/dbraw/zinc/63/50/47/327635047.db2.gz APUCFNKTEYTOET-OAHLLOKOSA-N 1 0 296.499 3.830 20 70 CHIDRO CCCCCOc1ccc([C@H](C)[NH2+]CC(C)(C)O)cc1 ZINC000160642975 327635890 /nfs/dbraw/zinc/63/58/90/327635890.db2.gz NZTKHYOTUQPVBB-AWEZNQCLSA-N 1 0 279.424 3.677 20 70 CHIDRO CCC[C@@H](C)[C@H](CC)[NH2+]CCCc1nc(C(C)C)no1 ZINC000160806000 328086906 /nfs/dbraw/zinc/08/69/06/328086906.db2.gz CLELBSYPZKUHQL-KGLIPLIRSA-N 1 0 281.444 3.930 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2ccc(OCC(F)F)cc2)o1 ZINC000160849314 328088688 /nfs/dbraw/zinc/08/86/88/328088688.db2.gz FLPMNEKSEXJJOK-UHFFFAOYSA-N 1 0 295.329 3.864 20 70 CHIDRO CC[C@@H](C)NC(=O)c1cccc(C[NH2+][C@H](C)C(C)(C)C)c1 ZINC000161116945 328132865 /nfs/dbraw/zinc/13/28/65/328132865.db2.gz USCVTIOIMTWLNK-ZIAGYGMSSA-N 1 0 290.451 3.739 20 70 CHIDRO C[N@H+](Cc1ccc2c[nH]nc2c1)Cc1cccc(Cl)c1 ZINC000161128189 328135545 /nfs/dbraw/zinc/13/55/45/328135545.db2.gz LWWHBDQTOXGTNO-UHFFFAOYSA-N 1 0 285.778 3.848 20 70 CHIDRO C[C@@H]([NH2+][C@H]1CCCc2cc(F)ccc21)c1ccncc1 ZINC000159553112 327534353 /nfs/dbraw/zinc/53/43/53/327534353.db2.gz ZUECOQFNVUBFRF-PXAZEXFGSA-N 1 0 270.351 3.949 20 70 CHIDRO CC(C)C(=O)NCCC[NH2+][C@H](C)c1ccc2ccccc2c1 ZINC000159992007 327585037 /nfs/dbraw/zinc/58/50/37/327585037.db2.gz UNCOJXPIOQHYKZ-OAHLLOKOSA-N 1 0 298.430 3.653 20 70 CHIDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1ccco1 ZINC000161373103 329931148 /nfs/dbraw/zinc/93/11/48/329931148.db2.gz GLIXCBFZLOZQKG-LBPRGKRZSA-N 1 0 259.324 3.801 20 70 CHIDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1ccco1 ZINC000161373209 329931180 /nfs/dbraw/zinc/93/11/80/329931180.db2.gz GLIXCBFZLOZQKG-GFCCVEGCSA-N 1 0 259.324 3.801 20 70 CHIDRO CC[C@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1c(C)cccc1C ZINC000161408652 329933300 /nfs/dbraw/zinc/93/33/00/329933300.db2.gz QZVWEKBGPNSFEX-HOTGVXAUSA-N 1 0 288.435 3.800 20 70 CHIDRO CC1(C)C[C@@H]([NH2+]C2CC(c3ccccc3F)C2)CCO1 ZINC000159926227 330854348 /nfs/dbraw/zinc/85/43/48/330854348.db2.gz WIMTWTJGDBZRAF-MOKVOYLWSA-N 1 0 277.383 3.619 20 70 CHIDRO COc1ccc2ccccc2c1C[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000160637402 330870606 /nfs/dbraw/zinc/87/06/06/330870606.db2.gz TWWISFBTFFHORT-OAHLLOKOSA-N 1 0 299.414 3.896 20 70 CHIDRO Cc1ccccc1C[C@@H](C)[NH2+][C@H](C)c1cncc(F)c1 ZINC000160769557 330874491 /nfs/dbraw/zinc/87/44/91/330874491.db2.gz CAWHGVWSGFFFBN-ZIAGYGMSSA-N 1 0 272.367 3.811 20 70 CHIDRO Fc1cc(Cl)cc(C[NH2+]C[C@@H]2Cc3ccccc3O2)c1 ZINC000160904647 330879072 /nfs/dbraw/zinc/87/90/72/330879072.db2.gz STTJSSWQNXIEDK-HNNXBMFYSA-N 1 0 291.753 3.572 20 70 CHIDRO CC(C)[C@H]1OCC[C@@H]1C[NH2+][C@@H](C)CCc1ccc(F)cc1 ZINC000160906609 330879182 /nfs/dbraw/zinc/87/91/82/330879182.db2.gz SBXVBNKBMZQEPF-YXJHDRRASA-N 1 0 293.426 3.798 20 70 CHIDRO CO[C@@H]1CCCC[C@@H]1[NH2+]CC[C@@H](C)c1ccccc1 ZINC000217473193 333120977 /nfs/dbraw/zinc/12/09/77/333120977.db2.gz CKTYLROFLBLUFV-HYVNUMGLSA-N 1 0 261.409 3.727 20 70 CHIDRO CCN(CC[NH2+]C1CC(c2ccccc2Cl)C1)C1CC1 ZINC000217479432 333121340 /nfs/dbraw/zinc/12/13/40/333121340.db2.gz VMNMCWBYXYEPIP-UHFFFAOYSA-N 1 0 292.854 3.660 20 70 CHIDRO C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1cc2ccccc2o1 ZINC000217663545 333122750 /nfs/dbraw/zinc/12/27/50/333122750.db2.gz VCFDLVYDTLGVAS-IMJJTQAJSA-N 1 0 284.403 3.710 20 70 CHIDRO CCc1ccc([C@H](C)[NH2+][C@@H]2CCN3CCCC[C@@H]23)s1 ZINC000217775102 333123499 /nfs/dbraw/zinc/12/34/99/333123499.db2.gz NYDVDAPFLDYGOX-CFVMTHIKSA-N 1 0 278.465 3.588 20 70 CHIDRO Cc1cccc(C[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000218084757 333126837 /nfs/dbraw/zinc/12/68/37/333126837.db2.gz RLBUCMWRQKKRPE-UHFFFAOYSA-N 1 0 250.345 3.766 20 70 CHIDRO CC(C)[C@H]([NH2+]C[C@H](O)Cc1ccccc1)c1ccccc1 ZINC000218761464 333136034 /nfs/dbraw/zinc/13/60/34/333136034.db2.gz JQFOQVGIPGZRMN-MOPGFXCFSA-N 1 0 283.415 3.577 20 70 CHIDRO CC(C)[C@@H]([NH2+]C[C@H](O)Cc1ccccc1)c1ccccc1 ZINC000218761427 333136035 /nfs/dbraw/zinc/13/60/35/333136035.db2.gz JQFOQVGIPGZRMN-RTBURBONSA-N 1 0 283.415 3.577 20 70 CHIDRO CC(C)C[N@H+](Cc1csc(C2CC2)n1)C1CC1 ZINC000161369905 519718856 /nfs/dbraw/zinc/71/88/56/519718856.db2.gz CJDPVQSGTCZFOJ-UHFFFAOYSA-N 1 0 250.411 3.641 20 70 CHIDRO CC(=O)Nc1ccccc1C[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000160352705 519750752 /nfs/dbraw/zinc/75/07/52/519750752.db2.gz OXTYKXDEVYNPNO-HIFRSBDPSA-N 1 0 274.408 3.561 20 70 CHIDRO CC(C)c1noc(CCC[NH2+][C@@H]2CCCc3ccccc32)n1 ZINC000160816001 519902139 /nfs/dbraw/zinc/90/21/39/519902139.db2.gz IKENDMQQWWTJTI-MRXNPFEDSA-N 1 0 299.418 3.793 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H]1CCO[C@@H]1C(C)C)c1ccccc1OC ZINC000160889941 522865701 /nfs/dbraw/zinc/86/57/01/522865701.db2.gz SOFNDOOHMFCFMU-QGPMSJSTSA-N 1 0 291.435 3.797 20 70 CHIDRO CC[C@@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1OC ZINC000161119065 522924658 /nfs/dbraw/zinc/92/46/58/522924658.db2.gz BGOFVSHJUGRCOK-HLLBOEOZSA-N 1 0 290.451 3.609 20 70 CHIDRO CC[C@H]1CCCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000161249774 523029084 /nfs/dbraw/zinc/02/90/84/523029084.db2.gz QPPWVAANWBLTMQ-ZDUSSCGKSA-N 1 0 250.411 3.785 20 70 CHIDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc(NC(C)=O)c1 ZINC000161411996 523222656 /nfs/dbraw/zinc/22/26/56/523222656.db2.gz IMLFEOKSEJGRKM-NVXWUHKLSA-N 1 0 274.408 3.703 20 70 CHIDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)cn1 ZINC000161285609 524599475 /nfs/dbraw/zinc/59/94/75/524599475.db2.gz KFPYYYQLNHOGKO-ZWKOTPCHSA-N 1 0 266.388 3.816 20 70 CHIDRO Cc1cccn2c(C[NH2+][C@@H]3CCCc4sccc43)cnc12 ZINC000160959064 525467917 /nfs/dbraw/zinc/46/79/17/525467917.db2.gz ZZFVRELEVCQATL-OAHLLOKOSA-N 1 0 297.427 3.871 20 70 CHIDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCCC2)nc1)C1(C)CC1 ZINC000160548915 525526674 /nfs/dbraw/zinc/52/66/74/525526674.db2.gz VCHPEKHIKXDIBO-OAHLLOKOSA-N 1 0 287.451 3.740 20 70 CHIDRO Cc1nc(-c2cc([C@H](C)[NH2+]CC(C)(C)O)cs2)cs1 ZINC000160617167 526563633 /nfs/dbraw/zinc/56/36/33/526563633.db2.gz SBXQZVGWUZJXGG-VIFPVBQESA-N 1 0 296.461 3.602 20 70 CHIDRO COCCC1(C[NH2+][C@@H](C)c2ccccc2C)CCC1 ZINC000159805482 260929051 /nfs/dbraw/zinc/92/90/51/260929051.db2.gz ZFWGDUYYZSOZDL-HNNXBMFYSA-N 1 0 261.409 3.852 20 70 CHIDRO Cc1n[nH]cc1C[N@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000159685920 261191394 /nfs/dbraw/zinc/19/13/94/261191394.db2.gz RYYYLJLUFSJCRK-CQSZACIVSA-N 1 0 269.392 3.519 20 70 CHIDRO CC[C@@H]([NH2+]Cc1cn(C)nc1C(F)(F)F)c1ccccc1 ZINC000159783147 261193898 /nfs/dbraw/zinc/19/38/98/261193898.db2.gz GIDDCTKARVZGLU-CYBMUJFWSA-N 1 0 297.324 3.680 20 70 CHIDRO Cc1ccc([C@H](C)[NH2+]Cc2cn3c(cccc3C)n2)s1 ZINC000160289117 261210230 /nfs/dbraw/zinc/21/02/30/261210230.db2.gz XQYFUVBRNKMBFS-ZDUSSCGKSA-N 1 0 285.416 3.863 20 70 CHIDRO CC[C@H]([NH2+]CCc1nccs1)c1ccc(F)cc1F ZINC000160845230 261228392 /nfs/dbraw/zinc/22/83/92/261228392.db2.gz UVIPEHITACSGOM-ZDUSSCGKSA-N 1 0 282.359 3.705 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2cccc3[nH]ccc32)o1 ZINC000160876064 261228747 /nfs/dbraw/zinc/22/87/47/261228747.db2.gz KYNPNIWTIIKQFA-UHFFFAOYSA-N 1 0 254.333 3.701 20 70 CHIDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc([S@](C)=O)cc2)s1 ZINC000160929650 261231898 /nfs/dbraw/zinc/23/18/98/261231898.db2.gz XBOGVRAOECWVHQ-HXPMCKFVSA-N 1 0 293.457 3.645 20 70 CHIDRO C[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1cccs1 ZINC000160979693 261233815 /nfs/dbraw/zinc/23/38/15/261233815.db2.gz FRCXUGOAYQUIRL-TZMCWYRMSA-N 1 0 261.390 3.522 20 70 CHIDRO Fc1ccc2c(N[C@@H]3CCO[C@@H](C4CC4)C3)cc[nH+]c2c1 ZINC000160443930 264244325 /nfs/dbraw/zinc/24/43/25/264244325.db2.gz MJOJVVLFYYIRII-CXAGYDPISA-N 1 0 286.350 3.743 20 70 CHIDRO CC1CCN(c2ccc(C[NH2+]C(C3CC3)C3CC3)cn2)CC1 ZINC000160474566 327613743 /nfs/dbraw/zinc/61/37/43/327613743.db2.gz ZFNLIBKPKIABHO-UHFFFAOYSA-N 1 0 299.462 3.596 20 70 CHIDRO CCCN(CC[NH+](CC)CC)C(=O)Nc1cccc(C)c1 ZINC000160545176 327619514 /nfs/dbraw/zinc/61/95/14/327619514.db2.gz HQEHNBRJYUOORP-UHFFFAOYSA-N 1 0 291.439 3.581 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2coc3ccccc23)o1 ZINC000160849755 328088621 /nfs/dbraw/zinc/08/86/21/328088621.db2.gz GJFGDRATFWNLDF-UHFFFAOYSA-N 1 0 255.317 3.966 20 70 CHIDRO CC(C)[C@H](C)[NH2+][C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000161128547 328135468 /nfs/dbraw/zinc/13/54/68/328135468.db2.gz CZCUGSOKZOGTPY-YVEFUNNKSA-N 1 0 275.392 3.543 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H]1CCCCN1CC)c1cccs1 ZINC000161177638 328151116 /nfs/dbraw/zinc/15/11/16/328151116.db2.gz APQXAVVBTYXGBS-UONOGXRCSA-N 1 0 266.454 3.663 20 70 CHIDRO CCSCC[N@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000159364368 327174742 /nfs/dbraw/zinc/17/47/42/327174742.db2.gz NFZVVBRUJRCGJF-JTQLQIEISA-N 1 0 259.365 3.711 20 70 CHIDRO CCC[C@@H]([NH2+]C[C@]1(C)CCCS1)c1ccccn1 ZINC000159367948 327174943 /nfs/dbraw/zinc/17/49/43/327174943.db2.gz KNOCCKXPCXGHCD-HIFRSBDPSA-N 1 0 264.438 3.798 20 70 CHIDRO C[C@H]([NH2+][C@H]1CCCSC1)c1cc2c(s1)CCC2 ZINC000159591277 327544618 /nfs/dbraw/zinc/54/46/18/327544618.db2.gz ZPHDSISATZTYNN-JQWIXIFHSA-N 1 0 267.463 3.783 20 70 CHIDRO CC(C)Oc1ccc(C[NH2+][C@H]2c3ccccc3C[C@@H]2C)cn1 ZINC000160056773 327590162 /nfs/dbraw/zinc/59/01/62/327590162.db2.gz XPJPAYLIGXTJDO-IFXJQAMLSA-N 1 0 296.414 3.892 20 70 CHIDRO Cc1cc([C@@H](C)[NH2+]C[C@@H](CO)c2ccccc2)c(C)s1 ZINC000161429825 329933780 /nfs/dbraw/zinc/93/37/80/329933780.db2.gz JQXBECJLHDFKDO-CJNGLKHVSA-N 1 0 289.444 3.792 20 70 CHIDRO CCSCc1cccc(NC(=O)C2([NH3+])CCCCC2)c1 ZINC000161481544 329941263 /nfs/dbraw/zinc/94/12/63/329941263.db2.gz UCBHIBSTDKZJFM-UHFFFAOYSA-N 1 0 292.448 3.540 20 70 CHIDRO Cn1ncc2c1CCC[C@@H]2[NH2+]C1CC(C)(C)CC(C)(C)C1 ZINC000159727170 330850793 /nfs/dbraw/zinc/85/07/93/330850793.db2.gz PMAVFQOASUMKAB-HNNXBMFYSA-N 1 0 289.467 3.992 20 70 CHIDRO Cn1ncc2c1CCC[C@H]2[NH2+]C1CC(C)(C)CC(C)(C)C1 ZINC000159727039 330850817 /nfs/dbraw/zinc/85/08/17/330850817.db2.gz PMAVFQOASUMKAB-OAHLLOKOSA-N 1 0 289.467 3.992 20 70 CHIDRO C[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cc(F)cc(F)c1 ZINC000159944951 330854786 /nfs/dbraw/zinc/85/47/86/330854786.db2.gz PALSPLXMPYTQRM-HZMBPMFUSA-N 1 0 269.335 3.573 20 70 CHIDRO CC[C@H]([NH2+][C@@H](C)c1cc2ccccc2o1)[C@@H]1CCOC1 ZINC000159950882 330854840 /nfs/dbraw/zinc/85/48/40/330854840.db2.gz CLFHYUJGTXBMNS-CFVMTHIKSA-N 1 0 273.376 3.899 20 70 CHIDRO CC1(C)C[C@H]([NH2+][C@H]2CCc3cc(Cl)ccc32)CCO1 ZINC000159963692 330855309 /nfs/dbraw/zinc/85/53/09/330855309.db2.gz BPODXHCPLOZYGJ-HIFRSBDPSA-N 1 0 279.811 3.875 20 70 CHIDRO C[C@@H]([NH2+][C@H]1CCO[C@@H](C)C1)c1ccc(Br)cc1 ZINC000160028694 330857128 /nfs/dbraw/zinc/85/71/28/330857128.db2.gz ZJVHYYZJCPKHLJ-WDMOLILDSA-N 1 0 298.224 3.667 20 70 CHIDRO OCC1(C[NH2+][C@@H]2CCCCc3ccccc32)CCCC1 ZINC000160107685 330858863 /nfs/dbraw/zinc/85/88/63/330858863.db2.gz NYBOAVCDQJCIHU-QGZVFWFLSA-N 1 0 273.420 3.596 20 70 CHIDRO Cc1ccc([C@H]([NH2+]CC2(CO)CCCC2)C2CC2)cc1 ZINC000160121266 330859482 /nfs/dbraw/zinc/85/94/82/330859482.db2.gz ARENCZYXUOFRKM-KRWDZBQOSA-N 1 0 273.420 3.588 20 70 CHIDRO Cc1ccc([C@@H]([NH2+]CC2(CO)CCCC2)C2CC2)cc1 ZINC000160121380 330859513 /nfs/dbraw/zinc/85/95/13/330859513.db2.gz ARENCZYXUOFRKM-QGZVFWFLSA-N 1 0 273.420 3.588 20 70 CHIDRO COc1cc(N[C@H](C)C[C@@H]2CCCCC[NH2+]2)ccc1F ZINC000160149420 330859811 /nfs/dbraw/zinc/85/98/11/330859811.db2.gz ATVYYYPHQNAFFB-OLZOCXBDSA-N 1 0 280.387 3.557 20 70 CHIDRO C[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1CCC(C)(C)O1 ZINC000160259721 330862242 /nfs/dbraw/zinc/86/22/42/330862242.db2.gz BVNXBVXFNQFKLL-HOCLYGCPSA-N 1 0 261.409 3.555 20 70 CHIDRO Clc1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1Cl ZINC000217643158 333122271 /nfs/dbraw/zinc/12/22/71/333122271.db2.gz ZXGBOJKXNRPUAS-CABCVRRESA-N 1 0 299.245 3.710 20 70 CHIDRO Cc1ccc(C)c([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c1 ZINC000217639571 333122302 /nfs/dbraw/zinc/12/23/02/333122302.db2.gz FUGUQYHACDBWBM-JQHSSLGASA-N 1 0 272.436 3.581 20 70 CHIDRO CCc1ccc([C@H](C)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000217668462 333122696 /nfs/dbraw/zinc/12/26/96/333122696.db2.gz FYWAVYUZVAJWCB-WBAXXEDZSA-N 1 0 272.436 3.526 20 70 CHIDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)CCc1ccccc1 ZINC000217938267 333125323 /nfs/dbraw/zinc/12/53/23/333125323.db2.gz LLWFUKHKAVFPGZ-BHYGNILZSA-N 1 0 261.409 3.555 20 70 CHIDRO CC(C)CCC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000161481639 519634124 /nfs/dbraw/zinc/63/41/24/519634124.db2.gz BAJMEAPPIXVPGD-UHFFFAOYSA-N 1 0 294.483 3.582 20 70 CHIDRO CC(C)c1noc(CCC[NH2+][C@@H](C)c2cccs2)n1 ZINC000160774211 519901956 /nfs/dbraw/zinc/90/19/56/519901956.db2.gz MBYFHOOWJLUZGP-NSHDSACASA-N 1 0 279.409 3.538 20 70 CHIDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cnn(CC)c2)C1(CC)CC ZINC000161305978 520434214 /nfs/dbraw/zinc/43/42/14/520434214.db2.gz DBMDORLRVYRYLW-CWRNSKLLSA-N 1 0 293.455 3.537 20 70 CHIDRO CCO[C@H]1C[C@@H]([NH2+][C@@H](C)c2cncc(F)c2)C1(CC)CC ZINC000161310498 520552070 /nfs/dbraw/zinc/55/20/70/520552070.db2.gz ZRWDJPSUHHWZEZ-MAZHCROVSA-N 1 0 294.414 3.855 20 70 CHIDRO CC[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccccc1 ZINC000161447231 522626656 /nfs/dbraw/zinc/62/66/56/522626656.db2.gz UOZBFKXBBJQIBO-MSOLQXFVSA-N 1 0 269.388 3.503 20 70 CHIDRO C[C@@H]1CCC[C@H](C)C1[NH2+][C@@H](CCCO)c1ccccc1 ZINC000160822476 524349545 /nfs/dbraw/zinc/34/95/45/524349545.db2.gz QRYPHCNYPWYUDI-HZSIZEEPSA-N 1 0 275.436 3.915 20 70 CHIDRO C[C@H]1C[C@@H]([NH2+]CCSc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000160047308 261203065 /nfs/dbraw/zinc/20/30/65/261203065.db2.gz YIEHLRMYFULKNR-JSGCOSHPSA-N 1 0 298.883 3.504 20 70 CHIDRO C[C@H]([NH2+]CCSc1ccc(Cl)cc1)c1cnn(C)c1 ZINC000160064916 261203719 /nfs/dbraw/zinc/20/37/19/261203719.db2.gz JFVZXRFXSVJTDC-NSHDSACASA-N 1 0 295.839 3.516 20 70 CHIDRO CC[C@@H](C[NH2+][C@H](C)c1cncs1)Oc1ccccc1F ZINC000160314464 261210542 /nfs/dbraw/zinc/21/05/42/261210542.db2.gz RIOFZSCRFPIGRR-NEPJUHHUSA-N 1 0 294.395 3.790 20 70 CHIDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cn3c(cccc3C)n1)CC2 ZINC000160324207 261210865 /nfs/dbraw/zinc/21/08/65/261210865.db2.gz VMLSDNGRULSFOE-GOSISDBHSA-N 1 0 291.398 3.728 20 70 CHIDRO CC1(C)C[C@H]([NH2+]Cc2cc3ccccc3s2)CCO1 ZINC000160594880 261218848 /nfs/dbraw/zinc/21/88/48/261218848.db2.gz OTJSGCGBSOKXBV-CYBMUJFWSA-N 1 0 275.417 3.949 20 70 CHIDRO COCc1ccc(CN(C)Cc2ccc(Cl)cc2)o1 ZINC000160805603 261227129 /nfs/dbraw/zinc/22/71/29/261227129.db2.gz CYZXDNRAOYPAGV-UHFFFAOYSA-N 1 0 279.767 3.711 20 70 CHIDRO CC[C@@H]([NH2+]CCc1nccs1)c1ccc(F)cc1F ZINC000160845355 261227871 /nfs/dbraw/zinc/22/78/71/261227871.db2.gz UVIPEHITACSGOM-CYBMUJFWSA-N 1 0 282.359 3.705 20 70 CHIDRO Cc1ccc(SCC[NH2+][C@H](C)c2cncc(F)c2)cc1 ZINC000160835117 261228249 /nfs/dbraw/zinc/22/82/49/261228249.db2.gz KITJNMPHLWMECT-CYBMUJFWSA-N 1 0 290.407 3.972 20 70 CHIDRO Cc1ccc(C(=O)CC[N@@H+](C)[C@@H](C)c2ccccn2)cc1 ZINC000161189601 261239919 /nfs/dbraw/zinc/23/99/19/261239919.db2.gz JPDQBAHUHQGSGF-HNNXBMFYSA-N 1 0 282.387 3.656 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccc(OC)cc1 ZINC000161478495 261247846 /nfs/dbraw/zinc/24/78/46/261247846.db2.gz HGOPCWADTOSGHO-PKOBYXMFSA-N 1 0 299.414 3.512 20 70 CHIDRO CC[C@@H]1CCC[N@H+](Cc2nnc(-c3cc(C)oc3C)o2)C1 ZINC000161399835 264278765 /nfs/dbraw/zinc/27/87/65/264278765.db2.gz KPFFUUUFPBUZIV-CYBMUJFWSA-N 1 0 289.379 3.568 20 70 CHIDRO Cc1ccccc1[C@@H](C)[NH2+]CCCc1nc(C(C)C)no1 ZINC000160808275 328087075 /nfs/dbraw/zinc/08/70/75/328087075.db2.gz WUCHZQGLJGOCJZ-CQSZACIVSA-N 1 0 287.407 3.785 20 70 CHIDRO CC[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)C[C@@H]1C)C1CC1 ZINC000160766864 328083886 /nfs/dbraw/zinc/08/38/86/328083886.db2.gz GXCBAVBJMGHLBG-ZYSHUDEJSA-N 1 0 286.463 3.675 20 70 CHIDRO c1cc2c(s1)CCC[C@@H]2[NH2+]Cc1cccc2c[nH]nc21 ZINC000160970326 328101227 /nfs/dbraw/zinc/10/12/27/328101227.db2.gz YBJFDZKEHVMBLA-AWEZNQCLSA-N 1 0 283.400 3.792 20 70 CHIDRO CC[C@H]1CCCN(C(C)(C)C[NH2+][C@@H](C)c2cncs2)C1 ZINC000161015959 328118054 /nfs/dbraw/zinc/11/80/54/328118054.db2.gz DANNSOONEHIHND-KBPBESRZSA-N 1 0 295.496 3.694 20 70 CHIDRO CC[C@@H](C)NC(=O)c1cccc(C[NH2+][C@H](CC)C(C)C)c1 ZINC000161102958 328131826 /nfs/dbraw/zinc/13/18/26/328131826.db2.gz VGXQIOPCSOZFGQ-RHSMWYFYSA-N 1 0 290.451 3.739 20 70 CHIDRO C[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1cc2ccccc2o1 ZINC000161127861 328135433 /nfs/dbraw/zinc/13/54/33/328135433.db2.gz RIHRVXKZEWKKBT-IMJJTQAJSA-N 1 0 286.419 3.956 20 70 CHIDRO COc1ccc(CC[NH2+][C@@H](C)c2ccccn2)c(Cl)c1 ZINC000159377589 327175925 /nfs/dbraw/zinc/17/59/25/327175925.db2.gz UIOBVASGAQPLHS-LBPRGKRZSA-N 1 0 290.794 3.637 20 70 CHIDRO COc1ccc([C@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)cc1 ZINC000159419391 327183778 /nfs/dbraw/zinc/18/37/78/327183778.db2.gz QXCRESYWPXOQDW-YOEHRIQHSA-N 1 0 279.424 3.533 20 70 CHIDRO Cc1cnc([C@@H]([NH2+]CCC(C)(C)C)C2CC2)s1 ZINC000159703635 327555469 /nfs/dbraw/zinc/55/54/69/327555469.db2.gz GRQMBROURYVTGG-LBPRGKRZSA-N 1 0 252.427 3.928 20 70 CHIDRO Cc1cnc([C@H]([NH2+]CCC(C)(C)C)C2CC2)s1 ZINC000159703529 327555473 /nfs/dbraw/zinc/55/54/73/327555473.db2.gz GRQMBROURYVTGG-GFCCVEGCSA-N 1 0 252.427 3.928 20 70 CHIDRO C[C@H](C[NH2+][C@H](C)C(C)(C)C)N1CCc2sccc2C1 ZINC000159873753 327573128 /nfs/dbraw/zinc/57/31/28/327573128.db2.gz KZPRAZFGPJZRJP-CHWSQXEVSA-N 1 0 280.481 3.519 20 70 CHIDRO Cc1ccccc1OCC[NH2+][C@H](C)c1ccccc1F ZINC000216625125 329295347 /nfs/dbraw/zinc/29/53/47/329295347.db2.gz DVYKWQDSGJVFGE-CQSZACIVSA-N 1 0 273.351 3.864 20 70 CHIDRO CCSc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2O)cc1 ZINC000159514171 330848593 /nfs/dbraw/zinc/84/85/93/330848593.db2.gz SDVPMCNAAIDBPM-RCBQFDQVSA-N 1 0 279.449 3.753 20 70 CHIDRO CCSCC[C@@H](C)[NH2+][C@@H]1CCc2ccc(OC)cc2C1 ZINC000159565847 330849070 /nfs/dbraw/zinc/84/90/70/330849070.db2.gz YPXDTHQDARVXCJ-CZUORRHYSA-N 1 0 293.476 3.674 20 70 CHIDRO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C1(C)C)c1ccc(Cl)cc1 ZINC000159978870 330855923 /nfs/dbraw/zinc/85/59/23/330855923.db2.gz VUCDVYVTMXYPSH-QOWREQOWSA-N 1 0 279.811 3.804 20 70 CHIDRO C[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc2c(c1)CCC2 ZINC000159988069 330856492 /nfs/dbraw/zinc/85/64/92/330856492.db2.gz DZZKRKMFQUTXAT-CXAGYDPISA-N 1 0 273.420 3.784 20 70 CHIDRO Cc1cc(N[C@H]2CCOC(C)(C)C2)c2ccccc2[nH+]1 ZINC000160635981 330870602 /nfs/dbraw/zinc/87/06/02/330870602.db2.gz OHHFALINFMTSEW-ZDUSSCGKSA-N 1 0 270.376 3.913 20 70 CHIDRO Fc1cc(Cl)ccc1C[NH2+]C[C@@H]1Cc2ccccc2O1 ZINC000160783962 330875707 /nfs/dbraw/zinc/87/57/07/330875707.db2.gz YFHTXBWSMUHABR-AWEZNQCLSA-N 1 0 291.753 3.572 20 70 CHIDRO CC(C)(C)[NH+]1CCC(NCc2cc(F)cc(Cl)c2)CC1 ZINC000160902813 330879194 /nfs/dbraw/zinc/87/91/94/330879194.db2.gz SHANNOSZGKIZJX-UHFFFAOYSA-N 1 0 298.833 3.832 20 70 CHIDRO C1CC1N1CCC([NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1 ZINC000217791029 333123977 /nfs/dbraw/zinc/12/39/77/333123977.db2.gz XFPZYZCNZNNMGR-BFYDXBDKSA-N 1 0 276.468 3.562 20 70 CHIDRO Cc1ccc(C[C@H](C)[NH2+]Cc2cnn(C(C)C)c2)s1 ZINC000217819623 333124080 /nfs/dbraw/zinc/12/40/80/333124080.db2.gz UQVPHYXCQMBWOH-LBPRGKRZSA-N 1 0 277.437 3.555 20 70 CHIDRO Fc1ccc(C[NH2+]Cc2cccc3cc[nH]c32)c(F)c1 ZINC000218164739 333128222 /nfs/dbraw/zinc/12/82/22/333128222.db2.gz GVNWQFULADNZKC-UHFFFAOYSA-N 1 0 272.298 3.736 20 70 CHIDRO CC(C)(C)[NH+]1CCC(NCc2coc3ccccc23)CC1 ZINC000161093502 518708200 /nfs/dbraw/zinc/70/82/00/518708200.db2.gz GDFRXYSUEPQFIV-UHFFFAOYSA-N 1 0 286.419 3.785 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1F ZINC000160560421 522864705 /nfs/dbraw/zinc/86/47/05/522864705.db2.gz JVYAQTDVXINURF-LYRGGWFBSA-N 1 0 283.362 3.557 20 70 CHIDRO CC[C@@H]([NH2+][C@H](C)COC)c1cccc(Cl)c1F ZINC000161469538 522933020 /nfs/dbraw/zinc/93/30/20/522933020.db2.gz QQPDQLBMZAOKCX-BXKDBHETSA-N 1 0 259.752 3.555 20 70 CHIDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000161426849 523198238 /nfs/dbraw/zinc/19/82/38/523198238.db2.gz NFWKTSZISWXZAM-BZPMIXESSA-N 1 0 282.453 3.909 20 70 CHIDRO C[N@@H+](Cc1csc(C2CC2)n1)CC1CCCC1 ZINC000161504488 523526344 /nfs/dbraw/zinc/52/63/44/523526344.db2.gz QESPRJVGUZWAGF-UHFFFAOYSA-N 1 0 250.411 3.643 20 70 CHIDRO C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cncs1 ZINC000160969656 525485160 /nfs/dbraw/zinc/48/51/60/525485160.db2.gz BORNZYQHDFIJHJ-YPMHNXCESA-N 1 0 258.390 3.524 20 70 CHIDRO COc1ccc2cc(C[NH2+][C@H]3CCOC(C)(C)C3)ccc2c1 ZINC000160474319 525631029 /nfs/dbraw/zinc/63/10/29/525631029.db2.gz FMCFRDGVHFIZBY-KRWDZBQOSA-N 1 0 299.414 3.896 20 70 CHIDRO Cc1ccc(C(=O)CC[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1 ZINC000160360340 526046071 /nfs/dbraw/zinc/04/60/71/526046071.db2.gz OEFBWERMWQWFEM-KRWDZBQOSA-N 1 0 282.387 3.733 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@@H](C)c2ccco2)n1 ZINC000160687894 261222095 /nfs/dbraw/zinc/22/20/95/261222095.db2.gz WFGIGEJZNADJPA-LBPRGKRZSA-N 1 0 264.394 3.718 20 70 CHIDRO C[C@@H]([NH2+][C@H]1CCCc2cc(F)ccc21)c1cccnc1 ZINC000159536983 261188181 /nfs/dbraw/zinc/18/81/81/261188181.db2.gz CBHAIDGDEWRYAB-PXAZEXFGSA-N 1 0 270.351 3.949 20 70 CHIDRO Cc1ccc(C[NH2+]C2CC(C)C2)c(Br)c1 ZINC000159642241 261190141 /nfs/dbraw/zinc/19/01/41/261190141.db2.gz OLYUZBJZTQIRHV-UHFFFAOYSA-N 1 0 268.198 3.646 20 70 CHIDRO CC[C@@H]([NH2+]C[C@](C)(O)c1ccsc1)c1ccccc1 ZINC000159929463 261198894 /nfs/dbraw/zinc/19/88/94/261198894.db2.gz OZSZSGFJIWBLIU-CVEARBPZSA-N 1 0 275.417 3.697 20 70 CHIDRO CC(C)CSCCC[NH2+][C@H](C)c1ccncc1 ZINC000160026772 261202212 /nfs/dbraw/zinc/20/22/12/261202212.db2.gz UZCUKWSXVMOUOR-CYBMUJFWSA-N 1 0 252.427 3.512 20 70 CHIDRO C[C@@H]1C[C@@H]([NH2+]CCSc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000160047162 261202993 /nfs/dbraw/zinc/20/29/93/261202993.db2.gz YIEHLRMYFULKNR-OCCSQVGLSA-N 1 0 298.883 3.504 20 70 CHIDRO CC[C@H](C)C[N@H+](CC)[C@@H](C)c1nc(-c2cccnc2)no1 ZINC000160589567 261219149 /nfs/dbraw/zinc/21/91/49/261219149.db2.gz HSVGANPBUWZQDZ-STQMWFEESA-N 1 0 288.395 3.561 20 70 CHIDRO Cc1ccc([C@@H](C)C[NH2+][C@H](C)c2cccnc2)cc1 ZINC000161052411 261235133 /nfs/dbraw/zinc/23/51/33/261235133.db2.gz CTKFEXDCMWPURP-LSDHHAIUSA-N 1 0 254.377 3.844 20 70 CHIDRO Cc1ccc(C(=O)CC[N@@H+](C)[C@H](C)c2cccnc2)cc1 ZINC000161188441 261240090 /nfs/dbraw/zinc/24/00/90/261240090.db2.gz NKWLUIJQGSAJMO-OAHLLOKOSA-N 1 0 282.387 3.656 20 70 CHIDRO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(C)nc1 ZINC000161315889 261243222 /nfs/dbraw/zinc/24/32/22/261243222.db2.gz AAHGGPNXLSEZTA-LBPRGKRZSA-N 1 0 290.794 3.903 20 70 CHIDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1cncs1 ZINC000161356721 261245558 /nfs/dbraw/zinc/24/55/58/261245558.db2.gz FYWAWKORYYCMQM-NSHDSACASA-N 1 0 276.380 3.665 20 70 CHIDRO CSC[C@H](CCO)[NH2+][C@@H](CC(C)C)c1cccs1 ZINC000160310980 261358082 /nfs/dbraw/zinc/35/80/82/261358082.db2.gz PKVLEPRVYOPOLA-STQMWFEESA-N 1 0 287.494 3.539 20 70 CHIDRO OCC1(C[NH2+]C2CC(c3ccc(Cl)cc3)C2)CCCC1 ZINC000160103082 262504031 /nfs/dbraw/zinc/50/40/31/262504031.db2.gz CXTUBQZKZLOHLS-UHFFFAOYSA-N 1 0 293.838 3.728 20 70 CHIDRO C[C@H]([NH3+])C(=O)Nc1cccc(CSC2CCCCC2)c1 ZINC000161029740 264269705 /nfs/dbraw/zinc/26/97/05/264269705.db2.gz GBWORMQCQMKXSJ-LBPRGKRZSA-N 1 0 292.448 3.538 20 70 CHIDRO CC[C@H]1CCC[N@H+](Cc2nnc(-c3cc(C)oc3C)o2)C1 ZINC000161399960 264278712 /nfs/dbraw/zinc/27/87/12/264278712.db2.gz KPFFUUUFPBUZIV-ZDUSSCGKSA-N 1 0 289.379 3.568 20 70 CHIDRO C[C@@H]([NH2+]CC(C)(C)O)c1ccc(-c2ccc(F)cc2)s1 ZINC000160624915 327633377 /nfs/dbraw/zinc/63/33/77/327633377.db2.gz PVPYILIXYLWDKK-LLVKDONJSA-N 1 0 293.407 3.976 20 70 CHIDRO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)nc1 ZINC000160781480 328084169 /nfs/dbraw/zinc/08/41/69/328084169.db2.gz DKCZZULQNPZJJT-ZDUSSCGKSA-N 1 0 258.340 3.722 20 70 CHIDRO COc1ccc(C[N@H+](C)Cc2sccc2C)c(OC)c1 ZINC000160836509 328088019 /nfs/dbraw/zinc/08/80/19/328088019.db2.gz KQGZWINTPLYYOF-UHFFFAOYSA-N 1 0 291.416 3.706 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2ccccc2)o1 ZINC000160851168 328088651 /nfs/dbraw/zinc/08/86/51/328088651.db2.gz WYCMYRGNRUSWJA-UHFFFAOYSA-N 1 0 281.359 3.610 20 70 CHIDRO CCCCC1CCC([NH2+][C@@H](C)c2cnccn2)CC1 ZINC000161172055 328150890 /nfs/dbraw/zinc/15/08/90/328150890.db2.gz UTSCUHXQKCTYHD-NFOMZHRRSA-N 1 0 261.413 3.876 20 70 CHIDRO CCC[C@H]([NH2+]C[C@@]1(C)CCCS1)c1ccccn1 ZINC000159368067 327175015 /nfs/dbraw/zinc/17/50/15/327175015.db2.gz KNOCCKXPCXGHCD-DZGCQCFKSA-N 1 0 264.438 3.798 20 70 CHIDRO CC[N@H+](CCOC1CCCCCC1)CCc1nccs1 ZINC000159380559 327175954 /nfs/dbraw/zinc/17/59/54/327175954.db2.gz NRESERBVOKYYFI-UHFFFAOYSA-N 1 0 296.480 3.747 20 70 CHIDRO CCS[C@@H]1CCC[C@H]([NH2+]C(C2CC2)C2CC2)C1 ZINC000159391963 327177626 /nfs/dbraw/zinc/17/76/26/327177626.db2.gz DCAJNCUYDGSVCH-UONOGXRCSA-N 1 0 253.455 3.829 20 70 CHIDRO C[C@H](c1ccc(F)c(Cl)c1)[N@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159484216 327200541 /nfs/dbraw/zinc/20/05/41/327200541.db2.gz AXXAACWMRYLIHF-GMXABZIVSA-N 1 0 285.790 3.633 20 70 CHIDRO Fc1cc(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)ccc1Cl ZINC000159496957 327208645 /nfs/dbraw/zinc/20/86/45/327208645.db2.gz XOUSHKQLZIHJLZ-DFBGVHRSSA-N 1 0 295.785 3.526 20 70 CHIDRO C[C@H](CCc1ccc(F)cc1)[NH2+][C@@H]1CCCSC1 ZINC000159652747 327551030 /nfs/dbraw/zinc/55/10/30/327551030.db2.gz IRUIDDRELVWVNC-IUODEOHRSA-N 1 0 267.413 3.632 20 70 CHIDRO C[C@H]([NH2+]CCOc1ccc(F)cc1)c1ccc(F)cc1F ZINC000216625857 329295474 /nfs/dbraw/zinc/29/54/74/329295474.db2.gz BYWMDJUOPJRWIB-NSHDSACASA-N 1 0 295.304 3.834 20 70 CHIDRO CCC[C@H](C(=O)NC[C@H](c1cccs1)[NH+](C)C)C(C)C ZINC000161274585 329922707 /nfs/dbraw/zinc/92/27/07/329922707.db2.gz UGUNKBYMHWYUMY-UONOGXRCSA-N 1 0 296.480 3.539 20 70 CHIDRO C[C@H](CCC(C)(C)C)NC(=O)[C@@H](C)[C@H]([NH3+])c1ccccc1 ZINC000159770342 330851209 /nfs/dbraw/zinc/85/12/09/330851209.db2.gz ZKNLTQTVYYDKDI-YCPHGPKFSA-N 1 0 290.451 3.654 20 70 CHIDRO CC[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(F)cc1 ZINC000159978902 330855990 /nfs/dbraw/zinc/85/59/90/330855990.db2.gz LODOBQDJWDIGOM-CABCVRRESA-N 1 0 265.372 3.824 20 70 CHIDRO OCC1(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)CCCC1 ZINC000160102813 330858835 /nfs/dbraw/zinc/85/88/35/330858835.db2.gz QFCUHTNSCYMOSM-INIZCTEOSA-N 1 0 293.838 3.933 20 70 CHIDRO CCc1ccc([C@@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)cc1 ZINC000160227704 330861611 /nfs/dbraw/zinc/86/16/11/330861611.db2.gz MOAQNOCYYBTVIW-CZUORRHYSA-N 1 0 261.409 3.857 20 70 CHIDRO Fc1cc(Cl)ccc1C[NH2+]CCOC1CCCCC1 ZINC000160824867 330876719 /nfs/dbraw/zinc/87/67/19/330876719.db2.gz OOZQMPHOEQQKSV-UHFFFAOYSA-N 1 0 285.790 3.918 20 70 CHIDRO CC(C)Oc1ccc([C@@H](C)[NH2+][C@H](C)C2CCOCC2)cc1 ZINC000160876432 330878469 /nfs/dbraw/zinc/87/84/69/330878469.db2.gz QUNUPSQZKDTXHF-HUUCEWRRSA-N 1 0 291.435 3.940 20 70 CHIDRO C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccccc1Cl ZINC000217661365 333122707 /nfs/dbraw/zinc/12/27/07/333122707.db2.gz JLGVEMDMRABGMD-RCBQFDQVSA-N 1 0 278.827 3.617 20 70 CHIDRO Cc1ccc([C@H](C)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1C ZINC000217662239 333122736 /nfs/dbraw/zinc/12/27/36/333122736.db2.gz HENHVGIBNBVROP-SZMVWBNQSA-N 1 0 272.436 3.581 20 70 CHIDRO Cc1ccc([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)c1 ZINC000217679790 333122955 /nfs/dbraw/zinc/12/29/55/333122955.db2.gz BDFINFGRKQCJSI-JQHSSLGASA-N 1 0 272.436 3.581 20 70 CHIDRO C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(F)cc1Cl ZINC000218128342 333127320 /nfs/dbraw/zinc/12/73/20/333127320.db2.gz LEPHGNGSWWXJLI-UVBJJODRSA-N 1 0 296.817 3.757 20 70 CHIDRO c1ccc(C(C[NH2+][C@@H]2CCSC2)c2ccccc2)cc1 ZINC000218579686 333133541 /nfs/dbraw/zinc/13/35/41/333133541.db2.gz NDVDQDZXUPPNQD-QGZVFWFLSA-N 1 0 283.440 3.914 20 70 CHIDRO CCS[C@H]1CCC[C@@H]([NH2+][C@H](CC)c2cnn(C)c2)C1 ZINC000159376905 521731364 /nfs/dbraw/zinc/73/13/64/521731364.db2.gz UBPQVXQTFAUOBS-QLFBSQMISA-N 1 0 281.469 3.525 20 70 CHIDRO CCSc1ccccc1[C@H](C)[NH2+]C1CCN(C)CC1 ZINC000161457628 521781008 /nfs/dbraw/zinc/78/10/08/521781008.db2.gz RWMMPZRVPOJPTG-ZDUSSCGKSA-N 1 0 278.465 3.543 20 70 CHIDRO C[C@H]([NH2+]Cc1ccc(N2CCCCCC2)nc1)C1(C)CC1 ZINC000160548779 525445198 /nfs/dbraw/zinc/44/51/98/525445198.db2.gz VCHPEKHIKXDIBO-HNNXBMFYSA-N 1 0 287.451 3.740 20 70 CHIDRO c1oc2ccccc2c1C[NH2+]CCOc1ccccc1 ZINC000161097678 526626918 /nfs/dbraw/zinc/62/69/18/526626918.db2.gz WQYNLPBJKLUBCL-UHFFFAOYSA-N 1 0 267.328 3.601 20 70 CHIDRO COCc1ccc(C[NH2+][C@H]2CCCc3sccc32)o1 ZINC000160986134 260203171 /nfs/dbraw/zinc/20/31/71/260203171.db2.gz PLYUOTUDJXXPNS-AWEZNQCLSA-N 1 0 277.389 3.655 20 70 CHIDRO CCC(CC)(CO)C[NH2+][C@H](C)c1cc(C)ccc1C ZINC000161463396 260976540 /nfs/dbraw/zinc/97/65/40/260976540.db2.gz MXILBHVNLOYWLQ-OAHLLOKOSA-N 1 0 263.425 3.753 20 70 CHIDRO C[C@H]([NH2+]CCC1Cc2ccccc2C1)c1ccncc1 ZINC000159739202 261192941 /nfs/dbraw/zinc/19/29/41/261192941.db2.gz VHHKVYOTEPOJHJ-AWEZNQCLSA-N 1 0 266.388 3.537 20 70 CHIDRO COc1ccc2oc([C@H](C)[NH2+]CCC(C)(C)O)c(C)c2c1 ZINC000159833075 261195218 /nfs/dbraw/zinc/19/52/18/261195218.db2.gz HOFHLLRSHGFJEH-LBPRGKRZSA-N 1 0 291.391 3.561 20 70 CHIDRO c1ccc2c(N[C@@H]3CCO[C@@H](C4CC4)C3)cc[nH+]c2c1 ZINC000160319467 261210954 /nfs/dbraw/zinc/21/09/54/261210954.db2.gz MKVPZVQONRPXCO-CXAGYDPISA-N 1 0 268.360 3.604 20 70 CHIDRO CC1(C)C[C@H]([NH2+]Cc2cccc(-c3cccnc3)c2)CCO1 ZINC000160460511 261214437 /nfs/dbraw/zinc/21/44/37/261214437.db2.gz YBRQGOVQYOJJNS-GOSISDBHSA-N 1 0 296.414 3.796 20 70 CHIDRO Cc1cccc(C)c1CC[NH2+][C@H](C)c1cccnc1 ZINC000160612414 261219723 /nfs/dbraw/zinc/21/97/23/261219723.db2.gz TXTMDIAWGMUWHZ-OAHLLOKOSA-N 1 0 254.377 3.592 20 70 CHIDRO Cc1ccc2ncc(C[NH2+][C@@H]3CCCc4sccc43)n2c1 ZINC000160992908 261233592 /nfs/dbraw/zinc/23/35/92/261233592.db2.gz JZFJGUMVOJVSKA-OAHLLOKOSA-N 1 0 297.427 3.871 20 70 CHIDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1cncc(F)c1 ZINC000161370886 261245514 /nfs/dbraw/zinc/24/55/14/261245514.db2.gz WFMLBUNDASVCBE-GFCCVEGCSA-N 1 0 288.341 3.742 20 70 CHIDRO C[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccc(Cl)s1 ZINC000161448714 261246717 /nfs/dbraw/zinc/24/67/17/261246717.db2.gz ANMSOVPLBVMVNJ-WCQYABFASA-N 1 0 295.835 3.828 20 70 CHIDRO CSc1ccc([C@H](C)[NH2+]C[C@H]2CCCC[C@@H]2O)cc1F ZINC000160520384 327617930 /nfs/dbraw/zinc/61/79/30/327617930.db2.gz SKJSZRDIQXNPGJ-LNSITVRQSA-N 1 0 297.439 3.749 20 70 CHIDRO CC[C@@H]([NH2+]CCCCc1nc(C)cs1)C(C)C ZINC000160687753 327971802 /nfs/dbraw/zinc/97/18/02/327971802.db2.gz ZAPDUIGAXQOAKV-CYBMUJFWSA-N 1 0 254.443 3.798 20 70 CHIDRO Cc1ccccc1C[C@@H](C)[NH2+][C@@H](C)CC(F)(F)F ZINC000160774453 328084164 /nfs/dbraw/zinc/08/41/64/328084164.db2.gz NKMFTMORGGLIBY-NEPJUHHUSA-N 1 0 259.315 3.857 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2ccc(C)cc2)o1 ZINC000160842266 328088214 /nfs/dbraw/zinc/08/82/14/328088214.db2.gz BBHBUEOHDZHAET-UHFFFAOYSA-N 1 0 295.386 3.919 20 70 CHIDRO CCOc1cc(C[N@H+](C)Cc2ccc(C)o2)ccc1OC ZINC000160856372 328089086 /nfs/dbraw/zinc/08/90/86/328089086.db2.gz JMBPAGCJSGCJIA-UHFFFAOYSA-N 1 0 289.375 3.627 20 70 CHIDRO C[C@H]([NH2+][C@H](CCO)c1ccccc1)[C@@H](C)c1ccccc1 ZINC000160972965 328104833 /nfs/dbraw/zinc/10/48/33/328104833.db2.gz HULPAPSLCLUSLR-JTDSTZFVSA-N 1 0 283.415 3.892 20 70 CHIDRO Cc1ccc(C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)nc1 ZINC000161168183 328138502 /nfs/dbraw/zinc/13/85/02/328138502.db2.gz OPDFETDURABNAE-RDJZCZTQSA-N 1 0 266.388 3.768 20 70 CHIDRO CC[N@H+](CCO[C@H]1CCCC[C@@H]1C)CCc1nccs1 ZINC000159432508 327189483 /nfs/dbraw/zinc/18/94/83/327189483.db2.gz RXWQAGULVFZEMX-GJZGRUSLSA-N 1 0 296.480 3.603 20 70 CHIDRO C[C@H](CCc1cccc(F)c1)[NH2+][C@H]1CCCSC1 ZINC000159573913 327540182 /nfs/dbraw/zinc/54/01/82/327540182.db2.gz FGWXHQJQPSQMRM-DOMZBBRYSA-N 1 0 267.413 3.632 20 70 CHIDRO COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H]2CCCSC2)cc1 ZINC000159605907 327546332 /nfs/dbraw/zinc/54/63/32/327546332.db2.gz LWAJDNKMDKUWEZ-VNHYZAJKSA-N 1 0 279.449 3.672 20 70 CHIDRO COc1ccc(Cl)cc1[C@H](C)[NH2+][C@H]1CCCSC1 ZINC000159634067 327548375 /nfs/dbraw/zinc/54/83/75/327548375.db2.gz QKBQFOSORUWFPG-JQWIXIFHSA-N 1 0 285.840 3.895 20 70 CHIDRO C[C@@H]([NH2+]CCC1CCN(CC(F)(F)F)CC1)C(C)(C)C ZINC000160026247 327587408 /nfs/dbraw/zinc/58/74/08/327587408.db2.gz CTQYBNDPBIBIPP-GFCCVEGCSA-N 1 0 294.405 3.675 20 70 CHIDRO CC[C@H](C[NH2+][C@H](C)[C@@H]1CCOC1)Oc1ccccc1Cl ZINC000160438375 327609256 /nfs/dbraw/zinc/60/92/56/327609256.db2.gz AFSDCTURVJDTLB-MGPQQGTHSA-N 1 0 297.826 3.512 20 70 CHIDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C)nc1)CCCO2 ZINC000161295046 329925918 /nfs/dbraw/zinc/92/59/18/329925918.db2.gz QVSDWFLUKKKOJN-KRWDZBQOSA-N 1 0 282.387 3.702 20 70 CHIDRO C[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc2c(c1)CCC2 ZINC000159988311 330856437 /nfs/dbraw/zinc/85/64/37/330856437.db2.gz DZZKRKMFQUTXAT-DYVFJYSZSA-N 1 0 273.420 3.784 20 70 CHIDRO Fc1ccc(C[NH2+]C2CCSCC2)cc1C(F)(F)F ZINC000160147066 330859754 /nfs/dbraw/zinc/85/97/54/330859754.db2.gz FFUUMTLWZHGITB-UHFFFAOYSA-N 1 0 293.329 3.830 20 70 CHIDRO Cc1ccccc1NC(=O)C[NH2+][C@H]1CCCC[C@@H]1C(C)C ZINC000160345833 330863219 /nfs/dbraw/zinc/86/32/19/330863219.db2.gz WBSTUUVDLSOBCK-WBVHZDCISA-N 1 0 288.435 3.738 20 70 CHIDRO Fc1cc(Cl)cc(C[NH2+]C[C@H]2Cc3ccccc3O2)c1 ZINC000160904496 330879111 /nfs/dbraw/zinc/87/91/11/330879111.db2.gz STTJSSWQNXIEDK-OAHLLOKOSA-N 1 0 291.753 3.572 20 70 CHIDRO CC[C@H](C)N(C)CC[NH2+]Cc1csc2ccccc12 ZINC000217395197 333120861 /nfs/dbraw/zinc/12/08/61/333120861.db2.gz AMJIRAXJRAMANZ-ZDUSSCGKSA-N 1 0 276.449 3.721 20 70 CHIDRO Cc1ccc(C)c([C@H](C)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c1 ZINC000217639737 333122239 /nfs/dbraw/zinc/12/22/39/333122239.db2.gz FUGUQYHACDBWBM-SZMVWBNQSA-N 1 0 272.436 3.581 20 70 CHIDRO CC(C)c1cccc(N[C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1 ZINC000217933436 333125177 /nfs/dbraw/zinc/12/51/77/333125177.db2.gz IKGDXOZUNUJGBS-JJRVBVJISA-N 1 0 260.425 3.951 20 70 CHIDRO C[C@H](Cc1cccs1)[NH2+]Cc1cccc2cc[nH]c21 ZINC000218090331 333126734 /nfs/dbraw/zinc/12/67/34/333126734.db2.gz OACCKSHXJLRDQK-GFCCVEGCSA-N 1 0 270.401 3.950 20 70 CHIDRO c1ccc2c(c1)-c1ccccc1C2[NH2+][C@@H]1CCSC1 ZINC000218600016 333133978 /nfs/dbraw/zinc/13/39/78/333133978.db2.gz XMPNJZSWUSYOFQ-GFCCVEGCSA-N 1 0 267.397 3.852 20 70 CHIDRO CC[N@H+](Cc1nnc(-c2cc(C)oc2C)o1)C1CCCC1 ZINC000161413680 521461146 /nfs/dbraw/zinc/46/11/46/521461146.db2.gz XJJXGXCABJOBKY-UHFFFAOYSA-N 1 0 289.379 3.711 20 70 CHIDRO CC[C@H]([NH2+]CC(CC)(CC)CO)c1ccc(C)cc1 ZINC000161431332 522570896 /nfs/dbraw/zinc/57/08/96/522570896.db2.gz UHELGPOUMFUIMU-INIZCTEOSA-N 1 0 263.425 3.834 20 70 CHIDRO CC[C@@H]([NH2+]CCCOC)c1cccc(Cl)c1F ZINC000161478769 522829555 /nfs/dbraw/zinc/82/95/55/522829555.db2.gz SHTLUGXVXICYMB-GFCCVEGCSA-N 1 0 259.752 3.556 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccccc1 ZINC000161447094 522850231 /nfs/dbraw/zinc/85/02/31/522850231.db2.gz UOZBFKXBBJQIBO-ZWKOTPCHSA-N 1 0 269.388 3.503 20 70 CHIDRO Cc1ccc(C)c([C@H](C)N(C)C(=O)c2ccc(C[NH3+])cc2)c1 ZINC000161307631 524208745 /nfs/dbraw/zinc/20/87/45/524208745.db2.gz SMZZWXHCCXFECK-HNNXBMFYSA-N 1 0 296.414 3.595 20 70 CHIDRO C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cncc(F)c1 ZINC000160992319 525486045 /nfs/dbraw/zinc/48/60/45/525486045.db2.gz RKNQUYDZTAATDQ-OCCSQVGLSA-N 1 0 270.351 3.601 20 70 CHIDRO CCc1oc2ccccc2c1C[N@H+](C)CCSC ZINC000216771193 227392762 /nfs/dbraw/zinc/39/27/62/227392762.db2.gz ZMLBIWDTEUOSAD-UHFFFAOYSA-N 1 0 263.406 3.790 20 70 CHIDRO CCC(CC)C[NH2+][C@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000159430365 261186185 /nfs/dbraw/zinc/18/61/85/261186185.db2.gz UEYQBBHUELEKQN-CYBMUJFWSA-N 1 0 297.464 3.567 20 70 CHIDRO C[C@@H]([NH2+]C[C@](C)(O)c1ccccc1)c1cccc(F)c1F ZINC000159482552 261186663 /nfs/dbraw/zinc/18/66/63/261186663.db2.gz AZHUVXBQKQOYOD-PXAZEXFGSA-N 1 0 291.341 3.523 20 70 CHIDRO COc1cc([C@@H](C)[NH2+][C@H]2CCCSC2)ccc1SC ZINC000159616832 261189766 /nfs/dbraw/zinc/18/97/66/261189766.db2.gz QLOUFOISUXYZKW-YPMHNXCESA-N 1 0 297.489 3.963 20 70 CHIDRO CCc1noc(CC)c1C[NH2+][C@@H](C)c1ccccc1C ZINC000159782287 261194044 /nfs/dbraw/zinc/19/40/44/261194044.db2.gz QDHAMBHFOBLZOU-ZDUSSCGKSA-N 1 0 272.392 3.959 20 70 CHIDRO CC(C)Oc1ccc(C[NH2+][C@@H]2CCc3ccccc32)cn1 ZINC000160048754 261202606 /nfs/dbraw/zinc/20/26/06/261202606.db2.gz FWGACJUNJZMLKA-QGZVFWFLSA-N 1 0 282.387 3.646 20 70 CHIDRO c1ccc2c(N[C@H]3CCO[C@@H](C4CC4)C3)cc[nH+]c2c1 ZINC000160319591 261211082 /nfs/dbraw/zinc/21/10/82/261211082.db2.gz MKVPZVQONRPXCO-SUMWQHHRSA-N 1 0 268.360 3.604 20 70 CHIDRO CC1(C)CCC[N@@H+]1CCCc1nc(-c2ccccc2)no1 ZINC000160467563 261215245 /nfs/dbraw/zinc/21/52/45/261215245.db2.gz CRNVEWKTITVQFW-UHFFFAOYSA-N 1 0 285.391 3.544 20 70 CHIDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)nc1)c1ccco1 ZINC000160504902 261216227 /nfs/dbraw/zinc/21/62/27/261216227.db2.gz AZJXWNXVLFLDGI-OAHLLOKOSA-N 1 0 299.418 3.762 20 70 CHIDRO CC(C)n1cc([C@@H](C)[NH2+]CCSc2ccccc2)cn1 ZINC000160523882 261217071 /nfs/dbraw/zinc/21/70/71/261217071.db2.gz MHUNVMPLIFGTLQ-CQSZACIVSA-N 1 0 289.448 3.907 20 70 CHIDRO CC[C@@H](C)C[N@H+](CC)[C@@H](C)c1nc(-c2cccnc2)no1 ZINC000160589444 261218959 /nfs/dbraw/zinc/21/89/59/261218959.db2.gz HSVGANPBUWZQDZ-OLZOCXBDSA-N 1 0 288.395 3.561 20 70 CHIDRO CC[C@H]([NH2+]Cc1scnc1C)c1ccc(F)cc1F ZINC000160887096 261230422 /nfs/dbraw/zinc/23/04/22/261230422.db2.gz AOKZCTMCAQCJHW-ZDUSSCGKSA-N 1 0 282.359 3.971 20 70 CHIDRO Cc1ccc(C(=O)CC[N@@H+](C)[C@H](C)c2ccccn2)cc1 ZINC000161189739 261240396 /nfs/dbraw/zinc/24/03/96/261240396.db2.gz JPDQBAHUHQGSGF-OAHLLOKOSA-N 1 0 282.387 3.656 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccc(OC)cc1 ZINC000161478380 261247826 /nfs/dbraw/zinc/24/78/26/261247826.db2.gz HGOPCWADTOSGHO-HKUYNNGSSA-N 1 0 299.414 3.512 20 70 CHIDRO c1ccc(C(C[NH2+][C@H]2CCSC2)c2ccccc2)cc1 ZINC000218579741 262031694 /nfs/dbraw/zinc/03/16/94/262031694.db2.gz NDVDQDZXUPPNQD-KRWDZBQOSA-N 1 0 283.440 3.914 20 70 CHIDRO CC[C@@H](C)[C@H](C)[NH2+]CCCCc1nc(C)cs1 ZINC000160646090 327635086 /nfs/dbraw/zinc/63/50/86/327635086.db2.gz OHLORZGLGHFSRD-YPMHNXCESA-N 1 0 254.443 3.798 20 70 CHIDRO CC[C@H]([NH2+]Cc1ccc(OC)nc1)c1ccc(F)cc1F ZINC000160699112 327972530 /nfs/dbraw/zinc/97/25/30/327972530.db2.gz ZUSHZQGSOHDVFB-HNNXBMFYSA-N 1 0 292.329 3.609 20 70 CHIDRO CC[N@H+](Cc1ccccn1)[C@@H](C)c1cccc(C)c1 ZINC000161042674 328121386 /nfs/dbraw/zinc/12/13/86/328121386.db2.gz URPVWSNVDBJEIO-HNNXBMFYSA-N 1 0 254.377 3.973 20 70 CHIDRO CCOc1ccccc1[C@H](C)N[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000161117183 328132941 /nfs/dbraw/zinc/13/29/41/328132941.db2.gz OROUPYUCIJKJER-JYJNAYRXSA-N 1 0 290.451 3.609 20 70 CHIDRO CCC[C@H]([NH2+]CC1(CCOC)CCC1)c1ccccn1 ZINC000159377877 327176070 /nfs/dbraw/zinc/17/60/70/327176070.db2.gz ILPZFQBPJKNYEH-HNNXBMFYSA-N 1 0 276.424 3.719 20 70 CHIDRO CC[C@@H]([NH2+]Cc1cn2ccccc2n1)c1cccc(OC)c1 ZINC000159407686 327503811 /nfs/dbraw/zinc/50/38/11/327503811.db2.gz ORDFIUMLKWBZIM-QGZVFWFLSA-N 1 0 295.386 3.584 20 70 CHIDRO CC1(C)C[C@@H]([NH2+][C@@H]2CCCSC2)c2ccc(F)cc2O1 ZINC000159582914 327544116 /nfs/dbraw/zinc/54/41/16/327544116.db2.gz WRZSGTWOFXPQIQ-TZMCWYRMSA-N 1 0 295.423 3.913 20 70 CHIDRO C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+][C@@H]1CCCSC1 ZINC000159662261 327553096 /nfs/dbraw/zinc/55/30/96/327553096.db2.gz MFZALTXFOCOIBO-YVLXSGLVSA-N 1 0 265.397 3.544 20 70 CHIDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CC)C2CC2)cc1OC ZINC000159975456 327583454 /nfs/dbraw/zinc/58/34/54/327583454.db2.gz CKVFUEBZZZJURW-WFASDCNBSA-N 1 0 277.408 3.933 20 70 CHIDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cncs2)C1(CC)CC ZINC000161299426 329926143 /nfs/dbraw/zinc/92/61/43/329926143.db2.gz HNFXBLHGQXOTHJ-FPMFFAJLSA-N 1 0 282.453 3.778 20 70 CHIDRO CCc1ccccc1NC(=O)C[NH2+][C@H]1CCCC[C@@H]1CC ZINC000161427356 329933435 /nfs/dbraw/zinc/93/34/35/329933435.db2.gz JQGRICLGKICNJA-HOCLYGCPSA-N 1 0 288.435 3.746 20 70 CHIDRO Cc1nn(C)cc1[C@@H](C)[NH2+]C1CC(C)(C)CC(C)(C)C1 ZINC000159726049 330850814 /nfs/dbraw/zinc/85/08/14/330850814.db2.gz KFRKSSBXHMIBEV-GFCCVEGCSA-N 1 0 277.456 3.984 20 70 CHIDRO C[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1cnc2ccsc2c1 ZINC000159991615 330856578 /nfs/dbraw/zinc/85/65/78/330856578.db2.gz TWGYUIDWWPDACA-DGCLKSJQSA-N 1 0 290.432 3.905 20 70 CHIDRO CC(C)OCC[NH2+][C@H]1CCC(C)(C)c2ccccc21 ZINC000160030669 330857159 /nfs/dbraw/zinc/85/71/59/330857159.db2.gz QAKJAIUPBAOYSS-INIZCTEOSA-N 1 0 261.409 3.814 20 70 CHIDRO Cc1cccc(-c2nc(C3([NH3+])CCCCC3)no2)c1Cl ZINC000160458970 330865864 /nfs/dbraw/zinc/86/58/64/330865864.db2.gz CJPFNWWAXYNTQE-UHFFFAOYSA-N 1 0 291.782 3.817 20 70 CHIDRO c1ccc2c(c1)-c1ccccc1C2[NH2+][C@H]1CCSC1 ZINC000218600099 333133843 /nfs/dbraw/zinc/13/38/43/333133843.db2.gz XMPNJZSWUSYOFQ-LBPRGKRZSA-N 1 0 267.397 3.852 20 70 CHIDRO CCN(CCC[NH+]1CCCCC1)[C@@H](C)c1cccc(O)c1 ZINC000161397363 521012741 /nfs/dbraw/zinc/01/27/41/521012741.db2.gz BUAVJBUXJZKTPQ-INIZCTEOSA-N 1 0 290.451 3.651 20 70 CHIDRO CCC[C@H](CC)[NH2+]Cc1cncc(Br)c1 ZINC000160572750 521082575 /nfs/dbraw/zinc/08/25/75/521082575.db2.gz XOSMWAXPWMDGCV-LBPRGKRZSA-N 1 0 271.202 3.512 20 70 CHIDRO CCCN(CC[NH+](CC)CC)C(=O)Nc1ccc(C)s1 ZINC000160532971 521659913 /nfs/dbraw/zinc/65/99/13/521659913.db2.gz NZTDACNGJLZXON-UHFFFAOYSA-N 1 0 297.468 3.642 20 70 CHIDRO CC[C@@H]1CCC[N@H+](Cc2csc(C3CC3)n2)C1 ZINC000161400379 523252050 /nfs/dbraw/zinc/25/20/50/523252050.db2.gz WEYWKNGWALNBHW-LLVKDONJSA-N 1 0 250.411 3.643 20 70 CHIDRO CC[C@H](C)[N@H+](C)Cc1nc2cc(Br)ccc2[nH]1 ZINC000160497427 523923321 /nfs/dbraw/zinc/92/33/21/523923321.db2.gz TYTOFQLESMMNTN-VIFPVBQESA-N 1 0 296.212 3.556 20 70 CHIDRO C[C@@H]1CC[N@H+](Cc2cnc3ccccn23)[C@H](c2ccco2)C1 ZINC000160906021 524516399 /nfs/dbraw/zinc/51/63/99/524516399.db2.gz PODAFVGEIJHLLY-ZBFHGGJFSA-N 1 0 295.386 3.901 20 70 CHIDRO C[C@H](C[C@@H]1CCCO1)[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000161269471 524628697 /nfs/dbraw/zinc/62/86/97/524628697.db2.gz LBLLXLVOTWTEBO-IVMMDQJWSA-N 1 0 293.382 3.587 20 70 CHIDRO C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cncs1 ZINC000160969533 525398734 /nfs/dbraw/zinc/39/87/34/525398734.db2.gz BORNZYQHDFIJHJ-AAEUAGOBSA-N 1 0 258.390 3.524 20 70 CHIDRO Cc1ccc(-c2nnc([C@H](C)[NH+]3CCCCC3)o2)cc1C ZINC000160457143 525859609 /nfs/dbraw/zinc/85/96/09/525859609.db2.gz JMBUNZHUZZBZDF-AWEZNQCLSA-N 1 0 285.391 3.900 20 70 CHIDRO Cc1nccn1CCCC[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000161426680 527392293 /nfs/dbraw/zinc/39/22/93/527392293.db2.gz LININKGEDUZXPA-AWEZNQCLSA-N 1 0 289.398 3.804 20 70 CHIDRO CCCCOc1ccc(C[NH2+][C@H]2CCOC(C)(C)C2)cc1 ZINC000160564718 260029201 /nfs/dbraw/zinc/02/92/01/260029201.db2.gz IGDWZSVWUJPFRU-INIZCTEOSA-N 1 0 291.435 3.913 20 70 CHIDRO CCS[C@H]1CCC[C@@H]([NH2+][C@@H](C)c2cncc(F)c2)C1 ZINC000159433051 261186244 /nfs/dbraw/zinc/18/62/44/261186244.db2.gz ZIIQDPKRCRIHIC-GLQYFDAESA-N 1 0 282.428 3.936 20 70 CHIDRO Clc1cc2cccnc2c(C[NH2+][C@H]2CCCSC2)c1 ZINC000159579528 261188979 /nfs/dbraw/zinc/18/89/79/261188979.db2.gz ZNKSQRVZIYCLJA-AWEZNQCLSA-N 1 0 292.835 3.873 20 70 CHIDRO C[C@H]([NH2+]CCOc1ccc(Cl)cc1)c1cncc(F)c1 ZINC000159640192 261190206 /nfs/dbraw/zinc/19/02/06/261190206.db2.gz SKLYDRCSOYILPB-NSHDSACASA-N 1 0 294.757 3.604 20 70 CHIDRO Cc1ccccc1[C@@H](C)[NH2+]C[C@](C)(O)c1ccsc1 ZINC000160049379 261202855 /nfs/dbraw/zinc/20/28/55/261202855.db2.gz BYYGIRBWRVJKOG-CJNGLKHVSA-N 1 0 275.417 3.615 20 70 CHIDRO Cc1ccsc1[C@@H](C)[NH2+]Cc1cn2c(cccc2C)n1 ZINC000160314228 261210724 /nfs/dbraw/zinc/21/07/24/261210724.db2.gz AWZQFCXRQHMKPV-CYBMUJFWSA-N 1 0 285.416 3.863 20 70 CHIDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1noc(-c2ccsc2)n1 ZINC000160644684 261221670 /nfs/dbraw/zinc/22/16/70/261221670.db2.gz YWJOPWMYORMBJB-WCQYABFASA-N 1 0 291.420 3.809 20 70 CHIDRO CC[C@H]([NH3+])C(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000160983237 261233391 /nfs/dbraw/zinc/23/33/91/261233391.db2.gz XOQZINMOJYHATJ-GJZGRUSLSA-N 1 0 294.826 3.521 20 70 CHIDRO Cc1ccc2ncc(C[NH2+][C@H]3CCCc4sccc43)n2c1 ZINC000160993044 261233527 /nfs/dbraw/zinc/23/35/27/261233527.db2.gz JZFJGUMVOJVSKA-HNNXBMFYSA-N 1 0 297.427 3.871 20 70 CHIDRO COc1ccc(COCCC[NH2+][C@@H](C)c2ccco2)cc1 ZINC000161091275 261235921 /nfs/dbraw/zinc/23/59/21/261235921.db2.gz WJQTWZVJDSRXPG-AWEZNQCLSA-N 1 0 289.375 3.546 20 70 CHIDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1cncc(F)c1 ZINC000161370795 261245573 /nfs/dbraw/zinc/24/55/73/261245573.db2.gz WFMLBUNDASVCBE-LBPRGKRZSA-N 1 0 288.341 3.742 20 70 CHIDRO CCC(CC)[C@@H](O)C[NH2+][C@@H](C)c1ccc(Cl)c(F)c1 ZINC000218247285 263119037 /nfs/dbraw/zinc/11/90/37/263119037.db2.gz GUIMIHMLNPCEFC-BONVTDFDSA-N 1 0 287.806 3.927 20 70 CHIDRO Cc1ccc2[nH+]ccc(N[C@@H]3CCO[C@@H](C4CC4)C3)c2c1 ZINC000160394375 264243397 /nfs/dbraw/zinc/24/33/97/264243397.db2.gz XYEYPLMNFGCMER-RDTXWAMCSA-N 1 0 282.387 3.913 20 70 CHIDRO C[C@H]([NH2+]CC(C)(C)O)c1ccc(-c2ccccc2F)s1 ZINC000160606988 327631655 /nfs/dbraw/zinc/63/16/55/327631655.db2.gz JBPXOSQCCNHHPM-NSHDSACASA-N 1 0 293.407 3.976 20 70 CHIDRO CC[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1ccc(Cl)s1 ZINC000160623570 327633318 /nfs/dbraw/zinc/63/33/18/327633318.db2.gz QNSRHESZFIJBTN-WOPDTQHZSA-N 1 0 287.856 3.993 20 70 CHIDRO CCc1ccc([C@@H](CO)[NH2+]Cc2cccc(Cl)c2)cc1 ZINC000160811297 328086997 /nfs/dbraw/zinc/08/69/97/328086997.db2.gz QSNCXSZTBFFFHN-QGZVFWFLSA-N 1 0 289.806 3.726 20 70 CHIDRO O=C(C[NH2+][C@H]1CCC[C@@H]1c1ccccc1)Nc1ccccc1 ZINC000160788544 328085449 /nfs/dbraw/zinc/08/54/49/328085449.db2.gz WAAWTHJNTVFCHR-MSOLQXFVSA-N 1 0 294.398 3.551 20 70 CHIDRO CCCCOc1cccc(C[NH2+][C@@H](CC)[C@H]2CCOC2)c1 ZINC000160830400 328088437 /nfs/dbraw/zinc/08/84/37/328088437.db2.gz SSJULHQFDRUCIJ-WMZOPIPTSA-N 1 0 291.435 3.770 20 70 CHIDRO CC[N@@H+](CCc1nccs1)CCC1CCCC1 ZINC000159372749 327174696 /nfs/dbraw/zinc/17/46/96/327174696.db2.gz OVNAOXAQXCRGFO-UHFFFAOYSA-N 1 0 252.427 3.588 20 70 CHIDRO Cc1cc(C)cc(CC[NH2+][C@@H](C)c2cncc(F)c2)c1 ZINC000159498451 327208604 /nfs/dbraw/zinc/20/86/04/327208604.db2.gz ZNOIOFDKCPJNAG-AWEZNQCLSA-N 1 0 272.367 3.731 20 70 CHIDRO CC[C@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000159574274 327540234 /nfs/dbraw/zinc/54/02/34/327540234.db2.gz AYEBRZWRTSMZEK-YJBOKZPZSA-N 1 0 296.414 3.625 20 70 CHIDRO Cc1csc([C@H]([NH2+]CCC(C)(C)C)C2CC2)n1 ZINC000159614109 327546838 /nfs/dbraw/zinc/54/68/38/327546838.db2.gz MLSAZHRJFKYJHZ-GFCCVEGCSA-N 1 0 252.427 3.928 20 70 CHIDRO CC(C)n1cc([C@@H](C)[NH2+]CCCc2cccc(F)c2)cn1 ZINC000159805449 327566433 /nfs/dbraw/zinc/56/64/33/327566433.db2.gz MTEIHPLIDRSTSM-CQSZACIVSA-N 1 0 289.398 3.887 20 70 CHIDRO CC[C@H](C)[C@@H](C)[NH2+]CCC1CCN(CC(F)(F)F)CC1 ZINC000159962182 327582516 /nfs/dbraw/zinc/58/25/16/327582516.db2.gz XEUVLCHULPUBDZ-QWHCGFSZSA-N 1 0 294.405 3.675 20 70 CHIDRO CSC[C@@H](CCO)[NH2+][C@@H](C)c1ccc(C(C)C)cc1 ZINC000160151905 327596591 /nfs/dbraw/zinc/59/65/91/327596591.db2.gz PTIFZTSODAXVBO-XJKSGUPXSA-N 1 0 281.465 3.575 20 70 CHIDRO C[C@H]1CN(C(=O)c2ccc(C[NH+](C)C)cc2)c2ccccc21 ZINC000160287989 327605199 /nfs/dbraw/zinc/60/51/99/327605199.db2.gz NDZMWWJZTUDLSV-AWEZNQCLSA-N 1 0 294.398 3.512 20 70 CHIDRO CC[C@@H](COC)[NH2+][C@H](CC(C)C)c1cccs1 ZINC000161384074 329932616 /nfs/dbraw/zinc/93/26/16/329932616.db2.gz UQUBFQOSEIIZOV-QWHCGFSZSA-N 1 0 255.427 3.850 20 70 CHIDRO CC[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccs1 ZINC000161477358 329941098 /nfs/dbraw/zinc/94/10/98/329941098.db2.gz HPSXFERUOURAOF-CABCVRRESA-N 1 0 275.417 3.565 20 70 CHIDRO COc1cc(C[NH2+]C2(C)CCC2)ccc1OC(C)C ZINC000159923161 330854351 /nfs/dbraw/zinc/85/43/51/330854351.db2.gz NWXRKKIXLDOXHW-UHFFFAOYSA-N 1 0 263.381 3.515 20 70 CHIDRO C[C@@]1([NH2+]Cc2cccc(Oc3ccccc3)c2)CCOC1 ZINC000160180147 330860268 /nfs/dbraw/zinc/86/02/68/330860268.db2.gz VHTLWGPBBJYIQU-GOSISDBHSA-N 1 0 283.371 3.748 20 70 CHIDRO CN(C)C1(C[NH2+][C@H](c2ccccc2)C2CC2)CCCC1 ZINC000160734904 330874164 /nfs/dbraw/zinc/87/41/64/330874164.db2.gz PRYHJYAXEMODQP-QGZVFWFLSA-N 1 0 272.436 3.602 20 70 CHIDRO CC(C)CC[NH+](CCC(C)C)Cc1cnc(N)s1 ZINC000218311436 333130826 /nfs/dbraw/zinc/13/08/26/333130826.db2.gz FXGHNLRMYSZYFD-UHFFFAOYSA-N 1 0 269.458 3.620 20 70 CHIDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2cnn(C(C)C)c2)s1 ZINC000217819557 333124072 /nfs/dbraw/zinc/12/40/72/333124072.db2.gz UQVPHYXCQMBWOH-GFCCVEGCSA-N 1 0 277.437 3.555 20 70 CHIDRO Fc1cc(F)cc(CC[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000218170896 333128377 /nfs/dbraw/zinc/12/83/77/333128377.db2.gz UJJPCRFYEYCXKF-UHFFFAOYSA-N 1 0 286.325 3.778 20 70 CHIDRO CCOc1ccc(C[NH2+]Cc2ccc(CC)s2)cc1 ZINC000218218892 333129620 /nfs/dbraw/zinc/12/96/20/333129620.db2.gz ZUNPAPZPABWGTO-UHFFFAOYSA-N 1 0 275.417 3.999 20 70 CHIDRO OCC[N@H+](Cc1ccc(F)c(Cl)c1)C1CCCCC1 ZINC000218306533 333130981 /nfs/dbraw/zinc/13/09/81/333130981.db2.gz VDPHBTCQGQQTPX-UHFFFAOYSA-N 1 0 285.790 3.606 20 70 CHIDRO CC(C)C[C@@H]([NH2+]CC(=O)NC(C)C)c1ccc(Cl)cc1 ZINC000161008888 519247490 /nfs/dbraw/zinc/24/74/90/519247490.db2.gz WYFORMZDTAGJPG-OAHLLOKOSA-N 1 0 296.842 3.541 20 70 CHIDRO CC(=O)Nc1ccccc1C[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC000160444401 519750831 /nfs/dbraw/zinc/75/08/31/519750831.db2.gz JVQODFNFDIBBQA-ZWKOTPCHSA-N 1 0 294.398 3.538 20 70 CHIDRO CCCCCC[C@H](C)CC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000161389388 520126603 /nfs/dbraw/zinc/12/66/03/520126603.db2.gz DKYDNEWVXYNHLO-PMRDEQMMSA-N 1 0 294.483 3.724 20 70 CHIDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cncc(F)c2)C1(CC)CC ZINC000161310754 520374604 /nfs/dbraw/zinc/37/46/04/520374604.db2.gz ZRWDJPSUHHWZEZ-APHBMKBZSA-N 1 0 294.414 3.855 20 70 CHIDRO CCO[C@H]1C[C@H]([NH2+][C@@H](C)c2cncc(F)c2)C1(CC)CC ZINC000161310625 520577657 /nfs/dbraw/zinc/57/76/57/520577657.db2.gz ZRWDJPSUHHWZEZ-RCBQFDQVSA-N 1 0 294.414 3.855 20 70 CHIDRO CC1(C)Cc2occc2[C@H]([NH2+]C[C@H](CO)c2ccccc2)C1 ZINC000161466746 520588196 /nfs/dbraw/zinc/58/81/96/520588196.db2.gz KEHHJIYSWHTALD-NVXWUHKLSA-N 1 0 299.414 3.659 20 70 CHIDRO CC[N@H+](Cc1cnc2ccccn12)[C@H](C)c1cccc(O)c1 ZINC000160531302 521434572 /nfs/dbraw/zinc/43/45/72/521434572.db2.gz VMDCWUSBQXPVEA-CQSZACIVSA-N 1 0 295.386 3.623 20 70 CHIDRO CCSCC[C@H](C)[N@H+](C)Cc1c(C)nc2ccccn21 ZINC000160904683 521715135 /nfs/dbraw/zinc/71/51/35/521715135.db2.gz BSCKFBVJVTZCQW-ZDUSSCGKSA-N 1 0 291.464 3.606 20 70 CHIDRO CCc1nc(C)c([C@H](C)N[C@@H]2CCC[C@H]([NH+](C)C)C2)s1 ZINC000161012139 522233816 /nfs/dbraw/zinc/23/38/16/522233816.db2.gz HNAAZHSHGACBCJ-YUTCNCBUSA-N 1 0 295.496 3.537 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H]1CCCO1)c1cccc(Cl)c1F ZINC000161485355 522616702 /nfs/dbraw/zinc/61/67/02/522616702.db2.gz JCEDKWIIYXBWES-GWCFXTLKSA-N 1 0 271.763 3.699 20 70 CHIDRO CC[C@@H](Cc1ccccc1)[NH2+][C@H](CCO)c1ccccc1 ZINC000161054227 522635538 /nfs/dbraw/zinc/63/55/38/522635538.db2.gz XTMFVMBNUZUKJZ-RBUKOAKNSA-N 1 0 283.415 3.721 20 70 CHIDRO CC[C@@H]1CCCC[C@H]1[NH2+]CCCCn1ccnc1C ZINC000161425573 523221243 /nfs/dbraw/zinc/22/12/43/523221243.db2.gz PORRTESZQROWBW-HZPDHXFCSA-N 1 0 263.429 3.530 20 70 CHIDRO C[C@@H](C[C@H]1CCCO1)[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000161269600 524861399 /nfs/dbraw/zinc/86/13/99/524861399.db2.gz LBLLXLVOTWTEBO-JGGQBBKZSA-N 1 0 293.382 3.587 20 70 CHIDRO C[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cc(F)cc(F)c1 ZINC000159945074 262447859 /nfs/dbraw/zinc/44/78/59/262447859.db2.gz PALSPLXMPYTQRM-YGRLFVJLSA-N 1 0 269.335 3.573 20 70 CHIDRO COCCC1(C[NH2+][C@H](C)c2ccccc2C)CCC1 ZINC000159805355 260928828 /nfs/dbraw/zinc/92/88/28/260928828.db2.gz ZFWGDUYYZSOZDL-OAHLLOKOSA-N 1 0 261.409 3.852 20 70 CHIDRO Clc1cc2cccnc2c(C[NH2+][C@@H]2CCCSC2)c1 ZINC000159579400 261189010 /nfs/dbraw/zinc/18/90/10/261189010.db2.gz ZNKSQRVZIYCLJA-CQSZACIVSA-N 1 0 292.835 3.873 20 70 CHIDRO C[C@@H](C1CC1)[N@@H+](Cc1ccccc1)CC1=CCCOC1 ZINC000159681991 261191607 /nfs/dbraw/zinc/19/16/07/261191607.db2.gz ZKDBRSJMSVOQPZ-HNNXBMFYSA-N 1 0 271.404 3.634 20 70 CHIDRO CCc1noc(CC)c1C[NH2+][C@H](C)c1ccccc1C ZINC000159782410 261193982 /nfs/dbraw/zinc/19/39/82/261193982.db2.gz QDHAMBHFOBLZOU-CYBMUJFWSA-N 1 0 272.392 3.959 20 70 CHIDRO Cc1ccc(C(=O)CC[NH2+]C(C)(C)c2nccs2)cc1 ZINC000160570369 261219052 /nfs/dbraw/zinc/21/90/52/261219052.db2.gz KAEJPTWVHARDJC-UHFFFAOYSA-N 1 0 288.416 3.549 20 70 CHIDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cc(C)ccc1C ZINC000218236801 263112254 /nfs/dbraw/zinc/11/22/54/263112254.db2.gz LNQGTMVPOHHPBI-BHYGNILZSA-N 1 0 261.409 3.912 20 70 CHIDRO CCCCN(C(=O)C[C@@H]1CCC[NH2+]1)[C@@H](C)c1ccccc1 ZINC000160185931 264234854 /nfs/dbraw/zinc/23/48/54/264234854.db2.gz WFDFTJQJYXRLBS-RDJZCZTQSA-N 1 0 288.435 3.518 20 70 CHIDRO CC[C@H]([NH2+][C@@H](C)COC)c1cccc(Cl)c1F ZINC000161469271 522688400 /nfs/dbraw/zinc/68/84/00/522688400.db2.gz QQPDQLBMZAOKCX-CABZTGNLSA-N 1 0 259.752 3.555 20 70 CHIDRO CC[NH+](CC)CCC[C@H](C)NC(=O)C(C)(C)C1CCCC1 ZINC000160647304 327634895 /nfs/dbraw/zinc/63/48/95/327634895.db2.gz APUCFNKTEYTOET-HNNXBMFYSA-N 1 0 296.499 3.830 20 70 CHIDRO CC[C@H](C)[C@H](C)[NH2+]CCCCc1nc(C)cs1 ZINC000160646182 327634987 /nfs/dbraw/zinc/63/49/87/327634987.db2.gz OHLORZGLGHFSRD-AAEUAGOBSA-N 1 0 254.443 3.798 20 70 CHIDRO CC[C@@H](C)[C@@H](C)[NH2+]CCCCc1nc(C)cs1 ZINC000160645839 327635029 /nfs/dbraw/zinc/63/50/29/327635029.db2.gz OHLORZGLGHFSRD-DGCLKSJQSA-N 1 0 254.443 3.798 20 70 CHIDRO C[N@H+](Cc1ccc(Cl)cc1)Cc1ccc2c[nH]nc2c1 ZINC000160806728 328087069 /nfs/dbraw/zinc/08/70/69/328087069.db2.gz DPNMDGLJPNAPPM-UHFFFAOYSA-N 1 0 285.778 3.848 20 70 CHIDRO CCCCOc1cccc(C[NH2+][C@H](CC)[C@@H]2CCOC2)c1 ZINC000160830274 328088463 /nfs/dbraw/zinc/08/84/63/328088463.db2.gz SSJULHQFDRUCIJ-SJLPKXTDSA-N 1 0 291.435 3.770 20 70 CHIDRO COc1ccc(C[N@H+](C)Cc2ccc(C)s2)c(OC)c1 ZINC000160831180 328088509 /nfs/dbraw/zinc/08/85/09/328088509.db2.gz CKWQTJORXDSCPM-UHFFFAOYSA-N 1 0 291.416 3.706 20 70 CHIDRO CC(C)NC(=O)C[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000160908136 328093870 /nfs/dbraw/zinc/09/38/70/328093870.db2.gz YJZCCGBGDYUGFR-HNNXBMFYSA-N 1 0 296.414 3.529 20 70 CHIDRO CC[C@@H]([NH2+][C@@H](C)CSC)c1ccc(F)cc1F ZINC000160940381 328096007 /nfs/dbraw/zinc/09/60/07/328096007.db2.gz IWEQPMZHRPEMRX-TVQRCGJNSA-N 1 0 259.365 3.757 20 70 CHIDRO CC[C@H](C)C[N@H+](CC)Cc1c(C)nc2ccccn21 ZINC000160953682 328097122 /nfs/dbraw/zinc/09/71/22/328097122.db2.gz JEOCLUWENWZPJJ-ZDUSSCGKSA-N 1 0 259.397 3.511 20 70 CHIDRO c1ccc(-c2ccccc2OCC[NH2+][C@H]2CCSC2)cc1 ZINC000161090303 328128700 /nfs/dbraw/zinc/12/87/00/328128700.db2.gz IUCOTCDLKDQNPO-INIZCTEOSA-N 1 0 299.439 3.828 20 70 CHIDRO CC[C@@H](C)NC(=O)c1cccc(C[NH2+][C@@H](C)C(C)(C)C)c1 ZINC000161116733 328132821 /nfs/dbraw/zinc/13/28/21/328132821.db2.gz USCVTIOIMTWLNK-KGLIPLIRSA-N 1 0 290.451 3.739 20 70 CHIDRO CCCn1nc(C)c(C[N@H+](C)Cc2ccc(F)cc2)c1C ZINC000161142115 328136641 /nfs/dbraw/zinc/13/66/41/328136641.db2.gz JBNJEMFNDKGSGS-UHFFFAOYSA-N 1 0 289.398 3.681 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H]1CCCCN1CC)c1cccs1 ZINC000161177525 328151106 /nfs/dbraw/zinc/15/11/06/328151106.db2.gz APQXAVVBTYXGBS-KBPBESRZSA-N 1 0 266.454 3.663 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H]1CCCCN1CC)c1cccs1 ZINC000161177879 328151124 /nfs/dbraw/zinc/15/11/24/328151124.db2.gz APQXAVVBTYXGBS-ZIAGYGMSSA-N 1 0 266.454 3.663 20 70 CHIDRO CCS[C@H]1CCC[C@@H]([NH2+]C(C2CC2)C2CC2)C1 ZINC000159392384 327177902 /nfs/dbraw/zinc/17/79/02/327177902.db2.gz DCAJNCUYDGSVCH-KGLIPLIRSA-N 1 0 253.455 3.829 20 70 CHIDRO COc1ccc([C@@H](C)[NH2+]C[C@](C)(O)CCC(C)C)cc1 ZINC000159419802 327184178 /nfs/dbraw/zinc/18/41/78/327184178.db2.gz QXCRESYWPXOQDW-RHSMWYFYSA-N 1 0 279.424 3.533 20 70 CHIDRO C[C@@H]([NH2+][C@@H]1CCCSC1)c1cc2c(s1)CCC2 ZINC000159591120 327544728 /nfs/dbraw/zinc/54/47/28/327544728.db2.gz ZPHDSISATZTYNN-ZYHUDNBSSA-N 1 0 267.463 3.783 20 70 CHIDRO C[C@H]([NH2+]CCC(C)(C)O)c1cc2cc(Cl)ccc2o1 ZINC000159884633 327574193 /nfs/dbraw/zinc/57/41/93/327574193.db2.gz PEZJVODKIBKXAF-JTQLQIEISA-N 1 0 281.783 3.898 20 70 CHIDRO CCOc1ccc([C@@H](C)[NH2+][C@H](CC)C2CC2)cc1OC ZINC000159975855 327583466 /nfs/dbraw/zinc/58/34/66/327583466.db2.gz CKVFUEBZZZJURW-IUODEOHRSA-N 1 0 277.408 3.933 20 70 CHIDRO CC(C)c1ccc(OCC[NH2+][C@@H](C)C2CCOCC2)cc1 ZINC000160344105 327605758 /nfs/dbraw/zinc/60/57/58/327605758.db2.gz RNTMLMLDGZCSOZ-HNNXBMFYSA-N 1 0 291.435 3.594 20 70 CHIDRO CCCCC1CCC([NH2+]C2CCC(NC(C)=O)CC2)CC1 ZINC000161363028 329930765 /nfs/dbraw/zinc/93/07/65/329930765.db2.gz JWRWSXXRVUFJDX-UHFFFAOYSA-N 1 0 294.483 3.772 20 70 CHIDRO Cc1cc(C)cc([C@@H](C)[NH2+]C[C@@H](CO)c2ccccc2)c1 ZINC000161406597 329933307 /nfs/dbraw/zinc/93/33/07/329933307.db2.gz CKCFDOVKSRTEHK-APWZRJJASA-N 1 0 283.415 3.730 20 70 CHIDRO CC[C@H]([NH2+][C@@H]1CCSc2ccc(F)cc21)[C@@H]1CCOC1 ZINC000159447191 330848028 /nfs/dbraw/zinc/84/80/28/330848028.db2.gz LCSOKMRIMSJCMR-BYCMXARLSA-N 1 0 295.423 3.767 20 70 CHIDRO CC1(C)C[C@@H]([NH2+][C@@H](c2ccccc2)c2ccccn2)CCO1 ZINC000159934398 330854614 /nfs/dbraw/zinc/85/46/14/330854614.db2.gz GMWXKJOVLYRUPJ-WMZOPIPTSA-N 1 0 296.414 3.718 20 70 CHIDRO Cc1ccc([C@H]([NH2+][C@H]2CCOC(C)(C)C2)C2CC2)cc1 ZINC000159981785 330856279 /nfs/dbraw/zinc/85/62/79/330856279.db2.gz MZPRGOHGDRHSBF-IRXDYDNUSA-N 1 0 273.420 3.993 20 70 CHIDRO Cc1cccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c1 ZINC000160206708 330861104 /nfs/dbraw/zinc/86/11/04/330861104.db2.gz HQLBHZIFFFZOKA-USXIJHARSA-N 1 0 261.409 3.849 20 70 CHIDRO C[C@H](CCc1ccccc1)[NH2+]C[C@H]1CCC(C)(C)O1 ZINC000160260135 330862237 /nfs/dbraw/zinc/86/22/37/330862237.db2.gz BVNXBVXFNQFKLL-GDBMZVCRSA-N 1 0 261.409 3.555 20 70 CHIDRO CC1(C)C[C@@H]([NH2+]Cc2ccc3ccccc3c2)CCO1 ZINC000160534192 330866887 /nfs/dbraw/zinc/86/68/87/330866887.db2.gz CNDXWHWMIYQKMD-KRWDZBQOSA-N 1 0 269.388 3.887 20 70 CHIDRO COc1ccc(CC[NH2+]Cc2ccc(Cl)cc2F)cc1 ZINC000160640392 330870680 /nfs/dbraw/zinc/87/06/80/330870680.db2.gz SCZYHWVGIGHURX-UHFFFAOYSA-N 1 0 293.769 3.820 20 70 CHIDRO COc1ccc(C[NH2+]Cc2cc(F)cc(Cl)c2)cc1 ZINC000160800247 330876329 /nfs/dbraw/zinc/87/63/29/330876329.db2.gz GBYFSSSYRPREFI-UHFFFAOYSA-N 1 0 279.742 3.778 20 70 CHIDRO CC(=O)Nc1ccccc1C[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000160444514 519750414 /nfs/dbraw/zinc/75/04/14/519750414.db2.gz JVQODFNFDIBBQA-QZTJIDSGSA-N 1 0 294.398 3.538 20 70 CHIDRO CC(=O)Nc1ccccc1C[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC000160353070 519750855 /nfs/dbraw/zinc/75/08/55/519750855.db2.gz OXTYKXDEVYNPNO-DZGCQCFKSA-N 1 0 274.408 3.561 20 70 CHIDRO CC[N@H+](Cc1csc(C2CC2)n1)C1CCCC1 ZINC000161414249 521441609 /nfs/dbraw/zinc/44/16/09/521441609.db2.gz XYVJLSZSZOWKEL-UHFFFAOYSA-N 1 0 250.411 3.785 20 70 CHIDRO CCSc1ccccc1[C@@H](C)[NH2+]C1CCN(C)CC1 ZINC000161457502 521780919 /nfs/dbraw/zinc/78/09/19/521780919.db2.gz RWMMPZRVPOJPTG-CYBMUJFWSA-N 1 0 278.465 3.543 20 70 CHIDRO CC[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1cccc(OC)c1 ZINC000160971982 522942886 /nfs/dbraw/zinc/94/28/86/522942886.db2.gz JATXGEDXFKTRIU-RTBURBONSA-N 1 0 299.414 3.860 20 70 CHIDRO COCc1ccccc1C[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000160894367 523103350 /nfs/dbraw/zinc/10/33/50/523103350.db2.gz JLFVHSVXDOMOIP-UHFFFAOYSA-N 1 0 293.769 3.915 20 70 CHIDRO CCc1ccc([C@@H](C)NC2CC[NH+](C3CCCC3)CC2)o1 ZINC000160512779 524023793 /nfs/dbraw/zinc/02/37/93/524023793.db2.gz FUEUYFBWWCSVMT-CQSZACIVSA-N 1 0 290.451 3.900 20 70 CHIDRO C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cncc(F)c1 ZINC000160992195 525398957 /nfs/dbraw/zinc/39/89/57/525398957.db2.gz RKNQUYDZTAATDQ-JSGCOSHPSA-N 1 0 270.351 3.601 20 70 CHIDRO Cc1ccc(C(=O)CC[N@@H+](C)[C@H](C)c2ccncc2)cc1 ZINC000161186705 526041577 /nfs/dbraw/zinc/04/15/77/526041577.db2.gz NWXNNDZJJNBUSD-OAHLLOKOSA-N 1 0 282.387 3.656 20 70 CHIDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCSC1)CCCO2 ZINC000159587813 526211326 /nfs/dbraw/zinc/21/13/26/526211326.db2.gz FYDSOZOQULZRKF-UKRRQHHQSA-N 1 0 277.433 3.694 20 70 CHIDRO C[C@H]1CCCC[N@@H+]1CCCNCc1coc2ccccc12 ZINC000161063523 526249168 /nfs/dbraw/zinc/24/91/68/526249168.db2.gz QLCXWHVWAQSKKB-HNNXBMFYSA-N 1 0 286.419 3.787 20 70 CHIDRO Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@H]1CCCC[C@@H]1O ZINC000160491158 526680483 /nfs/dbraw/zinc/68/04/83/526680483.db2.gz PELUWIVDMCWNBJ-YUTCNCBUSA-N 1 0 296.480 3.777 20 70 CHIDRO CCS[C@H]1CCC[C@@H]([NH2+][C@@H](C)c2cnc(C)nc2C)C1 ZINC000159400381 261185559 /nfs/dbraw/zinc/18/55/59/261185559.db2.gz VMMVYSDIYOPQQT-CFVMTHIKSA-N 1 0 293.480 3.808 20 70 CHIDRO CC(C)C[C@H]([NH2+][C@@H]1CCCSC1)c1ccccn1 ZINC000159530590 261188132 /nfs/dbraw/zinc/18/81/32/261188132.db2.gz JDEPWKOKPONOFL-HIFRSBDPSA-N 1 0 264.438 3.654 20 70 CHIDRO COc1ccc2oc([C@@H](C)[NH2+]CCC(C)(C)O)c(C)c2c1 ZINC000159832916 261195068 /nfs/dbraw/zinc/19/50/68/261195068.db2.gz HOFHLLRSHGFJEH-GFCCVEGCSA-N 1 0 291.391 3.561 20 70 CHIDRO Cc1ccsc1[C@H](C)[NH2+]C[C@](C)(O)c1ccsc1 ZINC000159981974 261200979 /nfs/dbraw/zinc/20/09/79/261200979.db2.gz AKJYDMHBJKBBIS-FZMZJTMJSA-N 1 0 281.446 3.676 20 70 CHIDRO CC[C@@H](C[NH2+][C@@H](C)c1cncs1)Oc1ccccc1F ZINC000160314235 261210668 /nfs/dbraw/zinc/21/06/68/261210668.db2.gz RIOFZSCRFPIGRR-RYUDHWBXSA-N 1 0 294.395 3.790 20 70 CHIDRO CC(C)n1cc([C@H](C)[NH2+]CCSc2ccccc2)cn1 ZINC000160523988 261217311 /nfs/dbraw/zinc/21/73/11/261217311.db2.gz MHUNVMPLIFGTLQ-AWEZNQCLSA-N 1 0 289.448 3.907 20 70 CHIDRO CC1(C)C[C@H]([NH2+]Cc2cccc(-c3ccccn3)c2)CCO1 ZINC000160563791 261218103 /nfs/dbraw/zinc/21/81/03/261218103.db2.gz FKAJWZCTZRWNIN-QGZVFWFLSA-N 1 0 296.414 3.796 20 70 CHIDRO CC1(C)C[C@@H]([NH2+]Cc2cc3ccccc3s2)CCO1 ZINC000160594992 261219345 /nfs/dbraw/zinc/21/93/45/261219345.db2.gz OTJSGCGBSOKXBV-ZDUSSCGKSA-N 1 0 275.417 3.949 20 70 CHIDRO CC[C@H]([NH2+]CCc1ccccn1)c1ccc(F)cc1F ZINC000160655586 261221341 /nfs/dbraw/zinc/22/13/41/261221341.db2.gz SEVWZZLXYFQDQJ-INIZCTEOSA-N 1 0 276.330 3.643 20 70 CHIDRO CC[C@@H]([NH2+]CCCCCOC)c1ccc(F)cc1F ZINC000160838674 261228314 /nfs/dbraw/zinc/22/83/14/261228314.db2.gz CXCDXFPKQSKXJB-OAHLLOKOSA-N 1 0 271.351 3.822 20 70 CHIDRO C[C@H]([NH2+][C@@H](CCCO)c1ccccc1)C1CCCC1 ZINC000160876708 261229109 /nfs/dbraw/zinc/22/91/09/261229109.db2.gz DIKNJGZPSJPVMN-YOEHRIQHSA-N 1 0 261.409 3.669 20 70 CHIDRO Clc1ncccc1C[NH2+][C@@H]1CCCc2sccc21 ZINC000160974388 261232890 /nfs/dbraw/zinc/23/28/90/261232890.db2.gz FOZDLQLSUAIEHH-GFCCVEGCSA-N 1 0 278.808 3.964 20 70 CHIDRO CC[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccc(OC)cc1 ZINC000161478620 261247892 /nfs/dbraw/zinc/24/78/92/261247892.db2.gz HGOPCWADTOSGHO-MJGOQNOKSA-N 1 0 299.414 3.512 20 70 CHIDRO Cc1cc(N[C@H]2CCO[C@@H](C3CC3)C2)c2ccccc2[nH+]1 ZINC000160418436 264244303 /nfs/dbraw/zinc/24/43/03/264244303.db2.gz RLFVEOVMRGBUJY-KBXCAEBGSA-N 1 0 282.387 3.913 20 70 CHIDRO Cc1cc(N[C@@H]2CCO[C@H](C3CC3)C2)c2ccccc2[nH+]1 ZINC000160418050 264244314 /nfs/dbraw/zinc/24/43/14/264244314.db2.gz RLFVEOVMRGBUJY-KDOFPFPSSA-N 1 0 282.387 3.913 20 70 CHIDRO CC[C@@H]([NH2+]CCCc1nc2c(s1)CCCC2)C1CC1 ZINC000160627448 327633236 /nfs/dbraw/zinc/63/32/36/327633236.db2.gz YFGUFHDFHXYZER-CYBMUJFWSA-N 1 0 278.465 3.733 20 70 CHIDRO C[C@@H]([NH2+]CC1(CO)CCCC1)c1cc2c(s1)CCCC2 ZINC000160087888 327962086 /nfs/dbraw/zinc/96/20/86/327962086.db2.gz JXBHKZNUNNFWSO-CYBMUJFWSA-N 1 0 293.476 3.830 20 70 CHIDRO CCc1ccc([C@H](CO)[NH2+]Cc2ccc(C)cc2C)cc1 ZINC000160797048 328086293 /nfs/dbraw/zinc/08/62/93/328086293.db2.gz YSHSQUCPTGXIQP-IBGZPJMESA-N 1 0 283.415 3.689 20 70 CHIDRO Cc1nc2ccccn2c1C[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000160875966 328090914 /nfs/dbraw/zinc/09/09/14/328090914.db2.gz RGEGFOKMHLXBIJ-AUUYWEPGSA-N 1 0 291.398 3.836 20 70 CHIDRO COc1ccc2oc(C[N@H+](C)Cc3ccc(C)o3)cc2c1 ZINC000160878165 328091226 /nfs/dbraw/zinc/09/12/26/328091226.db2.gz RRSXMFMXFNUTIZ-UHFFFAOYSA-N 1 0 285.343 3.975 20 70 CHIDRO CC(C)NC(=O)C[NH2+][C@H](C)c1cccc(-c2ccccc2)c1 ZINC000160908267 328093956 /nfs/dbraw/zinc/09/39/56/328093956.db2.gz YJZCCGBGDYUGFR-OAHLLOKOSA-N 1 0 296.414 3.529 20 70 CHIDRO C[C@H](c1ccccc1)[C@H](C)[NH2+][C@H](CCO)c1ccccc1 ZINC000160973100 328104943 /nfs/dbraw/zinc/10/49/43/328104943.db2.gz HULPAPSLCLUSLR-TXPKVOOTSA-N 1 0 283.415 3.892 20 70 CHIDRO C[NH+](C)C1(CNc2nccc3ccccc32)CCCC1 ZINC000161051429 328121153 /nfs/dbraw/zinc/12/11/53/328121153.db2.gz QEDVALBAQJTOOY-UHFFFAOYSA-N 1 0 269.392 3.521 20 70 CHIDRO Cc1ccccc1C[C@@H](C)[NH2+][C@H](CCO)c1ccccc1 ZINC000161044819 328121670 /nfs/dbraw/zinc/12/16/70/328121670.db2.gz PBVHZVLONKNLDA-VQIMIIECSA-N 1 0 283.415 3.639 20 70 CHIDRO CCCCC1CCC([NH2+][C@H](C)c2cnccn2)CC1 ZINC000161172196 328150929 /nfs/dbraw/zinc/15/09/29/328150929.db2.gz UTSCUHXQKCTYHD-WLYUNCDWSA-N 1 0 261.413 3.876 20 70 CHIDRO Cc1cc(C)cc(CC[NH2+][C@H](C)c2cnn(C(C)C)c2)c1 ZINC000159506744 327391490 /nfs/dbraw/zinc/39/14/90/327391490.db2.gz NZTUPZZTCWEAOJ-MRXNPFEDSA-N 1 0 285.435 3.974 20 70 CHIDRO Cc1cc(C)cc(CC[NH2+][C@@H](C)c2cnc(C)nc2C)c1 ZINC000159472088 327505660 /nfs/dbraw/zinc/50/56/60/327505660.db2.gz CNWNBYQOWAVONV-AWEZNQCLSA-N 1 0 283.419 3.604 20 70 CHIDRO Cc1nn(C)cc1C[NH2+]C(c1ccccc1)c1ccccc1 ZINC000159554395 327534677 /nfs/dbraw/zinc/53/46/77/327534677.db2.gz PUJHJUIERGVAQK-UHFFFAOYSA-N 1 0 291.398 3.608 20 70 CHIDRO CCCC(=O)Nc1cccc(C[NH2+][C@H](C)C(C)C)c1 ZINC000159884547 327574091 /nfs/dbraw/zinc/57/40/91/327574091.db2.gz IHJVAIRHALOCOG-CYBMUJFWSA-N 1 0 262.397 3.559 20 70 CHIDRO CCCC(=O)Nc1cccc(C[NH2+][C@@H](C)C(C)C)c1 ZINC000159884431 327574098 /nfs/dbraw/zinc/57/40/98/327574098.db2.gz IHJVAIRHALOCOG-ZDUSSCGKSA-N 1 0 262.397 3.559 20 70 CHIDRO COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@H](C)C1CC1 ZINC000160140504 327596198 /nfs/dbraw/zinc/59/61/98/327596198.db2.gz JGCOEDUAAWNAIS-NXEZZACHSA-N 1 0 253.773 3.798 20 70 CHIDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)c2ccccc2)cc1C ZINC000161472696 329937499 /nfs/dbraw/zinc/93/74/99/329937499.db2.gz NEHVXCCRIFERAA-LPHOPBHVSA-N 1 0 283.415 3.730 20 70 CHIDRO CCOC(CC[NH2+][C@H](C)c1ccc(CC)cc1)OCC ZINC000159537221 330848754 /nfs/dbraw/zinc/84/87/54/330848754.db2.gz ACSRGEBLIRPGNK-CQSZACIVSA-N 1 0 279.424 3.689 20 70 CHIDRO Cc1nn(C)cc1[C@H](C)[NH2+]C1CC(C)(C)CC(C)(C)C1 ZINC000159726183 330850774 /nfs/dbraw/zinc/85/07/74/330850774.db2.gz KFRKSSBXHMIBEV-LBPRGKRZSA-N 1 0 277.456 3.984 20 70 CHIDRO Cc1ccccc1C1CC([NH2+][C@@H]2CCOC(C)(C)C2)C1 ZINC000159964224 330855265 /nfs/dbraw/zinc/85/52/65/330855265.db2.gz AIDRLYPIPZKMDT-HWOWSKLDSA-N 1 0 273.420 3.788 20 70 CHIDRO CC(C)[NH+](CCNCc1cc(F)cc(Cl)c1)C(C)C ZINC000160795603 330876388 /nfs/dbraw/zinc/87/63/88/330876388.db2.gz RFAWORIRYIDMCG-UHFFFAOYSA-N 1 0 286.822 3.688 20 70 CHIDRO C[C@H](C[NH2+]C1CCC2(CCCC2)CC1)N(C)C1CC1 ZINC000217538753 333121604 /nfs/dbraw/zinc/12/16/04/333121604.db2.gz LSTDZTOSTTUCFE-CQSZACIVSA-N 1 0 264.457 3.562 20 70 CHIDRO C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(F)c(Cl)c1 ZINC000217634725 333122201 /nfs/dbraw/zinc/12/22/01/333122201.db2.gz ZDTBWUTWWRQZNE-UVBJJODRSA-N 1 0 296.817 3.757 20 70 CHIDRO CC(C)(C)c1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000217640109 333122376 /nfs/dbraw/zinc/12/23/76/333122376.db2.gz BQIOBZNJSWPFCJ-ROUUACIJSA-N 1 0 286.463 3.701 20 70 CHIDRO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]Cc1cccc(O)c1 ZINC000217875675 333124920 /nfs/dbraw/zinc/12/49/20/333124920.db2.gz BVUUMBLYHKXGHI-COXVUDFISA-N 1 0 261.409 3.943 20 70 CHIDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccccc1OC(F)F ZINC000218203206 333129310 /nfs/dbraw/zinc/12/93/10/333129310.db2.gz HIXMQLGFUWWCQZ-CORIIIEPSA-N 1 0 299.361 3.896 20 70 CHIDRO CCC[N@@H+](Cc1ccccc1)C[C@@H](O)Cc1ccccc1 ZINC000218685619 333135042 /nfs/dbraw/zinc/13/50/42/333135042.db2.gz KEKVNDKUSQQOEI-IBGZPJMESA-N 1 0 283.415 3.502 20 70 CHIDRO CC1(C)Cc2occc2[C@@H]([NH2+]C[C@H](CO)c2ccccc2)C1 ZINC000161466854 520589073 /nfs/dbraw/zinc/58/90/73/520589073.db2.gz KEHHJIYSWHTALD-WBVHZDCISA-N 1 0 299.414 3.659 20 70 CHIDRO CC[C@H]([NH2+]C1CCC(O)CC1)c1cccc(Cl)c1F ZINC000161477107 522559242 /nfs/dbraw/zinc/55/92/42/522559242.db2.gz RWQIRBDMIDVKHS-MGULZYLOSA-N 1 0 285.790 3.823 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H]1CCCO1)c1cccc(Cl)c1F ZINC000161485476 522853917 /nfs/dbraw/zinc/85/39/17/522853917.db2.gz JCEDKWIIYXBWES-GXFFZTMASA-N 1 0 271.763 3.699 20 70 CHIDRO C[C@@H](C[C@@H]1CCCO1)[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000161269346 524850617 /nfs/dbraw/zinc/85/06/17/524850617.db2.gz LBLLXLVOTWTEBO-DUVNUKRYSA-N 1 0 293.382 3.587 20 70 CHIDRO c1nc2ccccn2c1C[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000160419301 526609700 /nfs/dbraw/zinc/60/97/00/526609700.db2.gz JQDBIBGQUHWBGZ-SFHVURJKSA-N 1 0 281.403 3.657 20 70 CHIDRO c1ncc(C[NH+]2CCC(c3nc4ccccc4o3)CC2)s1 ZINC000161051259 526611462 /nfs/dbraw/zinc/61/14/62/526611462.db2.gz DACJXTRYQBGMBZ-UHFFFAOYSA-N 1 0 299.399 3.664 20 70 CHIDRO CSC1(C[NH2+][C@H](C)c2ccccc2C)CCOCC1 ZINC000159692542 261191359 /nfs/dbraw/zinc/19/13/59/261191359.db2.gz GOACFRDKCPJEDY-CQSZACIVSA-N 1 0 279.449 3.558 20 70 CHIDRO CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc(C[NH3+])cc1 ZINC000159756407 261193304 /nfs/dbraw/zinc/19/33/04/261193304.db2.gz WRRUOMOOUGBOHX-GOSISDBHSA-N 1 0 296.414 3.615 20 70 CHIDRO C[C@H]([NH2+]CCC(C)(C)O)c1nc(-c2ccccc2)cs1 ZINC000159840038 261195093 /nfs/dbraw/zinc/19/50/93/261195093.db2.gz PEOXOXMRIWTCCK-LBPRGKRZSA-N 1 0 290.432 3.622 20 70 CHIDRO C[C@@H]([NH2+]CCSc1ccc(Cl)cc1)C1CCOCC1 ZINC000160088199 261204132 /nfs/dbraw/zinc/20/41/32/261204132.db2.gz ZNXJUEZFHNKXIE-GFCCVEGCSA-N 1 0 299.867 3.837 20 70 CHIDRO O[C@H]1CCCC[C@@H]1C[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000160444008 261214585 /nfs/dbraw/zinc/21/45/85/261214585.db2.gz WJJMGAPBTVKRCJ-UGFHNGPFSA-N 1 0 295.423 3.503 20 70 CHIDRO Cc1ncc([C@@H](C)[NH2+]CCSc2ccccc2)c(C)n1 ZINC000160515872 261217235 /nfs/dbraw/zinc/21/72/35/261217235.db2.gz SSXDNWNWWHHWKD-GFCCVEGCSA-N 1 0 287.432 3.536 20 70 CHIDRO CCC[N@H+](CCCc1nc(-c2ccccc2)no1)C1CC1 ZINC000160569003 261218486 /nfs/dbraw/zinc/21/84/86/261218486.db2.gz SYGKIVXIABQKMJ-UHFFFAOYSA-N 1 0 285.391 3.544 20 70 CHIDRO Cc1ccccc1C[C@@H](C)[NH2+][C@@H](C)c1cnc(C)nc1C ZINC000160760949 261225009 /nfs/dbraw/zinc/22/50/09/261225009.db2.gz CMYIOEOIXAZHIJ-KGLIPLIRSA-N 1 0 283.419 3.684 20 70 CHIDRO Cc1ccc(SCC[NH2+][C@H](C)c2cncs2)cc1 ZINC000160780940 261226130 /nfs/dbraw/zinc/22/61/30/261226130.db2.gz GDEGVZCENDLJCI-GFCCVEGCSA-N 1 0 278.446 3.894 20 70 CHIDRO Cc1cc2cc([C@H](C)[NH2+]C3CCN(C)CC3)oc2cc1C ZINC000161439543 261246453 /nfs/dbraw/zinc/24/64/53/261246453.db2.gz ASCZIDRVOXBMJT-AWEZNQCLSA-N 1 0 286.419 3.794 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2cccs2)o1 ZINC000160851926 262301747 /nfs/dbraw/zinc/30/17/47/262301747.db2.gz JIMLHOAVJQQEKN-UHFFFAOYSA-N 1 0 287.388 3.672 20 70 CHIDRO CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(C[NH3+])cc1 ZINC000161298482 264281464 /nfs/dbraw/zinc/28/14/64/264281464.db2.gz DJQJXJROPKESFB-QGZVFWFLSA-N 1 0 288.435 3.576 20 70 CHIDRO O=C(C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1)Nc1ccccc1 ZINC000160788781 328085479 /nfs/dbraw/zinc/08/54/79/328085479.db2.gz WAAWTHJNTVFCHR-QZTJIDSGSA-N 1 0 294.398 3.551 20 70 CHIDRO CC[C@@H]([NH2+]CCOC(C)(C)C)c1ccc(F)cc1F ZINC000160837886 328087925 /nfs/dbraw/zinc/08/79/25/328087925.db2.gz MKBCNOKUKGEBAP-CQSZACIVSA-N 1 0 271.351 3.821 20 70 CHIDRO CCCCOc1cccc(C[NH2+][C@H](C)C2CCOCC2)c1 ZINC000160837594 328088006 /nfs/dbraw/zinc/08/80/06/328088006.db2.gz GOJMUQKIQSGNPE-OAHLLOKOSA-N 1 0 291.435 3.770 20 70 CHIDRO Cc1ccc(-c2nnc([C@H](C)[N@H+](C)CC3CC3)o2)cc1C ZINC000160911263 328094048 /nfs/dbraw/zinc/09/40/48/328094048.db2.gz KWWQNEBKJXQUEF-ZDUSSCGKSA-N 1 0 285.391 3.756 20 70 CHIDRO CC[C@@H]([NH2+][C@H](C)CSC)c1ccc(F)cc1F ZINC000160940626 328096091 /nfs/dbraw/zinc/09/60/91/328096091.db2.gz IWEQPMZHRPEMRX-NOZJJQNGSA-N 1 0 259.365 3.757 20 70 CHIDRO CC[C@@H](C)NC(=O)c1cccc(C[NH2+][C@@H](CC)C(C)C)c1 ZINC000161102750 328131722 /nfs/dbraw/zinc/13/17/22/328131722.db2.gz VGXQIOPCSOZFGQ-PBHICJAKSA-N 1 0 290.451 3.739 20 70 CHIDRO C[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1cc2ccccc2o1 ZINC000161128107 328135596 /nfs/dbraw/zinc/13/55/96/328135596.db2.gz RIHRVXKZEWKKBT-BPUTZDHNSA-N 1 0 286.419 3.956 20 70 CHIDRO CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@@H](C)C(C)(C)C)c1 ZINC000161116838 328132940 /nfs/dbraw/zinc/13/29/40/328132940.db2.gz USCVTIOIMTWLNK-KBPBESRZSA-N 1 0 290.451 3.739 20 70 CHIDRO Cc1ccc(C[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)nc1 ZINC000161168037 328138474 /nfs/dbraw/zinc/13/84/74/328138474.db2.gz OPDFETDURABNAE-DOTOQJQBSA-N 1 0 266.388 3.768 20 70 CHIDRO COc1ccccc1[C@@H](C)[NH2+]C[C@](C)(O)CCC(C)C ZINC000159369101 327174994 /nfs/dbraw/zinc/17/49/94/327174994.db2.gz PKFKNAGYLBHVRD-RHSMWYFYSA-N 1 0 279.424 3.533 20 70 CHIDRO C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+][C@@H]1CCCSC1 ZINC000159662012 327553015 /nfs/dbraw/zinc/55/30/15/327553015.db2.gz MFZALTXFOCOIBO-WDBKCZKBSA-N 1 0 265.397 3.544 20 70 CHIDRO c1sc2ccccc2c1C[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000159683137 327554388 /nfs/dbraw/zinc/55/43/88/327554388.db2.gz PNSKUOYCPHWJEG-OIISXLGYSA-N 1 0 299.439 3.949 20 70 CHIDRO Cc1ccccc1[C@H](CC(C)C)NC(=O)CC[NH2+]C(C)C ZINC000159692969 327555192 /nfs/dbraw/zinc/55/51/92/327555192.db2.gz PLPZVDQAEJUCRA-KRWDZBQOSA-N 1 0 290.451 3.587 20 70 CHIDRO OC1(C[NH2+]Cc2cccc(-c3ccccn3)c2)CCCCC1 ZINC000159744381 327560488 /nfs/dbraw/zinc/56/04/88/327560488.db2.gz GHJODFNYRVWULO-UHFFFAOYSA-N 1 0 296.414 3.533 20 70 CHIDRO C[C@@H](CCC(C)(C)C)NC(=O)CC[C@H]([NH3+])c1ccccc1 ZINC000159768653 327562280 /nfs/dbraw/zinc/56/22/80/327562280.db2.gz DOOXMJZBYUEJEU-HOCLYGCPSA-N 1 0 290.451 3.798 20 70 CHIDRO C[C@H]([NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccccc1 ZINC000159825589 327569031 /nfs/dbraw/zinc/56/90/31/327569031.db2.gz LDELYYWAFMUYQP-GJZGRUSLSA-N 1 0 292.386 3.679 20 70 CHIDRO CC(C)[C@@H]([NH2+]C[C@@H](C)N1CCc2sccc2C1)C1CC1 ZINC000159878965 327573225 /nfs/dbraw/zinc/57/32/25/327573225.db2.gz DKSFFWJTZYGNPH-CXAGYDPISA-N 1 0 292.492 3.519 20 70 CHIDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OC(C)C)nc1)CC2 ZINC000160084259 327592897 /nfs/dbraw/zinc/59/28/97/327592897.db2.gz ZJMTYSUOUVJOHY-GOSISDBHSA-N 1 0 296.414 3.954 20 70 CHIDRO CC[C@H]([NH2+]CCOc1ccc(C(C)C)cc1)[C@@H]1CCOC1 ZINC000160341105 327606295 /nfs/dbraw/zinc/60/62/95/327606295.db2.gz GJBCCNYYYKYANK-AEFFLSMTSA-N 1 0 291.435 3.594 20 70 CHIDRO Cc1cc(C)cc([C@H](C)[NH2+]C[C@H](CO)c2ccccc2)c1 ZINC000161406979 329933164 /nfs/dbraw/zinc/93/31/64/329933164.db2.gz CKCFDOVKSRTEHK-QFBILLFUSA-N 1 0 283.415 3.730 20 70 CHIDRO CC1(C)CC[C@H](C[NH2+]Cc2ccccc2C(F)(F)F)O1 ZINC000160279730 330862377 /nfs/dbraw/zinc/86/23/77/330862377.db2.gz VJIRHWSRRZYBTF-GFCCVEGCSA-N 1 0 287.325 3.753 20 70 CHIDRO CCCC[NH+]1CCC(NCc2cc(F)cc(Cl)c2)CC1 ZINC000160886906 330878818 /nfs/dbraw/zinc/87/88/18/330878818.db2.gz PNKKUMSRZTTYJD-UHFFFAOYSA-N 1 0 298.833 3.833 20 70 CHIDRO CC(C)[C@@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1ccccc1 ZINC000218761344 333135924 /nfs/dbraw/zinc/13/59/24/333135924.db2.gz JQFOQVGIPGZRMN-RBUKOAKNSA-N 1 0 283.415 3.577 20 70 CHIDRO CCc1nnc(C[NH2+][C@H](c2cccs2)C(CC)CC)[nH]1 ZINC000160378287 522354809 /nfs/dbraw/zinc/35/48/09/522354809.db2.gz IDTRFLYZWRXUJQ-HNNXBMFYSA-N 1 0 292.452 3.696 20 70 CHIDRO CC[C@@H]1CCCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000161249690 523179193 /nfs/dbraw/zinc/17/91/93/523179193.db2.gz QPPWVAANWBLTMQ-CYBMUJFWSA-N 1 0 250.411 3.785 20 70 CHIDRO Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)cn1 ZINC000161285470 524610681 /nfs/dbraw/zinc/61/06/81/524610681.db2.gz KFPYYYQLNHOGKO-MSOLQXFVSA-N 1 0 266.388 3.816 20 70 CHIDRO Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCCC3)o2)cc1C ZINC000160467504 525860224 /nfs/dbraw/zinc/86/02/24/525860224.db2.gz PJKZOVBTENVLKU-CYBMUJFWSA-N 1 0 271.364 3.510 20 70 CHIDRO Cc1ccc2c(c1)OCCC[C@@H]2[NH2+][C@@H]1CCCSC1 ZINC000159549775 526174775 /nfs/dbraw/zinc/17/47/75/526174775.db2.gz QHDIIAXZJJIRSY-HIFRSBDPSA-N 1 0 277.433 3.694 20 70 CHIDRO C[C@H]([NH2+][C@H]1CC(C)(C)Oc2cc(F)ccc21)C1CC1 ZINC000160125590 260945877 /nfs/dbraw/zinc/94/58/77/260945877.db2.gz JEWBWTVEQYTWDU-HZMBPMFUSA-N 1 0 263.356 3.816 20 70 CHIDRO CCS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cnc(C)nc2C)C1 ZINC000159400250 261185482 /nfs/dbraw/zinc/18/54/82/261185482.db2.gz VMMVYSDIYOPQQT-NWANDNLSSA-N 1 0 293.480 3.808 20 70 CHIDRO CCOc1cccc2cc([C@H](C)[NH2+]CCC(C)(C)O)oc21 ZINC000159775368 261193994 /nfs/dbraw/zinc/19/39/94/261193994.db2.gz CLKGZPHZALXGCP-LBPRGKRZSA-N 1 0 291.391 3.643 20 70 CHIDRO Cc1ccccc1[C@H](C)[NH2+]Cc1cn(C)nc1C(F)(F)F ZINC000159784778 261194064 /nfs/dbraw/zinc/19/40/64/261194064.db2.gz CMCRTUSOYUECSS-NSHDSACASA-N 1 0 297.324 3.598 20 70 CHIDRO Cc1ccc([C@@H](C)[NH2+]Cc2cn3c(cccc3C)n2)s1 ZINC000160289251 261209834 /nfs/dbraw/zinc/20/98/34/261209834.db2.gz XQYFUVBRNKMBFS-CYBMUJFWSA-N 1 0 285.416 3.863 20 70 CHIDRO Clc1c(Br)cccc1C[NH2+]CC1CC1 ZINC000160396902 261213408 /nfs/dbraw/zinc/21/34/08/261213408.db2.gz LNUMIFCGAVEVDX-UHFFFAOYSA-N 1 0 274.589 3.602 20 70 CHIDRO CC(C)c1ccc(C[N@H+](C)Cc2ccc(CO)o2)cc1 ZINC000160667758 261222475 /nfs/dbraw/zinc/22/24/75/261222475.db2.gz FWNMPAPMBDIZMG-UHFFFAOYSA-N 1 0 273.376 3.527 20 70 CHIDRO Cc1ccc(C(=O)CC[N@H+](Cc2cccnc2)C2CC2)cc1 ZINC000161157627 261238702 /nfs/dbraw/zinc/23/87/02/261238702.db2.gz UUDROIYWAGMBDK-UHFFFAOYSA-N 1 0 294.398 3.627 20 70 CHIDRO Cc1ccc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)cn1 ZINC000161275261 261241765 /nfs/dbraw/zinc/24/17/65/261241765.db2.gz MJDNFFZKFDIQPU-INIZCTEOSA-N 1 0 286.350 3.533 20 70 CHIDRO Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1ccc(C)nc1 ZINC000161275765 261242038 /nfs/dbraw/zinc/24/20/38/261242038.db2.gz YFZSESATOLRXHL-KRWDZBQOSA-N 1 0 282.387 3.702 20 70 CHIDRO OC[C@@H](C[NH2+][C@@H]1CCSc2ccccc21)c1ccccc1 ZINC000161453016 261247092 /nfs/dbraw/zinc/24/70/92/261247092.db2.gz ABOZSSDSJKTXSS-NVXWUHKLSA-N 1 0 299.439 3.589 20 70 CHIDRO CC(C)CCn1cccc1C[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000160485275 327615644 /nfs/dbraw/zinc/61/56/44/327615644.db2.gz XPAOPLYQOFPHMO-OAHLLOKOSA-N 1 0 278.440 3.581 20 70 CHIDRO CCC[C@H](C)[C@H](CC)[NH2+]CCCc1nc(C(C)C)no1 ZINC000160806097 328087038 /nfs/dbraw/zinc/08/70/38/328087038.db2.gz CLELBSYPZKUHQL-KBPBESRZSA-N 1 0 281.444 3.930 20 70 CHIDRO CCC[C@@H]([NH2+]CC1(CCOC)CCC1)c1ccccn1 ZINC000159378022 327175953 /nfs/dbraw/zinc/17/59/53/327175953.db2.gz ILPZFQBPJKNYEH-OAHLLOKOSA-N 1 0 276.424 3.719 20 70 CHIDRO CCc1cnc(CC[NH2+][C@@H](C)c2ccccc2C)s1 ZINC000159707277 327555705 /nfs/dbraw/zinc/55/57/05/327555705.db2.gz URWVBXXSMMBGQQ-ZDUSSCGKSA-N 1 0 274.433 3.907 20 70 CHIDRO CC(C)C(=O)NCCC[NH2+][C@H](C)c1cccc2ccccc21 ZINC000159995324 327585761 /nfs/dbraw/zinc/58/57/61/327585761.db2.gz WCZJUKVXFIVDKU-OAHLLOKOSA-N 1 0 298.430 3.653 20 70 CHIDRO CC(C)Oc1ccc(C[NH2+][C@@H]2c3ccccc3C[C@@H]2C)cn1 ZINC000160057062 327590324 /nfs/dbraw/zinc/59/03/24/327590324.db2.gz XPJPAYLIGXTJDO-LIRRHRJNSA-N 1 0 296.414 3.892 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1ccc(C)cc1 ZINC000218725755 329078202 /nfs/dbraw/zinc/07/82/02/329078202.db2.gz DQYSHEVTSAFZPI-RBUKOAKNSA-N 1 0 283.415 3.639 20 70 CHIDRO C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(F)c(Cl)c1 ZINC000217634545 329394948 /nfs/dbraw/zinc/39/49/48/329394948.db2.gz ZDTBWUTWWRQZNE-XZJROXQQSA-N 1 0 296.817 3.757 20 70 CHIDRO C[C@H](C[NH2+]C(C1CC1)C1CC1)COCc1ccccc1 ZINC000161297710 329926153 /nfs/dbraw/zinc/92/61/53/329926153.db2.gz CTEVIBPRSNTCIO-CQSZACIVSA-N 1 0 273.420 3.618 20 70 CHIDRO Fc1cc(F)cc(C[NH2+]Cc2cc3ccccc3[nH]2)c1 ZINC000161329717 329927887 /nfs/dbraw/zinc/92/78/87/329927887.db2.gz XIMNEHGZXXBQDC-UHFFFAOYSA-N 1 0 272.298 3.736 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccs1 ZINC000161477485 329941089 /nfs/dbraw/zinc/94/10/89/329941089.db2.gz HPSXFERUOURAOF-HUUCEWRRSA-N 1 0 275.417 3.565 20 70 CHIDRO C[C@H]([NH2+]CCC(C)(C)O)C(c1ccccc1)c1ccccc1 ZINC000159642749 330849739 /nfs/dbraw/zinc/84/97/39/330849739.db2.gz XVZOZFKXANYPLA-INIZCTEOSA-N 1 0 297.442 3.958 20 70 CHIDRO CCCCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cncc(F)c2)C1(C)C ZINC000159795294 330851596 /nfs/dbraw/zinc/85/15/96/330851596.db2.gz UIPOYTWBSZYHKZ-APHBMKBZSA-N 1 0 294.414 3.855 20 70 CHIDRO CC1(C)C[C@@H]([NH2+][C@H]2CCc3cc(Cl)ccc32)CCO1 ZINC000159963813 330855285 /nfs/dbraw/zinc/85/52/85/330855285.db2.gz BPODXHCPLOZYGJ-ZFWWWQNUSA-N 1 0 279.811 3.875 20 70 CHIDRO C[C@H]([NH2+]CC1(CO)CCCC1)c1cc2ccccc2o1 ZINC000160075918 330858443 /nfs/dbraw/zinc/85/84/43/330858443.db2.gz XECRWQDJTXQQOP-ZDUSSCGKSA-N 1 0 273.376 3.636 20 70 CHIDRO CCc1ccc([C@H]([NH2+][C@H](C)[C@@H]2CCOC2)C(C)C)cc1 ZINC000160399196 330864655 /nfs/dbraw/zinc/86/46/55/330864655.db2.gz KZFLPZIWBHSEJZ-ZTFGCOKTSA-N 1 0 275.436 3.961 20 70 CHIDRO C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccccc1Cl ZINC000217661203 333122480 /nfs/dbraw/zinc/12/24/80/333122480.db2.gz JLGVEMDMRABGMD-MAZHCROVSA-N 1 0 278.827 3.617 20 70 CHIDRO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]C1CCN(C2CC2)CC1 ZINC000217791303 333123863 /nfs/dbraw/zinc/12/38/63/333123863.db2.gz JXHAAANFHBYKNX-OLMNPRSZSA-N 1 0 278.484 3.664 20 70 CHIDRO CC[C@H]([NH2+]Cc1cccc2cc[nH]c21)c1nccs1 ZINC000217821883 333124139 /nfs/dbraw/zinc/12/41/39/333124139.db2.gz SAIGEPRREFBANE-ZDUSSCGKSA-N 1 0 271.389 3.865 20 70 CHIDRO CCCC1CCC([NH2+]Cc2ccc(O)c(F)c2)CC1 ZINC000217825708 333124439 /nfs/dbraw/zinc/12/44/39/333124439.db2.gz KJMWGSWNSYSLJM-UHFFFAOYSA-N 1 0 265.372 3.980 20 70 CHIDRO CCN1CCC[C@H]1C[NH2+][C@H](c1ccc(C)cc1)C1CC1 ZINC000217875350 333124760 /nfs/dbraw/zinc/12/47/60/333124760.db2.gz ADGNKYOKZQLDEI-ZWKOTPCHSA-N 1 0 272.436 3.520 20 70 CHIDRO CC(C)c1ccc(N[C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)cc1 ZINC000217915609 333125008 /nfs/dbraw/zinc/12/50/08/333125008.db2.gz DDAHMOBJXCDGHW-JJRVBVJISA-N 1 0 260.425 3.951 20 70 CHIDRO Cn1ncc2c1CCC[C@@H]2[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000217995042 333125591 /nfs/dbraw/zinc/12/55/91/333125591.db2.gz HKLLHMQTGYNSOO-HRCADAONSA-N 1 0 289.467 3.992 20 70 CHIDRO COc1cccc(CC[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000218112556 333127079 /nfs/dbraw/zinc/12/70/79/333127079.db2.gz GWYMTAJSHAAGAO-UHFFFAOYSA-N 1 0 280.371 3.509 20 70 CHIDRO CCc1ccc(C[NH2+]Cc2cc(C)ccc2OC)s1 ZINC000218215589 333129561 /nfs/dbraw/zinc/12/95/61/333129561.db2.gz VEFZFMSOSINQRB-UHFFFAOYSA-N 1 0 275.417 3.917 20 70 CHIDRO CC1(C)Cc2occc2[C@H]([NH2+]C[C@@H](CO)c2ccccc2)C1 ZINC000161466481 520588143 /nfs/dbraw/zinc/58/81/43/520588143.db2.gz KEHHJIYSWHTALD-DOTOQJQBSA-N 1 0 299.414 3.659 20 70 CHIDRO Cc1cccc2c1CC[C@H]2[NH2+][C@H](CCO)c1ccccc1 ZINC000160960646 524941645 /nfs/dbraw/zinc/94/16/45/524941645.db2.gz DTHOFRCPXQWLHB-RTBURBONSA-N 1 0 281.399 3.696 20 70 CHIDRO C[C@H]([NH2+]CCCc1nc2c(s1)CCCC2)C1(C)CC1 ZINC000160624485 525346288 /nfs/dbraw/zinc/34/62/88/525346288.db2.gz YOBWJPXUVBXQPV-LBPRGKRZSA-N 1 0 278.465 3.733 20 70 CHIDRO C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1cncs1 ZINC000160969923 525505260 /nfs/dbraw/zinc/50/52/60/525505260.db2.gz BORNZYQHDFIJHJ-DGCLKSJQSA-N 1 0 258.390 3.524 20 70 CHIDRO Cc1ccc(C(=O)CC[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1 ZINC000160360215 526044669 /nfs/dbraw/zinc/04/46/69/526044669.db2.gz OEFBWERMWQWFEM-QGZVFWFLSA-N 1 0 282.387 3.733 20 70 CHIDRO Cc1ncccc1C[NH2+][C@@H]1CCCc2sccc21 ZINC000160994968 527361608 /nfs/dbraw/zinc/36/16/08/527361608.db2.gz UGSYJGVYPFCXLP-CQSZACIVSA-N 1 0 258.390 3.619 20 70 CHIDRO CCC(CC)(CC)[NH2+]Cc1noc(-c2ccsc2)n1 ZINC000160940418 261231508 /nfs/dbraw/zinc/23/15/08/261231508.db2.gz YQELRBRELUVEHP-UHFFFAOYSA-N 1 0 279.409 3.857 20 70 CHIDRO CCS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cncc(F)c2)C1 ZINC000159432685 261186316 /nfs/dbraw/zinc/18/63/16/261186316.db2.gz ZIIQDPKRCRIHIC-TUKIKUTGSA-N 1 0 282.428 3.936 20 70 CHIDRO CC(C)C[C@@H]([NH2+][C@H]1CCCSC1)c1ccccn1 ZINC000159530974 261188165 /nfs/dbraw/zinc/18/81/65/261188165.db2.gz JDEPWKOKPONOFL-DZGCQCFKSA-N 1 0 264.438 3.654 20 70 CHIDRO CCc1ccc([C@@H](C)NCc2ccc(OC(C)C)nc2)o1 ZINC000160108975 261205132 /nfs/dbraw/zinc/20/51/32/261205132.db2.gz UEQHNCLFDOFQBN-CYBMUJFWSA-N 1 0 288.391 3.875 20 70 CHIDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cn3c(cccc3C)n1)CC2 ZINC000160324307 261210695 /nfs/dbraw/zinc/21/06/95/261210695.db2.gz VMLSDNGRULSFOE-SFHVURJKSA-N 1 0 291.398 3.728 20 70 CHIDRO Cc1ccccc1C[C@H](C)[NH2+][C@@H](C)c1cnc(C)nc1C ZINC000160761069 261224934 /nfs/dbraw/zinc/22/49/34/261224934.db2.gz CMYIOEOIXAZHIJ-KBPBESRZSA-N 1 0 283.419 3.684 20 70 CHIDRO Cc1ccc([C@H](C)[NH2+][C@@H](CCCO)c2ccccc2)o1 ZINC000160889276 261230316 /nfs/dbraw/zinc/23/03/16/261230316.db2.gz IWVZBUCEYSQXGX-HOCLYGCPSA-N 1 0 273.376 3.752 20 70 CHIDRO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(C)nc1 ZINC000161316005 261242907 /nfs/dbraw/zinc/24/29/07/261242907.db2.gz AAHGGPNXLSEZTA-GFCCVEGCSA-N 1 0 290.794 3.903 20 70 CHIDRO Cc1ccc(C[NH2+][C@H]2CSCCc3ccccc32)cn1 ZINC000161313140 261243027 /nfs/dbraw/zinc/24/30/27/261243027.db2.gz XSZABYWKALXPIA-KRWDZBQOSA-N 1 0 284.428 3.510 20 70 CHIDRO Cc1cc2cc([C@@H](C)[NH2+]C3CCN(C)CC3)oc2cc1C ZINC000161439419 261246647 /nfs/dbraw/zinc/24/66/47/261246647.db2.gz ASCZIDRVOXBMJT-CQSZACIVSA-N 1 0 286.419 3.794 20 70 CHIDRO CC(C)(C)C[C@@H]([NH2+]CC(=O)NC(C)(C)C)c1ccccc1 ZINC000159871875 262385958 /nfs/dbraw/zinc/38/59/58/262385958.db2.gz CURUZCWUYWKDEG-OAHLLOKOSA-N 1 0 290.451 3.668 20 70 CHIDRO Fc1ccc2c(N[C@@H]3CCO[C@H](C4CC4)C3)cc[nH+]c2c1 ZINC000160443682 264244526 /nfs/dbraw/zinc/24/45/26/264244526.db2.gz MJOJVVLFYYIRII-DYVFJYSZSA-N 1 0 286.350 3.743 20 70 CHIDRO COC[C@@H]([NH2+]CC1(Sc2ccccc2)CC1)C(C)C ZINC000160499342 327616116 /nfs/dbraw/zinc/61/61/16/327616116.db2.gz HSJDZDJPFBJJAQ-OAHLLOKOSA-N 1 0 279.449 3.572 20 70 CHIDRO CC1(C)C[C@@H]([NH2+]Cc2cccc(-c3ccncc3)c2)CCO1 ZINC000160592139 327630652 /nfs/dbraw/zinc/63/06/52/327630652.db2.gz JSDBFDZJHKTCBP-SFHVURJKSA-N 1 0 296.414 3.796 20 70 CHIDRO CC(C)(O)C[NH2+][C@H](CCc1ccccc1)c1ccccc1 ZINC000160630777 327633649 /nfs/dbraw/zinc/63/36/49/327633649.db2.gz CYMNJEUZNBAGMF-GOSISDBHSA-N 1 0 283.415 3.721 20 70 CHIDRO CCc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CCCCN2CC)s1 ZINC000161163266 327915962 /nfs/dbraw/zinc/91/59/62/327915962.db2.gz KSWAXPPLZMOWKY-JSGCOSHPSA-N 1 0 295.496 3.539 20 70 CHIDRO C[C@H]([NH2+]CC(=O)Nc1ccccc1)C(C)(C)c1ccccc1 ZINC000160784917 328085519 /nfs/dbraw/zinc/08/55/19/328085519.db2.gz JYZZWGDMNBXZCQ-HNNXBMFYSA-N 1 0 296.414 3.581 20 70 CHIDRO C[C@H]1C[N@H+](Cc2cnc3ccccn23)[C@@H]1c1ccccc1 ZINC000160875629 328090953 /nfs/dbraw/zinc/09/09/53/328090953.db2.gz DBXUZARVDGOOLW-KSSFIOAISA-N 1 0 277.371 3.527 20 70 CHIDRO Cc1ccn2c(C[NH2+][C@H]3CCCc4sccc43)cnc2c1 ZINC000160982676 328113400 /nfs/dbraw/zinc/11/34/00/328113400.db2.gz MCDKZYFCIXGDIH-HNNXBMFYSA-N 1 0 297.427 3.871 20 70 CHIDRO OCC[C@@H]([NH2+][C@H]1CCC[C@H](C2CC2)C1)c1ccccc1 ZINC000161066904 328124178 /nfs/dbraw/zinc/12/41/78/328124178.db2.gz YCRAWGZIBIVPOC-OKZBNKHCSA-N 1 0 273.420 3.669 20 70 CHIDRO Cc1ccccc1CC[NH2+]Cc1cccc2cc[nH]c21 ZINC000218072817 328179606 /nfs/dbraw/zinc/17/96/06/328179606.db2.gz YAICUFHJQIWRPT-UHFFFAOYSA-N 1 0 264.372 3.809 20 70 CHIDRO Cc1cccc(OCC[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000218143575 328215438 /nfs/dbraw/zinc/21/54/38/328215438.db2.gz GAMJHYVFQJYRPA-UHFFFAOYSA-N 1 0 280.371 3.645 20 70 CHIDRO CCC[C@H]([NH2+]C[C@]1(C)CCCS1)c1ccccn1 ZINC000159367818 327174989 /nfs/dbraw/zinc/17/49/89/327174989.db2.gz KNOCCKXPCXGHCD-ZFWWWQNUSA-N 1 0 264.438 3.798 20 70 CHIDRO COc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)cc1 ZINC000159419669 327184229 /nfs/dbraw/zinc/18/42/29/327184229.db2.gz QXCRESYWPXOQDW-PBHICJAKSA-N 1 0 279.424 3.533 20 70 CHIDRO CCCCN(C(=O)[C@@H]([NH3+])CC)[C@H](CC)c1ccccc1 ZINC000159781887 327563606 /nfs/dbraw/zinc/56/36/06/327563606.db2.gz ZLGMDJPFCOBQCJ-JKSUJKDBSA-N 1 0 276.424 3.504 20 70 CHIDRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccccc1 ZINC000159825718 327568986 /nfs/dbraw/zinc/56/89/86/327568986.db2.gz LDELYYWAFMUYQP-CABCVRRESA-N 1 0 292.386 3.679 20 70 CHIDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C)nc1)CCCO2 ZINC000161294931 329926056 /nfs/dbraw/zinc/92/60/56/329926056.db2.gz QVSDWFLUKKKOJN-QGZVFWFLSA-N 1 0 282.387 3.702 20 70 CHIDRO Cc1ccc(C[C@H]([NH2+]Cc2ccc(C)nc2)C2CC2)cc1 ZINC000161331909 329928724 /nfs/dbraw/zinc/92/87/24/329928724.db2.gz ATLKDIHHBDGZFL-IBGZPJMESA-N 1 0 280.415 3.809 20 70 CHIDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)cn1 ZINC000161432392 329934153 /nfs/dbraw/zinc/93/41/53/329934153.db2.gz HVKDZGXUFYNRQB-RISCZKNCSA-N 1 0 252.789 3.793 20 70 CHIDRO CCC[C@H](CCO)C[NH2+][C@H](C)c1ccc(Cl)c(F)c1 ZINC000218264738 330439233 /nfs/dbraw/zinc/43/92/33/330439233.db2.gz PGWCFIMXSJTJHB-VXGBXAGGSA-N 1 0 287.806 3.928 20 70 CHIDRO CC[C@@H](C)[NH2+][C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000159574396 330849219 /nfs/dbraw/zinc/84/92/19/330849219.db2.gz AYEBRZWRTSMZEK-CRAIPNDOSA-N 1 0 296.414 3.625 20 70 CHIDRO CC1(C)CC[C@@H](C[NH2+]Cc2ccccc2C(F)(F)F)O1 ZINC000160279852 330862405 /nfs/dbraw/zinc/86/24/05/330862405.db2.gz VJIRHWSRRZYBTF-LBPRGKRZSA-N 1 0 287.325 3.753 20 70 CHIDRO CC1(C)C[C@H](Nc2cc[nH+]c3ccccc23)CCO1 ZINC000160695360 330873705 /nfs/dbraw/zinc/87/37/05/330873705.db2.gz BEYKAKNOOHAVSI-GFCCVEGCSA-N 1 0 256.349 3.604 20 70 CHIDRO CC(C)CCC[C@H](C)[NH2+][C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000160962976 330881702 /nfs/dbraw/zinc/88/17/02/330881702.db2.gz CWYYJHDCHRZDGD-DZGCQCFKSA-N 1 0 276.424 3.557 20 70 CHIDRO C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1cccc(Cl)c1 ZINC000217660208 333122745 /nfs/dbraw/zinc/12/27/45/333122745.db2.gz SYHDLJIBMPQDEL-RCBQFDQVSA-N 1 0 278.827 3.617 20 70 CHIDRO Cc1nc2ccccn2c1C[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000217884810 333124896 /nfs/dbraw/zinc/12/48/96/333124896.db2.gz ATMPRFRBBHTGNA-GZBFAFLISA-N 1 0 271.408 3.557 20 70 CHIDRO Fc1ccc(C[NH2+]Cc2cccc3cc[nH]c32)cc1F ZINC000218138481 333127344 /nfs/dbraw/zinc/12/73/44/333127344.db2.gz WJMFSRSJCGMFQJ-UHFFFAOYSA-N 1 0 272.298 3.736 20 70 CHIDRO Cn1cccc1[C@H]1CCC[N@@H+]1C/C=C/c1ccccc1 ZINC000218754948 333135801 /nfs/dbraw/zinc/13/58/01/333135801.db2.gz DTSDPEUERGBHMB-YPHWWSSASA-N 1 0 266.388 3.875 20 70 CHIDRO CC(C)(C)c1n[nH]cc1C[NH2+][C@H]1CCCc2sccc21 ZINC000160969511 519089205 /nfs/dbraw/zinc/08/92/05/519089205.db2.gz YQKHXKIJBNWCAT-ZDUSSCGKSA-N 1 0 289.448 3.936 20 70 CHIDRO CC(C)c1noc(CCC[NH2+][C@H](C)c2ccccc2F)n1 ZINC000160759268 519903114 /nfs/dbraw/zinc/90/31/14/519903114.db2.gz RPXSPVMRZFFXBJ-GFCCVEGCSA-N 1 0 291.370 3.616 20 70 CHIDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccco2)C12CCCC2 ZINC000160765532 520436361 /nfs/dbraw/zinc/43/63/61/520436361.db2.gz KCWAHDBUUNJHMW-VHDGCEQUSA-N 1 0 263.381 3.668 20 70 CHIDRO CC[N@H+](Cc1c(C)nc2ccccn21)[C@@H](C)C(C)C ZINC000160435179 521275742 /nfs/dbraw/zinc/27/57/42/521275742.db2.gz HYYYTJAAERMZED-AWEZNQCLSA-N 1 0 259.397 3.509 20 70 CHIDRO CC[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccc(OC)c1 ZINC000161440261 522627634 /nfs/dbraw/zinc/62/76/34/522627634.db2.gz MVOFWEHZKJYCGD-MJGOQNOKSA-N 1 0 299.414 3.512 20 70 CHIDRO CC[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1cc(F)ccc1F ZINC000160507002 522631311 /nfs/dbraw/zinc/63/13/11/522631311.db2.gz WKUYLPULVHJZDZ-RLCCDNCMSA-N 1 0 283.362 3.557 20 70 CHIDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(NC(C)=O)c1 ZINC000161411867 523045670 /nfs/dbraw/zinc/04/56/70/523045670.db2.gz IMLFEOKSEJGRKM-RDJZCZTQSA-N 1 0 274.408 3.703 20 70 CHIDRO C[N@H+](Cc1csc(C2CC2)n1)C1CCCCC1 ZINC000161254034 523524175 /nfs/dbraw/zinc/52/41/75/523524175.db2.gz AXRHXXLMPXZXBB-UHFFFAOYSA-N 1 0 250.411 3.785 20 70 CHIDRO C[C@@H](OCCC[NH2+]Cc1ccccc1)c1ccccc1 ZINC000160976694 260194693 /nfs/dbraw/zinc/19/46/93/260194693.db2.gz RWENYSMPPXJHHK-MRXNPFEDSA-N 1 0 269.388 3.944 20 70 CHIDRO C[C@@H]([NH2+][C@H]1CCCSC1)c1cc(F)c(F)c(F)c1 ZINC000159571236 261188973 /nfs/dbraw/zinc/18/89/73/261188973.db2.gz AMJOLWBAVPKWQN-SCZZXKLOSA-N 1 0 275.339 3.650 20 70 CHIDRO C[C@H]([NH2+][C@H]1CCCSC1)c1cc(F)c(F)c(F)c1 ZINC000159571061 261188990 /nfs/dbraw/zinc/18/89/90/261188990.db2.gz AMJOLWBAVPKWQN-WPRPVWTQSA-N 1 0 275.339 3.650 20 70 CHIDRO C[C@@H](C1CC1)[N@H+](Cc1cncs1)Cc1ccccc1 ZINC000159672638 261191642 /nfs/dbraw/zinc/19/16/42/261191642.db2.gz ZVBVVWHZGBAUPT-ZDUSSCGKSA-N 1 0 272.417 3.944 20 70 CHIDRO CSC1(C[NH2+][C@@H](C)c2ccccc2C)CCOCC1 ZINC000159692684 261192075 /nfs/dbraw/zinc/19/20/75/261192075.db2.gz GOACFRDKCPJEDY-AWEZNQCLSA-N 1 0 279.449 3.558 20 70 CHIDRO Cc1cccc([C@@H](C)[NH2+]Cc2cn(C)nc2C(F)(F)F)c1 ZINC000159783574 261194265 /nfs/dbraw/zinc/19/42/65/261194265.db2.gz BSMKLMYRSCJQDV-LLVKDONJSA-N 1 0 297.324 3.598 20 70 CHIDRO Cc1ccccc1[C@H](C)[NH2+]C[C@@](C)(O)c1ccsc1 ZINC000160049814 261203049 /nfs/dbraw/zinc/20/30/49/261203049.db2.gz BYYGIRBWRVJKOG-XJKSGUPXSA-N 1 0 275.417 3.615 20 70 CHIDRO Cc1ccc(NC(=O)CCC(C)(C)C)c(C[NH+](C)C)c1 ZINC000160324144 261211055 /nfs/dbraw/zinc/21/10/55/261211055.db2.gz UKSQAOSIBOZHGA-UHFFFAOYSA-N 1 0 276.424 3.821 20 70 CHIDRO Cc1ccccc1C[C@@H](C)[NH2+][C@H](C)c1cnc(C)nc1C ZINC000160761214 261224956 /nfs/dbraw/zinc/22/49/56/261224956.db2.gz CMYIOEOIXAZHIJ-ZIAGYGMSSA-N 1 0 283.419 3.684 20 70 CHIDRO Cc1ccc(C[NH2+][C@@H](C)c2cccnc2Cl)s1 ZINC000160919517 261231336 /nfs/dbraw/zinc/23/13/36/261231336.db2.gz BLNBRTLEAVIBGY-JTQLQIEISA-N 1 0 266.797 3.956 20 70 CHIDRO CC[N@H+](Cc1ccccn1)[C@H]1CCCc2ccccc21 ZINC000161185278 328214993 /nfs/dbraw/zinc/21/49/93/328214993.db2.gz DZXHTSOMASGFFT-SFHVURJKSA-N 1 0 266.388 3.981 20 70 CHIDRO C[C@@H](CCc1cccc(F)c1)[NH2+][C@H]1CCCSC1 ZINC000159573782 327540212 /nfs/dbraw/zinc/54/02/12/327540212.db2.gz FGWXHQJQPSQMRM-WFASDCNBSA-N 1 0 267.413 3.632 20 70 CHIDRO CCC(CC)(CO)C[NH2+][C@@H](c1ccccc1)C(C)C ZINC000161400930 327541856 /nfs/dbraw/zinc/54/18/56/327541856.db2.gz XRFNFRFHSJLLFX-MRXNPFEDSA-N 1 0 263.425 3.772 20 70 CHIDRO CC(C)(O)CC[NH2+][C@H](Cc1ccccc1)c1cccs1 ZINC000159679079 327554167 /nfs/dbraw/zinc/55/41/67/327554167.db2.gz CVWSAESIRVPMQF-OAHLLOKOSA-N 1 0 289.444 3.783 20 70 CHIDRO Cc1cc(N(C)Cc2ccco2)c2ccccc2[nH+]1 ZINC000218466431 329067580 /nfs/dbraw/zinc/06/75/80/329067580.db2.gz RBWHXWZKUZPTEU-UHFFFAOYSA-N 1 0 252.317 3.773 20 70 CHIDRO CC(C)C[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccccn1 ZINC000161422234 329931381 /nfs/dbraw/zinc/93/13/81/329931381.db2.gz RGVCQEKVGTXTNW-IEBWSBKVSA-N 1 0 298.430 3.535 20 70 CHIDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1cccc(C)c1C ZINC000161407951 329933224 /nfs/dbraw/zinc/93/32/24/329933224.db2.gz DYOJIVOAAUCINN-WBVHZDCISA-N 1 0 288.435 3.800 20 70 CHIDRO C[C@@H]([NH2+]CCC(C)(C)O)C(c1ccccc1)c1ccccc1 ZINC000159642884 330849674 /nfs/dbraw/zinc/84/96/74/330849674.db2.gz XVZOZFKXANYPLA-MRXNPFEDSA-N 1 0 297.442 3.958 20 70 CHIDRO CCCCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cncc(F)c2)C1(C)C ZINC000159795024 330851500 /nfs/dbraw/zinc/85/15/00/330851500.db2.gz UIPOYTWBSZYHKZ-VBNZEHGJSA-N 1 0 294.414 3.855 20 70 CHIDRO CC(C)CCC[C@@H](C)[NH2+][C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000160962844 330881725 /nfs/dbraw/zinc/88/17/25/330881725.db2.gz CWYYJHDCHRZDGD-UKRRQHHQSA-N 1 0 276.424 3.557 20 70 CHIDRO Cc1nc2ccccn2c1C[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000217884715 333124918 /nfs/dbraw/zinc/12/49/18/333124918.db2.gz ATMPRFRBBHTGNA-UMVBOHGHSA-N 1 0 271.408 3.557 20 70 CHIDRO CN(C)[C@H](C[NH2+]Cc1cccc2cc[nH]c21)c1cccs1 ZINC000218070205 333126354 /nfs/dbraw/zinc/12/63/54/333126354.db2.gz PVBCPFUACRNBHI-OAHLLOKOSA-N 1 0 299.443 3.622 20 70 CHIDRO c1cc2cccc(C[NH2+][C@H]3CCc4ccccc43)c2[nH]1 ZINC000218083121 333126571 /nfs/dbraw/zinc/12/65/71/333126571.db2.gz XBUBRMJCGSNYPM-KRWDZBQOSA-N 1 0 262.356 3.945 20 70 CHIDRO COc1ccc([C@H]([NH2+]CCOc2ccccc2)C2CC2)cc1 ZINC000218197096 333129333 /nfs/dbraw/zinc/12/93/33/333129333.db2.gz LSBQLLSPNJBOSS-LJQANCHMSA-N 1 0 297.398 3.815 20 70 CHIDRO CC(C)[C@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1ccccc1 ZINC000218761385 333136032 /nfs/dbraw/zinc/13/60/32/333136032.db2.gz JQFOQVGIPGZRMN-OALUTQOASA-N 1 0 283.415 3.577 20 70 CHIDRO CC(C)(C)c1n[nH]cc1C[NH2+][C@@H]1CCCc2sccc21 ZINC000160969382 519091000 /nfs/dbraw/zinc/09/10/00/519091000.db2.gz YQKHXKIJBNWCAT-CYBMUJFWSA-N 1 0 289.448 3.936 20 70 CHIDRO CCCC[N@H+](C)C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC000160580734 520397707 /nfs/dbraw/zinc/39/77/07/520397707.db2.gz UREWWJVQIPACJN-YIONKMFJSA-N 1 0 296.455 3.649 20 70 CHIDRO CCc1nc2c(s1)[C@@H]([NH2+][C@@H]1CCCSC1)CCC2 ZINC000159584360 522475242 /nfs/dbraw/zinc/47/52/42/522475242.db2.gz XOBVMFPFCYIKHZ-MNOVXSKESA-N 1 0 282.478 3.568 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@H]1CCO[C@@H]1C(C)C)c1ccccc1OC ZINC000160889703 522856299 /nfs/dbraw/zinc/85/62/99/522856299.db2.gz SOFNDOOHMFCFMU-YXJHDRRASA-N 1 0 291.435 3.797 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccc(OC)c1 ZINC000161440389 522861983 /nfs/dbraw/zinc/86/19/83/522861983.db2.gz MVOFWEHZKJYCGD-IEBWSBKVSA-N 1 0 299.414 3.512 20 70 CHIDRO CC[C@@](C)(NCCC[NH+]1CCCCC1)c1nc(C)cs1 ZINC000161437643 523658303 /nfs/dbraw/zinc/65/83/03/523658303.db2.gz HVGMFQHQQUPXSM-MRXNPFEDSA-N 1 0 295.496 3.542 20 70 CHIDRO C[C@H]([NH2+]CCCc1nc2c(s1)CCCC2)c1ccco1 ZINC000160620208 525346118 /nfs/dbraw/zinc/34/61/18/525346118.db2.gz LYDREKBUYWEGQH-LBPRGKRZSA-N 1 0 290.432 3.898 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@H]2CC(C)(C)OC2(C)C)n1 ZINC000160701708 526340479 /nfs/dbraw/zinc/34/04/79/526340479.db2.gz WEOZIFQZSGADPW-ZDUSSCGKSA-N 1 0 296.480 3.710 20 70 CHIDRO CCCOc1ccc([C@H](C)[NH2+][C@H](CC)COC)cc1OC ZINC000160008304 260941070 /nfs/dbraw/zinc/94/10/70/260941070.db2.gz PSONMRXBJHUVKP-DZGCQCFKSA-N 1 0 295.423 3.560 20 70 CHIDRO CC[C@H](C[NH2+][C@@H](C)c1cncs1)Oc1ccccc1F ZINC000160314353 261210959 /nfs/dbraw/zinc/21/09/59/261210959.db2.gz RIOFZSCRFPIGRR-NWDGAFQWSA-N 1 0 294.395 3.790 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@H](C)c2cncc(F)c2)n1 ZINC000160694087 261223451 /nfs/dbraw/zinc/22/34/51/261223451.db2.gz QVSCGQYKRPMBGK-GFCCVEGCSA-N 1 0 293.411 3.659 20 70 CHIDRO OCCC[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1 ZINC000160732092 261225241 /nfs/dbraw/zinc/22/52/41/261225241.db2.gz VUARVEZDMGQGTB-RTBURBONSA-N 1 0 281.399 3.777 20 70 CHIDRO CC(C)C[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccn1 ZINC000161014225 327671877 /nfs/dbraw/zinc/67/18/77/327671877.db2.gz JULRZFHNFBLVHQ-BQFCYCMXSA-N 1 0 289.467 3.631 20 70 CHIDRO Cc1ccccc1[C@H](C)[NH2+]CCCc1nc(C(C)C)no1 ZINC000160808424 328087022 /nfs/dbraw/zinc/08/70/22/328087022.db2.gz WUCHZQGLJGOCJZ-AWEZNQCLSA-N 1 0 287.407 3.785 20 70 CHIDRO CC[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)C[C@@H]1C)C1CC1 ZINC000160767120 328083882 /nfs/dbraw/zinc/08/38/82/328083882.db2.gz GXCBAVBJMGHLBG-SNRMKQJTSA-N 1 0 286.463 3.675 20 70 CHIDRO CC[C@H]([NH2+]CCOC(C)(C)C)c1ccc(F)cc1F ZINC000160837776 328088052 /nfs/dbraw/zinc/08/80/52/328088052.db2.gz MKBCNOKUKGEBAP-AWEZNQCLSA-N 1 0 271.351 3.821 20 70 CHIDRO Cc1ccc(C[N@@H+](C)Cc2ccc3ncccc3c2)o1 ZINC000160856089 328089095 /nfs/dbraw/zinc/08/90/95/328089095.db2.gz REURYYDHNMQDGP-UHFFFAOYSA-N 1 0 266.344 3.768 20 70 CHIDRO CSc1ccc(C[N@H+](C)Cc2occc2C)cc1 ZINC000160913217 328094313 /nfs/dbraw/zinc/09/43/13/328094313.db2.gz ZITASGDENBNUON-UHFFFAOYSA-N 1 0 261.390 3.942 20 70 CHIDRO CC(C)=CCC[C@@H](C)[NH2+][C@H](CCO)c1ccccc1 ZINC000160987849 328113817 /nfs/dbraw/zinc/11/38/17/328113817.db2.gz NUYKAOGLCFLBNL-NVXWUHKLSA-N 1 0 261.409 3.835 20 70 CHIDRO CC(C)n1cc([C@H](C)[NH2+]C[C@@H]2CCc3ccccc32)cn1 ZINC000161000338 328116357 /nfs/dbraw/zinc/11/63/57/328116357.db2.gz FLJUPNJUWKZPNB-HOCLYGCPSA-N 1 0 283.419 3.845 20 70 CHIDRO OCC[C@@H]([NH2+][C@@H]1CCC[C@H](C2CC2)C1)c1ccccc1 ZINC000161066808 328124172 /nfs/dbraw/zinc/12/41/72/328124172.db2.gz YCRAWGZIBIVPOC-RCCFBDPRSA-N 1 0 273.420 3.669 20 70 CHIDRO CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@H](C)C(C)(C)C)c1 ZINC000161117078 328132809 /nfs/dbraw/zinc/13/28/09/328132809.db2.gz USCVTIOIMTWLNK-UONOGXRCSA-N 1 0 290.451 3.739 20 70 CHIDRO CC[C@H](C)[NH2+]CCc1ccc(OC(F)(F)F)cc1 ZINC000161163554 328138237 /nfs/dbraw/zinc/13/82/37/328138237.db2.gz GMVUZZVSOAHADA-JTQLQIEISA-N 1 0 261.287 3.516 20 70 CHIDRO COc1ccc([C@H](C)[NH2+]C[C@](C)(O)CCC(C)C)cc1F ZINC000159362252 327175477 /nfs/dbraw/zinc/17/54/77/327175477.db2.gz PYIAYKLRODAHPU-SUMWQHHRSA-N 1 0 297.414 3.672 20 70 CHIDRO CC[N@H+](CCc1nccs1)Cc1cc(C)cc(C)c1 ZINC000159376854 327175976 /nfs/dbraw/zinc/17/59/76/327175976.db2.gz ZKBNCVUNBAWWFR-UHFFFAOYSA-N 1 0 274.433 3.825 20 70 CHIDRO C[C@@H]([NH2+]Cc1cn2ccccc2n1)c1cc2c(s1)CCC2 ZINC000159422892 327186176 /nfs/dbraw/zinc/18/61/76/327186176.db2.gz ZKDOGCHALRULMG-GFCCVEGCSA-N 1 0 297.427 3.735 20 70 CHIDRO CCSc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)CC)cc1 ZINC000159432309 327189565 /nfs/dbraw/zinc/18/95/65/327189565.db2.gz LKFQWCKPEBXKIX-DOMZBBRYSA-N 1 0 267.438 3.610 20 70 CHIDRO CC[C@@H](C)[N@H+](C)CCNCc1ccccc1C(F)(F)F ZINC000217384453 327356344 /nfs/dbraw/zinc/35/63/44/327356344.db2.gz NICUCGBYLOGDHZ-GFCCVEGCSA-N 1 0 288.357 3.525 20 70 CHIDRO C[C@@H](CCc1ccc(F)cc1)[NH2+][C@H]1CCCSC1 ZINC000159652865 327550907 /nfs/dbraw/zinc/55/09/07/327550907.db2.gz IRUIDDRELVWVNC-WFASDCNBSA-N 1 0 267.413 3.632 20 70 CHIDRO OCC1(C[NH2+]C2CCC(c3ccccc3)CC2)CCCC1 ZINC000160116541 330859472 /nfs/dbraw/zinc/85/94/72/330859472.db2.gz QDAJLJLEWBIWMP-UHFFFAOYSA-N 1 0 287.447 3.855 20 70 CHIDRO CCCCCOc1ccc(C[NH2+][C@]2(C)CCOC2)cc1 ZINC000160183298 330860395 /nfs/dbraw/zinc/86/03/95/330860395.db2.gz NLBIGNNWTZGXIM-QGZVFWFLSA-N 1 0 277.408 3.524 20 70 CHIDRO CC1(C)CC[C@@H](C[NH2+][C@@H]2CCCc3ccccc32)O1 ZINC000160217536 330861607 /nfs/dbraw/zinc/86/16/07/330861607.db2.gz YTLRRLPCDLDCAA-GOEBONIOSA-N 1 0 259.393 3.611 20 70 CHIDRO CC(C)[NH+](CCNCc1ccc(Cl)cc1F)C(C)C ZINC000160634106 330870620 /nfs/dbraw/zinc/87/06/20/330870620.db2.gz FCYFSIJEPLFZSQ-UHFFFAOYSA-N 1 0 286.822 3.688 20 70 CHIDRO COc1ccccc1C[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000160796027 330876384 /nfs/dbraw/zinc/87/63/84/330876384.db2.gz NJTLVXIAFCMGBL-UHFFFAOYSA-N 1 0 279.742 3.778 20 70 CHIDRO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H](C)c1cnn(C)c1 ZINC000217451684 333121009 /nfs/dbraw/zinc/12/10/09/333121009.db2.gz KIWWTLFPYRSAPH-CLWVCHIJSA-N 1 0 263.429 3.532 20 70 CHIDRO CCCC1CCC([NH2+][C@H]2CCN3CCCC[C@@H]23)CC1 ZINC000217633479 333122149 /nfs/dbraw/zinc/12/21/49/333122149.db2.gz KBXZCINJJOAJOR-GQGLESIBSA-N 1 0 264.457 3.562 20 70 CHIDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC000218059698 333126281 /nfs/dbraw/zinc/12/62/81/333126281.db2.gz VAQQSSHJOWLKIN-COLVAYQJSA-N 1 0 269.335 3.573 20 70 CHIDRO c1cnn(-c2ccc(C[NH2+]CCCC3CCCC3)cc2)c1 ZINC000218213291 333129658 /nfs/dbraw/zinc/12/96/58/333129658.db2.gz SSMCJCNXOHZXJK-UHFFFAOYSA-N 1 0 283.419 3.932 20 70 CHIDRO CCC[C@H]([NH2+]CC(CC)(CC)CO)c1ccccc1 ZINC000161439961 521156778 /nfs/dbraw/zinc/15/67/78/521156778.db2.gz HJIKAKNYOYYUOT-INIZCTEOSA-N 1 0 263.425 3.916 20 70 CHIDRO CCC[NH+]1CCC(NC(=O)C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000159747587 517584664 /nfs/dbraw/zinc/58/46/64/517584664.db2.gz VIUHDXOURDLXQP-HNNXBMFYSA-N 1 0 294.483 3.584 20 70 CHIDRO CC(C)c1noc(CCC[NH2+][C@H](C)c2cccs2)n1 ZINC000160774343 519903003 /nfs/dbraw/zinc/90/30/03/519903003.db2.gz MBYFHOOWJLUZGP-LLVKDONJSA-N 1 0 279.409 3.538 20 70 CHIDRO CCO[C@H]1C[C@@H]([NH2+][C@@H](C)c2cnn(CC)c2)C1(CC)CC ZINC000161305609 520552449 /nfs/dbraw/zinc/55/24/49/520552449.db2.gz DBMDORLRVYRYLW-IMJJTQAJSA-N 1 0 293.455 3.537 20 70 CHIDRO C[NH+](C)Cc1cccc(NCc2cc(F)cc(F)c2)c1 ZINC000160603461 521930923 /nfs/dbraw/zinc/93/09/23/521930923.db2.gz QBYFWQONEGHCRM-UHFFFAOYSA-N 1 0 276.330 3.639 20 70 CHIDRO CCc1nc2c(s1)[C@H]([NH2+][C@H]1CCCSC1)CCC2 ZINC000159584478 522481462 /nfs/dbraw/zinc/48/14/62/522481462.db2.gz XOBVMFPFCYIKHZ-WDEREUQCSA-N 1 0 282.478 3.568 20 70 CHIDRO CC[C@H]([NH2+]CCCOC)c1cccc(Cl)c1F ZINC000161478654 522584626 /nfs/dbraw/zinc/58/46/26/522584626.db2.gz SHTLUGXVXICYMB-LBPRGKRZSA-N 1 0 259.752 3.556 20 70 CHIDRO CC[C@H]([NH2+][C@H](CCO)c1ccccc1)c1ccccc1OC ZINC000161081084 522748487 /nfs/dbraw/zinc/74/84/87/522748487.db2.gz KXTNUNIBOWYFGD-ZWKOTPCHSA-N 1 0 299.414 3.860 20 70 CHIDRO CC[C@@H]([NH2+]CC(CC)(CC)CO)c1ccc(C)cc1 ZINC000161431469 522819142 /nfs/dbraw/zinc/81/91/42/522819142.db2.gz UHELGPOUMFUIMU-MRXNPFEDSA-N 1 0 263.425 3.834 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1cc(F)ccc1F ZINC000160507112 522863674 /nfs/dbraw/zinc/86/36/74/522863674.db2.gz WKUYLPULVHJZDZ-LYRGGWFBSA-N 1 0 283.362 3.557 20 70 CHIDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000161426958 523045447 /nfs/dbraw/zinc/04/54/47/523045447.db2.gz NFWKTSZISWXZAM-DYEKYZERSA-N 1 0 282.453 3.909 20 70 CHIDRO Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCCCC3)o2)cc1C ZINC000160457012 525859779 /nfs/dbraw/zinc/85/97/79/525859779.db2.gz JMBUNZHUZZBZDF-CQSZACIVSA-N 1 0 285.391 3.900 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@@H]2CC(C)(C)OC2(C)C)n1 ZINC000160701566 526337836 /nfs/dbraw/zinc/33/78/36/526337836.db2.gz WEOZIFQZSGADPW-CYBMUJFWSA-N 1 0 296.480 3.710 20 70 CHIDRO Cc1ncccc1C[NH2+][C@H]1CCCc2sccc21 ZINC000160995070 527361019 /nfs/dbraw/zinc/36/10/19/527361019.db2.gz UGSYJGVYPFCXLP-AWEZNQCLSA-N 1 0 258.390 3.619 20 70 CHIDRO Cc1cc(C)c(C[NH2+][C@H]2CCOC(C)(C)C2)c(C)c1 ZINC000160471905 260011115 /nfs/dbraw/zinc/01/11/15/260011115.db2.gz ZVSBHOHZFATPKR-HNNXBMFYSA-N 1 0 261.409 3.659 20 70 CHIDRO CN(C)C1(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)CCCC1 ZINC000160680915 260084561 /nfs/dbraw/zinc/08/45/61/260084561.db2.gz WSIQCYRLSZAUKW-STQMWFEESA-N 1 0 292.389 3.572 20 70 CHIDRO CCS[C@H]1CCC[C@H]([NH2+][C@@H](C)c2cnc(C)nc2C)C1 ZINC000159400103 261185768 /nfs/dbraw/zinc/18/57/68/261185768.db2.gz VMMVYSDIYOPQQT-QEJZJMRPSA-N 1 0 293.480 3.808 20 70 CHIDRO C[C@H](C1CC1)[N@@H+](Cc1ccccc1)CC1=CCCOC1 ZINC000159682103 261191536 /nfs/dbraw/zinc/19/15/36/261191536.db2.gz ZKDBRSJMSVOQPZ-OAHLLOKOSA-N 1 0 271.404 3.634 20 70 CHIDRO CC[C@@H]([NH2+]C[C@@](C)(O)c1ccsc1)c1ccccc1 ZINC000159929747 261198969 /nfs/dbraw/zinc/19/89/69/261198969.db2.gz OZSZSGFJIWBLIU-HZPDHXFCSA-N 1 0 275.417 3.697 20 70 CHIDRO c1ccc2c(N[C@H]3CCO[C@H](C4CC4)C3)cc[nH+]c2c1 ZINC000160319347 261210691 /nfs/dbraw/zinc/21/06/91/261210691.db2.gz MKVPZVQONRPXCO-GUYCJALGSA-N 1 0 268.360 3.604 20 70 CHIDRO CC[C@H](C[NH2+][C@H](C)c1cncs1)Oc1ccccc1F ZINC000160314578 261211069 /nfs/dbraw/zinc/21/10/69/261211069.db2.gz RIOFZSCRFPIGRR-VXGBXAGGSA-N 1 0 294.395 3.790 20 70 CHIDRO CCCOc1cccc(C[NH2+][C@@H](C)c2cnn(CC)c2)c1 ZINC000160476862 261215150 /nfs/dbraw/zinc/21/51/50/261215150.db2.gz BRLKOLIHAYNXEQ-AWEZNQCLSA-N 1 0 287.407 3.543 20 70 CHIDRO Cc1nc(C[NH+]2CCCC2)oc1-c1ccc(Cl)cc1 ZINC000160467343 261215176 /nfs/dbraw/zinc/21/51/76/261215176.db2.gz AUZCQKHHLHNWBS-UHFFFAOYSA-N 1 0 276.767 3.899 20 70 CHIDRO Cc1cccc(C)c1CC[NH2+][C@@H](C)c1ccncc1 ZINC000160599694 261219720 /nfs/dbraw/zinc/21/97/20/261219720.db2.gz GGCRBRWPBZDOII-HNNXBMFYSA-N 1 0 254.377 3.592 20 70 CHIDRO OCCC[C@@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1 ZINC000160732350 261225119 /nfs/dbraw/zinc/22/51/19/261225119.db2.gz VUARVEZDMGQGTB-MOPGFXCFSA-N 1 0 281.399 3.777 20 70 CHIDRO Cc1ccc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)cn1 ZINC000161275136 261241935 /nfs/dbraw/zinc/24/19/35/261241935.db2.gz MJDNFFZKFDIQPU-MRXNPFEDSA-N 1 0 286.350 3.533 20 70 CHIDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1cncs1 ZINC000161356839 261245582 /nfs/dbraw/zinc/24/55/82/261245582.db2.gz FYWAWKORYYCMQM-LLVKDONJSA-N 1 0 276.380 3.665 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccc(OC)cc1 ZINC000161478752 261247403 /nfs/dbraw/zinc/24/74/03/261247403.db2.gz HGOPCWADTOSGHO-IEBWSBKVSA-N 1 0 299.414 3.512 20 70 CHIDRO CCc1ccc(C[NH2+]Cc2ccc(NC(C)=O)cc2)s1 ZINC000218219502 263095119 /nfs/dbraw/zinc/09/51/19/263095119.db2.gz PUXFKRJXRBGMLL-UHFFFAOYSA-N 1 0 288.416 3.559 20 70 CHIDRO CC[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)nc1)C1CC1 ZINC000160509363 327617713 /nfs/dbraw/zinc/61/77/13/327617713.db2.gz LIVLRTTUJJRDLW-QGZVFWFLSA-N 1 0 287.451 3.596 20 70 CHIDRO Cc1cccc2nc(C[NH2+][C@H]3CCc4cc(F)ccc43)cn21 ZINC000160289520 327696057 /nfs/dbraw/zinc/69/60/57/327696057.db2.gz OFXPOHDWOZNQIQ-KRWDZBQOSA-N 1 0 295.361 3.559 20 70 CHIDRO CCC[C@@H](C)[C@@H](CC)[NH2+]CCCc1nc(C(C)C)no1 ZINC000160805771 328086979 /nfs/dbraw/zinc/08/69/79/328086979.db2.gz CLELBSYPZKUHQL-ZIAGYGMSSA-N 1 0 281.444 3.930 20 70 CHIDRO CCc1ccc([C@@H](CO)[NH2+]Cc2ccc(Cl)cc2)cc1 ZINC000160810651 328087123 /nfs/dbraw/zinc/08/71/23/328087123.db2.gz AAEDJADZBBHQAH-QGZVFWFLSA-N 1 0 289.806 3.726 20 70 CHIDRO Cc1ccccc1C[C@H](C)[NH2+][C@@H](C)CC(F)(F)F ZINC000160774590 328084116 /nfs/dbraw/zinc/08/41/16/328084116.db2.gz NKMFTMORGGLIBY-RYUDHWBXSA-N 1 0 259.315 3.857 20 70 CHIDRO Cc1noc(C)c1CC[NH2+][C@H](C)c1cc(C)ccc1C ZINC000160896263 328093379 /nfs/dbraw/zinc/09/33/79/328093379.db2.gz JAQMWTOJOBLWQL-CYBMUJFWSA-N 1 0 272.392 3.802 20 70 CHIDRO CC[C@H]([NH2+][C@H](C)CSC)c1ccc(F)cc1F ZINC000160940514 328096001 /nfs/dbraw/zinc/09/60/01/328096001.db2.gz IWEQPMZHRPEMRX-RNCFNFMXSA-N 1 0 259.365 3.757 20 70 CHIDRO C[C@@H]([NH2+][C@H](CCO)c1ccccc1)[C@@H](C)c1ccccc1 ZINC000160972710 328104353 /nfs/dbraw/zinc/10/43/53/328104353.db2.gz HULPAPSLCLUSLR-GPMSIDNRSA-N 1 0 283.415 3.892 20 70 CHIDRO CCn1nc(C)c(C[N@H+](C)Cc2cccc(Cl)c2)c1C ZINC000161130101 328135627 /nfs/dbraw/zinc/13/56/27/328135627.db2.gz YVZQCQMUNSOFEC-UHFFFAOYSA-N 1 0 291.826 3.805 20 70 CHIDRO CCC[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1ccccn1 ZINC000159368201 327175020 /nfs/dbraw/zinc/17/50/20/327175020.db2.gz KNOCCKXPCXGHCD-UKRRQHHQSA-N 1 0 264.438 3.798 20 70 CHIDRO CC[C@@H]([NH2+][C@H]1CCCSC1)c1cc(F)ccc1F ZINC000159554154 327534409 /nfs/dbraw/zinc/53/44/09/327534409.db2.gz LSNZMSARYOOMBX-SMDDNHRTSA-N 1 0 271.376 3.901 20 70 CHIDRO C/C(=C/c1ccc(Cl)cc1)C[NH2+]CCc1cccnc1 ZINC000159961761 327582478 /nfs/dbraw/zinc/58/24/78/327582478.db2.gz GHPUZEHEETUZIO-KAMYIIQDSA-N 1 0 286.806 3.971 20 70 CHIDRO CC[C@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1cccc(C)c1C ZINC000161408352 329933250 /nfs/dbraw/zinc/93/32/50/329933250.db2.gz DYOJIVOAAUCINN-DOTOQJQBSA-N 1 0 288.435 3.800 20 70 CHIDRO COc1ccc(CC[C@H](C)[NH2+][C@H]2CCOC(C)(C)C2)cc1 ZINC000159943293 330854782 /nfs/dbraw/zinc/85/47/82/330854782.db2.gz BBFRBAVBVZSXMX-HOCLYGCPSA-N 1 0 291.435 3.564 20 70 CHIDRO CC[C@H](Cc1ccccc1)[NH2+][C@H]1CCOC(C)(C)C1 ZINC000159986472 330856273 /nfs/dbraw/zinc/85/62/73/330856273.db2.gz JSWDHENCHUMZBL-CVEARBPZSA-N 1 0 261.409 3.555 20 70 CHIDRO c1ccc2cc(CN[C@@H]3CC[N@@H+]4CCCC[C@@H]34)ccc2c1 ZINC000217640216 333122216 /nfs/dbraw/zinc/12/22/16/333122216.db2.gz LOUNHFOHRSKILE-MOPGFXCFSA-N 1 0 280.415 3.556 20 70 CHIDRO CC(C)(C)c1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000217640023 333122264 /nfs/dbraw/zinc/12/22/64/333122264.db2.gz BQIOBZNJSWPFCJ-MSOLQXFVSA-N 1 0 286.463 3.701 20 70 CHIDRO C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1cccc(Cl)c1 ZINC000217660040 333122659 /nfs/dbraw/zinc/12/26/59/333122659.db2.gz SYHDLJIBMPQDEL-MAZHCROVSA-N 1 0 278.827 3.617 20 70 CHIDRO c1cc2cccc(C[NH2+][C@@H]3CCc4ccccc4C3)c2[nH]1 ZINC000218071406 333126177 /nfs/dbraw/zinc/12/61/77/333126177.db2.gz ABMAUIRFNMMJAZ-GOSISDBHSA-N 1 0 276.383 3.815 20 70 CHIDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000218058976 333126275 /nfs/dbraw/zinc/12/62/75/333126275.db2.gz BKDOHBDNVLHQKS-NZVBXONLSA-N 1 0 269.335 3.573 20 70 CHIDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC000218059612 333126339 /nfs/dbraw/zinc/12/63/39/333126339.db2.gz VAQQSSHJOWLKIN-NZVBXONLSA-N 1 0 269.335 3.573 20 70 CHIDRO Clc1cc(Cl)cc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c1 ZINC000218478594 333132700 /nfs/dbraw/zinc/13/27/00/333132700.db2.gz MGXDPZRQDYHPIV-CABCVRRESA-N 1 0 299.245 3.710 20 70 CHIDRO CC(=O)Nc1ccccc1C[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000160352948 519750533 /nfs/dbraw/zinc/75/05/33/519750533.db2.gz OXTYKXDEVYNPNO-UKRRQHHQSA-N 1 0 274.408 3.561 20 70 CHIDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cncc(F)c2)C1(CC)CC ZINC000161310880 520433954 /nfs/dbraw/zinc/43/39/54/520433954.db2.gz ZRWDJPSUHHWZEZ-VBNZEHGJSA-N 1 0 294.414 3.855 20 70 CHIDRO CC1(C)Cc2occc2[C@@H]([NH2+]C[C@@H](CO)c2ccccc2)C1 ZINC000161466593 520588730 /nfs/dbraw/zinc/58/87/30/520588730.db2.gz KEHHJIYSWHTALD-RDJZCZTQSA-N 1 0 299.414 3.659 20 70 CHIDRO CCSCC[C@@H](C)[N@H+](C)Cc1c(C)nc2ccccn21 ZINC000160904560 521712081 /nfs/dbraw/zinc/71/20/81/521712081.db2.gz BSCKFBVJVTZCQW-CYBMUJFWSA-N 1 0 291.464 3.606 20 70 CHIDRO CC[C@H]([NH2+]C[C@H]1CCCCO1)c1ccc(F)cc1F ZINC000160825293 522631452 /nfs/dbraw/zinc/63/14/52/522631452.db2.gz VOPXVMZANYHBMI-DOMZBBRYSA-N 1 0 269.335 3.575 20 70 CHIDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000161427056 523223932 /nfs/dbraw/zinc/22/39/32/523223932.db2.gz NFWKTSZISWXZAM-YRGRVCCFSA-N 1 0 282.453 3.909 20 70 CHIDRO Cc1cc(C)cc(CC[NH2+][C@@H](C)c2cncs2)c1 ZINC000159470392 261187072 /nfs/dbraw/zinc/18/70/72/261187072.db2.gz BZSKFNXCYABNFP-ZDUSSCGKSA-N 1 0 260.406 3.653 20 70 CHIDRO CC[N@H+](CCc1nccs1)Cc1ccccc1C ZINC000159400127 261185410 /nfs/dbraw/zinc/18/54/10/261185410.db2.gz MFRIVCNWNUXCOM-UHFFFAOYSA-N 1 0 260.406 3.516 20 70 CHIDRO C[C@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1cccc(F)c1F ZINC000159482700 261186991 /nfs/dbraw/zinc/18/69/91/261186991.db2.gz AZHUVXBQKQOYOD-YVEFUNNKSA-N 1 0 291.341 3.523 20 70 CHIDRO Fc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCCSC1)CCCO2 ZINC000159549646 261188235 /nfs/dbraw/zinc/18/82/35/261188235.db2.gz NZYOKUFGLDOLFM-JSGCOSHPSA-N 1 0 281.396 3.525 20 70 CHIDRO CC(C)OCCC[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000159825797 261194918 /nfs/dbraw/zinc/19/49/18/261194918.db2.gz NSPCLKSFBUZMAL-HNNXBMFYSA-N 1 0 290.432 3.637 20 70 CHIDRO CC[N@H+](Cc1ncc(-c2ccccc2F)o1)C(C)C ZINC000159980355 261201274 /nfs/dbraw/zinc/20/12/74/261201274.db2.gz RJBMYIYFAKETPJ-UHFFFAOYSA-N 1 0 262.328 3.711 20 70 CHIDRO CC(C)CSCCC[NH2+][C@@H](C)c1cccnc1 ZINC000160019660 261201752 /nfs/dbraw/zinc/20/17/52/261201752.db2.gz WOKMGMYKFZOIKP-ZDUSSCGKSA-N 1 0 252.427 3.512 20 70 CHIDRO CC(C)CSCCC[NH2+][C@@H](C)c1ccncc1 ZINC000160026665 261202298 /nfs/dbraw/zinc/20/22/98/261202298.db2.gz UZCUKWSXVMOUOR-ZDUSSCGKSA-N 1 0 252.427 3.512 20 70 CHIDRO C[C@@H]1C[C@H]([NH2+]CCSc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000160046906 261202979 /nfs/dbraw/zinc/20/29/79/261202979.db2.gz YIEHLRMYFULKNR-TZMCWYRMSA-N 1 0 298.883 3.504 20 70 CHIDRO CC(=O)Nc1ccccc1C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000160444648 261214035 /nfs/dbraw/zinc/21/40/35/261214035.db2.gz JVQODFNFDIBBQA-ROUUACIJSA-N 1 0 294.398 3.538 20 70 CHIDRO CC(=O)Nc1ccccc1C[NH2+]C1CC(c2ccccc2)C1 ZINC000160425201 261214118 /nfs/dbraw/zinc/21/41/18/261214118.db2.gz XYRBEQCIVQYFTC-UHFFFAOYSA-N 1 0 294.398 3.681 20 70 CHIDRO CC[C@H]([NH2+]CCCCCOC)c1ccc(F)cc1F ZINC000160838524 261227804 /nfs/dbraw/zinc/22/78/04/261227804.db2.gz CXCDXFPKQSKXJB-HNNXBMFYSA-N 1 0 271.351 3.822 20 70 CHIDRO Cc1ccc(SCC[NH2+][C@@H](C)c2cncc(F)c2)cc1 ZINC000160834986 261228350 /nfs/dbraw/zinc/22/83/50/261228350.db2.gz KITJNMPHLWMECT-ZDUSSCGKSA-N 1 0 290.407 3.972 20 70 CHIDRO C[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)C1CCCC1 ZINC000160876822 261228926 /nfs/dbraw/zinc/22/89/26/261228926.db2.gz DIKNJGZPSJPVMN-PBHICJAKSA-N 1 0 261.409 3.669 20 70 CHIDRO Cc1ncc([C@@H](C)[NH2+]CC2(c3ccc(F)cc3)CC2)c(C)n1 ZINC000161357926 261245596 /nfs/dbraw/zinc/24/55/96/261245596.db2.gz NHOVBXKMIPFBCJ-GFCCVEGCSA-N 1 0 299.393 3.615 20 70 CHIDRO CCOC(CC[NH2+]CC[C@H](C)c1ccccc1)OCC ZINC000159545290 262360445 /nfs/dbraw/zinc/36/04/45/262360445.db2.gz TUBNNEGKHDTJKC-HNNXBMFYSA-N 1 0 279.424 3.559 20 70 CHIDRO Cc1ccc2[nH+]ccc(N[C@@H]3CCO[C@H](C4CC4)C3)c2c1 ZINC000160394092 264243348 /nfs/dbraw/zinc/24/33/48/264243348.db2.gz XYEYPLMNFGCMER-KDOFPFPSSA-N 1 0 282.387 3.913 20 70 CHIDRO C[C@@H]([NH2+]CC(C)(C)O)c1cccc(-c2ccccc2)c1 ZINC000160587471 327630176 /nfs/dbraw/zinc/63/01/76/327630176.db2.gz AARZOYUAZSZPQN-CQSZACIVSA-N 1 0 269.388 3.775 20 70 CHIDRO C[C@H]([NH2+]CC(C)(C)O)c1ccc(-c2ccc(F)cc2)s1 ZINC000160624801 327633212 /nfs/dbraw/zinc/63/32/12/327633212.db2.gz PVPYILIXYLWDKK-NSHDSACASA-N 1 0 293.407 3.976 20 70 CHIDRO CCc1ccc([C@H](CO)[NH2+]Cc2ccc(Cl)cc2)cc1 ZINC000160810772 328086927 /nfs/dbraw/zinc/08/69/27/328086927.db2.gz AAEDJADZBBHQAH-KRWDZBQOSA-N 1 0 289.806 3.726 20 70 CHIDRO Cc1ncccc1CN(C)Cc1ccccc1Cl ZINC000160824070 328088513 /nfs/dbraw/zinc/08/85/13/328088513.db2.gz TZXZWNQKTTVQBG-UHFFFAOYSA-N 1 0 260.768 3.675 20 70 CHIDRO COc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)cc1F ZINC000159362399 327175534 /nfs/dbraw/zinc/17/55/34/327175534.db2.gz PYIAYKLRODAHPU-DYVFJYSZSA-N 1 0 297.414 3.672 20 70 CHIDRO C[C@@H]([NH2+]CCCc1cccc(F)c1)c1cncs1 ZINC000159764044 327562133 /nfs/dbraw/zinc/56/21/33/327562133.db2.gz GIJYBTXIJNGTJW-LLVKDONJSA-N 1 0 264.369 3.566 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H](O)Cc1ccccc1)c1ccc(C)cc1 ZINC000218725908 329078350 /nfs/dbraw/zinc/07/83/50/329078350.db2.gz DQYSHEVTSAFZPI-RTBURBONSA-N 1 0 283.415 3.639 20 70 CHIDRO Cc1ccc(CN2CCO[C@H](c3cccc(F)c3)C2)cc1 ZINC000216700500 329299568 /nfs/dbraw/zinc/29/95/68/329299568.db2.gz DQWHMXAAPYKFBX-SFHVURJKSA-N 1 0 285.362 3.708 20 70 CHIDRO CCCCO[C@H]1C[C@H]([NH2+][C@@H](C)c2cncc(F)c2)C1(C)C ZINC000159795163 330851598 /nfs/dbraw/zinc/85/15/98/330851598.db2.gz UIPOYTWBSZYHKZ-RCBQFDQVSA-N 1 0 294.414 3.855 20 70 CHIDRO CC1(C)C[C@H]([NH2+]Cc2ccc3ccccc3c2)CCO1 ZINC000160534044 330866912 /nfs/dbraw/zinc/86/69/12/330866912.db2.gz CNDXWHWMIYQKMD-QGZVFWFLSA-N 1 0 269.388 3.887 20 70 CHIDRO CCCC1CCC([NH2+][C@@H]2CCN3CCCC[C@@H]23)CC1 ZINC000217633379 333122133 /nfs/dbraw/zinc/12/21/33/333122133.db2.gz KBXZCINJJOAJOR-BACDZXNISA-N 1 0 264.457 3.562 20 70 CHIDRO CC1(C)C[C@H]1C[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000217806451 333124168 /nfs/dbraw/zinc/12/41/68/333124168.db2.gz DUTZFINJRQHSPB-AWEZNQCLSA-N 1 0 259.393 3.536 20 70 CHIDRO COc1ccccc1CC[NH2+]Cc1cccc2cc[nH]c21 ZINC000218069285 333126355 /nfs/dbraw/zinc/12/63/55/333126355.db2.gz MCYSEIMYYFTWCC-UHFFFAOYSA-N 1 0 280.371 3.509 20 70 CHIDRO C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(F)cc1Cl ZINC000218128191 333127287 /nfs/dbraw/zinc/12/72/87/333127287.db2.gz LEPHGNGSWWXJLI-XZJROXQQSA-N 1 0 296.817 3.757 20 70 CHIDRO CCOc1ccccc1C[NH2+]Cc1ccc(CC)s1 ZINC000218218753 333129487 /nfs/dbraw/zinc/12/94/87/333129487.db2.gz WFISNYOGOGRTLC-UHFFFAOYSA-N 1 0 275.417 3.999 20 70 CHIDRO CC(C)c1noc(CCC[NH2+][C@@H](C)c2ccccc2F)n1 ZINC000160759149 519901882 /nfs/dbraw/zinc/90/18/82/519901882.db2.gz RPXSPVMRZFFXBJ-LBPRGKRZSA-N 1 0 291.370 3.616 20 70 CHIDRO CC1CC[NH+](C2CCC(NC(=O)CC(C)(C)C)CC2)CC1 ZINC000161486691 520992257 /nfs/dbraw/zinc/99/22/57/520992257.db2.gz FFZKEXJVMBXKAS-UHFFFAOYSA-N 1 0 294.483 3.582 20 70 CHIDRO CC[C@H]1CCCC[C@H]1[NH2+]CCCCn1ccnc1C ZINC000161425709 523060777 /nfs/dbraw/zinc/06/07/77/523060777.db2.gz PORRTESZQROWBW-JKSUJKDBSA-N 1 0 263.429 3.530 20 70 CHIDRO COc1ccc([C@@H](CCC(C)C)[NH2+]CC(C)(C)O)cc1 ZINC000160592116 525176445 /nfs/dbraw/zinc/17/64/45/525176445.db2.gz MKVRFFJCOIFQQG-MRXNPFEDSA-N 1 0 279.424 3.533 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@@H](C)C2CCCC2)n1 ZINC000160702915 526339020 /nfs/dbraw/zinc/33/90/20/526339020.db2.gz UFVXWUZBHDGTGT-ZDUSSCGKSA-N 1 0 266.454 3.943 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@@H](C)C2(C)CC2)n1 ZINC000160697579 526339046 /nfs/dbraw/zinc/33/90/46/526339046.db2.gz YBLYHEXHSIJWMU-LBPRGKRZSA-N 1 0 252.427 3.552 20 70 CHIDRO CN(C)C1(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)CCCC1 ZINC000160681138 260084381 /nfs/dbraw/zinc/08/43/81/260084381.db2.gz WSIQCYRLSZAUKW-OLZOCXBDSA-N 1 0 292.389 3.572 20 70 CHIDRO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+][C@@H](C)C1CC1 ZINC000160128174 260946354 /nfs/dbraw/zinc/94/63/54/260946354.db2.gz MEBJCWNOYPKHLX-WDEREUQCSA-N 1 0 287.432 3.963 20 70 CHIDRO Cc1cccc([C@@H]2CCC[N@@H+]2CCCCCn2cccn2)n1 ZINC000160159816 260947670 /nfs/dbraw/zinc/94/76/70/260947670.db2.gz YAGCZVFKLOTSLV-SFHVURJKSA-N 1 0 298.434 3.594 20 70 CHIDRO C[C@@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1cccc(F)c1F ZINC000159482824 261186935 /nfs/dbraw/zinc/18/69/35/261186935.db2.gz AZHUVXBQKQOYOD-SJKOYZFVSA-N 1 0 291.341 3.523 20 70 CHIDRO Cc1nn(C)cc1C[N@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000159671307 261190893 /nfs/dbraw/zinc/19/08/93/261190893.db2.gz COWKGCHFMHPSHE-OAHLLOKOSA-N 1 0 283.419 3.529 20 70 CHIDRO C[C@@H]([NH2+]CCC1Cc2ccccc2C1)c1cccnc1 ZINC000159729467 261193091 /nfs/dbraw/zinc/19/30/91/261193091.db2.gz ZWDYFYIHXNANMZ-CQSZACIVSA-N 1 0 266.388 3.537 20 70 CHIDRO C[C@@H]([NH2+]CCC(C)(C)O)c1nc(-c2ccccc2)cs1 ZINC000159840175 261195335 /nfs/dbraw/zinc/19/53/35/261195335.db2.gz PEOXOXMRIWTCCK-GFCCVEGCSA-N 1 0 290.432 3.622 20 70 CHIDRO Cc1ccccc1[C@@H](C)[NH2+]C[C@@](C)(O)c1ccsc1 ZINC000160049659 261202543 /nfs/dbraw/zinc/20/25/43/261202543.db2.gz BYYGIRBWRVJKOG-CZUORRHYSA-N 1 0 275.417 3.615 20 70 CHIDRO CCc1ccc([C@H](C)NCc2ccc(OC(C)C)nc2)o1 ZINC000160109115 261205134 /nfs/dbraw/zinc/20/51/34/261205134.db2.gz UEQHNCLFDOFQBN-ZDUSSCGKSA-N 1 0 288.391 3.875 20 70 CHIDRO Cc1ccsc1[C@H](C)[NH2+]Cc1cn2c(cccc2C)n1 ZINC000160314362 261211029 /nfs/dbraw/zinc/21/10/29/261211029.db2.gz AWZQFCXRQHMKPV-ZDUSSCGKSA-N 1 0 285.416 3.863 20 70 CHIDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(-c3ccccc3)o2)CCO1 ZINC000160597302 261219059 /nfs/dbraw/zinc/21/90/59/261219059.db2.gz ZIZLSSFLBBYNSM-HNNXBMFYSA-N 1 0 285.387 3.994 20 70 CHIDRO OCCC[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1 ZINC000160732221 261224977 /nfs/dbraw/zinc/22/49/77/261224977.db2.gz VUARVEZDMGQGTB-RBUKOAKNSA-N 1 0 281.399 3.777 20 70 CHIDRO Cc1ccccc1C[C@H](C)[NH2+][C@H](C)c1cnc(C)nc1C ZINC000160761332 261225445 /nfs/dbraw/zinc/22/54/45/261225445.db2.gz CMYIOEOIXAZHIJ-UONOGXRCSA-N 1 0 283.419 3.684 20 70 CHIDRO OCC[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000160933649 261231514 /nfs/dbraw/zinc/23/15/14/261231514.db2.gz SXHBKDRLSLSDCS-QZTJIDSGSA-N 1 0 285.362 3.526 20 70 CHIDRO OCC[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000160933785 261232066 /nfs/dbraw/zinc/23/20/66/261232066.db2.gz SXHBKDRLSLSDCS-MSOLQXFVSA-N 1 0 285.362 3.526 20 70 CHIDRO CC(C)Cn1cc(C[NH2+][C@@H]2CCCc3sccc32)cn1 ZINC000160973008 261232377 /nfs/dbraw/zinc/23/23/77/261232377.db2.gz WKRGJXCTQPRVJB-OAHLLOKOSA-N 1 0 289.448 3.768 20 70 CHIDRO c1cc2c(s1)CCC[C@H]2[NH2+]Cc1ccc2c[nH]nc2c1 ZINC000160957474 261232885 /nfs/dbraw/zinc/23/28/85/261232885.db2.gz KRNYJXNNPADZBQ-CQSZACIVSA-N 1 0 283.400 3.792 20 70 CHIDRO Cc1ccc(C(=O)CC[N@@H+](C)[C@@H](C)c2cccnc2)cc1 ZINC000161188343 261240510 /nfs/dbraw/zinc/24/05/10/261240510.db2.gz NKWLUIJQGSAJMO-HNNXBMFYSA-N 1 0 282.387 3.656 20 70 CHIDRO CCc1ccc(C[NH2+]Cc2c[nH]nc2-c2ccccc2)s1 ZINC000218218528 263095512 /nfs/dbraw/zinc/09/55/12/263095512.db2.gz VLECHOWIHADAED-UHFFFAOYSA-N 1 0 297.427 3.990 20 70 CHIDRO CCS[C@@H]1CCC[C@@H]([NH2+]C(C2CC2)C2CC2)C1 ZINC000159392258 327177771 /nfs/dbraw/zinc/17/77/71/327177771.db2.gz DCAJNCUYDGSVCH-ZIAGYGMSSA-N 1 0 253.455 3.829 20 70 CHIDRO Cc1cccc([C@H](C)[NH2+]CCCOCC(F)(F)F)c1 ZINC000160247921 327603968 /nfs/dbraw/zinc/60/39/68/327603968.db2.gz JMGNBJJNNMAQOQ-LBPRGKRZSA-N 1 0 275.314 3.615 20 70 CHIDRO Cc1cc([C@H](C)[NH2+]C[C@@H](CO)c2ccccc2)c(C)s1 ZINC000161429909 329933606 /nfs/dbraw/zinc/93/36/06/329933606.db2.gz JQXBECJLHDFKDO-BBRMVZONSA-N 1 0 289.444 3.792 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccs1 ZINC000161477117 329941117 /nfs/dbraw/zinc/94/11/17/329941117.db2.gz HPSXFERUOURAOF-GJZGRUSLSA-N 1 0 275.417 3.565 20 70 CHIDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)CC2 ZINC000159962372 330855254 /nfs/dbraw/zinc/85/52/54/330855254.db2.gz OYAICVDGDCHINO-GDBMZVCRSA-N 1 0 259.393 3.530 20 70 CHIDRO C[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc2c(c1)CCC2 ZINC000159988177 330856535 /nfs/dbraw/zinc/85/65/35/330856535.db2.gz DZZKRKMFQUTXAT-GUYCJALGSA-N 1 0 273.420 3.784 20 70 CHIDRO C[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cnc2ccsc2c1 ZINC000159991734 330856580 /nfs/dbraw/zinc/85/65/80/330856580.db2.gz TWGYUIDWWPDACA-AAEUAGOBSA-N 1 0 290.432 3.905 20 70 CHIDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](C)C1)c1ccc(Br)cc1 ZINC000160028417 330857121 /nfs/dbraw/zinc/85/71/21/330857121.db2.gz ZJVHYYZJCPKHLJ-MISXGVKJSA-N 1 0 298.224 3.667 20 70 CHIDRO Cc1cccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c1 ZINC000160206450 330861112 /nfs/dbraw/zinc/86/11/12/330861112.db2.gz HQLBHZIFFFZOKA-UAGQMJEPSA-N 1 0 261.409 3.849 20 70 CHIDRO CCCn1cc(C[NH2+][C@H]2CCCc3sccc32)cn1 ZINC000160982103 330882528 /nfs/dbraw/zinc/88/25/28/330882528.db2.gz RLCDGGFBTDFNMJ-AWEZNQCLSA-N 1 0 275.421 3.522 20 70 CHIDRO CC[C@@H](C)N(C)CC[NH2+]Cc1csc2ccccc12 ZINC000217395128 333120776 /nfs/dbraw/zinc/12/07/76/333120776.db2.gz AMJIRAXJRAMANZ-CYBMUJFWSA-N 1 0 276.449 3.721 20 70 CHIDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cc(C)ccc1C ZINC000218236868 333129854 /nfs/dbraw/zinc/12/98/54/333129854.db2.gz LNQGTMVPOHHPBI-USXIJHARSA-N 1 0 261.409 3.912 20 70 CHIDRO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]Cc1cn2ccccc2n1 ZINC000218581390 333133387 /nfs/dbraw/zinc/13/33/87/333133387.db2.gz BLNAJHRCVKDEDS-OIISXLGYSA-N 1 0 285.435 3.885 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1F ZINC000160560060 522616174 /nfs/dbraw/zinc/61/61/74/522616174.db2.gz JVYAQTDVXINURF-UVBJJODRSA-N 1 0 283.362 3.557 20 70 CHIDRO C[C@H]1CCC[C@H](C)C1[NH2+][C@@H](CCCO)c1ccccc1 ZINC000160822607 524180883 /nfs/dbraw/zinc/18/08/83/524180883.db2.gz QRYPHCNYPWYUDI-ZOBUZTSGSA-N 1 0 275.436 3.915 20 70 CHIDRO Cc1cc[nH+]c(NCCc2cccc3cccnc32)c1 ZINC000161182058 525693518 /nfs/dbraw/zinc/69/35/18/525693518.db2.gz FQSXBLKYFACLLX-UHFFFAOYSA-N 1 0 263.344 3.593 20 70 CHIDRO Cc1cc(-c2nnc(C[N@@H+](CC(C)C)C3CC3)o2)c(C)o1 ZINC000161369632 526058632 /nfs/dbraw/zinc/05/86/32/526058632.db2.gz CCZDPYUVFVGSSE-UHFFFAOYSA-N 1 0 289.379 3.567 20 70 CHIDRO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@H]1CCCC[C@@H]1O ZINC000160491020 526676639 /nfs/dbraw/zinc/67/66/39/526676639.db2.gz PELUWIVDMCWNBJ-BNOWGMLFSA-N 1 0 296.480 3.777 20 70 CHIDRO CC(C)[C@H](c1ccccc1Cl)[N@H+](C)CCn1cccn1 ZINC000217181665 260078038 /nfs/dbraw/zinc/07/80/38/260078038.db2.gz HAZYHXLMNQKBMB-MRXNPFEDSA-N 1 0 291.826 3.866 20 70 CHIDRO Fc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCCSC1)CCCO2 ZINC000159549366 261188177 /nfs/dbraw/zinc/18/81/77/261188177.db2.gz NZYOKUFGLDOLFM-OCCSQVGLSA-N 1 0 281.396 3.525 20 70 CHIDRO Cc1cccc(C)c1CC[NH2+][C@H](C)c1ccncc1 ZINC000160599810 261219698 /nfs/dbraw/zinc/21/96/98/261219698.db2.gz GGCRBRWPBZDOII-OAHLLOKOSA-N 1 0 254.377 3.592 20 70 CHIDRO OCCC[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000160671617 261222458 /nfs/dbraw/zinc/22/24/58/261222458.db2.gz ZNBALKLUXYKURO-RTBURBONSA-N 1 0 299.389 3.916 20 70 CHIDRO C[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccc(Cl)s1 ZINC000161448594 261246986 /nfs/dbraw/zinc/24/69/86/261246986.db2.gz ANMSOVPLBVMVNJ-YPMHNXCESA-N 1 0 295.835 3.828 20 70 CHIDRO Cc1ccc2[nH+]ccc(N[C@H]3CCO[C@H](C4CC4)C3)c2c1 ZINC000160394217 264242691 /nfs/dbraw/zinc/24/26/91/264242691.db2.gz XYEYPLMNFGCMER-KSSFIOAISA-N 1 0 282.387 3.913 20 70 CHIDRO CC(C)C[C@@H]1CCCCCN1C(=O)c1ccc(C[NH3+])cc1 ZINC000161298379 264281570 /nfs/dbraw/zinc/28/15/70/264281570.db2.gz DJQJXJROPKESFB-KRWDZBQOSA-N 1 0 288.435 3.576 20 70 CHIDRO Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccc(NC(N)=O)cc2)c1 ZINC000160704858 327974680 /nfs/dbraw/zinc/97/46/80/327974680.db2.gz QOKIMXNDXYGAIU-AWEZNQCLSA-N 1 0 297.402 3.645 20 70 CHIDRO Cc1csc(CCCC[NH2+][C@H](C(C)C)C2CC2)n1 ZINC000160708072 327976758 /nfs/dbraw/zinc/97/67/58/327976758.db2.gz YJXXUCXPHWLFLD-OAHLLOKOSA-N 1 0 266.454 3.798 20 70 CHIDRO CC(C)[C@@H](C)[NH2+][C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000161128678 328135482 /nfs/dbraw/zinc/13/54/82/328135482.db2.gz CZCUGSOKZOGTPY-PXAZEXFGSA-N 1 0 275.392 3.543 20 70 CHIDRO Cc1ncccc1C[N@H+](C)CCOc1ccc(Cl)cc1 ZINC000161164404 328138549 /nfs/dbraw/zinc/13/85/49/328138549.db2.gz JNVPLTRVKNGFEO-UHFFFAOYSA-N 1 0 290.794 3.554 20 70 CHIDRO CC(C)=CCC[C@H](C)[NH2+]Cc1cn2ccccc2n1 ZINC000159412408 327183242 /nfs/dbraw/zinc/18/32/42/327183242.db2.gz QQHFJTKQXXHATL-AWEZNQCLSA-N 1 0 257.381 3.559 20 70 CHIDRO Fc1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCCSC2)cc1 ZINC000159609361 327546436 /nfs/dbraw/zinc/54/64/36/327546436.db2.gz KINGNBVXZLSADL-OWCLPIDISA-N 1 0 279.424 3.947 20 70 CHIDRO Fc1ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c(Cl)c1 ZINC000159651360 327550397 /nfs/dbraw/zinc/55/03/97/327550397.db2.gz OSJCMYVGGFLMNR-CFVMTHIKSA-N 1 0 295.785 3.526 20 70 CHIDRO C[C@@H]([NH2+]CCCc1cccc(F)c1)c1cncc(F)c1 ZINC000159796273 327565124 /nfs/dbraw/zinc/56/51/24/327565124.db2.gz ZYMRUVRAEDQEMT-GFCCVEGCSA-N 1 0 276.330 3.643 20 70 CHIDRO CC1([NH2+]Cc2cc(Cl)c3c(c2)OCCCO3)CCC1 ZINC000159917681 327578455 /nfs/dbraw/zinc/57/84/55/327578455.db2.gz JDMYZMGLIFTIMZ-UHFFFAOYSA-N 1 0 281.783 3.534 20 70 CHIDRO CC[C@H]([NH2+]C[C@H](O)Cc1ccccc1)c1ccc(C)cc1 ZINC000218725973 329078251 /nfs/dbraw/zinc/07/82/51/329078251.db2.gz DQYSHEVTSAFZPI-MOPGFXCFSA-N 1 0 283.415 3.639 20 70 CHIDRO CC[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc2c(c1)CCO2 ZINC000159921785 330854233 /nfs/dbraw/zinc/85/42/33/330854233.db2.gz DCOSJBTWWGZORB-HOTGVXAUSA-N 1 0 289.419 3.620 20 70 CHIDRO CC1(C)C[C@@H]([NH2+][C@@H]2CCc3cc(Cl)ccc32)CCO1 ZINC000159963558 330855294 /nfs/dbraw/zinc/85/52/94/330855294.db2.gz BPODXHCPLOZYGJ-DZGCQCFKSA-N 1 0 279.811 3.875 20 70 CHIDRO C[C@H](CC[NH2+]C[C@H]1CCC(C)(C)O1)c1ccccc1 ZINC000160281194 330862387 /nfs/dbraw/zinc/86/23/87/330862387.db2.gz GZIXFULZOZIEHB-GDBMZVCRSA-N 1 0 261.409 3.727 20 70 CHIDRO Cc1ccccc1C1CC([NH2+]CC2(N(C)C)CCCC2)C1 ZINC000160708876 330873940 /nfs/dbraw/zinc/87/39/40/330873940.db2.gz QERBUDSMVCYPRX-UHFFFAOYSA-N 1 0 286.463 3.705 20 70 CHIDRO Cc1ccccc1C[C@@H](C)[NH2+][C@@H](C)c1cncc(F)c1 ZINC000160769279 330874496 /nfs/dbraw/zinc/87/44/96/330874496.db2.gz CAWHGVWSGFFFBN-KGLIPLIRSA-N 1 0 272.367 3.811 20 70 CHIDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccncc1 ZINC000160946544 330880774 /nfs/dbraw/zinc/88/07/74/330880774.db2.gz KSGSMZSSTOMERD-CYZMBNFOSA-N 1 0 272.314 3.853 20 70 CHIDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cc1F ZINC000217617923 333121990 /nfs/dbraw/zinc/12/19/90/333121990.db2.gz KUQTZFJOOMQICE-TYNCELHUSA-N 1 0 265.372 3.749 20 70 CHIDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccc(NC(N)=O)cc1 ZINC000217893735 333124881 /nfs/dbraw/zinc/12/48/81/333124881.db2.gz ISYZLODBVZMWHO-LMOYCYGVSA-N 1 0 289.423 3.653 20 70 CHIDRO CC[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc(OC)c1 ZINC000161439987 522609588 /nfs/dbraw/zinc/60/95/88/522609588.db2.gz MVOFWEHZKJYCGD-HKUYNNGSSA-N 1 0 299.414 3.512 20 70 CHIDRO CC[C@@H]([NH2+]C[C@H]1CCCO1)c1cccc(Cl)c1F ZINC000161485712 522864980 /nfs/dbraw/zinc/86/49/80/522864980.db2.gz JCEDKWIIYXBWES-ZWNOBZJWSA-N 1 0 271.763 3.699 20 70 CHIDRO CC[C@](C)(NCCC[NH+]1CCCCC1)c1nc(C)cs1 ZINC000161437514 523488701 /nfs/dbraw/zinc/48/87/01/523488701.db2.gz HVGMFQHQQUPXSM-INIZCTEOSA-N 1 0 295.496 3.542 20 70 CHIDRO c1nc2ccccn2c1C[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000160419436 526608992 /nfs/dbraw/zinc/60/89/92/526608992.db2.gz JQDBIBGQUHWBGZ-GOSISDBHSA-N 1 0 281.403 3.657 20 70 CHIDRO