smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COCC[N@H+](C)CCN[C@H](C)c1cc(Cl)c(OC)cc1OC ZINC000159405004 206244642 /nfs/dbraw/zinc/24/46/42/206244642.db2.gz XAHHVCFHGQUUAD-GFCCVEGCSA-N 1 1 330.856 2.586 20 70 EFIDMO COCC[N@@H+](C)CCN[C@H](C)c1cc(Cl)c(OC)cc1OC ZINC000159405004 206244646 /nfs/dbraw/zinc/24/46/46/206244646.db2.gz XAHHVCFHGQUUAD-GFCCVEGCSA-N 1 1 330.856 2.586 20 70 EFIDMO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)C(=O)NC(=O)NC(C)(C)C ZINC000159421924 206245264 /nfs/dbraw/zinc/24/52/64/206245264.db2.gz VJOPXQIDPVUCSK-UWVGGRQHSA-N 1 1 327.375 2.628 20 70 EFIDMO C[C@@H]([NH2+][C@@H](C)C(=O)NC(=O)NC(C)(C)C)c1cccc(F)c1F ZINC000159422078 206245664 /nfs/dbraw/zinc/24/56/64/206245664.db2.gz VJOPXQIDPVUCSK-ZJUUUORDSA-N 1 1 327.375 2.628 20 70 EFIDMO Cc1c(/C=C/C(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cnn1C ZINC000159443698 206247226 /nfs/dbraw/zinc/24/72/26/206247226.db2.gz WJHJIAGQWAMFTG-COAGQGPPSA-N 1 1 332.492 2.616 20 70 EFIDMO C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000159468939 206246757 /nfs/dbraw/zinc/24/67/57/206246757.db2.gz NXWQDVDMNCIIAN-BDAKNGLRSA-N 1 1 338.757 2.998 20 70 EFIDMO COC(=O)c1cc(CNC(C)(C)C[N@H+](C)Cc2ccccc2)c[nH]1 ZINC000159392165 206242581 /nfs/dbraw/zinc/24/25/81/206242581.db2.gz HZASLALNLRBQIA-UHFFFAOYSA-N 1 1 329.444 2.802 20 70 EFIDMO COC(=O)c1cc(CNC(C)(C)C[N@@H+](C)Cc2ccccc2)c[nH]1 ZINC000159392165 206242585 /nfs/dbraw/zinc/24/25/85/206242585.db2.gz HZASLALNLRBQIA-UHFFFAOYSA-N 1 1 329.444 2.802 20 70 EFIDMO CCCOc1ccc(CNC(=O)N2CCC[N@@H+](CC)CC2)cc1OC ZINC000159606262 206254344 /nfs/dbraw/zinc/25/43/44/206254344.db2.gz SEERHCUPOQPVOS-UHFFFAOYSA-N 1 1 349.475 2.721 20 70 EFIDMO Cc1ccc(C(=O)CC[N@H+]2CCC[C@H](CN3CCOCC3)C2)cc1 ZINC000159633851 206256470 /nfs/dbraw/zinc/25/64/70/206256470.db2.gz UHSMFLMOVIXAOQ-SFHVURJKSA-N 1 1 330.472 2.612 20 70 EFIDMO CC(=O)N(C)C1CC[NH+](Cc2ncc(-c3ccccc3F)o2)CC1 ZINC000159660964 206257900 /nfs/dbraw/zinc/25/79/00/206257900.db2.gz WGUJSVITESSPIK-UHFFFAOYSA-N 1 1 331.391 2.923 20 70 EFIDMO CCc1ccc([C@@H](C)CC(=O)N(C)CCC[NH+]2CCN(C)CC2)cc1 ZINC000159688358 206259182 /nfs/dbraw/zinc/25/91/82/206259182.db2.gz HWXXWVYHBWQMNL-SFHVURJKSA-N 1 1 345.531 2.839 20 70 EFIDMO CCOc1ccccc1NC(=O)CC[N@@H+](C)C1(C(=O)OC)CCCC1 ZINC000159498738 206248777 /nfs/dbraw/zinc/24/87/77/206248777.db2.gz IDSCKQQCMASUSE-UHFFFAOYSA-N 1 1 348.443 2.832 20 70 EFIDMO COc1ccc2cc(CN(C)C(=O)[C@H](C)[N@@H+](C)C[C@H](C)O)ccc2c1 ZINC000159566824 206252358 /nfs/dbraw/zinc/25/23/58/206252358.db2.gz KXDUOYMSUDCSJD-GJZGRUSLSA-N 1 1 344.455 2.508 20 70 EFIDMO CC(=O)NC[C@H]1CCC[N@H+](Cc2ncc(-c3ccccc3F)o2)C1 ZINC000159727161 206260883 /nfs/dbraw/zinc/26/08/83/206260883.db2.gz UUHSQFWOSQYMNP-CQSZACIVSA-N 1 1 331.391 2.829 20 70 EFIDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2ncc(-c3ccccc3F)o2)C1 ZINC000159727161 206260885 /nfs/dbraw/zinc/26/08/85/206260885.db2.gz UUHSQFWOSQYMNP-CQSZACIVSA-N 1 1 331.391 2.829 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc(F)c(F)cc1F ZINC000159752936 206262210 /nfs/dbraw/zinc/26/22/10/206262210.db2.gz QPNXKEPRXAERJI-UHFFFAOYSA-N 1 1 344.377 2.534 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2ccc(Br)cc2)CC1 ZINC000159830408 206265907 /nfs/dbraw/zinc/26/59/07/206265907.db2.gz HBZLKBQGPPSOGZ-UHFFFAOYSA-N 1 1 340.265 2.686 20 70 EFIDMO C[C@H](C(=O)NCc1cccs1)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159864176 206267232 /nfs/dbraw/zinc/26/72/32/206267232.db2.gz GBNODRSOERVQEP-CQSZACIVSA-N 1 1 331.485 2.951 20 70 EFIDMO COC[C@H]1CCCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000159920492 206269544 /nfs/dbraw/zinc/26/95/44/206269544.db2.gz VHNDULNFFBXBFM-WDSOQIARSA-N 1 1 345.487 2.575 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@H](OC)c2cccc(Cl)c2)CC1 ZINC000159926285 206269598 /nfs/dbraw/zinc/26/95/98/206269598.db2.gz IUEZQKCRDCSRLY-INIZCTEOSA-N 1 1 339.867 2.765 20 70 EFIDMO C[C@@H](Sc1ccncc1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159939201 206272181 /nfs/dbraw/zinc/27/21/81/206272181.db2.gz SMIXZKQDIIGHPE-NVXWUHKLSA-N 1 1 341.480 2.953 20 70 EFIDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1ccnc(-n2cccn2)c1 ZINC000159936152 206272474 /nfs/dbraw/zinc/27/24/74/206272474.db2.gz HOUUMELLSMYBQK-INIZCTEOSA-N 1 1 341.459 2.652 20 70 EFIDMO COCC1CCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159956532 206271637 /nfs/dbraw/zinc/27/16/37/206271637.db2.gz QPRAQFYOFRFMTK-LPHOPBHVSA-N 1 1 345.487 2.575 20 70 EFIDMO CC[C@@H](CNC(=O)N1CCC[N@@H+](CC)CC1)Oc1ccccc1F ZINC000159946984 206271841 /nfs/dbraw/zinc/27/18/41/206271841.db2.gz KAUKILIMGQHLPC-HNNXBMFYSA-N 1 1 337.439 2.720 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N(C)Cc1ccccn1 ZINC000159977836 206273675 /nfs/dbraw/zinc/27/36/75/206273675.db2.gz ZLGBNFUMFKDZGV-LPHOPBHVSA-N 1 1 338.455 2.744 20 70 EFIDMO FC(F)n1c(CSCC[NH+]2CCOCC2)nc2ccccc21 ZINC000160017798 206276019 /nfs/dbraw/zinc/27/60/19/206276019.db2.gz QGMBWYBABKHLFN-UHFFFAOYSA-N 1 1 327.400 2.997 20 70 EFIDMO CCOCCN(CC)C(=O)N[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000160077938 206279126 /nfs/dbraw/zinc/27/91/26/206279126.db2.gz HWLSHOZBJOKEQE-WMZOPIPTSA-N 1 1 333.476 2.717 20 70 EFIDMO CC[C@H](C)[N@@H+](C)CCNC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 ZINC000160129375 206280594 /nfs/dbraw/zinc/28/05/94/206280594.db2.gz HUKUFKRZXMUYTG-WMLDXEAASA-N 1 1 335.448 2.706 20 70 EFIDMO CCC[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000160159591 206282097 /nfs/dbraw/zinc/28/20/97/206282097.db2.gz PVPSSFPANPIQBU-OIISXLGYSA-N 1 1 349.544 2.874 20 70 EFIDMO CCC[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000160159591 206282101 /nfs/dbraw/zinc/28/21/01/206282101.db2.gz PVPSSFPANPIQBU-OIISXLGYSA-N 1 1 349.544 2.874 20 70 EFIDMO Cc1cc(C(=O)NCC[N@@H+]2CCc3sccc3C2)cc(Cl)n1 ZINC000160257059 206286296 /nfs/dbraw/zinc/28/62/96/206286296.db2.gz ZYVGBECNEHYZLG-UHFFFAOYSA-N 1 1 335.860 2.893 20 70 EFIDMO Cc1cc(C(=O)NCC[N@H+]2CCc3sccc3C2)cc(Cl)n1 ZINC000160257059 206286301 /nfs/dbraw/zinc/28/63/01/206286301.db2.gz ZYVGBECNEHYZLG-UHFFFAOYSA-N 1 1 335.860 2.893 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)Cc1cccc(Cl)c1 ZINC000160277229 206288848 /nfs/dbraw/zinc/28/88/48/206288848.db2.gz RJDAAJPQDZZBLN-UHFFFAOYSA-N 1 1 338.879 2.699 20 70 EFIDMO C[C@H](NC1CC[NH+](C2CCCC2)CC1)c1ccc(-n2cnnn2)cc1 ZINC000160502700 206300024 /nfs/dbraw/zinc/30/00/24/206300024.db2.gz MZBIRBIPVGEDPQ-HNNXBMFYSA-N 1 1 340.475 2.720 20 70 EFIDMO CC(=O)Nc1cc(C(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)ccc1F ZINC000160498181 206300349 /nfs/dbraw/zinc/30/03/49/206300349.db2.gz NLQLHQFMFCBGLU-OAHLLOKOSA-N 1 1 335.423 2.634 20 70 EFIDMO CC[N@H+](Cc1ccc(OCC(C)C)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000160550863 206303259 /nfs/dbraw/zinc/30/32/59/206303259.db2.gz AIDGCWOKCYVSDS-INIZCTEOSA-N 1 1 325.474 2.730 20 70 EFIDMO CC[N@@H+](Cc1ccc(OCC(C)C)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000160550863 206303262 /nfs/dbraw/zinc/30/32/62/206303262.db2.gz AIDGCWOKCYVSDS-INIZCTEOSA-N 1 1 325.474 2.730 20 70 EFIDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)Nc2ccn(CC(F)(F)F)n2)C1 ZINC000160759183 206312872 /nfs/dbraw/zinc/31/28/72/206312872.db2.gz BNZBQLSQEVIXBT-GFCCVEGCSA-N 1 1 347.385 2.545 20 70 EFIDMO C[C@H](CNC(=O)[C@H](C)[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1)c1ccccc1 ZINC000160970399 206320525 /nfs/dbraw/zinc/32/05/25/206320525.db2.gz QLVKWCCUYBPTIP-SHJAMOMRSA-N 1 1 344.499 2.922 20 70 EFIDMO CCOCCCNC(=O)[C@H](C)[NH2+][C@@H](CC)c1ccc(F)cc1F ZINC000161017275 206323765 /nfs/dbraw/zinc/32/37/65/206323765.db2.gz BZVLMPCEBSFBAK-LRDDRELGSA-N 1 1 328.403 2.937 20 70 EFIDMO CCOCCCNC(=O)[C@@H](C)[NH2+][C@@H](CC)c1ccc(F)cc1F ZINC000161017471 206323978 /nfs/dbraw/zinc/32/39/78/206323978.db2.gz BZVLMPCEBSFBAK-WBMJQRKESA-N 1 1 328.403 2.937 20 70 EFIDMO O=C(c1ccnc(Cl)c1F)N1CC[NH+](CCc2ccccc2)CC1 ZINC000161193384 206333795 /nfs/dbraw/zinc/33/37/95/206333795.db2.gz PIHQEPKGPIVVBW-UHFFFAOYSA-N 1 1 347.821 2.875 20 70 EFIDMO Cc1nnc(-c2ccc(C(=O)N[C@@H]3C[N@@H+](C(C)C)C[C@@H]3C)cc2)o1 ZINC000161287402 206339215 /nfs/dbraw/zinc/33/92/15/206339215.db2.gz IGUIVVVGCAVEPM-BLLLJJGKSA-N 1 1 328.416 2.504 20 70 EFIDMO CCC[N@H+](Cc1cnc2cnccn12)C[C@@H]1COc2ccccc2O1 ZINC000161416462 206346715 /nfs/dbraw/zinc/34/67/15/206346715.db2.gz ZIHCJOFRFYWIAT-MRXNPFEDSA-N 1 1 338.411 2.781 20 70 EFIDMO C[C@@H](NC(=O)N1CCC([N@@H+](C)CCO)CC1)c1cc2ccccc2o1 ZINC000161426973 206348016 /nfs/dbraw/zinc/34/80/16/206348016.db2.gz WHKVPDIMNONWAQ-CQSZACIVSA-N 1 1 345.443 2.592 20 70 EFIDMO C[C@H](CNC(=O)N[C@H]1CC[C@@H](C)c2ccccc21)C[NH+]1CCOCC1 ZINC000159825495 544799487 /nfs/dbraw/zinc/79/94/87/544799487.db2.gz XXKUBHXEPXLRAK-MDZRGWNJSA-N 1 1 345.487 2.893 20 70 EFIDMO Cc1cc(NC(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1OC(C)C ZINC000160046083 544801818 /nfs/dbraw/zinc/80/18/18/544801818.db2.gz MMICEJWGWJHTON-YOEHRIQHSA-N 1 1 335.448 2.623 20 70 EFIDMO Cc1cc(NC(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1OC(C)C ZINC000160046083 544801821 /nfs/dbraw/zinc/80/18/21/544801821.db2.gz MMICEJWGWJHTON-YOEHRIQHSA-N 1 1 335.448 2.623 20 70 EFIDMO C[C@H](NC(=O)Nc1ccc2nc(C3CC3)oc2c1)[C@H]1C[N@H+](C)CCO1 ZINC000160402482 544805744 /nfs/dbraw/zinc/80/57/44/544805744.db2.gz XKKHXWFIRJOWIJ-MEDUHNTESA-N 1 1 344.415 2.546 20 70 EFIDMO C[C@H](NC(=O)Nc1ccc2nc(C3CC3)oc2c1)[C@H]1C[N@@H+](C)CCO1 ZINC000160402482 544805747 /nfs/dbraw/zinc/80/57/47/544805747.db2.gz XKKHXWFIRJOWIJ-MEDUHNTESA-N 1 1 344.415 2.546 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1cc(-c2ccncc2)on1 ZINC000160483822 544806611 /nfs/dbraw/zinc/80/66/11/544806611.db2.gz YUXRAQVSVFJFSQ-OAHLLOKOSA-N 1 1 328.416 2.587 20 70 EFIDMO CCOCCC1(CNC(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)CCCC1 ZINC000161106333 544809843 /nfs/dbraw/zinc/80/98/43/544809843.db2.gz OFXYBXKIEHCIKH-KRWDZBQOSA-N 1 1 337.508 2.757 20 70 EFIDMO CCSc1cc(Cl)ccc1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000161282454 544811483 /nfs/dbraw/zinc/81/14/83/544811483.db2.gz KRNVVOUWDYFMAC-FZMZJTMJSA-N 1 1 342.892 2.901 20 70 EFIDMO CCSc1cc(Cl)ccc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000161282454 544811484 /nfs/dbraw/zinc/81/14/84/544811484.db2.gz KRNVVOUWDYFMAC-FZMZJTMJSA-N 1 1 342.892 2.901 20 70 EFIDMO c1ccc(-c2noc(CCCN3CCN(c4cc[nH+]cc4)CC3)n2)cc1 ZINC000161368436 544813570 /nfs/dbraw/zinc/81/35/70/544813570.db2.gz POTJVKAPBCMFJC-UHFFFAOYSA-N 1 1 349.438 2.886 20 70 EFIDMO CCC(CC)[C@@H](CNC(=O)Nc1ccc(C)nc1)[NH+]1CCOCC1 ZINC000161401116 544814070 /nfs/dbraw/zinc/81/40/70/544814070.db2.gz JGTCSBCCSXKLHG-QGZVFWFLSA-N 1 1 334.464 2.649 20 70 EFIDMO C[C@@H](c1ccccc1Cl)N1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1 ZINC000159370506 274278329 /nfs/dbraw/zinc/27/83/29/274278329.db2.gz BYRUMAYWSZSGNE-SUMWQHHRSA-N 1 1 335.879 2.815 20 70 EFIDMO C[C@@H](c1ccccc1Cl)[NH+]1CCC(N2CCC[C@@H]2C(N)=O)CC1 ZINC000159370506 274278330 /nfs/dbraw/zinc/27/83/30/274278330.db2.gz BYRUMAYWSZSGNE-SUMWQHHRSA-N 1 1 335.879 2.815 20 70 EFIDMO COC(=O)C1([N@H+](C)CCc2nc(-c3ccccc3)no2)CCCC1 ZINC000159490289 277309746 /nfs/dbraw/zinc/30/97/46/277309746.db2.gz YTZLDAVNWIRLSY-UHFFFAOYSA-N 1 1 329.400 2.697 20 70 EFIDMO COC(=O)C1([N@@H+](C)CCc2nc(-c3ccccc3)no2)CCCC1 ZINC000159490289 277309748 /nfs/dbraw/zinc/30/97/48/277309748.db2.gz YTZLDAVNWIRLSY-UHFFFAOYSA-N 1 1 329.400 2.697 20 70 EFIDMO CC(C)[C@H](CNC(=O)C1(Cc2ccccc2)CCC1)[NH+]1CCOCC1 ZINC000160791699 310702641 /nfs/dbraw/zinc/70/26/41/310702641.db2.gz NVSVBTPOUQVSSN-IBGZPJMESA-N 1 1 344.499 2.872 20 70 EFIDMO CC(C)OC(=O)c1ccn(Cc2cn3cc(Cl)ccc3[nH+]2)c(=O)c1 ZINC000161023614 310705103 /nfs/dbraw/zinc/70/51/03/310705103.db2.gz SLRHRYPXZHGZJS-UHFFFAOYSA-N 1 1 345.786 2.763 20 70 EFIDMO COc1ccc(OC)c(CN2CC[NH+](Cc3occc3C)CC2)c1 ZINC000161045604 310705259 /nfs/dbraw/zinc/70/52/59/310705259.db2.gz NPZWWGQUGGABRC-UHFFFAOYSA-N 1 1 330.428 2.923 20 70 EFIDMO COC(=O)CCN(Cc1ccncc1)c1cc(C)[nH+]c(C(C)C)n1 ZINC000161353524 310708478 /nfs/dbraw/zinc/70/84/78/310708478.db2.gz HHMLPQPCVRCIJL-UHFFFAOYSA-N 1 1 328.416 2.873 20 70 EFIDMO CCC[N@H+](Cc1c[nH]nc1-c1cccs1)[C@@H]1CCS(=O)(=O)C1 ZINC000161086390 473205772 /nfs/dbraw/zinc/20/57/72/473205772.db2.gz MXMYCKHLJLSZJA-CYBMUJFWSA-N 1 1 339.486 2.537 20 70 EFIDMO CCC[N@@H+](Cc1c[nH]nc1-c1cccs1)[C@@H]1CCS(=O)(=O)C1 ZINC000161086390 473205775 /nfs/dbraw/zinc/20/57/75/473205775.db2.gz MXMYCKHLJLSZJA-CYBMUJFWSA-N 1 1 339.486 2.537 20 70 EFIDMO CN(C)c1cc[nH+]c(N2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)n1 ZINC000161135523 473211384 /nfs/dbraw/zinc/21/13/84/473211384.db2.gz VNZXUWSUFGXLOW-HOTGVXAUSA-N 1 1 330.407 2.774 20 70 EFIDMO Cc1ccc(-n2ccnc2)c(C(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1 ZINC000161146814 473212312 /nfs/dbraw/zinc/21/23/12/473212312.db2.gz JKOJKQKSHCWGDP-DOTOQJQBSA-N 1 1 326.444 2.639 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@@H+]([C@@H](C)c2nc(C(C)(C)C)no2)C1 ZINC000161275281 473222913 /nfs/dbraw/zinc/22/29/13/473222913.db2.gz ZGNNHHJQLJOETE-QWHCGFSZSA-N 1 1 332.452 2.919 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@H+]([C@@H](C)c2nc(C(C)(C)C)no2)C1 ZINC000161275281 473222916 /nfs/dbraw/zinc/22/29/16/473222916.db2.gz ZGNNHHJQLJOETE-QWHCGFSZSA-N 1 1 332.452 2.919 20 70 EFIDMO Cc1nnc(-c2ccc(C(=O)N[C@H]3C[N@@H+](C(C)C)C[C@@H]3C)cc2)o1 ZINC000161287538 473223389 /nfs/dbraw/zinc/22/33/89/473223389.db2.gz IGUIVVVGCAVEPM-LRDDRELGSA-N 1 1 328.416 2.504 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(C)c(C)c2)C1 ZINC000161322344 473226897 /nfs/dbraw/zinc/22/68/97/473226897.db2.gz WCDCLRFYEHPLSK-MRXNPFEDSA-N 1 1 341.459 2.733 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(C)c(C)c2)C1 ZINC000161322344 473226901 /nfs/dbraw/zinc/22/69/01/473226901.db2.gz WCDCLRFYEHPLSK-MRXNPFEDSA-N 1 1 341.459 2.733 20 70 EFIDMO COc1ccc2nc(C)cc(C(=O)NC[C@H]3CC[N@H+](C4CC4)C3)c2c1 ZINC000161336311 473227369 /nfs/dbraw/zinc/22/73/69/473227369.db2.gz PXNXDCGFKGGOGI-CQSZACIVSA-N 1 1 339.439 2.766 20 70 EFIDMO CCOCCC1(CNC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000161343249 473227956 /nfs/dbraw/zinc/22/79/56/473227956.db2.gz UNMCGFMPMLCLEJ-SJLPKXTDSA-N 1 1 349.519 2.852 20 70 EFIDMO O=C1[C@H]([N@H+]2CC[C@H]3OCCC[C@@H]3C2)CCCN1c1ccccc1F ZINC000161447791 473235899 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20 70 EFIDMO CCc1nnc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)[nH]1 ZINC000159462398 473029498 /nfs/dbraw/zinc/02/94/98/473029498.db2.gz QYDJLZSVTXMAKL-PBWFPOADSA-N 1 1 349.479 2.729 20 70 EFIDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)N1CCC(c2cc[nH]n2)CC1 ZINC000159460288 473030052 /nfs/dbraw/zinc/03/00/52/473030052.db2.gz BLKMLZPOQOKEFF-KRWDZBQOSA-N 1 1 347.507 2.953 20 70 EFIDMO O=C(Cc1csc(-c2ccoc2)n1)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000159493242 473032470 /nfs/dbraw/zinc/03/24/70/473032470.db2.gz DTPQBWGLODFPAV-AWEZNQCLSA-N 1 1 331.441 2.546 20 70 EFIDMO Cc1cc(NC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)c[nH]c1=O ZINC000159642057 473047188 /nfs/dbraw/zinc/04/71/88/473047188.db2.gz FAXLQZBRBNMSHC-OAHLLOKOSA-N 1 1 343.402 2.673 20 70 EFIDMO CCOC(=O)CCc1ccc(NC(=O)N[C@H]2CCC[N@@H+](CC)C2)cc1 ZINC000159655129 473048862 /nfs/dbraw/zinc/04/88/62/473048862.db2.gz VZMDZQDELZTXDG-KRWDZBQOSA-N 1 1 347.459 2.788 20 70 EFIDMO CCOC(=O)CCc1ccc(NC(=O)N[C@@H]2CCC[N@@H+](CC)C2)cc1 ZINC000159655278 473049010 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C[N@@H+](CCC(=O)Nc1c(Cl)cccc1Cl)[C@@H](CN)C1CC1 ZINC000160105899 473088466 /nfs/dbraw/zinc/08/84/66/473088466.db2.gz ZANGVGFOEHHIDJ-ZDUSSCGKSA-N 1 1 330.259 2.991 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)N(CCCCO)C2CC2)C[N@H+]1Cc1ccccc1 ZINC000160119287 473090190 /nfs/dbraw/zinc/09/01/90/473090190.db2.gz VPWVCSQBJNVQJH-SJLPKXTDSA-N 1 1 345.487 2.596 20 70 EFIDMO CCC[C@H]([NH2+][C@@H](C)c1cnccn1)C(=O)N1CCc2sccc2C1 ZINC000160172485 473093527 /nfs/dbraw/zinc/09/35/27/473093527.db2.gz MNNPPLQWZBGHMF-ZFWWWQNUSA-N 1 1 344.484 2.942 20 70 EFIDMO CC(C)OC(=O)[C@H](C)[N@@H+](C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000160178955 473093749 /nfs/dbraw/zinc/09/37/49/473093749.db2.gz BYABAWDRFMVFJN-AWEZNQCLSA-N 1 1 326.481 2.543 20 70 EFIDMO COC[C@@H](NC(=O)NC(C)(C)C[N@@H+](C)Cc1ccccc1)C1CC1 ZINC000160202409 473096503 /nfs/dbraw/zinc/09/65/03/473096503.db2.gz NRKVVVYGMOOWNN-QGZVFWFLSA-N 1 1 333.476 2.621 20 70 EFIDMO CCC[C@@H]1CN(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)CCO1 ZINC000160269756 473103469 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CC(C)S(=O)(=O)CCC[N@@H+](C)CCCOc1ccc(F)cc1 ZINC000160834014 473180701 /nfs/dbraw/zinc/18/07/01/473180701.db2.gz SQWJHLGYJJQONB-UHFFFAOYSA-N 1 1 331.453 2.740 20 70 EFIDMO Cc1c(C(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)cnn1CC(C)C ZINC000160858058 473183070 /nfs/dbraw/zinc/18/30/70/473183070.db2.gz WDJSEWLKPGATQN-OWCLPIDISA-N 1 1 334.508 2.944 20 70 EFIDMO Cn1cc(C2CC[NH+](Cc3nnc(-c4ccccc4)n3C)CC2)cn1 ZINC000160899178 473188431 /nfs/dbraw/zinc/18/84/31/473188431.db2.gz WXWJTENVSKKJPQ-UHFFFAOYSA-N 1 1 336.443 2.595 20 70 EFIDMO COC(=O)c1csc(NC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1 ZINC000160918086 473190650 /nfs/dbraw/zinc/19/06/50/473190650.db2.gz SGWRVULRMJBEID-NWDGAFQWSA-N 1 1 339.461 2.777 20 70 EFIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CC[C@@H](Nc2ccccc2)C1 ZINC000160911933 473190852 /nfs/dbraw/zinc/19/08/52/473190852.db2.gz YCDBRLGTYRYUAY-QZTJIDSGSA-N 1 1 342.487 2.899 20 70 EFIDMO CCOCCNC(=O)N1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000160927742 473191793 /nfs/dbraw/zinc/19/17/93/473191793.db2.gz KTEUXVCAOCXYFV-INIZCTEOSA-N 1 1 325.497 2.709 20 70 EFIDMO CC(C)C1CCC(NC(=O)NC2CC[NH+](CCN(C)C)CC2)CC1 ZINC000160943088 473193650 /nfs/dbraw/zinc/19/36/50/473193650.db2.gz MKDZNPMUFGOCNZ-UHFFFAOYSA-N 1 1 338.540 2.526 20 70 EFIDMO C[N@H+](CC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)[C@H]1CCSC1 ZINC000160964840 473195161 /nfs/dbraw/zinc/19/51/61/473195161.db2.gz LBFICOKKXLZOKU-HNNXBMFYSA-N 1 1 349.500 2.591 20 70 EFIDMO C[N@@H+](CC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)[C@H]1CCSC1 ZINC000160964840 473195162 /nfs/dbraw/zinc/19/51/62/473195162.db2.gz LBFICOKKXLZOKU-HNNXBMFYSA-N 1 1 349.500 2.591 20 70 EFIDMO CCC[N@H+](Cc1cc2cc(F)ccc2o1)[C@@H]1CCS(=O)(=O)C1 ZINC000161076348 473204569 /nfs/dbraw/zinc/20/45/69/473204569.db2.gz WNEJZSCRRPXNNN-CQSZACIVSA-N 1 1 325.405 2.971 20 70 EFIDMO CCC[N@@H+](Cc1cc2cc(F)ccc2o1)[C@@H]1CCS(=O)(=O)C1 ZINC000161076348 473204574 /nfs/dbraw/zinc/20/45/74/473204574.db2.gz WNEJZSCRRPXNNN-CQSZACIVSA-N 1 1 325.405 2.971 20 70 EFIDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1cccc(O)c1 ZINC000217037202 520581732 /nfs/dbraw/zinc/58/17/32/520581732.db2.gz HKZPAPNKRIDDGW-QGZVFWFLSA-N 1 1 333.476 2.889 20 70 EFIDMO COc1ccc(O)c(C(=O)NCCC[N@@H+](C)Cc2ccccc2)c1 ZINC000218296364 524728252 /nfs/dbraw/zinc/72/82/52/524728252.db2.gz JJVKADZASZAPJN-UHFFFAOYSA-N 1 1 328.412 2.653 20 70 EFIDMO Cc1cccc(O[C@H](C)C(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)c1 ZINC000218517041 524778849 /nfs/dbraw/zinc/77/88/49/524778849.db2.gz USUBCMNJJFCBBX-YESZJQIVSA-N 1 1 348.487 2.766 20 70 EFIDMO O=C(CC[N@H+]1CCO[C@]2(CCc3ccccc32)C1)NC1CCCC1 ZINC000159610355 526492981 /nfs/dbraw/zinc/49/29/81/526492981.db2.gz ZRGFXPAVRJXSQI-HXUWFJFHSA-N 1 1 328.456 2.609 20 70 EFIDMO CC(C)(C)c1nsc(NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)n1 ZINC000160151676 526906983 /nfs/dbraw/zinc/90/69/83/526906983.db2.gz JKQNXKLXPBOQCC-GJZGRUSLSA-N 1 1 346.500 2.883 20 70 EFIDMO CCC[C@H](CCO)CNC(=O)NC[C@H]1CCCC[N@H+]1CC(C)C ZINC000160911193 528118576 /nfs/dbraw/zinc/11/85/76/528118576.db2.gz FWTGXTYIJDBDQN-IAGOWNOFSA-N 1 1 327.513 2.595 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](C)CC3CCC3)nc(N)c21 ZINC000161062855 528128926 /nfs/dbraw/zinc/12/89/26/528128926.db2.gz ZSCRJDXSRVJCBQ-UHFFFAOYSA-N 1 1 332.404 2.522 20 70 EFIDMO CCOCCC1(C(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)CCC1 ZINC000161468537 528601910 /nfs/dbraw/zinc/60/19/10/528601910.db2.gz AMSUSGUDWUFYOT-IYBDPMFKSA-N 1 1 340.508 2.587 20 70 EFIDMO CCOCCC1(C(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CCC1 ZINC000161468537 528601913 /nfs/dbraw/zinc/60/19/13/528601913.db2.gz AMSUSGUDWUFYOT-IYBDPMFKSA-N 1 1 340.508 2.587 20 70 EFIDMO CCC(CC)(CCO)CNC(=O)NC[C@H]1CCCC[N@H+]1CC(C)C ZINC000160934898 528641371 /nfs/dbraw/zinc/64/13/71/528641371.db2.gz QUISDPFJWWYAJH-QGZVFWFLSA-N 1 1 341.540 2.985 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCCSCc2ccc(C)cc2)CC1 ZINC000159548863 529024332 /nfs/dbraw/zinc/02/43/32/529024332.db2.gz NIHFQCMSRYOKIZ-UHFFFAOYSA-N 1 1 335.517 2.965 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)CC1 ZINC000159926766 529024549 /nfs/dbraw/zinc/02/45/49/529024549.db2.gz HFECCJVTAOREBP-CQSZACIVSA-N 1 1 339.867 2.845 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@H](C)Oc2cccc(Cl)c2)CC1 ZINC000159918459 529027462 /nfs/dbraw/zinc/02/74/62/529027462.db2.gz UCTQNODZYPZQRR-AWEZNQCLSA-N 1 1 339.867 2.845 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)CC1 ZINC000159871507 529031362 /nfs/dbraw/zinc/03/13/62/529031362.db2.gz ADHWKWJYCMLGCQ-KRWDZBQOSA-N 1 1 348.466 2.532 20 70 EFIDMO CCc1ccc([C@@H](C)CC(=O)NC[C@H](C)CN2CC[NH+](C)CC2)cc1 ZINC000160109360 529704192 /nfs/dbraw/zinc/70/41/92/529704192.db2.gz PVUZYEPAUROKCP-ROUUACIJSA-N 1 1 345.531 2.742 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC000160116981 529845880 /nfs/dbraw/zinc/84/58/80/529845880.db2.gz FYTWAOZAYXJUFK-MSOLQXFVSA-N 1 1 348.462 2.746 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)C1(c2ccccc2F)CC1 ZINC000159727226 529845978 /nfs/dbraw/zinc/84/59/78/529845978.db2.gz KYQWIKAFNWUDCY-UHFFFAOYSA-N 1 1 348.462 2.674 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccnc2ccccc21 ZINC000159583843 529846249 /nfs/dbraw/zinc/84/62/49/529846249.db2.gz QJSPCJOVNPLPNZ-UHFFFAOYSA-N 1 1 341.455 2.665 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(F)cc1Cl ZINC000160054575 529846502 /nfs/dbraw/zinc/84/65/02/529846502.db2.gz CBHGWVYHYXYHLJ-UHFFFAOYSA-N 1 1 342.842 2.910 20 70 EFIDMO C[N@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)[C@@H](CN)C1CC1 ZINC000160067650 529871033 /nfs/dbraw/zinc/87/10/33/529871033.db2.gz GMEAYMKXMFOBLZ-AWEZNQCLSA-N 1 1 330.259 2.991 20 70 EFIDMO C[N@@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)[C@@H](CN)C1CC1 ZINC000160067650 529871035 /nfs/dbraw/zinc/87/10/35/529871035.db2.gz GMEAYMKXMFOBLZ-AWEZNQCLSA-N 1 1 330.259 2.991 20 70 EFIDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000160814406 284195037 /nfs/dbraw/zinc/19/50/37/284195037.db2.gz KSGXSHUYDDNAKK-GOEBONIOSA-N 1 1 331.464 2.663 20 70 EFIDMO COC(=O)C1([NH2+]CC2CCN(C(=O)C(C)(C)C)CC2)CCCCC1 ZINC000159740630 533252423 /nfs/dbraw/zinc/25/24/23/533252423.db2.gz HWMYUTDIWLBALN-UHFFFAOYSA-N 1 1 338.492 2.737 20 70 EFIDMO COCCOc1ccc(NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC000159754880 533255869 /nfs/dbraw/zinc/25/58/69/533255869.db2.gz RYGJYOBYTXHLRA-YJBOKZPZSA-N 1 1 347.459 2.660 20 70 EFIDMO CN(C(=O)CSc1nccc2ccccc21)[C@@H]1CCC[N@@H+](C)C1 ZINC000159912700 225302289 /nfs/dbraw/zinc/30/22/89/225302289.db2.gz HITORAJHXSFDHF-OAHLLOKOSA-N 1 1 329.469 2.880 20 70 EFIDMO C[C@H](Sc1ccncc1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159939049 225307286 /nfs/dbraw/zinc/30/72/86/225307286.db2.gz SMIXZKQDIIGHPE-DOTOQJQBSA-N 1 1 341.480 2.953 20 70 EFIDMO C[C@H](O)C[C@H](CNC(=O)[C@@H](c1ccccc1)[NH+](C)C)c1ccccc1 ZINC000160071721 225332256 /nfs/dbraw/zinc/33/22/56/225332256.db2.gz YQICRYUEDRALTE-PWIZWCRZSA-N 1 1 340.467 2.960 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc2nnc(C3CC3)n2n1 ZINC000160237953 225367346 /nfs/dbraw/zinc/36/73/46/225367346.db2.gz PRSAWDUSAQUAME-PBHICJAKSA-N 1 1 348.454 2.934 20 70 EFIDMO C[C@H](C(=O)NCCc1csc(C(C)(C)C)n1)[NH+]1CCSCC1 ZINC000160642490 225443349 /nfs/dbraw/zinc/44/33/49/225443349.db2.gz IIDWEOBGWUVZOS-GFCCVEGCSA-N 1 1 341.546 2.537 20 70 EFIDMO Cc1cc(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)ccc1OC(C)C ZINC000160046365 544801184 /nfs/dbraw/zinc/80/11/84/544801184.db2.gz MMICEJWGWJHTON-WMLDXEAASA-N 1 1 335.448 2.623 20 70 EFIDMO Cc1cc(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1OC(C)C ZINC000160046365 544801186 /nfs/dbraw/zinc/80/11/86/544801186.db2.gz MMICEJWGWJHTON-WMLDXEAASA-N 1 1 335.448 2.623 20 70 EFIDMO C[C@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)[C@@H]1C[N@H+](C)CCO1 ZINC000160178533 544802617 /nfs/dbraw/zinc/80/26/17/544802617.db2.gz CBSLLMLJKBCENZ-FZMZJTMJSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)[C@@H]1C[N@@H+](C)CCO1 ZINC000160178533 544802622 /nfs/dbraw/zinc/80/26/22/544802622.db2.gz CBSLLMLJKBCENZ-FZMZJTMJSA-N 1 1 345.365 2.632 20 70 EFIDMO Cc1cc(NC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)ccc1C(F)(F)F ZINC000160175224 544802694 /nfs/dbraw/zinc/80/26/94/544802694.db2.gz CRFBVVASQGSRDA-BXUZGUMPSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1cc(NC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1C(F)(F)F ZINC000160175224 544802697 /nfs/dbraw/zinc/80/26/97/544802697.db2.gz CRFBVVASQGSRDA-BXUZGUMPSA-N 1 1 345.365 2.854 20 70 EFIDMO C[C@H](NC(=O)Nc1cc(-c2ccccc2)ns1)[C@H]1C[N@H+](C)CCO1 ZINC000160152568 544802973 /nfs/dbraw/zinc/80/29/73/544802973.db2.gz RLYGXKZUEKFFQT-SWLSCSKDSA-N 1 1 346.456 2.651 20 70 EFIDMO C[C@H](NC(=O)Nc1cc(-c2ccccc2)ns1)[C@H]1C[N@@H+](C)CCO1 ZINC000160152568 544802979 /nfs/dbraw/zinc/80/29/79/544802979.db2.gz RLYGXKZUEKFFQT-SWLSCSKDSA-N 1 1 346.456 2.651 20 70 EFIDMO CSc1ccc(NC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc1Cl ZINC000160347842 544805361 /nfs/dbraw/zinc/80/53/61/544805361.db2.gz QTGRVQUEKKEQTN-MFKMUULPSA-N 1 1 343.880 2.903 20 70 EFIDMO CSc1ccc(NC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1Cl ZINC000160347842 544805366 /nfs/dbraw/zinc/80/53/66/544805366.db2.gz QTGRVQUEKKEQTN-MFKMUULPSA-N 1 1 343.880 2.903 20 70 EFIDMO C[NH+]1CCN(CC(=O)N2CCCC[C@H]2CCCc2ccccc2)CC1 ZINC000161396010 544813091 /nfs/dbraw/zinc/81/30/91/544813091.db2.gz ZYZJYQCHDGTGCO-FQEVSTJZSA-N 1 1 343.515 2.638 20 70 EFIDMO C[NH+]1CCN(CC(=O)N2CCCC[C@@H]2CCCc2ccccc2)CC1 ZINC000161395870 544813124 /nfs/dbraw/zinc/81/31/24/544813124.db2.gz ZYZJYQCHDGTGCO-HXUWFJFHSA-N 1 1 343.515 2.638 20 70 EFIDMO COc1ccccc1[C@H]([NH3+])C(=O)N1CC[C@@H](c2ccccc2OC)C1 ZINC000160377840 273022064 /nfs/dbraw/zinc/02/20/64/273022064.db2.gz YYSSKORNOVOJFN-KUHUBIRLSA-N 1 1 340.423 2.720 20 70 EFIDMO COc1ccccc1[C@@H]([NH3+])C(=O)N1CC[C@@H](c2ccccc2OC)C1 ZINC000160377658 273022104 /nfs/dbraw/zinc/02/21/04/273022104.db2.gz YYSSKORNOVOJFN-AUUYWEPGSA-N 1 1 340.423 2.720 20 70 EFIDMO CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@H](C)C(=O)N(C)C(C)C ZINC000160034792 276341911 /nfs/dbraw/zinc/34/19/11/276341911.db2.gz DFHAAUONQAVMGJ-QGZVFWFLSA-N 1 1 346.519 2.875 20 70 EFIDMO C[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000161068952 290011747 /nfs/dbraw/zinc/01/17/47/290011747.db2.gz UKTRLOGLFKNIQS-XKQJLSEDSA-N 1 1 339.505 2.582 20 70 EFIDMO C[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000161069190 290049471 /nfs/dbraw/zinc/04/94/71/290049471.db2.gz UKTRLOGLFKNIQS-JQFCIGGWSA-N 1 1 339.505 2.582 20 70 EFIDMO Clc1cc(CSCC[NH+]2CCOCC2)cc2c1OCCO2 ZINC000160049575 310694183 /nfs/dbraw/zinc/69/41/83/310694183.db2.gz NIMNIPDBSAYSDT-UHFFFAOYSA-N 1 1 329.849 2.677 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc2c(c1)CCC2 ZINC000160287997 310696827 /nfs/dbraw/zinc/69/68/27/310696827.db2.gz FOOVNIQFVIOEJE-UHFFFAOYSA-N 1 1 330.472 2.606 20 70 EFIDMO CC[NH2+]CC1CCN(C(=O)[C@@H]2CCCCN2Cc2ccccc2)CC1 ZINC000161110288 473207123 /nfs/dbraw/zinc/20/71/23/473207123.db2.gz NDHKCDRASFCGSH-FQEVSTJZSA-N 1 1 343.515 2.889 20 70 EFIDMO CCCOc1cccc(C[N@H+](CCC)[C@@H]2CCS(=O)(=O)C2)c1 ZINC000161104410 473207266 /nfs/dbraw/zinc/20/72/66/473207266.db2.gz KWEAUCGYBRWJGA-MRXNPFEDSA-N 1 1 325.474 2.875 20 70 EFIDMO CCCOc1cccc(C[N@@H+](CCC)[C@@H]2CCS(=O)(=O)C2)c1 ZINC000161104410 473207271 /nfs/dbraw/zinc/20/72/71/473207271.db2.gz KWEAUCGYBRWJGA-MRXNPFEDSA-N 1 1 325.474 2.875 20 70 EFIDMO COCCC1(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000161121156 473209641 /nfs/dbraw/zinc/20/96/41/473209641.db2.gz OCVWZDVYYDWDGF-OAHLLOKOSA-N 1 1 336.501 2.893 20 70 EFIDMO Cc1ccccc1C[C@H](C)NC(=O)C[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000161132318 473210186 /nfs/dbraw/zinc/21/01/86/473210186.db2.gz WYJIPPNXNDZOKV-FBBABVLZSA-N 1 1 344.499 2.669 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)NCc1ccccc1OC ZINC000161129456 473210293 /nfs/dbraw/zinc/21/02/93/473210293.db2.gz ONDODODFXVFTEN-OAHLLOKOSA-N 1 1 327.428 2.617 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)NCc1ccccc1OC ZINC000161129456 473210297 /nfs/dbraw/zinc/21/02/97/473210297.db2.gz ONDODODFXVFTEN-OAHLLOKOSA-N 1 1 327.428 2.617 20 70 EFIDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N(C)C[C@@H]2CCC[C@@H]2O)C1 ZINC000161129491 473210556 /nfs/dbraw/zinc/21/05/56/473210556.db2.gz AMKQDJYPGCQAJU-IKGGRYGDSA-N 1 1 339.524 2.689 20 70 EFIDMO CCN(C(=O)NCC1(OC)CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000161167297 473213752 /nfs/dbraw/zinc/21/37/52/473213752.db2.gz SWYMUZVTKMVGBC-SFHVURJKSA-N 1 1 345.487 2.862 20 70 EFIDMO COCCOc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)cc1OC ZINC000161195606 473216446 /nfs/dbraw/zinc/21/64/46/473216446.db2.gz KCEYQWDOPKKCCD-VYDXJSESSA-N 1 1 336.476 2.854 20 70 EFIDMO COCCOc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1OC ZINC000161195606 473216451 /nfs/dbraw/zinc/21/64/51/473216451.db2.gz KCEYQWDOPKKCCD-VYDXJSESSA-N 1 1 336.476 2.854 20 70 EFIDMO C[C@@H](C(=O)NC[C@@H]1CC[N@@H+](C)C1)c1ccc(Br)cc1 ZINC000161259114 473220836 /nfs/dbraw/zinc/22/08/36/473220836.db2.gz BMJCPFXLCCHOQN-NEPJUHHUSA-N 1 1 325.250 2.621 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)NCC2CCCCC2)C1 ZINC000161328900 473226390 /nfs/dbraw/zinc/22/63/90/473226390.db2.gz 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C[N@H+](CC(=O)N(Cc1ccccc1)C(C)(C)C)C[C@H]1CCC[C@@H]1O ZINC000159521340 473035684 /nfs/dbraw/zinc/03/56/84/473035684.db2.gz NPJUWXFEIGJJMK-MSOLQXFVSA-N 1 1 332.488 2.907 20 70 EFIDMO CCN(CC)C(=O)C[N@@H+](C)CCc1cccc(OC(F)(F)F)c1 ZINC000159575910 473040205 /nfs/dbraw/zinc/04/02/05/473040205.db2.gz UBPNBUZYBODVCP-UHFFFAOYSA-N 1 1 332.366 2.928 20 70 EFIDMO CC(C)n1nccc1C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000159585528 473041294 /nfs/dbraw/zinc/04/12/94/473041294.db2.gz NHKBPJXSEZIRRX-UHFFFAOYSA-N 1 1 342.443 2.591 20 70 EFIDMO CCCN(Cc1ccc(C)cc1)C(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000159598440 473042793 /nfs/dbraw/zinc/04/27/93/473042793.db2.gz YFTDZLYHETWCSI-MOPGFXCFSA-N 1 1 332.488 2.826 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccc2c1ccn2C ZINC000159610209 473044522 /nfs/dbraw/zinc/04/45/22/473044522.db2.gz MEMCRPRPARWUMD-UHFFFAOYSA-N 1 1 343.471 2.609 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](C)c2cc(OC)c(OC)cc2C)CC1 ZINC000159633027 473046614 /nfs/dbraw/zinc/04/66/14/473046614.db2.gz 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C[C@@H]1C[C@@H](NC(=O)NCC2(O)CCCCC2)C[N@H+]1Cc1ccccc1 ZINC000159978409 473077579 /nfs/dbraw/zinc/07/75/79/473077579.db2.gz HQLMYTHEDJGGAU-SJLPKXTDSA-N 1 1 345.487 2.644 20 70 EFIDMO c1ccc(-n2nc(CSCC[NH+]3CCOCC3)c3c2CCC3)cc1 ZINC000159996766 473078971 /nfs/dbraw/zinc/07/89/71/473078971.db2.gz ZYESSGJLFDFQHQ-UHFFFAOYSA-N 1 1 343.496 2.926 20 70 EFIDMO CCn1nccc1C[NH2+]Cc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000160092236 473087426 /nfs/dbraw/zinc/08/74/26/473087426.db2.gz LASVLKIFONDSNM-CALCHBBNSA-N 1 1 342.487 2.802 20 70 EFIDMO CCCCn1ncc(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1C ZINC000160195545 473095807 /nfs/dbraw/zinc/09/58/07/473095807.db2.gz UURBXKGIGBOSEH-DOTOQJQBSA-N 1 1 333.480 2.940 20 70 EFIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)NCc1ncccc1F ZINC000160210194 473096672 /nfs/dbraw/zinc/09/66/72/473096672.db2.gz KZRKDYJBPOQKFB-UHFFFAOYSA-N 1 1 344.434 2.931 20 70 EFIDMO Cc1noc(C)c1[C@H](C)CNC(=O)NC[C@H]1CC[N@H+](CC(C)C)C1 ZINC000160248278 473101212 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CN(C)c1ccc(C(=O)NCC[N@H+]2CCc3sccc3C2)c(F)c1 ZINC000160634291 473154938 /nfs/dbraw/zinc/15/49/38/473154938.db2.gz ABURQNWNYIZPOL-UHFFFAOYSA-N 1 1 347.459 2.741 20 70 EFIDMO COc1cc2[nH+]c(N[C@@H]3CCOC(C)(C)C3)nc(N)c2cc1OC ZINC000160672816 473159409 /nfs/dbraw/zinc/15/94/09/473159409.db2.gz GMRWIKXNMZZXFK-SNVBAGLBSA-N 1 1 332.404 2.599 20 70 EFIDMO COc1cc2[nH+]c(N[C@H]3CCOC(C)(C)C3)nc(N)c2cc1OC ZINC000160672954 473159538 /nfs/dbraw/zinc/15/95/38/473159538.db2.gz GMRWIKXNMZZXFK-JTQLQIEISA-N 1 1 332.404 2.599 20 70 EFIDMO Cc1cc(NC(=O)[C@@H](c2ccccc2)[NH+]2CCC(O)CC2)ccc1O ZINC000160676472 473160325 /nfs/dbraw/zinc/16/03/25/473160325.db2.gz AFTWBAGXYJWIGR-LJQANCHMSA-N 1 1 340.423 2.837 20 70 EFIDMO COc1cc(OC)cc(N2CC[C@H]([NH2+][C@@H](C)c3ccoc3)C2=O)c1 ZINC000160678308 473160580 /nfs/dbraw/zinc/16/05/80/473160580.db2.gz PJHOMZMIWAZLOX-SJCJKPOMSA-N 1 1 330.384 2.753 20 70 EFIDMO CCO[C@H]1C[C@H](N(C)C(=O)NC[C@@H](c2ccco2)[NH+](C)C)C12CCC2 ZINC000160693842 473162024 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CCOC(=O)c1c(C)oc2nc(C[N@H+]3CCC[C@H](CC)C3)nc(N)c21 ZINC000160448596 528128487 /nfs/dbraw/zinc/12/84/87/528128487.db2.gz ZXLOKLHQFMWTKM-LBPRGKRZSA-N 1 1 346.431 2.912 20 70 EFIDMO CCOCCN1CC[NH+](CCc2cccc(OC(F)(F)F)c2)CC1 ZINC000159919194 528750692 /nfs/dbraw/zinc/75/06/92/528750692.db2.gz UPSGGJMGJHKBMY-UHFFFAOYSA-N 1 1 346.393 2.782 20 70 EFIDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H](O)c1ccccc1 ZINC000159786155 528836226 /nfs/dbraw/zinc/83/62/26/528836226.db2.gz QFKOFIVZOOQNTA-IBGZPJMESA-N 1 1 326.440 2.877 20 70 EFIDMO CCC[C@@H](CCO)CNC(=O)NC[C@H]1CCCC[N@H+]1CC(C)C ZINC000160911063 528931696 /nfs/dbraw/zinc/93/16/96/528931696.db2.gz FWTGXTYIJDBDQN-DLBZAZTESA-N 1 1 327.513 2.595 20 70 EFIDMO CCN(C(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O)[C@@H](C)c1ccc(F)cc1 ZINC000159737141 528949036 /nfs/dbraw/zinc/94/90/36/528949036.db2.gz BJMHLRSALRGHCF-ZVZYQTTQSA-N 1 1 336.451 2.828 20 70 EFIDMO CCN(C(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O)[C@H](C)c1ccc(F)cc1 ZINC000159737278 528950206 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CC[N@H+]1CCCN(C(=O)N[C@@H](COCC(C)C)c2ccco2)CC1 ZINC000159791874 529029121 /nfs/dbraw/zinc/02/91/21/529029121.db2.gz VFEBUHVWALIHOO-INIZCTEOSA-N 1 1 337.464 2.731 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](c2ccccc2)c2ccccn2)CC1 ZINC000159539803 529031472 /nfs/dbraw/zinc/03/14/72/529031472.db2.gz RVLCKQPMUFGBFK-LJQANCHMSA-N 1 1 338.455 2.908 20 70 EFIDMO CCN1CC[NH+](CCCNC(=O)CCCc2sccc2C)CC1 ZINC000161498479 529144427 /nfs/dbraw/zinc/14/44/27/529144427.db2.gz GJDCKZYOVIPBLZ-UHFFFAOYSA-N 1 1 337.533 2.523 20 70 EFIDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 ZINC000160129285 529342041 /nfs/dbraw/zinc/34/20/41/529342041.db2.gz HUKUFKRZXMUYTG-RHSMWYFYSA-N 1 1 335.448 2.706 20 70 EFIDMO CC[C@@H](CNC(=O)N1CCC[N@@H+](CC)CC1)Oc1ccccc1C ZINC000159952047 529478959 /nfs/dbraw/zinc/47/89/59/529478959.db2.gz YCHARVGEXDMZBZ-KRWDZBQOSA-N 1 1 333.476 2.890 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc2c(cccc2F)[nH]1 ZINC000160282674 529846375 /nfs/dbraw/zinc/84/63/75/529846375.db2.gz OJRZJVYGJMLTRA-UHFFFAOYSA-N 1 1 347.434 2.737 20 70 EFIDMO CN(Cc1ccccc1)CC(C)(C)C[NH+]1CCC(CC(N)=O)CC1 ZINC000159800680 529999487 /nfs/dbraw/zinc/99/94/87/529999487.db2.gz CXOKMZYZGROAAS-UHFFFAOYSA-N 1 1 331.504 2.732 20 70 EFIDMO C[N@H+](Cc1ccccc1)CC(C)(C)CN1CCC(CC(N)=O)CC1 ZINC000159800680 529999490 /nfs/dbraw/zinc/99/94/90/529999490.db2.gz CXOKMZYZGROAAS-UHFFFAOYSA-N 1 1 331.504 2.732 20 70 EFIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)CN1CCC(CC(N)=O)CC1 ZINC000159800680 529999491 /nfs/dbraw/zinc/99/94/91/529999491.db2.gz CXOKMZYZGROAAS-UHFFFAOYSA-N 1 1 331.504 2.732 20 70 EFIDMO CC[N@@H+]1CCCN(C(=O)NC[C@H](c2ccco2)N2CCCCC2)CC1 ZINC000159523661 285210608 /nfs/dbraw/zinc/21/06/08/285210608.db2.gz IWPMPJOGUXTMOC-QGZVFWFLSA-N 1 1 348.491 2.544 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@H](c2ccco2)N2CCCCC2)CC1 ZINC000159523661 285210613 /nfs/dbraw/zinc/21/06/13/285210613.db2.gz IWPMPJOGUXTMOC-QGZVFWFLSA-N 1 1 348.491 2.544 20 70 EFIDMO COCc1nc(C)cc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000160214668 533280201 /nfs/dbraw/zinc/28/02/01/533280201.db2.gz UWRVKYPZYAZABT-WMLDXEAASA-N 1 1 326.444 2.864 20 70 EFIDMO COCc1nc(C)cc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000160214794 533280594 /nfs/dbraw/zinc/28/05/94/533280594.db2.gz UWRVKYPZYAZABT-YOEHRIQHSA-N 1 1 326.444 2.864 20 70 EFIDMO C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000159474613 533648981 /nfs/dbraw/zinc/64/89/81/533648981.db2.gz YEHFCSDHZWGOME-BDAKNGLRSA-N 1 1 338.757 2.998 20 70 EFIDMO CCOc1cccc(C[NH+]2CCC(CC(N)=O)CC2)c1OC(F)F ZINC000159740144 225269191 /nfs/dbraw/zinc/26/91/91/225269191.db2.gz MKWLOYTWWSVUHU-UHFFFAOYSA-N 1 1 342.386 2.774 20 70 EFIDMO C[C@H]1C[C@@H](NC(=O)N(C)Cc2cscn2)C[N@H+]1Cc1ccccc1 ZINC000159896732 225298767 /nfs/dbraw/zinc/29/87/67/225298767.db2.gz OJERRNCVMQAKPR-GOEBONIOSA-N 1 1 344.484 2.948 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N(C)[C@@H]1CCSC1 ZINC000160024354 225321410 /nfs/dbraw/zinc/32/14/10/225321410.db2.gz LBFIFVKEULMJJG-OIISXLGYSA-N 1 1 333.501 2.654 20 70 EFIDMO COC[C@@H](C)n1c(C)cc(C(=O)C[N@H+](C)C[C@@H]2CCC[C@@H]2O)c1C ZINC000159659847 225257041 /nfs/dbraw/zinc/25/70/41/225257041.db2.gz ZCTRWKFRLISHLJ-HFTRVMKXSA-N 1 1 336.476 2.588 20 70 EFIDMO COC[C@@H](C)n1c(C)cc(C(=O)C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c1C ZINC000159659847 225257045 /nfs/dbraw/zinc/25/70/45/225257045.db2.gz ZCTRWKFRLISHLJ-HFTRVMKXSA-N 1 1 336.476 2.588 20 70 EFIDMO C[C@H]1C[C@@H](NC(=O)N(C)Cc2nccs2)C[N@H+]1Cc1ccccc1 ZINC000160336112 225390098 /nfs/dbraw/zinc/39/00/98/225390098.db2.gz JJNJKROWVKXEFP-GOEBONIOSA-N 1 1 344.484 2.948 20 70 EFIDMO C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccncc2)C[N@H+]1Cc1ccccc1 ZINC000160348214 225394338 /nfs/dbraw/zinc/39/43/38/225394338.db2.gz GWYVIBSRGLDIOO-QFBILLFUSA-N 1 1 338.455 2.886 20 70 EFIDMO CCn1nccc1C[NH2+]Cc1cccc(C(=O)NCc2ccco2)c1 ZINC000160042798 225324673 /nfs/dbraw/zinc/32/46/73/225324673.db2.gz YZWARHOIGCVYOJ-UHFFFAOYSA-N 1 1 338.411 2.716 20 70 EFIDMO Cc1nccn1-c1cncc(N[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000160222931 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EFIDMO CCn1cnnc1[C@H]1CCC[N@H+](CC(=O)Nc2c(C)cccc2C)C1 ZINC000161323300 473226183 /nfs/dbraw/zinc/22/61/83/473226183.db2.gz QHXJQZHNYWZOFR-INIZCTEOSA-N 1 1 341.459 2.733 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@@H+](CC(=O)Nc2c(C)cccc2C)C1 ZINC000161323300 473226186 /nfs/dbraw/zinc/22/61/86/473226186.db2.gz QHXJQZHNYWZOFR-INIZCTEOSA-N 1 1 341.459 2.733 20 70 EFIDMO CCOCCC1(CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000161343502 473228027 /nfs/dbraw/zinc/22/80/27/473228027.db2.gz UNMCGFMPMLCLEJ-FUHWJXTLSA-N 1 1 349.519 2.852 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@@H+](CC(=O)N(C(C)C)C2CCCC2)C1 ZINC000161345203 473228541 /nfs/dbraw/zinc/22/85/41/473228541.db2.gz VVFUTEKAORYMGL-MRXNPFEDSA-N 1 1 347.507 2.657 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@@H+](CC(=O)N(C(C)C)C2CCCC2)C1 ZINC000161345320 473228573 /nfs/dbraw/zinc/22/85/73/473228573.db2.gz VVFUTEKAORYMGL-INIZCTEOSA-N 1 1 347.507 2.657 20 70 EFIDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cnc(-c2ccccc2)nc1C ZINC000161391100 473232238 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COc1cc(F)c(C(=O)NCCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000161499293 473239832 /nfs/dbraw/zinc/23/98/32/473239832.db2.gz ZKIHJKWOMJJNAS-CYBMUJFWSA-N 1 1 338.423 2.837 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+]3CC[C@@H](CC)C3)nc(N)c21 ZINC000161509604 473240769 /nfs/dbraw/zinc/24/07/69/473240769.db2.gz CLHJBYJKKGRWKT-LLVKDONJSA-N 1 1 332.404 2.522 20 70 EFIDMO CCNc1ncc(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000159372468 473022909 /nfs/dbraw/zinc/02/29/09/473022909.db2.gz FTDFQDJFGOCFJJ-ZFWWWQNUSA-N 1 1 344.484 2.825 20 70 EFIDMO O=C1NC2(CCCC2)C(=O)N1CC[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000159444539 473028057 /nfs/dbraw/zinc/02/80/57/473028057.db2.gz SENVOLRWZYWAAP-MRXNPFEDSA-N 1 1 345.418 2.827 20 70 EFIDMO CC(C)COC(=O)N1CCC[N@H+](Cc2cnc3ccccn23)CC1 ZINC000159465105 473029368 /nfs/dbraw/zinc/02/93/68/473029368.db2.gz NUGQXWHOICXUQA-UHFFFAOYSA-N 1 1 330.432 2.635 20 70 EFIDMO CC(C)COC(=O)N1CCC[N@@H+](Cc2cnc3ccccn23)CC1 ZINC000159465105 473029375 /nfs/dbraw/zinc/02/93/75/473029375.db2.gz NUGQXWHOICXUQA-UHFFFAOYSA-N 1 1 330.432 2.635 20 70 EFIDMO COc1ccccc1[C@H]1CCN(C(=O)NC[C@H]2CCC[N@@H+](C)C2)C1 ZINC000159454980 473029767 /nfs/dbraw/zinc/02/97/67/473029767.db2.gz BEHZOPHCTSQOKC-CVEARBPZSA-N 1 1 331.460 2.536 20 70 EFIDMO CS(=O)(=O)NCC[C@@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1F ZINC000159452559 473029978 /nfs/dbraw/zinc/02/99/78/473029978.db2.gz URYGVWPEDFEHSE-ZDUSSCGKSA-N 1 1 348.871 2.773 20 70 EFIDMO CS(=O)(=O)NCC[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1F ZINC000159452559 473029984 /nfs/dbraw/zinc/02/99/84/473029984.db2.gz URYGVWPEDFEHSE-ZDUSSCGKSA-N 1 1 348.871 2.773 20 70 EFIDMO O=C(Cc1csc(-c2ccoc2)n1)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000159493099 473032701 /nfs/dbraw/zinc/03/27/01/473032701.db2.gz DTPQBWGLODFPAV-CQSZACIVSA-N 1 1 331.441 2.546 20 70 EFIDMO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000159490565 473032831 /nfs/dbraw/zinc/03/28/31/473032831.db2.gz DVZOCRYBMQEBNH-QWRGUYRKSA-N 1 1 347.365 2.742 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1cccc(-c2nc[nH]n2)c1 ZINC000159579390 473041985 /nfs/dbraw/zinc/04/19/85/473041985.db2.gz DHVHEKKVGJVFMO-KRWDZBQOSA-N 1 1 341.459 2.712 20 70 EFIDMO CC(C)C[N@@H+]1CCCC[C@H]1CNC(=O)c1cccc(-c2nnc[nH]2)c1 ZINC000159579390 473041993 /nfs/dbraw/zinc/04/19/93/473041993.db2.gz DHVHEKKVGJVFMO-KRWDZBQOSA-N 1 1 341.459 2.712 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1cccc(-c2nnc[nH]2)c1 ZINC000159579390 473041999 /nfs/dbraw/zinc/04/19/99/473041999.db2.gz DHVHEKKVGJVFMO-KRWDZBQOSA-N 1 1 341.459 2.712 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc2cc(F)ccc2[nH]1 ZINC000159660134 473049352 /nfs/dbraw/zinc/04/93/52/473049352.db2.gz HHMJHRRXHXUXNI-UHFFFAOYSA-N 1 1 347.434 2.737 20 70 EFIDMO COc1cc(NC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cc(OC)c1OC ZINC000159663922 473049695 /nfs/dbraw/zinc/04/96/95/473049695.db2.gz SSCBHXXNVQALLE-ZFWWWQNUSA-N 1 1 348.443 2.915 20 70 EFIDMO CCOc1ccc([C@@H](C)NC(=O)N2CCC[N@@H+](CC)CC2)cc1OC ZINC000159679785 473050849 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ZINC000160981030 473196464 /nfs/dbraw/zinc/19/64/64/473196464.db2.gz GPZPFTZDONCMCG-GOSISDBHSA-N 1 1 339.501 2.881 20 70 EFIDMO CC(C)S(=O)(=O)CCC[N@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000160981030 473196469 /nfs/dbraw/zinc/19/64/69/473196469.db2.gz GPZPFTZDONCMCG-GOSISDBHSA-N 1 1 339.501 2.881 20 70 EFIDMO CCOCCCNC(=O)[C@@H](C)[NH2+][C@H](CC)c1ccc(F)cc1F ZINC000161017607 473199249 /nfs/dbraw/zinc/19/92/49/473199249.db2.gz BZVLMPCEBSFBAK-MLGOLLRUSA-N 1 1 328.403 2.937 20 70 EFIDMO Cc1ccc(NCCCNC(=O)NCCc2ccc(Cl)nc2)[nH+]c1 ZINC000161033732 473200525 /nfs/dbraw/zinc/20/05/25/473200525.db2.gz GZCFWAVOISBREX-UHFFFAOYSA-N 1 1 347.850 2.782 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)NCc1cccc(OC)c1 ZINC000161057518 473202671 /nfs/dbraw/zinc/20/26/71/473202671.db2.gz MXNJPQGCRZJJMB-OAHLLOKOSA-N 1 1 327.428 2.617 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)NCc1cccc(OC)c1 ZINC000161057518 473202676 /nfs/dbraw/zinc/20/26/76/473202676.db2.gz MXNJPQGCRZJJMB-OAHLLOKOSA-N 1 1 327.428 2.617 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)NC(=O)Nc1ccccc1F ZINC000161068976 473203845 /nfs/dbraw/zinc/20/38/45/473203845.db2.gz GAFCQLBJKYHPDT-ZDUSSCGKSA-N 1 1 344.390 2.779 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)NC(=O)Nc1ccccc1F ZINC000161068976 473203848 /nfs/dbraw/zinc/20/38/48/473203848.db2.gz GAFCQLBJKYHPDT-ZDUSSCGKSA-N 1 1 344.390 2.779 20 70 EFIDMO C[C@@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000161069083 473203947 /nfs/dbraw/zinc/20/39/47/473203947.db2.gz UKTRLOGLFKNIQS-XYPHTWIQSA-N 1 1 339.505 2.582 20 70 EFIDMO COc1cc(Cl)c(C)cc1NC(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000159811372 533927156 /nfs/dbraw/zinc/92/71/56/533927156.db2.gz WCDBPOPLQHFTAH-DOMZBBRYSA-N 1 1 340.851 2.688 20 70 EFIDMO COc1ccccc1CC[N@@H+](C)[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000159860398 534034477 /nfs/dbraw/zinc/03/44/77/534034477.db2.gz RYDIGLSOCFBYEN-AWEZNQCLSA-N 1 1 344.377 2.723 20 70 EFIDMO C[C@@H](CNC(=O)c1cccc(NC(=O)N(C)C)c1)[N@H+]1CCC[C@H](C)C1 ZINC000159875758 534042880 /nfs/dbraw/zinc/04/28/80/534042880.db2.gz LIEQDPKXWSPKTF-GJZGRUSLSA-N 1 1 346.475 2.630 20 70 EFIDMO C[C@@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000216831851 524147025 /nfs/dbraw/zinc/14/70/25/524147025.db2.gz AELKSCLNGLNJRT-KFWWJZLASA-N 1 1 332.444 2.740 20 70 EFIDMO C[C@@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000216831851 524147034 /nfs/dbraw/zinc/14/70/34/524147034.db2.gz AELKSCLNGLNJRT-KFWWJZLASA-N 1 1 332.444 2.740 20 70 EFIDMO Cc1ccc(CNC(=O)CN2CC[N@@H+](C)C[C@@H]2c2ccccc2)cc1 ZINC000216734106 524505579 /nfs/dbraw/zinc/50/55/79/524505579.db2.gz FCZGKXDUFLPCDU-HXUWFJFHSA-N 1 1 337.467 2.600 20 70 EFIDMO Cc1ccc(CNC(=O)CN2CC[N@H+](C)C[C@@H]2c2ccccc2)cc1 ZINC000216734106 524505586 /nfs/dbraw/zinc/50/55/86/524505586.db2.gz FCZGKXDUFLPCDU-HXUWFJFHSA-N 1 1 337.467 2.600 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N(CCO)Cc1ccccc1 ZINC000160938392 527964212 /nfs/dbraw/zinc/96/42/12/527964212.db2.gz VRHMJNYBGCYVPC-LJQANCHMSA-N 1 1 347.503 2.701 20 70 EFIDMO CC(C)c1ccc(CC2CC[NH+](Cc3nc(N)nc(N)n3)CC2)cc1 ZINC000159948072 528083495 /nfs/dbraw/zinc/08/34/95/528083495.db2.gz FRXNALZMSMYDME-UHFFFAOYSA-N 1 1 340.475 2.614 20 70 EFIDMO CCCc1cc(NC[C@@H]2CCC[N@@H+](CC(C)C)C2)n2ncnc2n1 ZINC000161300077 528611222 /nfs/dbraw/zinc/61/12/22/528611222.db2.gz AWHQCLRZVSDIMP-HNNXBMFYSA-N 1 1 330.480 2.857 20 70 EFIDMO CCC(CC)(C[NH2+]Cc1nc(Cc2ccccc2)no1)C(=O)OC ZINC000159680810 528692922 /nfs/dbraw/zinc/69/29/22/528692922.db2.gz QVLJACNTYJWMLJ-UHFFFAOYSA-N 1 1 331.416 2.729 20 70 EFIDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@](C)(O)C1 ZINC000160205599 528836669 /nfs/dbraw/zinc/83/66/69/528836669.db2.gz CFYIXBCMQIXQOA-IBGZPJMESA-N 1 1 333.476 2.583 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCCc2c(C)[nH]c3ccccc32)CC1 ZINC000159804650 529025672 /nfs/dbraw/zinc/02/56/72/529025672.db2.gz TZOAYFAGDDBDIH-UHFFFAOYSA-N 1 1 328.460 2.756 20 70 EFIDMO CCOC[C@H]1CCN(C(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)C1 ZINC000160905080 529025925 /nfs/dbraw/zinc/02/59/25/529025925.db2.gz OEWPRJCSNOMAOQ-IRXDYDNUSA-N 1 1 325.497 2.565 20 70 EFIDMO CC(C)NC(=O)Nc1ccnn1[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000161036422 529139349 /nfs/dbraw/zinc/13/93/49/529139349.db2.gz JEYJKBZBHDVLPR-INIZCTEOSA-N 1 1 327.432 2.860 20 70 EFIDMO CCSCC[N@@H+](C)CCCOc1ccc(S(C)(=O)=O)cc1 ZINC000159659769 529178779 /nfs/dbraw/zinc/17/87/79/529178779.db2.gz OAPSSYBCQVFAJH-UHFFFAOYSA-N 1 1 331.503 2.544 20 70 EFIDMO CCc1cc2c(CSCC[NH+]3CCOCC3)cc(=O)oc2cc1O ZINC000159879990 529570671 /nfs/dbraw/zinc/57/06/71/529570671.db2.gz XRRLNJHTAVIKHE-UHFFFAOYSA-N 1 1 349.452 2.626 20 70 EFIDMO CC[C@H](C)C[N@@H+](CC)Cc1nnc2n1c1ccccc1c(=O)n2CC ZINC000160567248 529658045 /nfs/dbraw/zinc/65/80/45/529658045.db2.gz GFFAINSTEGTSSR-AWEZNQCLSA-N 1 1 341.459 2.932 20 70 EFIDMO CCc1ccc([C@@H](C)CC(=O)NC[C@@H](C)CN2CC[NH+](C)CC2)cc1 ZINC000160109085 529704067 /nfs/dbraw/zinc/70/40/67/529704067.db2.gz PVUZYEPAUROKCP-MSOLQXFVSA-N 1 1 345.531 2.742 20 70 EFIDMO CN(C)c1cccc(C[N@H+](C)CC(=O)NC(=O)Nc2ccccc2)c1 ZINC000159830912 529789262 /nfs/dbraw/zinc/78/92/62/529789262.db2.gz NEDGEKIJAHDPPV-UHFFFAOYSA-N 1 1 340.427 2.533 20 70 EFIDMO CN(C)c1cccc(C[N@@H+](C)CC(=O)NC(=O)Nc2ccccc2)c1 ZINC000159830912 529789265 /nfs/dbraw/zinc/78/92/65/529789265.db2.gz NEDGEKIJAHDPPV-UHFFFAOYSA-N 1 1 340.427 2.533 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc(Cl)ccc1F ZINC000160277813 529846145 /nfs/dbraw/zinc/84/61/45/529846145.db2.gz YGWPFRMPUVGONF-UHFFFAOYSA-N 1 1 342.842 2.910 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)[C@@H]1CSc2ccccc21 ZINC000160349432 529846167 /nfs/dbraw/zinc/84/61/67/529846167.db2.gz JPKVBYMQERPKHZ-MRXNPFEDSA-N 1 1 348.512 2.693 20 70 EFIDMO C[N@@H+](Cc1nc2sc3c(c2c(N)n1)CCCC3)C[C@H]1CCC[C@@H]1O ZINC000159734348 530023889 /nfs/dbraw/zinc/02/38/89/530023889.db2.gz ZOLARMLGNDWTQH-YPMHNXCESA-N 1 1 346.500 2.745 20 70 EFIDMO C[N@H+](Cc1nc2sc3c(c2c(N)n1)CCCC3)C[C@H]1CCC[C@@H]1O ZINC000159734348 530023891 /nfs/dbraw/zinc/02/38/91/530023891.db2.gz ZOLARMLGNDWTQH-YPMHNXCESA-N 1 1 346.500 2.745 20 70 EFIDMO O=C1NC2(CCCC2)C(=O)N1CC[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000159394740 296361942 /nfs/dbraw/zinc/36/19/42/296361942.db2.gz VRVBKIQBDWUWPK-MRXNPFEDSA-N 1 1 333.476 2.896 20 70 EFIDMO COC(=O)C1([N@@H+](C)CCC(=O)Nc2cc(F)cc(F)c2)CCCC1 ZINC000159496136 533227730 /nfs/dbraw/zinc/22/77/30/533227730.db2.gz CFCRHOWSVJOQQI-UHFFFAOYSA-N 1 1 340.370 2.711 20 70 EFIDMO COc1ccc2cc(CN(C)C(=O)[C@H](C)[N@@H+](C)C[C@@H](C)O)ccc2c1 ZINC000159566964 533326846 /nfs/dbraw/zinc/32/68/46/533326846.db2.gz KXDUOYMSUDCSJD-CABCVRRESA-N 1 1 344.455 2.508 20 70 EFIDMO C[C@@H](NC1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(-n2cnnn2)cc1 ZINC000159638343 533330668 /nfs/dbraw/zinc/33/06/68/533330668.db2.gz OTOSCJMYJXLGKW-CYBMUJFWSA-N 1 1 328.464 2.622 20 70 EFIDMO CS(=O)(=O)NCC[C@@H]1CCCC[N@H+]1C/C=C/c1ccc(F)cc1 ZINC000159432449 533401082 /nfs/dbraw/zinc/40/10/82/533401082.db2.gz DJCFGKVYMSCSHX-BDUNBXCCSA-N 1 1 340.464 2.633 20 70 EFIDMO C[C@@H]([NH2+][C@@H]1CCCN(c2ccn(C)n2)C1=O)c1cccc(F)c1F ZINC000159441705 533521808 /nfs/dbraw/zinc/52/18/08/533521808.db2.gz FCMNWRXJTOZMIH-BXUZGUMPSA-N 1 1 334.370 2.545 20 70 EFIDMO C[C@H]([NH2+][C@@H]1CCCN(c2cnn(C)c2)C1=O)c1cccc(F)c1F ZINC000159515121 225231527 /nfs/dbraw/zinc/23/15/27/225231527.db2.gz FGTIIUYWPKTESC-XHDPSFHLSA-N 1 1 334.370 2.545 20 70 EFIDMO C[C@H]([NH2+][C@@H]1CCCN(c2ccn(C)n2)C1=O)c1cccc(F)c1F ZINC000159441611 225219002 /nfs/dbraw/zinc/21/90/02/225219002.db2.gz FCMNWRXJTOZMIH-SMDDNHRTSA-N 1 1 334.370 2.545 20 70 EFIDMO C[C@H]([NH2+][C@H]1CCCN(c2ccn(C)n2)C1=O)c1cccc(F)c1F ZINC000159441801 225219120 /nfs/dbraw/zinc/21/91/20/225219120.db2.gz FCMNWRXJTOZMIH-FZMZJTMJSA-N 1 1 334.370 2.545 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCCCC(C)(C)CO ZINC000159743733 225269504 /nfs/dbraw/zinc/26/95/04/225269504.db2.gz MKJDWJCMQXQDKL-AEFFLSMTSA-N 1 1 347.503 2.605 20 70 EFIDMO CSc1ccsc1C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159868426 225294718 /nfs/dbraw/zinc/29/47/18/225294718.db2.gz OPSXRVTUSITXIK-UHFFFAOYSA-N 1 1 342.530 2.900 20 70 EFIDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2ccnc(-n3cccn3)c2)C1 ZINC000159939968 225306252 /nfs/dbraw/zinc/30/62/52/225306252.db2.gz RUJPSJZSGHIVBF-INIZCTEOSA-N 1 1 341.459 2.509 20 70 EFIDMO Cc1ccccc1[C@@H]1C[C@H]1C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000160260467 225372977 /nfs/dbraw/zinc/37/29/77/225372977.db2.gz YPAPASDUZUOGQU-RBUKOAKNSA-N 1 1 344.499 2.915 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1nc2ccccc2c(=O)[nH]1 ZINC000160228743 225365045 /nfs/dbraw/zinc/36/50/45/225365045.db2.gz RXVYTKMTGDZPBI-KDOFPFPSSA-N 1 1 334.423 2.856 20 70 EFIDMO C[C@@H](NC1CC[NH+](C2CCCC2)CC1)c1cccc(-n2cnnn2)c1 ZINC000160457520 544805245 /nfs/dbraw/zinc/80/52/45/544805245.db2.gz FCEYISRUFFWANN-OAHLLOKOSA-N 1 1 340.475 2.720 20 70 EFIDMO CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NC[C@H]2CC[N@@H+](C)C2)c1 ZINC000161305229 544812780 /nfs/dbraw/zinc/81/27/80/544812780.db2.gz FKUUCWFCBNYAGU-GFCCVEGCSA-N 1 1 337.851 2.616 20 70 EFIDMO Cc1nccc(NC(=O)N2CC[NH+](CCOC(C)C)CC2)c1Cl ZINC000159514097 544795933 /nfs/dbraw/zinc/79/59/33/544795933.db2.gz LMMRHSXLGJRINM-UHFFFAOYSA-N 1 1 340.855 2.618 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)CC1 ZINC000160975003 276162188 /nfs/dbraw/zinc/16/21/88/276162188.db2.gz QJXSVCUFNHBMOF-ROUUACIJSA-N 1 1 331.460 2.644 20 70 EFIDMO C[C@@H]1Cc2ccccc2N1C(=O)CN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000216732423 278040825 /nfs/dbraw/zinc/04/08/25/278040825.db2.gz GWKAEVGCHCVRJW-DYESRHJHSA-N 1 1 349.478 2.953 20 70 EFIDMO C[C@@H]1Cc2ccccc2N1C(=O)CN1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000216732423 278040826 /nfs/dbraw/zinc/04/08/26/278040826.db2.gz GWKAEVGCHCVRJW-DYESRHJHSA-N 1 1 349.478 2.953 20 70 EFIDMO CC[N@@H+]1CCCN(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)CC1 ZINC000159523522 279285289 /nfs/dbraw/zinc/28/52/89/279285289.db2.gz IWPMPJOGUXTMOC-KRWDZBQOSA-N 1 1 348.491 2.544 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)CC1 ZINC000159523522 279285291 /nfs/dbraw/zinc/28/52/91/279285291.db2.gz IWPMPJOGUXTMOC-KRWDZBQOSA-N 1 1 348.491 2.544 20 70 EFIDMO Cc1cc(N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)nc(C2CC2)n1 ZINC000160491547 301335839 /nfs/dbraw/zinc/33/58/39/301335839.db2.gz JPTNLSLSKTVMQI-HLLBOEOZSA-N 1 1 330.476 2.740 20 70 EFIDMO CC(C)c1nc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cs1 ZINC000160159157 310695473 /nfs/dbraw/zinc/69/54/73/310695473.db2.gz ZZBXPAGXKKQHIU-UHFFFAOYSA-N 1 1 339.505 2.697 20 70 EFIDMO CC[N@@H+](Cc1cnn(C)c1)Cc1ccc(OCc2nccn2C)cc1 ZINC000161125402 473208913 /nfs/dbraw/zinc/20/89/13/473208913.db2.gz KZSJPHXBOBRYRF-UHFFFAOYSA-N 1 1 339.443 2.755 20 70 EFIDMO COCCC1(CNC(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)CCCC1 ZINC000161125706 473209381 /nfs/dbraw/zinc/20/93/81/473209381.db2.gz AYGWBVSYZACHQG-INIZCTEOSA-N 1 1 337.508 2.899 20 70 EFIDMO Cc1nn(C)c(N2CCOCC2)c1C[N@H+](C)Cc1cccc(Cl)c1 ZINC000161136194 473211130 /nfs/dbraw/zinc/21/11/30/473211130.db2.gz DBXZTNMQRGDBFS-UHFFFAOYSA-N 1 1 348.878 2.851 20 70 EFIDMO Cc1nn(C)c(N2CCOCC2)c1C[N@@H+](C)Cc1cccc(Cl)c1 ZINC000161136194 473211134 /nfs/dbraw/zinc/21/11/34/473211134.db2.gz DBXZTNMQRGDBFS-UHFFFAOYSA-N 1 1 348.878 2.851 20 70 EFIDMO Cc1ccc(-n2ccnc2)c(C(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1 ZINC000161146900 473212064 /nfs/dbraw/zinc/21/20/64/473212064.db2.gz JKOJKQKSHCWGDP-RDJZCZTQSA-N 1 1 326.444 2.639 20 70 EFIDMO COCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cnccn2)cc1OC ZINC000161218733 473217702 /nfs/dbraw/zinc/21/77/02/473217702.db2.gz MGEWTQAAMADFJA-KBPBESRZSA-N 1 1 331.416 2.922 20 70 EFIDMO C[C@@]1(O)CCCN(C(=O)NC[C@H]2CCCC[N@H+]2Cc2ccccc2)C1 ZINC000161231155 473218839 /nfs/dbraw/zinc/21/88/39/473218839.db2.gz MPSDXRHEWYVOOH-UYAOXDASSA-N 1 1 345.487 2.598 20 70 EFIDMO C[N@H+]1CC[C@H](CNC(=O)CSc2cccc(Br)c2)C1 ZINC000161261642 473221900 /nfs/dbraw/zinc/22/19/00/473221900.db2.gz WGSJSSRXVOFASC-LLVKDONJSA-N 1 1 343.290 2.609 20 70 EFIDMO CC(C)[N@@H+]1C[C@H](NC(=O)c2c[nH]nc2-c2ccc(F)cc2)[C@@H](C)C1 ZINC000161280638 473224097 /nfs/dbraw/zinc/22/40/97/473224097.db2.gz QZAHNNARIVTACE-LRDDRELGSA-N 1 1 330.407 2.674 20 70 EFIDMO COc1ccc2nc(C)cc(C(=O)NC[C@@H]3CC[N@H+](C4CC4)C3)c2c1 ZINC000161336205 473227127 /nfs/dbraw/zinc/22/71/27/473227127.db2.gz PXNXDCGFKGGOGI-AWEZNQCLSA-N 1 1 339.439 2.766 20 70 EFIDMO Cn1ncc(CN2CC[N@@H+](C)C[C@@H]2c2ccccc2)c1C(F)(F)F ZINC000161343317 473228280 /nfs/dbraw/zinc/22/82/80/473228280.db2.gz KDSGOKWLMSITLY-OAHLLOKOSA-N 1 1 338.377 2.928 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+]3C[C@@H](C)CC[C@@H]3C)nc(N)c21 ZINC000161340887 473228382 /nfs/dbraw/zinc/22/83/82/473228382.db2.gz RLXMESSKLRWWGD-QWRGUYRKSA-N 1 1 346.431 2.911 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+]3C[C@@H](C)CC[C@@H]3C)nc(N)c21 ZINC000161340887 473228386 /nfs/dbraw/zinc/22/83/86/473228386.db2.gz RLXMESSKLRWWGD-QWRGUYRKSA-N 1 1 346.431 2.911 20 70 EFIDMO O=C(NCC[N@@H+]1CCc2ccccc2C1)c1ccnc(Cl)c1F ZINC000161383230 473230873 /nfs/dbraw/zinc/23/08/73/473230873.db2.gz YOOYFWLFPZQXBE-UHFFFAOYSA-N 1 1 333.794 2.662 20 70 EFIDMO O=C(NCC[N@H+]1CCc2ccccc2C1)c1ccnc(Cl)c1F ZINC000161383230 473230878 /nfs/dbraw/zinc/23/08/78/473230878.db2.gz YOOYFWLFPZQXBE-UHFFFAOYSA-N 1 1 333.794 2.662 20 70 EFIDMO c1ccc(CC[N@H+]2CC[C@H](C[NH2+]C3CCC4(CC3)OCCO4)C2)cc1 ZINC000161425836 473234549 /nfs/dbraw/zinc/23/45/49/473234549.db2.gz UGJJMLPWMDCWJO-LJQANCHMSA-N 1 1 344.499 2.826 20 70 EFIDMO c1ccc(CCN2CC[C@H](C[NH2+]C3CCC4(CC3)OCCO4)C2)cc1 ZINC000161425836 473234553 /nfs/dbraw/zinc/23/45/53/473234553.db2.gz UGJJMLPWMDCWJO-LJQANCHMSA-N 1 1 344.499 2.826 20 70 EFIDMO CNS(=O)(=O)c1cccc([C@@H](C)[NH2+][C@H](C)c2cncc(F)c2)c1 ZINC000161473984 473237721 /nfs/dbraw/zinc/23/77/21/473237721.db2.gz NERRKOOQUMNVSH-VXGBXAGGSA-N 1 1 337.420 2.541 20 70 EFIDMO C[N@@H+](CCCNC(=O)N[C@@H](CCO)C(C)(C)C)Cc1ccccc1 ZINC000161477439 473238747 /nfs/dbraw/zinc/23/87/47/473238747.db2.gz VPYUVXVAROZSNI-KRWDZBQOSA-N 1 1 335.492 2.605 20 70 EFIDMO C[N@@H+](CCCNC(=O)N[C@@H]1CCOC(C)(C)C1)C1CCCCC1 ZINC000161491802 473240069 /nfs/dbraw/zinc/24/00/69/473240069.db2.gz KYSMWCNCCFTTET-OAHLLOKOSA-N 1 1 325.497 2.898 20 70 EFIDMO C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)N(c1nccs1)C1CCCCC1 ZINC000159406086 473026159 /nfs/dbraw/zinc/02/61/59/473026159.db2.gz BZRAPEFYGUZSAR-STQMWFEESA-N 1 1 325.478 2.510 20 70 EFIDMO C[C@H](O)C[N@H+](C)[C@@H](C)C(=O)N(c1nccs1)C1CCCCC1 ZINC000159406086 473026155 /nfs/dbraw/zinc/02/61/55/473026155.db2.gz BZRAPEFYGUZSAR-STQMWFEESA-N 1 1 325.478 2.510 20 70 EFIDMO O[C@H](COc1ccccc1)C[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159430443 473027495 /nfs/dbraw/zinc/02/74/95/473027495.db2.gz UPXMUVFHMKLATE-GHTZIAJQSA-N 1 1 339.435 2.600 20 70 EFIDMO O[C@H](COc1ccccc1)C[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159430443 473027498 /nfs/dbraw/zinc/02/74/98/473027498.db2.gz UPXMUVFHMKLATE-GHTZIAJQSA-N 1 1 339.435 2.600 20 70 EFIDMO C[N@@H+](CCOc1cccc(Br)c1)C[C@@H]1CCC[C@@H]1O ZINC000159457721 473029465 /nfs/dbraw/zinc/02/94/65/473029465.db2.gz DTUIOMALOSIVMP-WFASDCNBSA-N 1 1 328.250 2.921 20 70 EFIDMO CS(=O)(=O)NCC[C@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1F ZINC000159452704 473030123 /nfs/dbraw/zinc/03/01/23/473030123.db2.gz URYGVWPEDFEHSE-CYBMUJFWSA-N 1 1 348.871 2.773 20 70 EFIDMO CS(=O)(=O)NCC[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1F ZINC000159452704 473030128 /nfs/dbraw/zinc/03/01/28/473030128.db2.gz URYGVWPEDFEHSE-CYBMUJFWSA-N 1 1 348.871 2.773 20 70 EFIDMO COCc1nc(C)c(C(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000159448714 473030392 /nfs/dbraw/zinc/03/03/92/473030392.db2.gz ZAARMKGBOXAXKG-FRRDWIJNSA-N 1 1 339.505 2.694 20 70 EFIDMO C[N@H+](Cc1ccc(I)cc1)C[C@@H]1CCC[C@@H]1O ZINC000159501559 473032866 /nfs/dbraw/zinc/03/28/66/473032866.db2.gz FINXVVCCTPORCV-JSGCOSHPSA-N 1 1 345.224 2.884 20 70 EFIDMO CC(C)C[C@H](NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O)c1ccccc1 ZINC000159568252 473040370 /nfs/dbraw/zinc/04/03/70/473040370.db2.gz ZAPYSZSUPMORMB-FHWLQOOXSA-N 1 1 332.488 2.983 20 70 EFIDMO CCc1ccccc1NC(=O)CNC(=O)C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000159614577 473044285 /nfs/dbraw/zinc/04/42/85/473044285.db2.gz QIZQABPQJAUDOM-WMZOPIPTSA-N 1 1 343.471 2.568 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCCc2ccc(OC(C)C)cc2)CC1 ZINC000159606712 473044323 /nfs/dbraw/zinc/04/43/23/473044323.db2.gz SRRPIUZQJBYXAK-UHFFFAOYSA-N 1 1 333.476 2.754 20 70 EFIDMO Cc1cc(NC(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)c[nH]c1=O ZINC000159642179 473046516 /nfs/dbraw/zinc/04/65/16/473046516.db2.gz FAXLQZBRBNMSHC-HNNXBMFYSA-N 1 1 343.402 2.673 20 70 EFIDMO COc1ccc(NC(=O)NC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cc1 ZINC000159637324 473047032 /nfs/dbraw/zinc/04/70/32/473047032.db2.gz SYZOGYJKCXIXTM-BBRMVZONSA-N 1 1 331.416 2.608 20 70 EFIDMO CCC[C@H]1CN(C(=O)NCCC[N@H+]2CCc3ccccc3C2)CCO1 ZINC000159633596 473047068 /nfs/dbraw/zinc/04/70/68/473047068.db2.gz WMFDJLVVGFGQTG-IBGZPJMESA-N 1 1 345.487 2.645 20 70 EFIDMO COc1cccc(CN(C)C(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c1OC ZINC000159640242 473047247 /nfs/dbraw/zinc/04/72/47/473047247.db2.gz AGXQBSBBLJEDQP-RDJZCZTQSA-N 1 1 346.471 2.927 20 70 EFIDMO CC(C)CCn1ccc(NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)n1 ZINC000159663398 473049555 /nfs/dbraw/zinc/04/95/55/473049555.db2.gz VGVHTFXUNAOGKH-HZPDHXFCSA-N 1 1 333.480 2.877 20 70 EFIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)NC[C@@]1(C)CCCO1 ZINC000159700476 473052444 /nfs/dbraw/zinc/05/24/44/473052444.db2.gz CSUKGINSRFVUNW-LJQANCHMSA-N 1 1 333.476 2.765 20 70 EFIDMO COC(=O)Nc1ccc(CNC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cc1 ZINC000159717234 473053491 /nfs/dbraw/zinc/05/34/91/473053491.db2.gz HYTOHNWBHYKMDY-RDJZCZTQSA-N 1 1 345.443 2.746 20 70 EFIDMO C[N@H+]1CCC[C@@H]1CNC(=O)N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000159716269 473053898 /nfs/dbraw/zinc/05/38/98/473053898.db2.gz SOAILRSQKKLUEP-KGLIPLIRSA-N 1 1 337.851 2.597 20 70 EFIDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3csc([C@@H]4CCCO4)n3)CC[C@@H]21 ZINC000159722707 473054638 /nfs/dbraw/zinc/05/46/38/473054638.db2.gz GPATYFJFMBCZAE-SNPRPXQTSA-N 1 1 335.473 2.551 20 70 EFIDMO COCCOc1cccc(CNC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c1 ZINC000159721733 473055136 /nfs/dbraw/zinc/05/51/36/473055136.db2.gz DKAZEHMTTOZYGY-HKUYNNGSSA-N 1 1 346.471 2.593 20 70 EFIDMO Cc1noc(C)c1[C@H](C)CNC(=O)N[C@@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000159747877 473057615 /nfs/dbraw/zinc/05/76/15/473057615.db2.gz LQLXZDNNBMPFLO-MJBXVCDLSA-N 1 1 336.480 2.815 20 70 EFIDMO CCOCCC1(CNC(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000159754489 473058178 /nfs/dbraw/zinc/05/81/78/473058178.db2.gz BLBNLEKDUSQJCA-IXDOHACOSA-N 1 1 339.524 2.859 20 70 EFIDMO Cc1ccccc1[C@H](NC(=O)NC[C@@H](C)C[NH+]1CCOCC1)C(C)C ZINC000159766549 473059720 /nfs/dbraw/zinc/05/97/20/473059720.db2.gz SAAVVFTXMJOOTI-VQIMIIECSA-N 1 1 347.503 2.960 20 70 EFIDMO C[C@@H](C(=O)NCc1ccccc1)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159777028 473060468 /nfs/dbraw/zinc/06/04/68/473060468.db2.gz VROJOJDRTWLROT-INIZCTEOSA-N 1 1 325.456 2.889 20 70 EFIDMO CC[N@@H+](CC(=O)N[C@H](c1ccccn1)c1ccccc1OC)C1CC1 ZINC000159837181 473064558 /nfs/dbraw/zinc/06/45/58/473064558.db2.gz FHOINTGPOSUILL-FQEVSTJZSA-N 1 1 339.439 2.780 20 70 EFIDMO C[C@@H](CNC(=O)CCCc1nc(C2CC2)no1)[N@H+]1CCC[C@@H](C)C1 ZINC000159873708 473068682 /nfs/dbraw/zinc/06/86/82/473068682.db2.gz ZHTMNHPVQQASFO-KGLIPLIRSA-N 1 1 334.464 2.506 20 70 EFIDMO CC[C@H](CNC(=O)N1CCO[C@@H](C)[C@@H]1C)[N@H+]1CCc2ccccc2C1 ZINC000159871789 473069136 /nfs/dbraw/zinc/06/91/36/473069136.db2.gz MSCRMZKVLPLEHG-TXPKVOOTSA-N 1 1 345.487 2.642 20 70 EFIDMO CCN(C(=O)N[C@@H](C)CCOC)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159894834 473069723 /nfs/dbraw/zinc/06/97/23/473069723.db2.gz VSNORFYJVVOBBT-FUHWJXTLSA-N 1 1 333.476 2.717 20 70 EFIDMO C[C@H](NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000159908874 473071160 /nfs/dbraw/zinc/07/11/60/473071160.db2.gz FAVQNVWLASHINF-WFEDQXDTSA-N 1 1 349.519 2.896 20 70 EFIDMO Cc1noc(Cl)c1CC(=O)NC[C@@H](C)[N@H+]1CCc2ccccc2C1 ZINC000159907237 473071429 /nfs/dbraw/zinc/07/14/29/473071429.db2.gz HREUFYSMXWJPKM-GFCCVEGCSA-N 1 1 347.846 2.742 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](C)c2nc(C3CCCCC3)no2)CC1 ZINC000159931979 473073657 /nfs/dbraw/zinc/07/36/57/473073657.db2.gz OQDLNTNFHDSRKN-CQSZACIVSA-N 1 1 349.479 2.916 20 70 EFIDMO C[C@H]1C[C@H](NC(=O)NCCOc2ccccc2Cl)C[N@H+]1C1CC1 ZINC000159999568 473080134 /nfs/dbraw/zinc/08/01/34/473080134.db2.gz WEQVMZZNBJZZLC-STQMWFEESA-N 1 1 337.851 2.643 20 70 EFIDMO CC(C)(C)C(=O)N1CCC(C[N@H+]2CCO[C@H](c3ccco3)C2)CC1 ZINC000160099626 473087081 /nfs/dbraw/zinc/08/70/81/473087081.db2.gz RJAAIHQKJKGEQG-KRWDZBQOSA-N 1 1 334.460 2.938 20 70 EFIDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cnc(C(F)(F)F)nc2)cn1 ZINC000160120058 473089489 /nfs/dbraw/zinc/08/94/89/473089489.db2.gz OFTAVFFFTQOOAK-UHFFFAOYSA-N 1 1 348.288 2.637 20 70 EFIDMO Cc1ccc(CN2CCN(CC[N@H+](C)Cc3ccccc3)CC2)nc1 ZINC000160119299 473089545 /nfs/dbraw/zinc/08/95/45/473089545.db2.gz QDDZFMPQPUSROG-UHFFFAOYSA-N 1 1 338.499 2.640 20 70 EFIDMO CCOCCC[N@H+]1CCCN(C(=O)CCc2ccc(OC)cc2)CC1 ZINC000160132434 473089622 /nfs/dbraw/zinc/08/96/22/473089622.db2.gz MEUBDDNKKQMURT-UHFFFAOYSA-N 1 1 348.487 2.589 20 70 EFIDMO COCCC1(CNC(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)CCC1 ZINC000160199564 473096802 /nfs/dbraw/zinc/09/68/02/473096802.db2.gz IEKIRHPYYUEGFE-HOTGVXAUSA-N 1 1 325.497 2.613 20 70 EFIDMO COc1cccc(C2(NC(=O)NCC[N@H+]3CCC[C@H](C)C3)CC2)c1 ZINC000160276226 473103815 /nfs/dbraw/zinc/10/38/15/473103815.db2.gz JHYPCPPMPNWFBI-HNNXBMFYSA-N 1 1 331.460 2.715 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)N2CCS[C@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC000160323383 473108633 /nfs/dbraw/zinc/10/86/33/473108633.db2.gz OXUYKWXNPXLRAO-BFYDXBDKSA-N 1 1 333.501 2.796 20 70 EFIDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccn(CC(F)(F)F)n2)C1 ZINC000160339040 473110082 /nfs/dbraw/zinc/11/00/82/473110082.db2.gz KLDOEBMDGUSOPC-LBPRGKRZSA-N 1 1 347.385 2.641 20 70 EFIDMO NC(=O)CC[C@H]1CCC[N@H+](Cc2ncc(-c3ccccc3F)o2)C1 ZINC000160328719 473110499 /nfs/dbraw/zinc/11/04/99/473110499.db2.gz ZJSMERFRUFUUEP-CYBMUJFWSA-N 1 1 331.391 2.958 20 70 EFIDMO NC(=O)CC[C@H]1CCC[N@@H+](Cc2ncc(-c3ccccc3F)o2)C1 ZINC000160328719 473110507 /nfs/dbraw/zinc/11/05/07/473110507.db2.gz ZJSMERFRUFUUEP-CYBMUJFWSA-N 1 1 331.391 2.958 20 70 EFIDMO Cc1cccc([C@H](C)C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000160348341 473112005 /nfs/dbraw/zinc/11/20/05/473112005.db2.gz CECFQLALTOWLRP-KRWDZBQOSA-N 1 1 332.488 2.915 20 70 EFIDMO NC(=O)[C@H]1CCC[N@@H+]1Cc1cccc(OCc2ccccc2F)c1 ZINC000160363216 473112530 /nfs/dbraw/zinc/11/25/30/473112530.db2.gz NLCIOZMLEBXPJS-GOSISDBHSA-N 1 1 328.387 2.854 20 70 EFIDMO NC(=O)[C@H]1CCC[N@H+]1Cc1cccc(OCc2ccccc2F)c1 ZINC000160363216 473112536 /nfs/dbraw/zinc/11/25/36/473112536.db2.gz NLCIOZMLEBXPJS-GOSISDBHSA-N 1 1 328.387 2.854 20 70 EFIDMO COc1cc(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc(OC)c1C ZINC000160385662 473115491 /nfs/dbraw/zinc/11/54/91/473115491.db2.gz QTCLIQKNNYXRJF-MRXNPFEDSA-N 1 1 334.460 2.862 20 70 EFIDMO Cc1csc2nc(C)nc(N3CCC[C@H]3C[NH+]3CCOCC3)c12 ZINC000160392230 473117003 /nfs/dbraw/zinc/11/70/03/473117003.db2.gz YLQQLVZQWMWNPF-AWEZNQCLSA-N 1 1 332.473 2.609 20 70 EFIDMO Cn1ccnc1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC000160400625 473117865 /nfs/dbraw/zinc/11/78/65/473117865.db2.gz WZLODRJTAOMIFB-YIONKMFJSA-N 1 1 334.464 2.782 20 70 EFIDMO Cn1ccnc1C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC000160400625 473117870 /nfs/dbraw/zinc/11/78/70/473117870.db2.gz WZLODRJTAOMIFB-YIONKMFJSA-N 1 1 334.464 2.782 20 70 EFIDMO COc1ccccc1C[N@H+](C)Cc1cnc(N2CCOCC2)s1 ZINC000160415367 473119311 /nfs/dbraw/zinc/11/93/11/473119311.db2.gz OCROOKNMAZQRPH-UHFFFAOYSA-N 1 1 333.457 2.620 20 70 EFIDMO COc1ccccc1C[N@@H+](C)Cc1cnc(N2CCOCC2)s1 ZINC000160415367 473119316 /nfs/dbraw/zinc/11/93/16/473119316.db2.gz OCROOKNMAZQRPH-UHFFFAOYSA-N 1 1 333.457 2.620 20 70 EFIDMO CC(C)NC(=O)c1ccc(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000160460030 473128013 /nfs/dbraw/zinc/12/80/13/473128013.db2.gz WHEFHMMDQIODPD-CVEARBPZSA-N 1 1 345.487 2.675 20 70 EFIDMO CC(C)Cn1ncc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1C1CC1 ZINC000160487183 473132191 /nfs/dbraw/zinc/13/21/91/473132191.db2.gz GNMVROQPFZIKDO-SJLPKXTDSA-N 1 1 344.503 2.973 20 70 EFIDMO CC[N@H+](Cc1ccc(Br)c(C)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160544672 473140274 /nfs/dbraw/zinc/14/02/74/473140274.db2.gz PKGWPIVNUWENKY-CYBMUJFWSA-N 1 1 346.290 2.767 20 70 EFIDMO CC[N@@H+](Cc1ccc(Br)c(C)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160544672 473140278 /nfs/dbraw/zinc/14/02/78/473140278.db2.gz PKGWPIVNUWENKY-CYBMUJFWSA-N 1 1 346.290 2.767 20 70 EFIDMO COc1cc(C)c(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc1OC ZINC000160548661 473140948 /nfs/dbraw/zinc/14/09/48/473140948.db2.gz WBISIKGTTYERLJ-OAHLLOKOSA-N 1 1 334.460 2.862 20 70 EFIDMO CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C1 ZINC000160598284 473149797 /nfs/dbraw/zinc/14/97/97/473149797.db2.gz NTXFDKYPXSFHFR-ZACQAIPSSA-N 1 1 346.475 2.750 20 70 EFIDMO COc1ccc(CN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)C2CC2)cc1 ZINC000160611718 473150403 /nfs/dbraw/zinc/15/04/03/473150403.db2.gz OMHGONDRDNAATK-QGZVFWFLSA-N 1 1 343.471 2.854 20 70 EFIDMO CN(C)C(=O)c1ccc(C[N@H+](C)Cc2ccc(OC(F)F)cc2)[nH]1 ZINC000160621384 473152634 /nfs/dbraw/zinc/15/26/34/473152634.db2.gz HCSJEZLPOODFAC-UHFFFAOYSA-N 1 1 337.370 2.950 20 70 EFIDMO CN(C)C(=O)c1ccc(C[N@@H+](C)Cc2ccc(OC(F)F)cc2)[nH]1 ZINC000160621384 473152643 /nfs/dbraw/zinc/15/26/43/473152643.db2.gz HCSJEZLPOODFAC-UHFFFAOYSA-N 1 1 337.370 2.950 20 70 EFIDMO CC1CC[NH+](CCCCNC(=O)c2cccc(-c3nnc[nH]3)c2)CC1 ZINC000160622257 473154239 /nfs/dbraw/zinc/15/42/39/473154239.db2.gz XOFJDBYELVJJQH-UHFFFAOYSA-N 1 1 341.459 2.714 20 70 EFIDMO O=C(Nc1cnn(Cc2ccccc2)c1)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000160635604 473154726 /nfs/dbraw/zinc/15/47/26/473154726.db2.gz MRCRJMXRVWTWSQ-KRWDZBQOSA-N 1 1 339.443 2.537 20 70 EFIDMO CCn1cc([C@@H](C)[NH2+][C@H](CN2CCCC2=O)c2ccccc2)cn1 ZINC000160656797 473157689 /nfs/dbraw/zinc/15/76/89/473157689.db2.gz NAAHOSQTIOIBQP-CRAIPNDOSA-N 1 1 326.444 2.917 20 70 EFIDMO CC[C@](C)([NH2+]Cc1nc(-c2c(F)cccc2F)cs1)C(N)=O ZINC000160659725 473158213 /nfs/dbraw/zinc/15/82/13/473158213.db2.gz VRKOHGMCBWJYGI-HNNXBMFYSA-N 1 1 325.384 2.832 20 70 EFIDMO COc1cccc(N2CC[NH+](Cc3cnc4cc(C)ccn34)CC2)c1 ZINC000160687096 473161458 /nfs/dbraw/zinc/16/14/58/473161458.db2.gz XNUKRVHVTBQZMZ-UHFFFAOYSA-N 1 1 336.439 2.974 20 70 EFIDMO CC(C)c1csc(CNC(=O)NC[C@@H](c2ccco2)[NH+](C)C)n1 ZINC000160696106 473162790 /nfs/dbraw/zinc/16/27/90/473162790.db2.gz IREBPKNUDRZGOI-ZDUSSCGKSA-N 1 1 336.461 2.962 20 70 EFIDMO COC(=O)C1([N@@H+](C)CC2CCN(C(=O)C(C)(C)C)CC2)CCCC1 ZINC000160708055 473164393 /nfs/dbraw/zinc/16/43/93/473164393.db2.gz OIBMXECJUKKBEN-UHFFFAOYSA-N 1 1 338.492 2.689 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](C)CC3CCCC3)nc(N)c21 ZINC000160730255 473167393 /nfs/dbraw/zinc/16/73/93/473167393.db2.gz QFXKWJWPZXDZMA-UHFFFAOYSA-N 1 1 346.431 2.912 20 70 EFIDMO CCS[C@H]1CCCCN(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)C1 ZINC000160747755 473170607 /nfs/dbraw/zinc/17/06/07/473170607.db2.gz WYBNLPTWSYXLOE-HOTGVXAUSA-N 1 1 325.522 2.788 20 70 EFIDMO CCC1(C(=O)NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)CCCC1 ZINC000160747677 473170637 /nfs/dbraw/zinc/17/06/37/473170637.db2.gz RJKXKHGIVVFSHI-ZWKOTPCHSA-N 1 1 330.472 2.708 20 70 EFIDMO COCC[N@@H+](C)CC[C@H](NC(=O)NC1(C)CCC1)c1ccccc1 ZINC000160772029 473173685 /nfs/dbraw/zinc/17/36/85/473173685.db2.gz BCKRSYKZJMADPO-KRWDZBQOSA-N 1 1 333.476 2.938 20 70 EFIDMO O=C1OCCN1c1cccc2c1CC[N@H+](Cc1cnc3ccccn13)C2 ZINC000160819877 473178421 /nfs/dbraw/zinc/17/84/21/473178421.db2.gz FHZBHDPZJHEQDZ-UHFFFAOYSA-N 1 1 348.406 2.849 20 70 EFIDMO O=C1OCCN1c1cccc2c1CC[N@@H+](Cc1cnc3ccccn13)C2 ZINC000160819877 473178426 /nfs/dbraw/zinc/17/84/26/473178426.db2.gz FHZBHDPZJHEQDZ-UHFFFAOYSA-N 1 1 348.406 2.849 20 70 EFIDMO c1cc2c(s1)CCC[C@@H]2[NH2+]Cc1cn(Cc2cccnc2)nn1 ZINC000160968388 473195379 /nfs/dbraw/zinc/19/53/79/473195379.db2.gz QJTFCFWMTSNMLY-INIZCTEOSA-N 1 1 325.441 2.950 20 70 EFIDMO COC(=O)c1csc(NC(=O)NCC[N@@H+](C)Cc2ccccc2)c1 ZINC000160995568 473197307 /nfs/dbraw/zinc/19/73/07/473197307.db2.gz MDEGRDLPKARXQO-UHFFFAOYSA-N 1 1 347.440 2.788 20 70 EFIDMO CCc1oc2ccccc2c1C[NH+]1CCN(C(=O)[C@@H]2CCCO2)CC1 ZINC000160994903 473197566 /nfs/dbraw/zinc/19/75/66/473197566.db2.gz MMHOWDIGTJZEPP-IBGZPJMESA-N 1 1 342.439 2.818 20 70 EFIDMO CCC[C@@H]1CN(C(=O)Nc2ccc(OC)cc2C)CC[N@H+]1CCOC ZINC000160993447 473197755 /nfs/dbraw/zinc/19/77/55/473197755.db2.gz OFXPSDZYNDSUOD-MRXNPFEDSA-N 1 1 349.475 2.968 20 70 EFIDMO CC(C)n1cccc1C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000161062012 473203420 /nfs/dbraw/zinc/20/34/20/473203420.db2.gz LNUSJQYKSIJMDE-UHFFFAOYSA-N 1 1 333.476 2.834 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)NCCc1ccccc1C ZINC000161079797 473204584 /nfs/dbraw/zinc/20/45/84/473204584.db2.gz DZKMFDGCYPNHQL-QGZVFWFLSA-N 1 1 325.456 2.959 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)NCCc1ccccc1C ZINC000161079797 473204589 /nfs/dbraw/zinc/20/45/89/473204589.db2.gz DZKMFDGCYPNHQL-QGZVFWFLSA-N 1 1 325.456 2.959 20 70 EFIDMO CC[C@@H](C)[N@@H+](C)CCNCc1cc2c(c(Br)c1)OCO2 ZINC000217375594 474142461 /nfs/dbraw/zinc/14/24/61/474142461.db2.gz MTZIBIFMJBQMOL-LLVKDONJSA-N 1 1 343.265 2.998 20 70 EFIDMO CC[C@@H](C)N(C)CC[NH2+]Cc1cc2c(c(Br)c1)OCO2 ZINC000217375594 474142465 /nfs/dbraw/zinc/14/24/65/474142465.db2.gz MTZIBIFMJBQMOL-LLVKDONJSA-N 1 1 343.265 2.998 20 70 EFIDMO C[C@H](NCCC[N@@H+]1CCCC[C@H]1C)c1ccc(-n2cnnn2)cc1 ZINC000160282676 533850777 /nfs/dbraw/zinc/85/07/77/533850777.db2.gz ISNSIDSLJVNPAA-CVEARBPZSA-N 1 1 328.464 2.577 20 70 EFIDMO C[C@H](NCCC[N@H+]1CCCC[C@H]1C)c1ccc(-n2cnnn2)cc1 ZINC000160282676 533850788 /nfs/dbraw/zinc/85/07/88/533850788.db2.gz ISNSIDSLJVNPAA-CVEARBPZSA-N 1 1 328.464 2.577 20 70 EFIDMO C[C@@H](CNC(=O)NCCc1ccc(Cl)nc1)[N@H+]1CCC[C@H](C)C1 ZINC000160202520 533958127 /nfs/dbraw/zinc/95/81/27/533958127.db2.gz RONDUFBZMGZOJI-KBPBESRZSA-N 1 1 338.883 2.697 20 70 EFIDMO COc1ccc(Br)c(C[NH2+]Cc2cccc(C(N)=O)c2)c1 ZINC000218156190 523484535 /nfs/dbraw/zinc/48/45/35/523484535.db2.gz DCLDTSGZRIYRML-UHFFFAOYSA-N 1 1 349.228 2.846 20 70 EFIDMO Cc1nc2ncnn2c(N[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)c1C ZINC000160213847 534713209 /nfs/dbraw/zinc/71/32/09/534713209.db2.gz YLVWUIFUGDCXJP-GUYCJALGSA-N 1 1 336.443 2.674 20 70 EFIDMO Cc1nc2ncnn2c(N[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)c1C ZINC000160213709 534714017 /nfs/dbraw/zinc/71/40/17/534714017.db2.gz YLVWUIFUGDCXJP-SUMWQHHRSA-N 1 1 336.443 2.674 20 70 EFIDMO Cc1cccc(C)c1OCCCNC(=O)NC[C@H](C)[N@@H+](C)C1CC1 ZINC000216915783 524313087 /nfs/dbraw/zinc/31/30/87/524313087.db2.gz YEVHZYAKYSNDCI-INIZCTEOSA-N 1 1 333.476 2.854 20 70 EFIDMO Cc1cccc([C@@H]2CCC[N@H+]2CCN2C(=O)c3ccccc3C2=O)n1 ZINC000159968831 524852764 /nfs/dbraw/zinc/85/27/64/524852764.db2.gz HSXNIBJIIBRFFW-SFHVURJKSA-N 1 1 335.407 2.823 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N(C)CCc1ccncc1 ZINC000161021840 527963188 /nfs/dbraw/zinc/96/31/88/527963188.db2.gz OCTLTNQMDVGCFW-GOSISDBHSA-N 1 1 332.492 2.776 20 70 EFIDMO CCO[C@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1ccccc1 ZINC000159844045 527990298 /nfs/dbraw/zinc/99/02/98/527990298.db2.gz YSCGMSUPOXQZQH-SFHVURJKSA-N 1 1 348.487 2.581 20 70 EFIDMO CCCOc1cccc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000160286322 528732031 /nfs/dbraw/zinc/73/20/31/528732031.db2.gz PMCVXAFAHTUHRI-UHFFFAOYSA-N 1 1 348.487 2.906 20 70 EFIDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@@](C)(O)C1 ZINC000160205477 528837456 /nfs/dbraw/zinc/83/74/56/528837456.db2.gz CFYIXBCMQIXQOA-LJQANCHMSA-N 1 1 333.476 2.583 20 70 EFIDMO CCOC[C@@H]1CCN(C(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)C1 ZINC000160904964 528933768 /nfs/dbraw/zinc/93/37/68/528933768.db2.gz OEWPRJCSNOMAOQ-SJORKVTESA-N 1 1 325.497 2.565 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H](OC)c2cccc(Cl)c2)CC1 ZINC000159926452 529024710 /nfs/dbraw/zinc/02/47/10/529024710.db2.gz IUEZQKCRDCSRLY-MRXNPFEDSA-N 1 1 339.867 2.765 20 70 EFIDMO CCOC[C@H]1CCN(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000160019901 529027332 /nfs/dbraw/zinc/02/73/32/529027332.db2.gz RIOBFKQMQFXIBJ-WDSOQIARSA-N 1 1 345.487 2.717 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2cccc(OCC(C)C)c2)CC1 ZINC000159747890 529027644 /nfs/dbraw/zinc/02/76/44/529027644.db2.gz VFBPEDYQHQYEPQ-UHFFFAOYSA-N 1 1 333.476 2.959 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2cccc(C(F)(F)F)c2)CC1 ZINC000159520560 529027863 /nfs/dbraw/zinc/02/78/63/529027863.db2.gz VLQCUVMJVUWWOJ-UHFFFAOYSA-N 1 1 329.366 2.943 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](c2ccccc2)c2ccccn2)CC1 ZINC000159539653 529028884 /nfs/dbraw/zinc/02/88/84/529028884.db2.gz RVLCKQPMUFGBFK-IBGZPJMESA-N 1 1 338.455 2.908 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2csc(-c3ccco3)n2)CC1 ZINC000160001036 529029010 /nfs/dbraw/zinc/02/90/10/529029010.db2.gz NMYJWBVWZRKXJJ-UHFFFAOYSA-N 1 1 334.445 2.640 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)CC1 ZINC000160015319 529030604 /nfs/dbraw/zinc/03/06/04/529030604.db2.gz BBYYEQSBWUGZPK-OALUTQOASA-N 1 1 345.487 2.862 20 70 EFIDMO CCO[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1ccccc1 ZINC000159844171 529088424 /nfs/dbraw/zinc/08/84/24/529088424.db2.gz YSCGMSUPOXQZQH-GOSISDBHSA-N 1 1 348.487 2.581 20 70 EFIDMO CCCCn1ncc(C(=O)NCC[N@@H+]2CCc3ccccc3C2)c1C ZINC000160905296 529094401 /nfs/dbraw/zinc/09/44/01/529094401.db2.gz IUQKXSOHANQYEU-UHFFFAOYSA-N 1 1 340.471 2.780 20 70 EFIDMO CCCCn1ncc(C(=O)NCC[N@H+]2CCc3ccccc3C2)c1C ZINC000160905296 529094406 /nfs/dbraw/zinc/09/44/06/529094406.db2.gz IUQKXSOHANQYEU-UHFFFAOYSA-N 1 1 340.471 2.780 20 70 EFIDMO C[C@@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000161069331 296163744 /nfs/dbraw/zinc/16/37/44/296163744.db2.gz UKTRLOGLFKNIQS-COXVUDFISA-N 1 1 339.505 2.582 20 70 EFIDMO CN(C)C(=O)c1ccc(CNC(C)(C)C[N@H+](C)Cc2ccccc2)[nH]1 ZINC000159380883 206243392 /nfs/dbraw/zinc/24/33/92/206243392.db2.gz MGVSALRQRKZWRL-UHFFFAOYSA-N 1 1 342.487 2.717 20 70 EFIDMO CN(C)C(=O)c1ccc(CNC(C)(C)C[N@@H+](C)Cc2ccccc2)[nH]1 ZINC000159380883 206243394 /nfs/dbraw/zinc/24/33/94/206243394.db2.gz MGVSALRQRKZWRL-UHFFFAOYSA-N 1 1 342.487 2.717 20 70 EFIDMO COCC[N@H+](C)CCN[C@@H](C)c1cc(Cl)c(OC)cc1OC ZINC000159404933 206244064 /nfs/dbraw/zinc/24/40/64/206244064.db2.gz XAHHVCFHGQUUAD-LBPRGKRZSA-N 1 1 330.856 2.586 20 70 EFIDMO COCC[N@@H+](C)CCN[C@@H](C)c1cc(Cl)c(OC)cc1OC ZINC000159404933 206244066 /nfs/dbraw/zinc/24/40/66/206244066.db2.gz XAHHVCFHGQUUAD-LBPRGKRZSA-N 1 1 330.856 2.586 20 70 EFIDMO Cc1cc(C)c(NC(=O)C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)c(C)c1 ZINC000159396133 206244544 /nfs/dbraw/zinc/24/45/44/206244544.db2.gz XFIPZYFOLTZBFD-QGZVFWFLSA-N 1 1 345.487 2.644 20 70 EFIDMO CCCc1ccccc1NC(=O)C(=O)NC[C@H]1CC[N@@H+](CC(C)C)C1 ZINC000159426580 206246190 /nfs/dbraw/zinc/24/61/90/206246190.db2.gz VHNUCYMMIGWXJP-MRXNPFEDSA-N 1 1 345.487 2.672 20 70 EFIDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)C(=O)Nc2cccc(C(C)C)c2)C1 ZINC000159449000 206246466 /nfs/dbraw/zinc/24/64/66/206246466.db2.gz QYNKDIIXPXGWPH-INIZCTEOSA-N 1 1 345.487 2.843 20 70 EFIDMO O=C1NC2(CCCC2)C(=O)N1CC[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000159444398 206246855 /nfs/dbraw/zinc/24/68/55/206246855.db2.gz SENVOLRWZYWAAP-INIZCTEOSA-N 1 1 345.418 2.827 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)C1(Cc2ccccc2)CC1 ZINC000159623521 206255737 /nfs/dbraw/zinc/25/57/37/206255737.db2.gz JAAQHPADRVGAGM-UHFFFAOYSA-N 1 1 344.499 2.826 20 70 EFIDMO CCCOCc1ccccc1CNC(=O)N1CCC[N@@H+](CC)CC1 ZINC000159686499 206259679 /nfs/dbraw/zinc/25/96/79/206259679.db2.gz YJXMEAQOEACZQH-UHFFFAOYSA-N 1 1 333.476 2.850 20 70 EFIDMO Cc1noc([C@H]2CCC[N@@H+]([C@@H]3CCN(c4ccc(C)cc4)C3=O)C2)n1 ZINC000159493043 206249019 /nfs/dbraw/zinc/24/90/19/206249019.db2.gz ZWWIHGIZXLYKQS-DOTOQJQBSA-N 1 1 340.427 2.671 20 70 EFIDMO Cc1noc([C@H]2CCC[N@H+]([C@@H]3CCN(c4ccc(C)cc4)C3=O)C2)n1 ZINC000159493043 206249021 /nfs/dbraw/zinc/24/90/21/206249021.db2.gz ZWWIHGIZXLYKQS-DOTOQJQBSA-N 1 1 340.427 2.671 20 70 EFIDMO C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000159512937 206250392 /nfs/dbraw/zinc/25/03/92/206250392.db2.gz ZHYIYNFAVCJDNQ-HOTGVXAUSA-N 1 1 342.439 2.905 20 70 EFIDMO CCOc1ccccc1[C@H](CC)NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159503317 206250511 /nfs/dbraw/zinc/25/05/11/206250511.db2.gz JASOOGMGTOOVFO-SZMVWBNQSA-N 1 1 348.487 2.745 20 70 EFIDMO COc1ccccc1Oc1ccc(CNC(=O)[C@@H]2CSC[NH2+]2)cc1 ZINC000159534898 206251850 /nfs/dbraw/zinc/25/18/50/206251850.db2.gz HLXZDNISISTCPT-HNNXBMFYSA-N 1 1 344.436 2.766 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2ccccc2OC(F)F)CC1 ZINC000159576841 206252652 /nfs/dbraw/zinc/25/26/52/206252652.db2.gz OOWPESFLNTUPSE-UHFFFAOYSA-N 1 1 327.375 2.525 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](c2ccc(OC)cc2)C2CC2)CC1 ZINC000159569361 206253574 /nfs/dbraw/zinc/25/35/74/206253574.db2.gz PANSLMSWQOCGDL-GOSISDBHSA-N 1 1 331.460 2.884 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)CCCc1ccccc1 ZINC000159583010 206253616 /nfs/dbraw/zinc/25/36/16/206253616.db2.gz NQABZNICLZFPBM-UHFFFAOYSA-N 1 1 332.488 2.826 20 70 EFIDMO CC(C)Oc1ccccc1C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159719358 206260603 /nfs/dbraw/zinc/26/06/03/206260603.db2.gz RXMHLPSLAPNNFO-UHFFFAOYSA-N 1 1 348.487 2.904 20 70 EFIDMO COc1ccc(C(F)(F)C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC000159728612 206261041 /nfs/dbraw/zinc/26/10/41/206261041.db2.gz WEHUHDFAFYGWCV-CJNGLKHVSA-N 1 1 338.398 2.730 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](c2nccs2)c2ccccc2)CC1 ZINC000159820371 206264662 /nfs/dbraw/zinc/26/46/62/206264662.db2.gz AEUOQGNJJMDCKU-MRXNPFEDSA-N 1 1 344.484 2.970 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](c2nccs2)c2ccccc2)CC1 ZINC000159820216 206265852 /nfs/dbraw/zinc/26/58/52/206265852.db2.gz AEUOQGNJJMDCKU-INIZCTEOSA-N 1 1 344.484 2.970 20 70 EFIDMO O=C(c1cccc(CSCC[NH+]2CCOCC2)c1)N1CCCCC1 ZINC000159810613 206266055 /nfs/dbraw/zinc/26/60/55/206266055.db2.gz IOGJUMAUNZBBGG-UHFFFAOYSA-N 1 1 348.512 2.878 20 70 EFIDMO C[C@@H](CNC(=O)c1cc(=O)[nH]c2cc(F)ccc21)[N@H+]1CCC[C@@H](C)C1 ZINC000159875911 206268250 /nfs/dbraw/zinc/26/82/50/206268250.db2.gz PIMQXKSAQDQSDT-OLZOCXBDSA-N 1 1 345.418 2.517 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)CC1 ZINC000159934407 206272359 /nfs/dbraw/zinc/27/23/59/206272359.db2.gz UKDFFGNSHPZZCC-INIZCTEOSA-N 1 1 341.459 2.671 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](Cc2ccccc2OC)C(C)C)CC1 ZINC000159943724 206271862 /nfs/dbraw/zinc/27/18/62/206271862.db2.gz HWRYOFZAAGQEBK-SFHVURJKSA-N 1 1 347.503 3.000 20 70 EFIDMO CC[C@H](C)[N@H+](C)CCN[C@@H](C)CC(=O)Nc1cccnc1Cl ZINC000160060802 206278476 /nfs/dbraw/zinc/27/84/76/206278476.db2.gz ATZQPPCAVXYNLG-STQMWFEESA-N 1 1 326.872 2.772 20 70 EFIDMO CC[C@H](C)[N@@H+](C)CCN[C@@H](C)CC(=O)Nc1cccnc1Cl ZINC000160060802 206278479 /nfs/dbraw/zinc/27/84/79/206278479.db2.gz ATZQPPCAVXYNLG-STQMWFEESA-N 1 1 326.872 2.772 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1coc2ccccc12 ZINC000160252262 206286601 /nfs/dbraw/zinc/28/66/01/206286601.db2.gz KOPWMYDSOVNRPM-UHFFFAOYSA-N 1 1 330.428 2.863 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(F)c(Cl)c1 ZINC000160307798 206289298 /nfs/dbraw/zinc/28/92/98/206289298.db2.gz GYRSAYHGGFOWMX-UHFFFAOYSA-N 1 1 342.842 2.910 20 70 EFIDMO CC[N@@H+](C)Cc1cccc(CNC(=O)NCCc2ccncc2C)c1 ZINC000160312145 206289608 /nfs/dbraw/zinc/28/96/08/206289608.db2.gz KHYXXOOTSCXZOD-UHFFFAOYSA-N 1 1 340.471 2.884 20 70 EFIDMO CC[C@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1ccccc1 ZINC000160317463 206290149 /nfs/dbraw/zinc/29/01/49/206290149.db2.gz UFNCICMAICEYIE-SFHVURJKSA-N 1 1 332.488 2.997 20 70 EFIDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1[nH]c(-c2cccc(OC)c2)nc1C ZINC000160330388 206291070 /nfs/dbraw/zinc/29/10/70/206291070.db2.gz XUNPETMIVWCDDR-HNNXBMFYSA-N 1 1 342.443 2.608 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)[C@H]1CSc2ccccc21 ZINC000160349569 206291096 /nfs/dbraw/zinc/29/10/96/206291096.db2.gz JPKVBYMQERPKHZ-INIZCTEOSA-N 1 1 348.512 2.693 20 70 EFIDMO C[C@H]1C[C@H](NC(=O)N(C)Cc2nccs2)C[N@H+]1Cc1ccccc1 ZINC000160335856 206291182 /nfs/dbraw/zinc/29/11/82/206291182.db2.gz JJNJKROWVKXEFP-HOCLYGCPSA-N 1 1 344.484 2.948 20 70 EFIDMO CC(=O)Nc1ccc(F)c(C(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)c1 ZINC000160493335 206300412 /nfs/dbraw/zinc/30/04/12/206300412.db2.gz AWZUTTAKXXHCPS-OAHLLOKOSA-N 1 1 335.423 2.634 20 70 EFIDMO C[C@H]([NH2+]CC(=O)NCC(F)(F)F)c1ccccc1OC(F)(F)F ZINC000160532774 206302640 /nfs/dbraw/zinc/30/26/40/206302640.db2.gz PSVVMDIRHGTVSF-QMMMGPOBSA-N 1 1 344.255 2.914 20 70 EFIDMO c1cc2c(s1)CCC[C@H]2[NH2+]Cc1cn(Cc2cccnc2)nn1 ZINC000160968254 206320564 /nfs/dbraw/zinc/32/05/64/206320564.db2.gz QJTFCFWMTSNMLY-MRXNPFEDSA-N 1 1 325.441 2.950 20 70 EFIDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1csc([C@@H]2CCCO2)n1 ZINC000160973295 206321502 /nfs/dbraw/zinc/32/15/02/206321502.db2.gz LCIOAXLNELWMKD-AWEZNQCLSA-N 1 1 334.445 2.662 20 70 EFIDMO CCC[C@H]1CN(C(=O)Nc2ccc(OC)cc2C)CC[N@H+]1CCOC ZINC000160993580 206321941 /nfs/dbraw/zinc/32/19/41/206321941.db2.gz OFXPSDZYNDSUOD-INIZCTEOSA-N 1 1 349.475 2.968 20 70 EFIDMO CC(C)NC(=O)Nc1ccnn1[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000161036330 206325758 /nfs/dbraw/zinc/32/57/58/206325758.db2.gz JEYJKBZBHDVLPR-MRXNPFEDSA-N 1 1 327.432 2.860 20 70 EFIDMO COCCC1(CNC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)CC1 ZINC000161066241 206326523 /nfs/dbraw/zinc/32/65/23/206326523.db2.gz KSETWHIKOLGPPX-QGZVFWFLSA-N 1 1 331.460 2.501 20 70 EFIDMO COCCC1(CNC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)CC1 ZINC000161066241 206326527 /nfs/dbraw/zinc/32/65/27/206326527.db2.gz KSETWHIKOLGPPX-QGZVFWFLSA-N 1 1 331.460 2.501 20 70 EFIDMO COCCC1(CNC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)CC1 ZINC000161066118 206326582 /nfs/dbraw/zinc/32/65/82/206326582.db2.gz KSETWHIKOLGPPX-KRWDZBQOSA-N 1 1 331.460 2.501 20 70 EFIDMO COCCC1(CNC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)CC1 ZINC000161066118 206326586 /nfs/dbraw/zinc/32/65/86/206326586.db2.gz KSETWHIKOLGPPX-KRWDZBQOSA-N 1 1 331.460 2.501 20 70 EFIDMO CC[NH2+]CC1CCN(C(=O)[C@H]2CCCCN2Cc2ccccc2)CC1 ZINC000161110413 206329239 /nfs/dbraw/zinc/32/92/39/206329239.db2.gz NDHKCDRASFCGSH-HXUWFJFHSA-N 1 1 343.515 2.889 20 70 EFIDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cccc3[nH]c(=O)oc32)c1 ZINC000160595705 206304883 /nfs/dbraw/zinc/30/48/83/206304883.db2.gz HJBLLJZVUOKVLB-UHFFFAOYSA-N 1 1 339.395 2.503 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)NCCc1ccc(F)cc1 ZINC000161197172 206334222 /nfs/dbraw/zinc/33/42/22/206334222.db2.gz RMPACKNDTZZLMU-OAHLLOKOSA-N 1 1 329.419 2.790 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)NCCc1ccc(F)cc1 ZINC000161197172 206334225 /nfs/dbraw/zinc/33/42/25/206334225.db2.gz RMPACKNDTZZLMU-OAHLLOKOSA-N 1 1 329.419 2.790 20 70 EFIDMO CCn1cc([C@@H](C)NCc2ccccc2C[NH+]2CCC(O)CC2)cn1 ZINC000161197585 206335087 /nfs/dbraw/zinc/33/50/87/206335087.db2.gz ZEBMJRGOXYYJKX-MRXNPFEDSA-N 1 1 342.487 2.711 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](C)[C@@H](C)C3(C)CC3)nc(N)c21 ZINC000161495044 206351176 /nfs/dbraw/zinc/35/11/76/206351176.db2.gz BWRQVPGZBSCMBZ-NSHDSACASA-N 1 1 346.431 2.911 20 70 EFIDMO COc1cc(F)c(C(=O)NCCC[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000161499413 206353579 /nfs/dbraw/zinc/35/35/79/206353579.db2.gz ZKIHJKWOMJJNAS-ZDUSSCGKSA-N 1 1 338.423 2.837 20 70 EFIDMO CCCn1ccc2ccc(NC(=O)N[C@@H](C)[C@@H]3C[N@H+](C)CCO3)cc21 ZINC000159941579 544800415 /nfs/dbraw/zinc/80/04/15/544800415.db2.gz AFENVXOQLOVVAQ-KSSFIOAISA-N 1 1 344.459 2.892 20 70 EFIDMO CCCn1ccc2ccc(NC(=O)N[C@@H](C)[C@@H]3C[N@@H+](C)CCO3)cc21 ZINC000159941579 544800419 /nfs/dbraw/zinc/80/04/19/544800419.db2.gz AFENVXOQLOVVAQ-KSSFIOAISA-N 1 1 344.459 2.892 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@H](OC)c2ccccc2Cl)CC1 ZINC000160001203 544800916 /nfs/dbraw/zinc/80/09/16/544800916.db2.gz ZKUOSOYSQSMSAY-INIZCTEOSA-N 1 1 339.867 2.765 20 70 EFIDMO C[C@H](NC(=O)Nc1ccccc1CC(F)(F)F)[C@H]1C[N@H+](C)CCO1 ZINC000160116850 544802839 /nfs/dbraw/zinc/80/28/39/544802839.db2.gz OMTFPKNKTLGTSC-SMDDNHRTSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@H](NC(=O)Nc1ccccc1CC(F)(F)F)[C@H]1C[N@@H+](C)CCO1 ZINC000160116850 544802844 /nfs/dbraw/zinc/80/28/44/544802844.db2.gz OMTFPKNKTLGTSC-SMDDNHRTSA-N 1 1 345.365 2.632 20 70 EFIDMO Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000160299609 544803961 /nfs/dbraw/zinc/80/39/61/544803961.db2.gz QFBULCQQAONOKF-BXUZGUMPSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000160299609 544803963 /nfs/dbraw/zinc/80/39/63/544803963.db2.gz QFBULCQQAONOKF-BXUZGUMPSA-N 1 1 345.365 2.854 20 70 EFIDMO CCOc1cc(Cl)ccc1NC(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000160572923 544807603 /nfs/dbraw/zinc/80/76/03/544807603.db2.gz NQFJSKGBUNCXGL-XHDPSFHLSA-N 1 1 341.839 2.579 20 70 EFIDMO CCOc1cc(Cl)ccc1NC(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000160572923 544807606 /nfs/dbraw/zinc/80/76/06/544807606.db2.gz NQFJSKGBUNCXGL-XHDPSFHLSA-N 1 1 341.839 2.579 20 70 EFIDMO C[C@H](CC(=O)NCC[N@@H+](C)Cc1ccc(F)cc1)c1ccncc1 ZINC000161255981 544810842 /nfs/dbraw/zinc/81/08/42/544810842.db2.gz YJXFXIQSZAGXPF-OAHLLOKOSA-N 1 1 329.419 2.963 20 70 EFIDMO CS(=O)(=O)CCCC[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000161242845 544810961 /nfs/dbraw/zinc/81/09/61/544810961.db2.gz WBIQTDZBBDNHKV-AWEZNQCLSA-N 1 1 331.503 2.554 20 70 EFIDMO O=C1[C@H]([N@H+]2CC[C@]3(CCOC3)C2)CCN1c1ccc(Cl)c(F)c1 ZINC000161026642 275030299 /nfs/dbraw/zinc/03/02/99/275030299.db2.gz VDJIMRHNYCXFGS-WBVHZDCISA-N 1 1 338.810 2.697 20 70 EFIDMO C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000159576223 290078880 /nfs/dbraw/zinc/07/88/80/290078880.db2.gz FGVARNIVRPNSOD-KBPBESRZSA-N 1 1 348.443 2.758 20 70 EFIDMO Cc1cccc(O[C@H](C)C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000160321832 310697663 /nfs/dbraw/zinc/69/76/63/310697663.db2.gz JNIJAYMZOOXQRU-QGZVFWFLSA-N 1 1 348.487 2.579 20 70 EFIDMO COc1cc(OC)cc(N2CC[C@H]([NH2+][C@H](C)c3ccoc3)C2=O)c1 ZINC000160678436 310701471 /nfs/dbraw/zinc/70/14/71/310701471.db2.gz PJHOMZMIWAZLOX-PXAZEXFGSA-N 1 1 330.384 2.753 20 70 EFIDMO COc1cccc(N2CC[NH+](Cc3cnc4c(C)cccn34)CC2)c1 ZINC000160690137 310701939 /nfs/dbraw/zinc/70/19/39/310701939.db2.gz OIWXTUGIFREDGA-UHFFFAOYSA-N 1 1 336.439 2.974 20 70 EFIDMO CCC[N@H+](Cc1c[nH]nc1-c1cccs1)[C@H]1CCS(=O)(=O)C1 ZINC000161086500 473205671 /nfs/dbraw/zinc/20/56/71/473205671.db2.gz MXMYCKHLJLSZJA-ZDUSSCGKSA-N 1 1 339.486 2.537 20 70 EFIDMO CCC[N@@H+](Cc1c[nH]nc1-c1cccs1)[C@H]1CCS(=O)(=O)C1 ZINC000161086500 473205675 /nfs/dbraw/zinc/20/56/75/473205675.db2.gz MXMYCKHLJLSZJA-ZDUSSCGKSA-N 1 1 339.486 2.537 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+]3CCCC(C)(C)C3)nc(N)c21 ZINC000161091202 473206642 /nfs/dbraw/zinc/20/66/42/473206642.db2.gz LNVTXZLOHVRRRV-UHFFFAOYSA-N 1 1 346.431 2.912 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+]3CCCC(C)(C)C3)nc(N)c21 ZINC000161091202 473206646 /nfs/dbraw/zinc/20/66/46/473206646.db2.gz LNVTXZLOHVRRRV-UHFFFAOYSA-N 1 1 346.431 2.912 20 70 EFIDMO CCCOc1cccc(C[N@H+](CCC)[C@H]2CCS(=O)(=O)C2)c1 ZINC000161104516 473207248 /nfs/dbraw/zinc/20/72/48/473207248.db2.gz KWEAUCGYBRWJGA-INIZCTEOSA-N 1 1 325.474 2.875 20 70 EFIDMO CCCOc1cccc(C[N@@H+](CCC)[C@H]2CCS(=O)(=O)C2)c1 ZINC000161104516 473207253 /nfs/dbraw/zinc/20/72/53/473207253.db2.gz KWEAUCGYBRWJGA-INIZCTEOSA-N 1 1 325.474 2.875 20 70 EFIDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)NCc1ccccc1CO ZINC000161137172 473211217 /nfs/dbraw/zinc/21/12/17/473211217.db2.gz RBVBEBPDHVZRRO-INIZCTEOSA-N 1 1 333.476 2.633 20 70 EFIDMO Cn1ccc(C[N@H+](C)CC(=O)Nc2ccccc2Br)c1 ZINC000161171399 473213734 /nfs/dbraw/zinc/21/37/34/473213734.db2.gz IWEVSEPPQOHJKN-UHFFFAOYSA-N 1 1 336.233 2.858 20 70 EFIDMO Cn1ccc(C[N@@H+](C)CC(=O)Nc2ccccc2Br)c1 ZINC000161171399 473213738 /nfs/dbraw/zinc/21/37/38/473213738.db2.gz IWEVSEPPQOHJKN-UHFFFAOYSA-N 1 1 336.233 2.858 20 70 EFIDMO COCCOc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1OC ZINC000161195516 473216201 /nfs/dbraw/zinc/21/62/01/473216201.db2.gz KCEYQWDOPKKCCD-YQQAZPJKSA-N 1 1 336.476 2.854 20 70 EFIDMO COCCOc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000161195516 473216207 /nfs/dbraw/zinc/21/62/07/473216207.db2.gz KCEYQWDOPKKCCD-YQQAZPJKSA-N 1 1 336.476 2.854 20 70 EFIDMO C[C@]1(O)CCCN(C(=O)NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)C1 ZINC000161230763 473218621 /nfs/dbraw/zinc/21/86/21/473218621.db2.gz MPSDXRHEWYVOOH-ICSRJNTNSA-N 1 1 345.487 2.598 20 70 EFIDMO CC[C@@H](NC(=O)N1CCC([N@@H+](C)CCO)CC1)c1ccc(C)cc1 ZINC000161282470 473223405 /nfs/dbraw/zinc/22/34/05/473223405.db2.gz MQYZHKXUNKRGDJ-GOSISDBHSA-N 1 1 333.476 2.544 20 70 EFIDMO CC[C@H](NC(=O)N1CCC([N@@H+](C)CCO)CC1)c1ccc(C)cc1 ZINC000161282365 473223521 /nfs/dbraw/zinc/22/35/21/473223521.db2.gz MQYZHKXUNKRGDJ-SFHVURJKSA-N 1 1 333.476 2.544 20 70 EFIDMO C[N@H+]1CC[C@H](CNC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)C1 ZINC000161310088 473225608 /nfs/dbraw/zinc/22/56/08/473225608.db2.gz CVXVTGHHJARSKH-MRXNPFEDSA-N 1 1 345.487 2.672 20 70 EFIDMO CC[C@@H]1CCCCN1C(=O)[C@H](C)[N@H+]1CCC[C@H](c2nncn2CC)C1 ZINC000161331107 473227642 /nfs/dbraw/zinc/22/76/42/473227642.db2.gz QTILXTKOYRBCHE-YESZJQIVSA-N 1 1 347.507 2.657 20 70 EFIDMO COc1ccc(C[N@H+]2CCC[C@@H](c3nnc4n3CCC4)C2)cc1F ZINC000161405981 473232635 /nfs/dbraw/zinc/23/26/35/473232635.db2.gz YKSMAGKZQZBSTN-CQSZACIVSA-N 1 1 330.407 2.752 20 70 EFIDMO C[N@@H+](CCCNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)C1CCCCC1 ZINC000161490464 473240013 /nfs/dbraw/zinc/24/00/13/473240013.db2.gz JMRCAPSOGKERFZ-KSZLIROESA-N 1 1 349.519 2.898 20 70 EFIDMO O=C(Nc1ccc(Cl)cn1)[C@@H]1CCC[N@@H+](CCOCC2CC2)C1 ZINC000159382141 473023315 /nfs/dbraw/zinc/02/33/15/473023315.db2.gz JEHZREWMGASVPW-CQSZACIVSA-N 1 1 337.851 2.812 20 70 EFIDMO CS(=O)(=O)NCC[C@@H]1CCCC[N@H+]1Cc1coc2ccccc12 ZINC000159392437 473025031 /nfs/dbraw/zinc/02/50/31/473025031.db2.gz XDDHZMNKTBTHRV-HNNXBMFYSA-N 1 1 336.457 2.727 20 70 EFIDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)NC[C@@H]1CCOc2ccccc21 ZINC000159466895 473029867 /nfs/dbraw/zinc/02/98/67/473029867.db2.gz ITGLSNKVAVZUKK-RDJZCZTQSA-N 1 1 331.460 2.534 20 70 EFIDMO CS(=O)(=O)NCC[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)c(F)c1 ZINC000159461400 473030219 /nfs/dbraw/zinc/03/02/19/473030219.db2.gz KRBOTMJZLSRIHS-CYBMUJFWSA-N 1 1 348.871 2.773 20 70 EFIDMO CS(=O)(=O)NCC[C@H]1CCCC[N@H+]1Cc1ccc(Cl)c(F)c1 ZINC000159461400 473030221 /nfs/dbraw/zinc/03/02/21/473030221.db2.gz KRBOTMJZLSRIHS-CYBMUJFWSA-N 1 1 348.871 2.773 20 70 EFIDMO O=C(CC[N@H+]1CCO[C@]2(CCc3ccccc32)C1)N1CCCCC1 ZINC000159567182 473039964 /nfs/dbraw/zinc/03/99/64/473039964.db2.gz FJJKBUCHYIZBPL-HXUWFJFHSA-N 1 1 328.456 2.563 20 70 EFIDMO CN(C)C(=O)c1cccc(NC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c1 ZINC000159578784 473042017 /nfs/dbraw/zinc/04/20/17/473042017.db2.gz SEEVFHYVPSTGEY-YOEHRIQHSA-N 1 1 329.444 2.591 20 70 EFIDMO CC[N@@H+](CCOc1ccc(Br)cc1)[C@H](C)C(=O)N(C)C ZINC000159600230 473042474 /nfs/dbraw/zinc/04/24/74/473042474.db2.gz WAUFWUMHYCSNKP-GFCCVEGCSA-N 1 1 343.265 2.627 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](C)c2ccc(OC)cc2OC)CC1 ZINC000159613161 473044306 /nfs/dbraw/zinc/04/43/06/473044306.db2.gz XVMNPQHRCPADNR-AWEZNQCLSA-N 1 1 335.448 2.502 20 70 EFIDMO COC(=O)CC[N@@H+](CCC(=O)c1ccc(C)cc1)C[C@@H]1CCCO1 ZINC000159699908 473052949 /nfs/dbraw/zinc/05/29/49/473052949.db2.gz NQPPCCNDRXEPPD-KRWDZBQOSA-N 1 1 333.428 2.612 20 70 EFIDMO C[NH+]1CCN(CCCCNC(=O)NCC2CCC(C)(C)CC2)CC1 ZINC000159712688 473053384 /nfs/dbraw/zinc/05/33/84/473053384.db2.gz VIIUYIKSHQDREF-UHFFFAOYSA-N 1 1 338.540 2.530 20 70 EFIDMO COc1ccc(Br)c(C[NH2+][C@H](C)C(=O)NC(C)(C)C)c1 ZINC000159711728 473054231 /nfs/dbraw/zinc/05/42/31/473054231.db2.gz GWUWNEQZOXBVBT-SNVBAGLBSA-N 1 1 343.265 2.851 20 70 EFIDMO CC(C)Oc1cc(CNC(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)ccn1 ZINC000159748261 473057724 /nfs/dbraw/zinc/05/77/24/473057724.db2.gz KLYGNWIAZNRUGD-HZPDHXFCSA-N 1 1 348.491 2.788 20 70 EFIDMO CSCCCCC(=O)NC[C@@H](C)[NH+]1CCN(c2ccccc2)CC1 ZINC000159844442 473066014 /nfs/dbraw/zinc/06/60/14/473066014.db2.gz JNUQFCYRVLWWCQ-QGZVFWFLSA-N 1 1 349.544 2.847 20 70 EFIDMO CCCCOc1cccc(CNC(=O)C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c1 ZINC000159859889 473067069 /nfs/dbraw/zinc/06/70/69/473067069.db2.gz YRHOPIFBEAIQKZ-MJGOQNOKSA-N 1 1 348.487 2.575 20 70 EFIDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)N(C)C[C@@H]2CCC[C@@H]2O)C1 ZINC000159902497 473071150 /nfs/dbraw/zinc/07/11/50/473071150.db2.gz UYVPNRVIMHGPNY-YVSFHVDLSA-N 1 1 339.524 2.545 20 70 EFIDMO Cc1cnccc1CCNC(=O)NCC(C)(C)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000159902085 473071352 /nfs/dbraw/zinc/07/13/52/473071352.db2.gz MRKZEGSNQJMVRB-IYBDPMFKSA-N 1 1 346.519 2.988 20 70 EFIDMO CCCC1(CNC(=O)NC[C@H](C(C)C)N2CC[NH+](C)CC2)CCC1 ZINC000159909545 473071688 /nfs/dbraw/zinc/07/16/88/473071688.db2.gz CZFLIZQMEOJAKF-QGZVFWFLSA-N 1 1 338.540 2.528 20 70 EFIDMO Cc1noc(Cl)c1CC(=O)NC[C@H](C)[N@H+]1CCc2ccccc2C1 ZINC000159907398 473072245 /nfs/dbraw/zinc/07/22/45/473072245.db2.gz HREUFYSMXWJPKM-LBPRGKRZSA-N 1 1 347.846 2.742 20 70 EFIDMO Cc1ccccc1CCC(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159929436 473072773 /nfs/dbraw/zinc/07/27/73/473072773.db2.gz IRNAMESLBIRYPZ-UHFFFAOYSA-N 1 1 332.488 2.744 20 70 EFIDMO Cn1cc(C[C@H]2CC[N@@H+](CC3CCN(C(=O)C(C)(C)C)CC3)C2)cn1 ZINC000159959598 473075285 /nfs/dbraw/zinc/07/52/85/473075285.db2.gz MUTARVGVJPQRHB-QGZVFWFLSA-N 1 1 346.519 2.569 20 70 EFIDMO CCCCCN(CCO)C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159952739 473075609 /nfs/dbraw/zinc/07/56/09/473075609.db2.gz AHLNDFIVXSRIAF-PKOBYXMFSA-N 1 1 347.503 2.701 20 70 EFIDMO C[C@H](CNC(=O)NC1(c2ccccc2)CCCC1)C[NH+]1CCOCC1 ZINC000159954058 473075963 /nfs/dbraw/zinc/07/59/63/473075963.db2.gz HPSWXGMWHHSSSJ-QGZVFWFLSA-N 1 1 345.487 2.723 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCC1(O)CCCCC1 ZINC000159963525 473076418 /nfs/dbraw/zinc/07/64/18/473076418.db2.gz HJRDTQRFPZIWRZ-WMZOPIPTSA-N 1 1 345.487 2.501 20 70 EFIDMO CCN1CC[C@H]([NH2+]CCC2CCN(CC(F)(F)F)CC2)[C@H](C)C1 ZINC000159976755 473077865 /nfs/dbraw/zinc/07/78/65/473077865.db2.gz IJXFWYHNEMOEOM-ZBFHGGJFSA-N 1 1 335.458 2.971 20 70 EFIDMO C[C@@H]1CN(C)[C@@H](C)C[C@@H]1[NH2+]CCC1CCN(CC(F)(F)F)CC1 ZINC000159990203 473079119 /nfs/dbraw/zinc/07/91/19/473079119.db2.gz TXYFQSJIZVCKSH-YCPHGPKFSA-N 1 1 335.458 2.969 20 70 EFIDMO CCNC(=O)C[N@H+](CCCO)C(c1ccccc1)c1ccccc1 ZINC000160051826 473083334 /nfs/dbraw/zinc/08/33/34/473083334.db2.gz CEOWJQRIUZXJMU-UHFFFAOYSA-N 1 1 326.440 2.597 20 70 EFIDMO CCNC(=O)C[N@@H+](CCCO)C(c1ccccc1)c1ccccc1 ZINC000160051826 473083343 /nfs/dbraw/zinc/08/33/43/473083343.db2.gz CEOWJQRIUZXJMU-UHFFFAOYSA-N 1 1 326.440 2.597 20 70 EFIDMO COc1ccc(Br)cc1C(=O)N1CC[NH+](C(C)C)CC1 ZINC000160052680 473084240 /nfs/dbraw/zinc/08/42/40/473084240.db2.gz ZZQOKOWLDWFLAX-UHFFFAOYSA-N 1 1 341.249 2.624 20 70 EFIDMO CC[N@H+]1CCCC[C@H]1CNC(=O)NCC1(CCOC)CCCC1 ZINC000160103247 473086765 /nfs/dbraw/zinc/08/67/65/473086765.db2.gz XDIPZADASVVIAQ-INIZCTEOSA-N 1 1 325.497 2.757 20 70 EFIDMO O=C(Nc1cn[nH]c1)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1 ZINC000160131294 473089644 /nfs/dbraw/zinc/08/96/44/473089644.db2.gz QIIUIZAYWYBDFP-HNNXBMFYSA-N 1 1 338.333 2.803 20 70 EFIDMO C[C@H]1C[C@@H](NC(=O)N(CCCCO)C2CC2)C[N@H+]1Cc1ccccc1 ZINC000160119410 473089823 /nfs/dbraw/zinc/08/98/23/473089823.db2.gz VPWVCSQBJNVQJH-FUHWJXTLSA-N 1 1 345.487 2.596 20 70 EFIDMO CC(C)OC(=O)[C@@H](C)[N@@H+](C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000160178827 473093902 /nfs/dbraw/zinc/09/39/02/473093902.db2.gz BYABAWDRFMVFJN-CQSZACIVSA-N 1 1 326.481 2.543 20 70 EFIDMO CCCCn1ncc(NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1C ZINC000160195676 473095215 /nfs/dbraw/zinc/09/52/15/473095215.db2.gz UURBXKGIGBOSEH-RDJZCZTQSA-N 1 1 333.480 2.940 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1nnnn1-c1ccccc1 ZINC000160233941 473098964 /nfs/dbraw/zinc/09/89/64/473098964.db2.gz YQNYIJWSGNQAOJ-YJBOKZPZSA-N 1 1 334.427 2.595 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1nnnn1-c1ccccc1 ZINC000160233814 473099192 /nfs/dbraw/zinc/09/91/92/473099192.db2.gz YQNYIJWSGNQAOJ-QAPCUYQASA-N 1 1 334.427 2.595 20 70 EFIDMO Cc1cccc(OC[C@@H](O)C[NH+]2CCN(c3cccs3)CC2)c1 ZINC000160312224 473106285 /nfs/dbraw/zinc/10/62/85/473106285.db2.gz RTYHAQDLDHSZTA-INIZCTEOSA-N 1 1 332.469 2.618 20 70 EFIDMO Cc1cccc2[nH]c(CNC(=O)CCn3cc[nH+]c3C(C)C)nc21 ZINC000160315116 473107509 /nfs/dbraw/zinc/10/75/09/473107509.db2.gz NNAJZGSJUXKIGJ-UHFFFAOYSA-N 1 1 325.416 2.898 20 70 EFIDMO C[C@@H](C(=O)N(C)c1ccc2c(c1)OCO2)[N@@H+]1CCc2ccccc2C1 ZINC000160337544 473109478 /nfs/dbraw/zinc/10/94/78/473109478.db2.gz CEIHSCVZDISCKI-AWEZNQCLSA-N 1 1 338.407 2.825 20 70 EFIDMO C[C@@H](C(=O)N(C)c1ccc2c(c1)OCO2)[N@H+]1CCc2ccccc2C1 ZINC000160337544 473109484 /nfs/dbraw/zinc/10/94/84/473109484.db2.gz CEIHSCVZDISCKI-AWEZNQCLSA-N 1 1 338.407 2.825 20 70 EFIDMO COc1cc(C[N@@H+]2CCC[C@H]2C(N)=O)ccc1OCc1cccs1 ZINC000160350908 473111744 /nfs/dbraw/zinc/11/17/44/473111744.db2.gz XBXKSTUBZPAMKZ-HNNXBMFYSA-N 1 1 346.452 2.785 20 70 EFIDMO COc1cc(C[N@H+]2CCC[C@H]2C(N)=O)ccc1OCc1cccs1 ZINC000160350908 473111752 /nfs/dbraw/zinc/11/17/52/473111752.db2.gz XBXKSTUBZPAMKZ-HNNXBMFYSA-N 1 1 346.452 2.785 20 70 EFIDMO CCN(C(=O)NCC(C)(C)OC)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160431495 473123929 /nfs/dbraw/zinc/12/39/29/473123929.db2.gz HEZUAEJYHKGLIC-KRWDZBQOSA-N 1 1 333.476 2.717 20 70 EFIDMO C[C@@H](CN1CCOCC1)[N@@H+](CCOCC1CC1)Cc1ccccc1 ZINC000160457585 473128346 /nfs/dbraw/zinc/12/83/46/473128346.db2.gz XGMWBBOUDTUSTM-SFHVURJKSA-N 1 1 332.488 2.636 20 70 EFIDMO Cc1nnc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)o1 ZINC000160584478 473146493 /nfs/dbraw/zinc/14/64/93/473146493.db2.gz IDXBLWZLMVYGTR-PBWFPOADSA-N 1 1 336.436 2.740 20 70 EFIDMO Cc1nnc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)o1 ZINC000160584478 473146502 /nfs/dbraw/zinc/14/65/02/473146502.db2.gz IDXBLWZLMVYGTR-PBWFPOADSA-N 1 1 336.436 2.740 20 70 EFIDMO CC(C)CC1(C(=O)NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)CCC1 ZINC000160614338 473152339 /nfs/dbraw/zinc/15/23/39/473152339.db2.gz YZPRTYIWFYXPNB-MOPGFXCFSA-N 1 1 344.499 2.954 20 70 EFIDMO CN(C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)[C@H]1CCc2ccccc2C1 ZINC000160627945 473153918 /nfs/dbraw/zinc/15/39/18/473153918.db2.gz JAOHJWVIMJIGSE-OALUTQOASA-N 1 1 327.472 2.670 20 70 EFIDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N(Cc1cccc(F)c1)C1CC1 ZINC000160636461 473155706 /nfs/dbraw/zinc/15/57/06/473155706.db2.gz HDTZWCOVZFBWOZ-KRWDZBQOSA-N 1 1 331.435 2.984 20 70 EFIDMO Cc1cccc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c1Br ZINC000160665547 473157421 /nfs/dbraw/zinc/15/74/21/473157421.db2.gz POVBGEMDJJFFHR-LBPRGKRZSA-N 1 1 337.261 2.972 20 70 EFIDMO O=C1CC[C@@H]2C[N@H+](Cc3ccc(F)c(Br)c3)CC[C@@H]2N1 ZINC000160739387 473167928 /nfs/dbraw/zinc/16/79/28/473167928.db2.gz QDRPUENNUZQMOM-RISCZKNCSA-N 1 1 341.224 2.689 20 70 EFIDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(F)c(Br)c3)CC[C@@H]2N1 ZINC000160739387 473167934 /nfs/dbraw/zinc/16/79/34/473167934.db2.gz QDRPUENNUZQMOM-RISCZKNCSA-N 1 1 341.224 2.689 20 70 EFIDMO CCCC[N@@H+](Cc1cccc(-n2cccn2)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160755365 473171108 /nfs/dbraw/zinc/17/11/08/473171108.db2.gz VXLKCEGUUQQOLM-GOSISDBHSA-N 1 1 347.484 2.662 20 70 EFIDMO COCC[N@@H+](C)CC[C@@H](NC(=O)NC1(C)CCC1)c1ccccc1 ZINC000160772152 473174073 /nfs/dbraw/zinc/17/40/73/473174073.db2.gz BCKRSYKZJMADPO-QGZVFWFLSA-N 1 1 333.476 2.938 20 70 EFIDMO Cc1ccc2c(c1)[C@H](NC(=O)NCCC[N@@H+]1CCCC[C@@H]1C)CO2 ZINC000160791580 473174530 /nfs/dbraw/zinc/17/45/30/473174530.db2.gz BIPKOCDZJFSHTJ-DOTOQJQBSA-N 1 1 331.460 2.992 20 70 EFIDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCCC[C@H]1c1ncc[nH]1 ZINC000160814300 473178815 /nfs/dbraw/zinc/17/88/15/473178815.db2.gz KSGXSHUYDDNAKK-HOCLYGCPSA-N 1 1 331.464 2.663 20 70 EFIDMO Cc1cnn([C@@H]2CCCN(C(=O)N[C@@H]3CC[N@H+](C4CCCC4)C3)C2)c1 ZINC000160832427 473181322 /nfs/dbraw/zinc/18/13/22/473181322.db2.gz QRZGPCUOEDBEGC-SJLPKXTDSA-N 1 1 345.491 2.555 20 70 EFIDMO CCCC(O)(CCC)CNC(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000160857136 473183294 /nfs/dbraw/zinc/18/32/94/473183294.db2.gz IVFUVNSXZHJIJK-OAHLLOKOSA-N 1 1 325.497 2.634 20 70 EFIDMO CC[C@H]([NH2+][C@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(F)cc1F ZINC000160937019 473192540 /nfs/dbraw/zinc/19/25/40/473192540.db2.gz QHJOGQHNMAWDRN-HOTGVXAUSA-N 1 1 334.370 2.545 20 70 EFIDMO COc1ccc(CNC(=O)C[NH2+][C@@H](C)c2ccc(OC)cc2F)cc1 ZINC000160960363 473194226 /nfs/dbraw/zinc/19/42/26/473194226.db2.gz PHNDOJVXZSREJX-ZDUSSCGKSA-N 1 1 346.402 2.810 20 70 EFIDMO Cc1ccccc1CNC(=O)[C@H](C)[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000161030762 473200845 /nfs/dbraw/zinc/20/08/45/473200845.db2.gz MABJZLDFTCNMKY-ILZDJORESA-N 1 1 330.472 2.627 20 70 EFIDMO COc1ccccc1SCC(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000161052681 473202582 /nfs/dbraw/zinc/20/25/82/473202582.db2.gz UCGLKXPPOQYJEY-ZDUSSCGKSA-N 1 1 334.441 2.799 20 70 EFIDMO CCCCC[N@@H+](CC(=O)N1CCN(C)CC1)Cc1ccc(F)cc1 ZINC000216721447 520155352 /nfs/dbraw/zinc/15/53/52/520155352.db2.gz FVGZMPAMVYOWAP-UHFFFAOYSA-N 1 1 335.467 2.592 20 70 EFIDMO CCc1c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cnn1CC(C)C ZINC000159726785 523687744 /nfs/dbraw/zinc/68/77/44/523687744.db2.gz FPFJAFXHFASCEX-CRAIPNDOSA-N 1 1 332.492 2.658 20 70 EFIDMO Cc1cccc([C@@H]2CCC[N@H+]2CC(=O)NCCOCCC(C)C)n1 ZINC000160288567 524851815 /nfs/dbraw/zinc/85/18/15/524851815.db2.gz DOZHMMLWKLGBBB-SFHVURJKSA-N 1 1 333.476 2.706 20 70 EFIDMO Cc1cccc([C@@H]2CCC[N@@H+]2CC(=O)NCCOCCC(C)C)n1 ZINC000160288567 524851819 /nfs/dbraw/zinc/85/18/19/524851819.db2.gz DOZHMMLWKLGBBB-SFHVURJKSA-N 1 1 333.476 2.706 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N(C)CCc1ccncc1 ZINC000161021970 527967339 /nfs/dbraw/zinc/96/73/39/527967339.db2.gz OCTLTNQMDVGCFW-SFHVURJKSA-N 1 1 332.492 2.776 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N(CCO)Cc1ccccc1 ZINC000160938520 527968431 /nfs/dbraw/zinc/96/84/31/527968431.db2.gz VRHMJNYBGCYVPC-IBGZPJMESA-N 1 1 347.503 2.701 20 70 EFIDMO CCN(CCCNC(=O)N1CCC[N@@H+](CC)CC1)c1ccccc1 ZINC000159557182 528453487 /nfs/dbraw/zinc/45/34/87/528453487.db2.gz MUWYOLCENQBDOU-UHFFFAOYSA-N 1 1 332.492 2.640 20 70 EFIDMO CCC(CC)(CCO)CNC(=O)NC[C@@H]1CCCC[N@H+]1CC(C)C ZINC000160934773 528641407 /nfs/dbraw/zinc/64/14/07/528641407.db2.gz QUISDPFJWWYAJH-KRWDZBQOSA-N 1 1 341.540 2.985 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)CC1 ZINC000160015173 529030031 /nfs/dbraw/zinc/03/00/31/529030031.db2.gz BBYYEQSBWUGZPK-MOPGFXCFSA-N 1 1 345.487 2.862 20 70 EFIDMO CN(C)c1cccc(C[N@H+](C)CC(=O)NCc2ccccc2F)c1 ZINC000159799651 529789204 /nfs/dbraw/zinc/78/92/04/529789204.db2.gz MCPGEIPWCNOLDF-UHFFFAOYSA-N 1 1 329.419 2.640 20 70 EFIDMO CN(C)c1cccc(C[N@@H+](C)CC(=O)NCc2ccccc2F)c1 ZINC000159799651 529789206 /nfs/dbraw/zinc/78/92/06/529789206.db2.gz MCPGEIPWCNOLDF-UHFFFAOYSA-N 1 1 329.419 2.640 20 70 EFIDMO C[N@H+](CC(=O)Nc1ccccc1C(F)(F)F)C[C@H]1CCC[C@@H]1O ZINC000159775789 529839093 /nfs/dbraw/zinc/83/90/93/529839093.db2.gz HOVNSEFCBYCHMB-RISCZKNCSA-N 1 1 330.350 2.737 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)C(F)(F)c1ccccc1 ZINC000159943095 529845791 /nfs/dbraw/zinc/84/57/91/529845791.db2.gz PAVKGCSZYUWLFB-UHFFFAOYSA-N 1 1 340.414 2.595 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1 ZINC000160116857 529846216 /nfs/dbraw/zinc/84/62/16/529846216.db2.gz FYTWAOZAYXJUFK-QZTJIDSGSA-N 1 1 348.462 2.746 20 70 EFIDMO COCC[N@H+](CC(=O)c1c[nH]c2ccc(C(=O)OC)cc21)CC(C)C ZINC000160581405 239054340 /nfs/dbraw/zinc/05/43/40/239054340.db2.gz QOFUWKAYWPPOKS-UHFFFAOYSA-N 1 1 346.427 2.742 20 70 EFIDMO C[C@H](C(=O)Nc1ccc(N2CCCC2=O)cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000218674743 241337403 /nfs/dbraw/zinc/33/74/03/241337403.db2.gz BOFMBBPXGKGGPP-HUUCEWRRSA-N 1 1 329.444 2.872 20 70 EFIDMO COc1cc2[nH+]c(N[C@@H]3CCO[C@@H](C4CC4)C3)nc(N)c2cc1OC ZINC000160277137 533177672 /nfs/dbraw/zinc/17/76/72/533177672.db2.gz SFYAYDKDIPSBDP-BXUZGUMPSA-N 1 1 344.415 2.599 20 70 EFIDMO CS(=O)(=O)NCC[C@@H]1CCCC[N@H+]1Cc1ccc2ncccc2c1 ZINC000159408512 533401060 /nfs/dbraw/zinc/40/10/60/533401060.db2.gz WYNIQKMOFRATFR-KRWDZBQOSA-N 1 1 347.484 2.529 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)N(C)C[C@@H]2CCCOC2)C[N@H+]1Cc1ccccc1 ZINC000160262107 533607403 /nfs/dbraw/zinc/60/74/03/533607403.db2.gz VVIAAYQKWIGPSC-NZSAHSFTSA-N 1 1 345.487 2.717 20 70 EFIDMO COc1cc(C)cc(CNC(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)c1 ZINC000160246697 533635413 /nfs/dbraw/zinc/63/54/13/533635413.db2.gz ZXDMFNQFGCYVPA-INIZCTEOSA-N 1 1 333.476 2.781 20 70 EFIDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc2[nH]cnc21 ZINC000159400924 225210140 /nfs/dbraw/zinc/21/01/40/225210140.db2.gz XWOLSYWLBXWRCS-QGZVFWFLSA-N 1 1 348.450 2.857 20 70 EFIDMO O=C(NC[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc2nc[nH]c21 ZINC000159400924 225210143 /nfs/dbraw/zinc/21/01/43/225210143.db2.gz XWOLSYWLBXWRCS-QGZVFWFLSA-N 1 1 348.450 2.857 20 70 EFIDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc2nc[nH]c21 ZINC000159400924 225210147 /nfs/dbraw/zinc/21/01/47/225210147.db2.gz XWOLSYWLBXWRCS-QGZVFWFLSA-N 1 1 348.450 2.857 20 70 EFIDMO O=C1NCCN1C1CC[NH+](Cc2cc(Cl)ccc2Cl)CC1 ZINC000159418634 225213679 /nfs/dbraw/zinc/21/36/79/225213679.db2.gz TZSYOGFBMIVQFO-UHFFFAOYSA-N 1 1 328.243 2.983 20 70 EFIDMO Cc1cc(=O)oc2cc(OCC[N@H+](C)C[C@H]3CCC[C@@H]3O)ccc12 ZINC000159743819 225269539 /nfs/dbraw/zinc/26/95/39/225269539.db2.gz ABSNCZPKPMNWOI-PBHICJAKSA-N 1 1 331.412 2.573 20 70 EFIDMO Cn1ccnc1COc1ccc(CSCC[NH+]2CCOCC2)cc1 ZINC000159861551 225292043 /nfs/dbraw/zinc/29/20/43/225292043.db2.gz SKPUGUKSIMQQFF-UHFFFAOYSA-N 1 1 347.484 2.565 20 70 EFIDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1ccnc(-n2cccn2)c1 ZINC000159936044 225306287 /nfs/dbraw/zinc/30/62/87/225306287.db2.gz HOUUMELLSMYBQK-MRXNPFEDSA-N 1 1 341.459 2.652 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ncnc2nc(N)ccc21 ZINC000160247687 225372022 /nfs/dbraw/zinc/37/20/22/225372022.db2.gz SFBMVIDUVGEBNT-CJNGLKHVSA-N 1 1 334.427 2.539 20 70 EFIDMO C[C@H]1C[C@H](NC(=O)N(C)Cc2ccncc2)C[N@H+]1Cc1ccccc1 ZINC000160347942 225394250 /nfs/dbraw/zinc/39/42/50/225394250.db2.gz GWYVIBSRGLDIOO-LPHOPBHVSA-N 1 1 338.455 2.886 20 70 EFIDMO C[C@H](O)C[C@@H](CNC(=O)[C@@H](c1ccccc1)[NH+](C)C)c1ccccc1 ZINC000160071478 225332378 /nfs/dbraw/zinc/33/23/78/225332378.db2.gz YQICRYUEDRALTE-FFZOFVMBSA-N 1 1 340.467 2.960 20 70 EFIDMO Cc1cccc([C@H](C)NC(=O)NC[C@H](C)C[NH+]2CCOCC2)c1C ZINC000160169532 225353856 /nfs/dbraw/zinc/35/38/56/225353856.db2.gz JEUOWOPZYSDHPL-YOEHRIQHSA-N 1 1 333.476 2.632 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc(C(=O)N(C)C)cn1 ZINC000160220011 225363256 /nfs/dbraw/zinc/36/32/56/225363256.db2.gz PFGQQSSKBYWSOM-YJBOKZPZSA-N 1 1 338.455 2.716 20 70 EFIDMO COCCc1nsc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000160217375 225363518 /nfs/dbraw/zinc/36/35/18/225363518.db2.gz WZWWFPYUGYNVMK-ZFWWWQNUSA-N 1 1 332.473 2.659 20 70 EFIDMO Cc1nccn1-c1cncc(N[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000160222838 225364988 /nfs/dbraw/zinc/36/49/88/225364988.db2.gz BMFOIQVCIPQHTL-MAUKXSAKSA-N 1 1 348.454 2.903 20 70 EFIDMO CCCn1ccc2ccc(NC(=O)N[C@@H](C)[C@H]3C[N@H+](C)CCO3)cc21 ZINC000159941850 544800201 /nfs/dbraw/zinc/80/02/01/544800201.db2.gz AFENVXOQLOVVAQ-KBXCAEBGSA-N 1 1 344.459 2.892 20 70 EFIDMO CCCn1ccc2ccc(NC(=O)N[C@@H](C)[C@H]3C[N@@H+](C)CCO3)cc21 ZINC000159941850 544800205 /nfs/dbraw/zinc/80/02/05/544800205.db2.gz AFENVXOQLOVVAQ-KBXCAEBGSA-N 1 1 344.459 2.892 20 70 EFIDMO CCCn1ccc2ccc(NC(=O)N[C@H](C)[C@@H]3C[N@H+](C)CCO3)cc21 ZINC000159941754 544800760 /nfs/dbraw/zinc/80/07/60/544800760.db2.gz AFENVXOQLOVVAQ-KDOFPFPSSA-N 1 1 344.459 2.892 20 70 EFIDMO CCCn1ccc2ccc(NC(=O)N[C@H](C)[C@@H]3C[N@@H+](C)CCO3)cc21 ZINC000159941754 544800765 /nfs/dbraw/zinc/80/07/65/544800765.db2.gz AFENVXOQLOVVAQ-KDOFPFPSSA-N 1 1 344.459 2.892 20 70 EFIDMO CCN(C[C@@H]1CCOC1)C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159999367 544800994 /nfs/dbraw/zinc/80/09/94/544800994.db2.gz FWFZGRMOYHDYMN-YTQUADARSA-N 1 1 345.487 2.575 20 70 EFIDMO CC(C)CCOc1ccc(NC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1 ZINC000160279987 544803684 /nfs/dbraw/zinc/80/36/84/544803684.db2.gz UIQKLZWXDLUTHB-CRAIPNDOSA-N 1 1 349.475 2.952 20 70 EFIDMO CC(C)CCOc1ccc(NC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1 ZINC000160279987 544803687 /nfs/dbraw/zinc/80/36/87/544803687.db2.gz UIQKLZWXDLUTHB-CRAIPNDOSA-N 1 1 349.475 2.952 20 70 EFIDMO CC(C)CCOc1ccc(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc1 ZINC000160279856 544803800 /nfs/dbraw/zinc/80/38/00/544803800.db2.gz UIQKLZWXDLUTHB-MAUKXSAKSA-N 1 1 349.475 2.952 20 70 EFIDMO CC(C)CCOc1ccc(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc1 ZINC000160279856 544803804 /nfs/dbraw/zinc/80/38/04/544803804.db2.gz UIQKLZWXDLUTHB-MAUKXSAKSA-N 1 1 349.475 2.952 20 70 EFIDMO CC(C)CCOc1ccc(NC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc1 ZINC000160279728 544804498 /nfs/dbraw/zinc/80/44/98/544804498.db2.gz UIQKLZWXDLUTHB-QAPCUYQASA-N 1 1 349.475 2.952 20 70 EFIDMO CC(C)CCOc1ccc(NC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1 ZINC000160279728 544804501 /nfs/dbraw/zinc/80/45/01/544804501.db2.gz UIQKLZWXDLUTHB-QAPCUYQASA-N 1 1 349.475 2.952 20 70 EFIDMO CSc1ccc(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc1Cl ZINC000160347966 544805098 /nfs/dbraw/zinc/80/50/98/544805098.db2.gz QTGRVQUEKKEQTN-GXFFZTMASA-N 1 1 343.880 2.903 20 70 EFIDMO CSc1ccc(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc1Cl ZINC000160347966 544805105 /nfs/dbraw/zinc/80/51/05/544805105.db2.gz QTGRVQUEKKEQTN-GXFFZTMASA-N 1 1 343.880 2.903 20 70 EFIDMO Cc1cc(F)c(C(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1F ZINC000160415985 544805473 /nfs/dbraw/zinc/80/54/73/544805473.db2.gz NXVCFZWVCTTZFW-BETUJISGSA-N 1 1 340.414 2.891 20 70 EFIDMO Cc1cc(F)c(C(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1F ZINC000160415985 544805479 /nfs/dbraw/zinc/80/54/79/544805479.db2.gz NXVCFZWVCTTZFW-BETUJISGSA-N 1 1 340.414 2.891 20 70 EFIDMO Cc1cc(F)c(C(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)cc1F ZINC000160416094 544805637 /nfs/dbraw/zinc/80/56/37/544805637.db2.gz NXVCFZWVCTTZFW-CHWSQXEVSA-N 1 1 340.414 2.891 20 70 EFIDMO CS(=O)(=O)CCCC[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000161242973 544810923 /nfs/dbraw/zinc/81/09/23/544810923.db2.gz WBIQTDZBBDNHKV-CQSZACIVSA-N 1 1 331.503 2.554 20 70 EFIDMO COc1ccc([C@H]2CCC[N@@H+]2CCCCS(C)(=O)=O)c(OC)c1 ZINC000161279551 544811137 /nfs/dbraw/zinc/81/11/37/544811137.db2.gz OFRWKIQWBTTYST-MRXNPFEDSA-N 1 1 341.473 2.666 20 70 EFIDMO COc1ccc([C@H]2CCC[N@H+]2CCCCS(C)(=O)=O)c(OC)c1 ZINC000161279551 544811142 /nfs/dbraw/zinc/81/11/42/544811142.db2.gz OFRWKIQWBTTYST-MRXNPFEDSA-N 1 1 341.473 2.666 20 70 EFIDMO CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H]2CC[N@@H+](C)C2)c1 ZINC000161305124 544812871 /nfs/dbraw/zinc/81/28/71/544812871.db2.gz FKUUCWFCBNYAGU-LBPRGKRZSA-N 1 1 337.851 2.616 20 70 EFIDMO CCC(CC)[C@H](CNC(=O)Nc1ccc(C)nc1)[NH+]1CCOCC1 ZINC000161401292 544813656 /nfs/dbraw/zinc/81/36/56/544813656.db2.gz JGTCSBCCSXKLHG-KRWDZBQOSA-N 1 1 334.464 2.649 20 70 EFIDMO C[N@H+](CCCCS(C)(=O)=O)Cc1cc(Br)cs1 ZINC000161461387 544814627 /nfs/dbraw/zinc/81/46/27/544814627.db2.gz RAGDAAWLDVUFJB-UHFFFAOYSA-N 1 1 340.308 2.767 20 70 EFIDMO C[N@@H+](CCCCS(C)(=O)=O)Cc1cc(Br)cs1 ZINC000161461387 544814630 /nfs/dbraw/zinc/81/46/30/544814630.db2.gz RAGDAAWLDVUFJB-UHFFFAOYSA-N 1 1 340.308 2.767 20 70 EFIDMO CCC(C)(CC)C(=O)N[C@@H](C)C[NH+]1CCN(c2ccccn2)CC1 ZINC000159392264 544794833 /nfs/dbraw/zinc/79/48/33/544794833.db2.gz PTXAHROBCXWBLC-INIZCTEOSA-N 1 1 332.492 2.535 20 70 EFIDMO Cc1cc(F)c(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc1F ZINC000159623975 544797722 /nfs/dbraw/zinc/79/77/22/544797722.db2.gz LNSFIELDGKAIHT-UHFFFAOYSA-N 1 1 340.414 2.704 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)CC1 ZINC000160974888 279286185 /nfs/dbraw/zinc/28/61/85/279286185.db2.gz QJXSVCUFNHBMOF-MSOLQXFVSA-N 1 1 331.460 2.644 20 70 EFIDMO CC(C)CCSCC(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159990629 310693764 /nfs/dbraw/zinc/69/37/64/310693764.db2.gz GIEZVMOEUHPMQO-UHFFFAOYSA-N 1 1 330.538 2.583 20 70 EFIDMO CC[C@H](OC1CCCC1)C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000160257507 310696737 /nfs/dbraw/zinc/69/67/37/310696737.db2.gz ZHQCVLFCIRZVKR-KRWDZBQOSA-N 1 1 340.508 2.541 20 70 EFIDMO Cc1cc[nH+]c(N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)c1 ZINC000161354068 310708443 /nfs/dbraw/zinc/70/84/43/310708443.db2.gz TXWRHBBMAMTIKK-UHFFFAOYSA-N 1 1 329.831 2.935 20 70 EFIDMO CCc1ncc(NC(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)cn1 ZINC000161178735 473215484 /nfs/dbraw/zinc/21/54/84/473215484.db2.gz PJAKTLVOPYYSDN-GFCCVEGCSA-N 1 1 345.472 2.669 20 70 EFIDMO CCc1ncc(NC(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)cn1 ZINC000161178735 473215488 /nfs/dbraw/zinc/21/54/88/473215488.db2.gz PJAKTLVOPYYSDN-GFCCVEGCSA-N 1 1 345.472 2.669 20 70 EFIDMO CCC[N@@H+](CCO)Cc1cc(OC)ccc1OCc1ccccn1 ZINC000161202300 473217446 /nfs/dbraw/zinc/21/74/46/473217446.db2.gz OJNAUZSUGMBDLC-UHFFFAOYSA-N 1 1 330.428 2.874 20 70 EFIDMO C[C@@]1(O)CCCN(C(=O)NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)C1 ZINC000161230891 473218509 /nfs/dbraw/zinc/21/85/09/473218509.db2.gz MPSDXRHEWYVOOH-AZUAARDMSA-N 1 1 345.487 2.598 20 70 EFIDMO C[C@]1(O)CCCN(C(=O)NC[C@H]2CCCC[N@H+]2Cc2ccccc2)C1 ZINC000161231012 473218698 /nfs/dbraw/zinc/21/86/98/473218698.db2.gz MPSDXRHEWYVOOH-QUCCMNQESA-N 1 1 345.487 2.598 20 70 EFIDMO CN(C(=O)C[N@@H+](C)CCCc1cc(-c2ccc(F)cc2)n[nH]1)C1CC1 ZINC000161230658 473219265 /nfs/dbraw/zinc/21/92/65/473219265.db2.gz WVZNDQSWGVYVFT-UHFFFAOYSA-N 1 1 344.434 2.701 20 70 EFIDMO CC[NH+]1CCC(N(C)C(=O)c2cc(-c3cccc(OC)c3)[nH]n2)CC1 ZINC000161232758 473219507 /nfs/dbraw/zinc/21/95/07/473219507.db2.gz IJOMJBGZQJUUBE-UHFFFAOYSA-N 1 1 342.443 2.642 20 70 EFIDMO C[C@@H](C(=O)NC1CC1)[N@@H+](C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000161235007 473219850 /nfs/dbraw/zinc/21/98/50/473219850.db2.gz GGBLMJDPYPODJK-AWEZNQCLSA-N 1 1 326.444 2.608 20 70 EFIDMO C[N@H+](CC(=O)NC1CC1)Cc1cc(Br)cc2cccnc21 ZINC000161241302 473220063 /nfs/dbraw/zinc/22/00/63/473220063.db2.gz WMTPCMFQZFNLAG-UHFFFAOYSA-N 1 1 348.244 2.708 20 70 EFIDMO C[N@@H+](CC(=O)NC1CC1)Cc1cc(Br)cc2cccnc21 ZINC000161241302 473220069 /nfs/dbraw/zinc/22/00/69/473220069.db2.gz WMTPCMFQZFNLAG-UHFFFAOYSA-N 1 1 348.244 2.708 20 70 EFIDMO CC(C)[N@@H+]1C[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]c2=O)[C@@H](C)C1 ZINC000161312814 473225576 /nfs/dbraw/zinc/22/55/76/473225576.db2.gz NUUNZZNGPRIXET-KSSFIOAISA-N 1 1 339.439 2.500 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc(C)c2)C1 ZINC000161315042 473225727 /nfs/dbraw/zinc/22/57/27/473225727.db2.gz MABNHXTTXGDYHE-HOTGVXAUSA-N 1 1 341.459 2.813 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cccc(C)c2)C1 ZINC000161315042 473225730 /nfs/dbraw/zinc/22/57/30/473225730.db2.gz MABNHXTTXGDYHE-HOTGVXAUSA-N 1 1 341.459 2.813 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2C)C1 ZINC000161331880 473227087 /nfs/dbraw/zinc/22/70/87/473227087.db2.gz PNNZILFPMQHQNP-JKSUJKDBSA-N 1 1 341.459 2.813 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccccc2C)C1 ZINC000161331880 473227092 /nfs/dbraw/zinc/22/70/92/473227092.db2.gz PNNZILFPMQHQNP-JKSUJKDBSA-N 1 1 341.459 2.813 20 70 EFIDMO CCc1cccc(NC(=O)C[N@H+]2CCC[C@H](c3nncn3CC)C2)c1 ZINC000161341150 473227965 /nfs/dbraw/zinc/22/79/65/473227965.db2.gz SJTZBMDHJYJABQ-INIZCTEOSA-N 1 1 341.459 2.679 20 70 EFIDMO CCc1cccc(NC(=O)C[N@@H+]2CCC[C@H](c3nncn3CC)C2)c1 ZINC000161341150 473227966 /nfs/dbraw/zinc/22/79/66/473227966.db2.gz SJTZBMDHJYJABQ-INIZCTEOSA-N 1 1 341.459 2.679 20 70 EFIDMO CC(C)OC[C@H](O)C[N@@H+](C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000161358523 473229690 /nfs/dbraw/zinc/22/96/90/473229690.db2.gz SGVOULXRNLRFHS-GOSISDBHSA-N 1 1 331.460 2.727 20 70 EFIDMO Cc1sc2[nH]c(C[N@H+](C[C@@H]3CCOC3)C3CC3)nc(=O)c2c1C ZINC000161409596 473233980 /nfs/dbraw/zinc/23/39/80/473233980.db2.gz BVDXQHRCIDYYFQ-LBPRGKRZSA-N 1 1 333.457 2.602 20 70 EFIDMO Cc1sc2[nH]c(C[N@@H+](C[C@@H]3CCOC3)C3CC3)nc(=O)c2c1C ZINC000161409596 473233984 /nfs/dbraw/zinc/23/39/84/473233984.db2.gz BVDXQHRCIDYYFQ-LBPRGKRZSA-N 1 1 333.457 2.602 20 70 EFIDMO C[N@@H+](CCCNC(=O)N[C@H](CCO)C(C)(C)C)Cc1ccccc1 ZINC000161477317 473238114 /nfs/dbraw/zinc/23/81/14/473238114.db2.gz VPYUVXVAROZSNI-QGZVFWFLSA-N 1 1 335.492 2.605 20 70 EFIDMO Cc1ccc(-c2csc(NC(=O)[C@@H](C)[N@@H+](C)C[C@@H](C)O)n2)cc1 ZINC000159447649 473030238 /nfs/dbraw/zinc/03/02/38/473030238.db2.gz CXNJPYKTTQMIEH-CHWSQXEVSA-N 1 1 333.457 2.758 20 70 EFIDMO Cc1ccc(-c2csc(NC(=O)[C@@H](C)[N@H+](C)C[C@@H](C)O)n2)cc1 ZINC000159447649 473030239 /nfs/dbraw/zinc/03/02/39/473030239.db2.gz CXNJPYKTTQMIEH-CHWSQXEVSA-N 1 1 333.457 2.758 20 70 EFIDMO C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000159576359 473040437 /nfs/dbraw/zinc/04/04/37/473040437.db2.gz FGVARNIVRPNSOD-KGLIPLIRSA-N 1 1 348.443 2.758 20 70 EFIDMO CCN(C(=O)NC[C@@H]1CCCCO1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159652271 473048021 /nfs/dbraw/zinc/04/80/21/473048021.db2.gz RRLCACOCZQZODA-OALUTQOASA-N 1 1 345.487 2.862 20 70 EFIDMO Cc1cc(C[NH+]2CCC(CC(N)=O)CC2)sc1Br ZINC000159775852 473060755 /nfs/dbraw/zinc/06/07/55/473060755.db2.gz VEGWAEPRTRCTCU-UHFFFAOYSA-N 1 1 331.279 2.906 20 70 EFIDMO Cc1cc(C(=O)C[N@H+](C)C[C@H]2CCC[C@@H]2O)c(C)n1-c1nccs1 ZINC000159812612 473063383 /nfs/dbraw/zinc/06/33/83/473063383.db2.gz YSTHBZQOJBXAPD-ZBFHGGJFSA-N 1 1 347.484 2.826 20 70 EFIDMO Cc1cc(C(=O)C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c(C)n1-c1nccs1 ZINC000159812612 473063388 /nfs/dbraw/zinc/06/33/88/473063388.db2.gz YSTHBZQOJBXAPD-ZBFHGGJFSA-N 1 1 347.484 2.826 20 70 EFIDMO C[C@H](CNC(=O)NCCOc1ccccc1Cl)[N@@H+](C)C1CC1 ZINC000159862508 473067468 /nfs/dbraw/zinc/06/74/68/473067468.db2.gz UZKKONSKRPVSBA-GFCCVEGCSA-N 1 1 325.840 2.501 20 70 EFIDMO Cc1cc(C)cc(OCc2noc(C[N@H+](C)C[C@@H]3CCC[C@@H]3O)n2)c1 ZINC000159875463 473069071 /nfs/dbraw/zinc/06/90/71/473069071.db2.gz YBGVYIGJKSNGGR-RDJZCZTQSA-N 1 1 345.443 2.858 20 70 EFIDMO Cc1cc(C)cc(OCc2noc(C[N@@H+](C)C[C@@H]3CCC[C@@H]3O)n2)c1 ZINC000159875463 473069077 /nfs/dbraw/zinc/06/90/77/473069077.db2.gz YBGVYIGJKSNGGR-RDJZCZTQSA-N 1 1 345.443 2.858 20 70 EFIDMO CCOCCC[NH+]1CCN(C(=O)c2ccc(F)cc2Cl)CC1 ZINC000159904453 473071135 /nfs/dbraw/zinc/07/11/35/473071135.db2.gz MVXLFRVXBLZIBV-UHFFFAOYSA-N 1 1 328.815 2.664 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)CC1 ZINC000159931843 473073081 /nfs/dbraw/zinc/07/30/81/473073081.db2.gz OQDLNTNFHDSRKN-AWEZNQCLSA-N 1 1 349.479 2.916 20 70 EFIDMO CCCCCN(CCO)C(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159952856 473075649 /nfs/dbraw/zinc/07/56/49/473075649.db2.gz AHLNDFIVXSRIAF-HKUYNNGSSA-N 1 1 347.503 2.701 20 70 EFIDMO CNC(=O)[C@@H](C)C[N@H+](C)Cc1nc(-c2c(F)cccc2F)cs1 ZINC000159988863 473078328 /nfs/dbraw/zinc/07/83/28/473078328.db2.gz HBIMDERXXJMEQJ-JTQLQIEISA-N 1 1 339.411 2.902 20 70 EFIDMO CNC(=O)[C@@H](C)C[N@@H+](C)Cc1nc(-c2c(F)cccc2F)cs1 ZINC000159988863 473078336 /nfs/dbraw/zinc/07/83/36/473078336.db2.gz HBIMDERXXJMEQJ-JTQLQIEISA-N 1 1 339.411 2.902 20 70 EFIDMO CC[N@@H+](Cc1ccc(C(=O)N(C)Cc2cnn(C)c2)cc1)C(C)C ZINC000160016793 473079458 /nfs/dbraw/zinc/07/94/58/473079458.db2.gz VOIWYKSHAKKNQU-UHFFFAOYSA-N 1 1 328.460 2.923 20 70 EFIDMO CCSCc1cccc(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)c1 ZINC000160028640 473081135 /nfs/dbraw/zinc/08/11/35/473081135.db2.gz YYZMBGSGOPTFGL-XJKSGUPXSA-N 1 1 337.489 2.780 20 70 EFIDMO CCSCc1cccc(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)c1 ZINC000160028640 473081139 /nfs/dbraw/zinc/08/11/39/473081139.db2.gz YYZMBGSGOPTFGL-XJKSGUPXSA-N 1 1 337.489 2.780 20 70 EFIDMO CCN(C[C@@H]1CCCO1)C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000160027931 473081429 /nfs/dbraw/zinc/08/14/29/473081429.db2.gz BWCABKVDQISRIK-YTQUADARSA-N 1 1 345.487 2.717 20 70 EFIDMO CCCCCN(CCO)C(=O)N[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000160052609 473084221 /nfs/dbraw/zinc/08/42/21/473084221.db2.gz QXTJJWWMIDGCCW-HKUYNNGSSA-N 1 1 347.503 2.844 20 70 EFIDMO CCOCCN(CC)C(=O)N[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000160077805 473085290 /nfs/dbraw/zinc/08/52/90/473085290.db2.gz HWLSHOZBJOKEQE-FUHWJXTLSA-N 1 1 333.476 2.717 20 70 EFIDMO CC[N@H+]1CC[C@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3F)n2)C1 ZINC000160131581 473089739 /nfs/dbraw/zinc/08/97/39/473089739.db2.gz GHXDTXGAQUVTMZ-CYBMUJFWSA-N 1 1 348.397 2.531 20 70 EFIDMO O=C(Nc1cn[nH]c1)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1 ZINC000160131159 473090052 /nfs/dbraw/zinc/09/00/52/473090052.db2.gz QIIUIZAYWYBDFP-OAHLLOKOSA-N 1 1 338.333 2.803 20 70 EFIDMO Cc1cccc([C@@H]2CCC[N@@H+]2CCNS(=O)(=O)c2ccccc2)n1 ZINC000160160817 473092620 /nfs/dbraw/zinc/09/26/20/473092620.db2.gz OZZPKDVKUKMJCW-SFHVURJKSA-N 1 1 345.468 2.505 20 70 EFIDMO Cc1cccc([C@@H]2CCC[N@H+]2CCNS(=O)(=O)c2ccccc2)n1 ZINC000160160817 473092628 /nfs/dbraw/zinc/09/26/28/473092628.db2.gz OZZPKDVKUKMJCW-SFHVURJKSA-N 1 1 345.468 2.505 20 70 EFIDMO CCc1ccc(/C=C/C(=O)N2CCCC[C@H]2C[NH+]2CCOCC2)o1 ZINC000160241401 473099323 /nfs/dbraw/zinc/09/93/23/473099323.db2.gz BCDBDNUDCJDNDN-FDMDGMSGSA-N 1 1 332.444 2.569 20 70 EFIDMO O=C(NCCc1cccc(O)c1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000160235015 473099501 /nfs/dbraw/zinc/09/95/01/473099501.db2.gz FQUKHQJXMDOSEX-LJQANCHMSA-N 1 1 338.451 2.963 20 70 EFIDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc2c([nH]c1=O)CCCCC2 ZINC000160245194 473100614 /nfs/dbraw/zinc/10/06/14/473100614.db2.gz IXGLCRFGHMINNJ-MRXNPFEDSA-N 1 1 345.487 2.638 20 70 EFIDMO CC[N@@H+](CCNC(=O)Nc1ccc(O[C@H]2CCOC2)cc1)C(C)C ZINC000160260563 473102370 /nfs/dbraw/zinc/10/23/70/473102370.db2.gz HZNAHLLZZBHAFA-KRWDZBQOSA-N 1 1 335.448 2.706 20 70 EFIDMO C[C@@H](CNC(=O)NCC(C)(C)Cc1ccccc1)C[NH+]1CCOCC1 ZINC000160268101 473102653 /nfs/dbraw/zinc/10/26/53/473102653.db2.gz QQXMPTLMTODZOT-KRWDZBQOSA-N 1 1 347.503 2.523 20 70 EFIDMO CCC[C@H]1CN(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)CCO1 ZINC000160265115 473102681 /nfs/dbraw/zinc/10/26/81/473102681.db2.gz RMAJZIDOZNDTMO-IRXDYDNUSA-N 1 1 325.497 2.852 20 70 EFIDMO CCOC(=O)[C@@H]1CCC[N@@H+](CC2CCN(C(=O)C(C)(C)C)CC2)C1 ZINC000160281524 473103873 /nfs/dbraw/zinc/10/38/73/473103873.db2.gz XYXZAFWRKXAICE-MRXNPFEDSA-N 1 1 338.492 2.546 20 70 EFIDMO [NH3+]Cc1ccc(C(=O)N2CCC[C@H](C(=O)c3ccc(F)cc3)C2)o1 ZINC000160389471 473115706 /nfs/dbraw/zinc/11/57/06/473115706.db2.gz KRZLKLXFJZHJIL-ZDUSSCGKSA-N 1 1 330.359 2.613 20 70 EFIDMO C[N@@H+](CCCNC(=O)c1cccc(-n2ccnn2)c1)Cc1ccccc1 ZINC000160404027 473118035 /nfs/dbraw/zinc/11/80/35/473118035.db2.gz UONOOKGBZORVPC-UHFFFAOYSA-N 1 1 349.438 2.519 20 70 EFIDMO CCc1cc2c(ncnc2N2CCC[C@H]2C[NH+]2CCOCC2)s1 ZINC000160421822 473120739 /nfs/dbraw/zinc/12/07/39/473120739.db2.gz GMRUFMYKTQSGSP-ZDUSSCGKSA-N 1 1 332.473 2.555 20 70 EFIDMO CCOc1ccc(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc1OC ZINC000160434016 473124372 /nfs/dbraw/zinc/12/43/72/473124372.db2.gz QPPKFPJNUIHSIQ-MRXNPFEDSA-N 1 1 334.460 2.944 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(-c2ncon2)cc1 ZINC000160442279 473125783 /nfs/dbraw/zinc/12/57/83/473125783.db2.gz MRTCJFFVCYSWRN-MRXNPFEDSA-N 1 1 328.416 2.587 20 70 EFIDMO CCC[C@H]1CN(C(=O)Nc2cccc(F)c2F)CC[N@H+]1CCOC ZINC000160465551 473128806 /nfs/dbraw/zinc/12/88/06/473128806.db2.gz SXMWTHSVLIUJRP-ZDUSSCGKSA-N 1 1 341.402 2.929 20 70 EFIDMO CCOCCC[NH+]1CCN(C(=O)c2c(F)cccc2Cl)CC1 ZINC000160464408 473128835 /nfs/dbraw/zinc/12/88/35/473128835.db2.gz HRHVRCDDKGMIDA-UHFFFAOYSA-N 1 1 328.815 2.664 20 70 EFIDMO CN(C)C(=O)COc1ccccc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000160465051 473128950 /nfs/dbraw/zinc/12/89/50/473128950.db2.gz CYGDIRCRZWXDSM-UHFFFAOYSA-N 1 1 330.403 2.925 20 70 EFIDMO CCC[C@@H]1CN(C(=O)Nc2cccc(F)c2F)CC[N@H+]1CCOC ZINC000160465395 473129132 /nfs/dbraw/zinc/12/91/32/473129132.db2.gz SXMWTHSVLIUJRP-CYBMUJFWSA-N 1 1 341.402 2.929 20 70 EFIDMO CC(C)Cn1ncc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1C1CC1 ZINC000160487265 473132153 /nfs/dbraw/zinc/13/21/53/473132153.db2.gz GNMVROQPFZIKDO-AEFFLSMTSA-N 1 1 344.503 2.973 20 70 EFIDMO CCc1cc(=O)[nH]c(CN2CC[NH+](C/C=C/c3ccccc3)CC2)n1 ZINC000160493602 473132560 /nfs/dbraw/zinc/13/25/60/473132560.db2.gz ZIPBOFXQBWBGOJ-RMKNXTFCSA-N 1 1 338.455 2.576 20 70 EFIDMO Cc1ccccc1OCC[N@H+](C)[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000160507904 473135068 /nfs/dbraw/zinc/13/50/68/473135068.db2.gz WKYGHJDHIUSYFC-CQSZACIVSA-N 1 1 344.377 2.859 20 70 EFIDMO CC[N@@H+]1CCc2nc(NC(=O)c3cnn(CC(C)C)c3C)sc2C1 ZINC000160512663 473135315 /nfs/dbraw/zinc/13/53/15/473135315.db2.gz JSCNPCQCMHDGGP-UHFFFAOYSA-N 1 1 347.488 2.934 20 70 EFIDMO CC[N@H+]1CCc2nc(NC(=O)c3cnn(CC(C)C)c3C)sc2C1 ZINC000160512663 473135321 /nfs/dbraw/zinc/13/53/21/473135321.db2.gz JSCNPCQCMHDGGP-UHFFFAOYSA-N 1 1 347.488 2.934 20 70 EFIDMO CCCCOc1ccc(C[N@H+](CC)[C@@H]2CCS(=O)(=O)C2)cc1 ZINC000160568045 473143586 /nfs/dbraw/zinc/14/35/86/473143586.db2.gz COZBNUHQAYRULU-MRXNPFEDSA-N 1 1 325.474 2.875 20 70 EFIDMO CCCCOc1ccc(C[N@@H+](CC)[C@@H]2CCS(=O)(=O)C2)cc1 ZINC000160568045 473143589 /nfs/dbraw/zinc/14/35/89/473143589.db2.gz COZBNUHQAYRULU-MRXNPFEDSA-N 1 1 325.474 2.875 20 70 EFIDMO CC[N@H+](Cc1cccc(-c2ccccn2)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160569980 473143804 /nfs/dbraw/zinc/14/38/04/473143804.db2.gz QMDXPFAAROXKFG-QGZVFWFLSA-N 1 1 330.453 2.758 20 70 EFIDMO CC[N@@H+](Cc1cccc(-c2ccccn2)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160569980 473143810 /nfs/dbraw/zinc/14/38/10/473143810.db2.gz QMDXPFAAROXKFG-QGZVFWFLSA-N 1 1 330.453 2.758 20 70 EFIDMO CC(C)c1nn(C)c(Cl)c1C(=O)NCC[N@H+]1CCC[C@H](C)C1 ZINC000160586006 473145865 /nfs/dbraw/zinc/14/58/65/473145865.db2.gz FZQWZQXPAXHZIF-LBPRGKRZSA-N 1 1 326.872 2.659 20 70 EFIDMO CNC(=O)C1CC[NH+]([C@@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)CC1 ZINC000160611501 473151147 /nfs/dbraw/zinc/15/11/47/473151147.db2.gz IKOVMVLLPUNGRV-AWEZNQCLSA-N 1 1 342.443 2.872 20 70 EFIDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1ccn(CC(F)(F)F)n1 ZINC000160628708 473154064 /nfs/dbraw/zinc/15/40/64/473154064.db2.gz HJFPVWOODYBQKG-LBPRGKRZSA-N 1 1 347.385 2.831 20 70 EFIDMO CC[C@@](C)([NH2+]Cc1nc(-c2c(F)cccc2F)cs1)C(N)=O ZINC000160659854 473157791 /nfs/dbraw/zinc/15/77/91/473157791.db2.gz VRKOHGMCBWJYGI-OAHLLOKOSA-N 1 1 325.384 2.832 20 70 EFIDMO Cc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H]1CC[N@@H+](CC3CC3)C1)CCC2 ZINC000160685582 473160295 /nfs/dbraw/zinc/16/02/95/473160295.db2.gz YEWMUTJWTKDOEE-GDBMZVCRSA-N 1 1 348.516 2.955 20 70 EFIDMO COc1cc(Br)ccc1C(=O)N1CC[N@H+](C)C(C)(C)C1 ZINC000160683835 473160874 /nfs/dbraw/zinc/16/08/74/473160874.db2.gz ZLCCNKDIRFILBN-UHFFFAOYSA-N 1 1 341.249 2.624 20 70 EFIDMO COc1cc(Br)ccc1C(=O)N1CC[N@@H+](C)C(C)(C)C1 ZINC000160683835 473160880 /nfs/dbraw/zinc/16/08/80/473160880.db2.gz ZLCCNKDIRFILBN-UHFFFAOYSA-N 1 1 341.249 2.624 20 70 EFIDMO Cc1ccc2c(c1)[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)CO2 ZINC000160694245 473161410 /nfs/dbraw/zinc/16/14/10/473161410.db2.gz UMXYHKRQEYUJOL-CABCVRRESA-N 1 1 329.400 2.624 20 70 EFIDMO CCc1nnc(C[NH2+]C(C)(C)COc2ncccc2C(F)(F)F)[nH]1 ZINC000160703581 473163858 /nfs/dbraw/zinc/16/38/58/473163858.db2.gz YSHODHHDUILZAQ-UHFFFAOYSA-N 1 1 343.353 2.728 20 70 EFIDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1cc(C(=O)OC)cs1 ZINC000160734190 473168184 /nfs/dbraw/zinc/16/81/84/473168184.db2.gz HJNLBZJOVFUYPE-ZDUSSCGKSA-N 1 1 339.461 2.921 20 70 EFIDMO O=C1CC[C@@H]2C[N@@H+](Cc3cccc(F)c3Br)CC[C@@H]2N1 ZINC000160738791 473168986 /nfs/dbraw/zinc/16/89/86/473168986.db2.gz ZAWOBEORLAFQPE-MFKMUULPSA-N 1 1 341.224 2.689 20 70 EFIDMO O=C1CC[C@@H]2C[N@H+](Cc3cccc(F)c3Br)CC[C@@H]2N1 ZINC000160738791 473168982 /nfs/dbraw/zinc/16/89/82/473168982.db2.gz ZAWOBEORLAFQPE-MFKMUULPSA-N 1 1 341.224 2.689 20 70 EFIDMO CCCC[N@H+](CC1=Cc2ccccc2OC1)[C@@H]1CCS(=O)(=O)C1 ZINC000160774801 473173978 /nfs/dbraw/zinc/17/39/78/473173978.db2.gz HCTBEGKBCABUKX-QGZVFWFLSA-N 1 1 335.469 2.752 20 70 EFIDMO CCCC[N@@H+](CC1=Cc2ccccc2OC1)[C@@H]1CCS(=O)(=O)C1 ZINC000160774801 473173980 /nfs/dbraw/zinc/17/39/80/473173980.db2.gz HCTBEGKBCABUKX-QGZVFWFLSA-N 1 1 335.469 2.752 20 70 EFIDMO CO[C@@H]1CCC[C@H]1NC(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000160809173 473177172 /nfs/dbraw/zinc/17/71/72/473177172.db2.gz WEVBDCBSRWTFMX-QZTJIDSGSA-N 1 1 345.487 2.690 20 70 EFIDMO CN(Cc1cnc(N2CC[NH+](C)CC2)nc1)Cc1ccccc1Cl ZINC000160820784 473178592 /nfs/dbraw/zinc/17/85/92/473178592.db2.gz IGXVAHSYEKHLQP-UHFFFAOYSA-N 1 1 345.878 2.514 20 70 EFIDMO Cc1cnn([C@@H]2CCCN(C(=O)N[C@H]3CC[N@H+](C4CCCC4)C3)C2)c1 ZINC000160832690 473180531 /nfs/dbraw/zinc/18/05/31/473180531.db2.gz QRZGPCUOEDBEGC-FUHWJXTLSA-N 1 1 345.491 2.555 20 70 EFIDMO CCn1ccnc1C[NH+]1CCC(C(=O)NCCc2cccs2)CC1 ZINC000160866904 473184388 /nfs/dbraw/zinc/18/43/88/473184388.db2.gz FUYWXQPSXJGFIC-UHFFFAOYSA-N 1 1 346.500 2.535 20 70 EFIDMO O=C(NCCCNc1ccccc1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000160880023 473187400 /nfs/dbraw/zinc/18/74/00/473187400.db2.gz GWPJWPAAWSWDSE-KRWDZBQOSA-N 1 1 330.476 2.805 20 70 EFIDMO COC[C@H]1CCCN(C(=O)NC[C@H]2CCCC[N@H+]2CC(C)C)C1 ZINC000160937510 473192700 /nfs/dbraw/zinc/19/27/00/473192700.db2.gz CUDWQLRLIGYJDA-DLBZAZTESA-N 1 1 325.497 2.565 20 70 EFIDMO Cc1ccccc1OCCC[N@@H+](C)CCCS(=O)(=O)C(C)C ZINC000160951130 473193548 /nfs/dbraw/zinc/19/35/48/473193548.db2.gz JCLCEAUTAVUDRX-UHFFFAOYSA-N 1 1 327.490 2.909 20 70 EFIDMO Cc1ccccc1OCCC[N@H+](C)CCCS(=O)(=O)C(C)C ZINC000160951130 473193552 /nfs/dbraw/zinc/19/35/52/473193552.db2.gz JCLCEAUTAVUDRX-UHFFFAOYSA-N 1 1 327.490 2.909 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC(n2ccnc2)CC1 ZINC000160967035 473194992 /nfs/dbraw/zinc/19/49/92/473194992.db2.gz GJZXSPRRIAXCRI-GOSISDBHSA-N 1 1 347.507 2.740 20 70 EFIDMO C[N@H+](CC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)[C@@H]1CCSC1 ZINC000160964698 473195220 /nfs/dbraw/zinc/19/52/20/473195220.db2.gz LBFICOKKXLZOKU-OAHLLOKOSA-N 1 1 349.500 2.591 20 70 EFIDMO C[N@@H+](CC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)[C@@H]1CCSC1 ZINC000160964698 473195223 /nfs/dbraw/zinc/19/52/23/473195223.db2.gz LBFICOKKXLZOKU-OAHLLOKOSA-N 1 1 349.500 2.591 20 70 EFIDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)NCCc1ccncc1C ZINC000161015108 473199102 /nfs/dbraw/zinc/19/91/02/473199102.db2.gz LAOJQUXHGTYZNI-SFHVURJKSA-N 1 1 332.492 2.886 20 70 EFIDMO COC(=O)c1csc(NC(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)c1 ZINC000161032817 473201017 /nfs/dbraw/zinc/20/10/17/473201017.db2.gz DWRSTMQEOGSSNP-LBPRGKRZSA-N 1 1 339.461 2.634 20 70 EFIDMO Cc1c(C(=O)N2CC[NH+](C(C)C)CC2)cnn1-c1cc(C)ccc1C ZINC000161182983 533751518 /nfs/dbraw/zinc/75/15/18/533751518.db2.gz DHZSNAVKALJPNE-UHFFFAOYSA-N 1 1 340.471 2.964 20 70 EFIDMO Cc1ccc2c(CSCC[NH+]3CCOCC3)cc(=O)oc2c1C ZINC000159837068 534393131 /nfs/dbraw/zinc/39/31/31/534393131.db2.gz WCEUKADVOGWXRF-UHFFFAOYSA-N 1 1 333.453 2.975 20 70 EFIDMO C[N@@H+]1CCN(CC(=O)Nc2ccc(F)c(F)c2)[C@@H](c2ccccc2)C1 ZINC000216732081 523893447 /nfs/dbraw/zinc/89/34/47/523893447.db2.gz KNYPXGGPPYZUAJ-GOSISDBHSA-N 1 1 345.393 2.892 20 70 EFIDMO C[N@H+]1CCN(CC(=O)Nc2ccc(F)c(F)c2)[C@@H](c2ccccc2)C1 ZINC000216732081 523893451 /nfs/dbraw/zinc/89/34/51/523893451.db2.gz KNYPXGGPPYZUAJ-GOSISDBHSA-N 1 1 345.393 2.892 20 70 EFIDMO C[C@H]1C[N@H+](Cc2cc(Br)cc3c2OCC3)CC[C@@H]1O ZINC000159460137 524612894 /nfs/dbraw/zinc/61/28/94/524612894.db2.gz LLIXAVJCLXBKRW-HZMBPMFUSA-N 1 1 326.234 2.587 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2cc(Br)cc3c2OCC3)CC[C@@H]1O ZINC000159460137 524612903 /nfs/dbraw/zinc/61/29/03/524612903.db2.gz LLIXAVJCLXBKRW-HZMBPMFUSA-N 1 1 326.234 2.587 20 70 EFIDMO C[C@@H](CNC(=O)NC1(c2ccccc2)CCCC1)C[NH+]1CCOCC1 ZINC000159953909 524672401 /nfs/dbraw/zinc/67/24/01/524672401.db2.gz HPSWXGMWHHSSSJ-KRWDZBQOSA-N 1 1 345.487 2.723 20 70 EFIDMO Cc1ccc(NC(=O)NC(=O)C[N@@H+](CCCO)CC(C)(C)C)cc1C ZINC000217095028 525150736 /nfs/dbraw/zinc/15/07/36/525150736.db2.gz FNEHWHHURRPKSW-UHFFFAOYSA-N 1 1 349.475 2.682 20 70 EFIDMO Cc1ccn(-c2ccc(N[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C)nn2)n1 ZINC000160219064 534850961 /nfs/dbraw/zinc/85/09/61/534850961.db2.gz RBIQDNYOWCNONB-MAUKXSAKSA-N 1 1 348.454 2.903 20 70 EFIDMO CC(=O)NC[C@H]1CCC[N@@H+]([C@H](C)c2nc(Cc3ccccc3)no2)C1 ZINC000159732005 526790442 /nfs/dbraw/zinc/79/04/42/526790442.db2.gz BFWIFXWBMOACPV-RHSMWYFYSA-N 1 1 342.443 2.570 20 70 EFIDMO CC(=O)NC[C@H]1CCC[N@H+]([C@H](C)c2nc(Cc3ccccc3)no2)C1 ZINC000159732005 526790447 /nfs/dbraw/zinc/79/04/47/526790447.db2.gz BFWIFXWBMOACPV-RHSMWYFYSA-N 1 1 342.443 2.570 20 70 EFIDMO CCOC(=O)[C@@H](CC)[N@@H+](CC)CC1CCN(c2ccccn2)CC1 ZINC000160034497 527773225 /nfs/dbraw/zinc/77/32/25/527773225.db2.gz OIDZWURWHILCQL-QGZVFWFLSA-N 1 1 333.476 2.962 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)NC[C@@H](CO)c1ccccc1 ZINC000160903545 527965232 /nfs/dbraw/zinc/96/52/32/527965232.db2.gz LDBYTWQKZAIFGJ-RBUKOAKNSA-N 1 1 347.503 2.572 20 70 EFIDMO CCC[C@H](CCO)CNC(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159969272 528120140 /nfs/dbraw/zinc/12/01/40/528120140.db2.gz PNPWSMGSPAZXHV-SCTDSRPQSA-N 1 1 347.503 2.605 20 70 EFIDMO CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@H](C)C(=O)NCC(C)C ZINC000160018301 528348816 /nfs/dbraw/zinc/34/88/16/528348816.db2.gz BCVYISZPBWRKKE-QGZVFWFLSA-N 1 1 346.519 2.781 20 70 EFIDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@H](O)c1ccccc1 ZINC000159786442 528836386 /nfs/dbraw/zinc/83/63/86/528836386.db2.gz QFKOFIVZOOQNTA-LJQANCHMSA-N 1 1 326.440 2.877 20 70 EFIDMO CCOC[C@@H]1CCN(C(=O)NC[C@H]2CCCC[N@H+]2CC(C)C)C1 ZINC000160905193 528933332 /nfs/dbraw/zinc/93/33/32/528933332.db2.gz OEWPRJCSNOMAOQ-IAGOWNOFSA-N 1 1 325.497 2.565 20 70 EFIDMO CCC[C@@H](CCO)CNC(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159968892 528933205 /nfs/dbraw/zinc/93/32/05/528933205.db2.gz PNPWSMGSPAZXHV-JENIJYKNSA-N 1 1 347.503 2.605 20 70 EFIDMO CCC[C@@H](CCO)CNC(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159969141 528933557 /nfs/dbraw/zinc/93/35/57/528933557.db2.gz PNPWSMGSPAZXHV-LNLFQRSKSA-N 1 1 347.503 2.605 20 70 EFIDMO CCOC[C@H]1CCN(C(=O)NC[C@H]2CCCC[N@H+]2CC(C)C)C1 ZINC000160905299 529025471 /nfs/dbraw/zinc/02/54/71/529025471.db2.gz OEWPRJCSNOMAOQ-DLBZAZTESA-N 1 1 325.497 2.565 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCCOc2ccccc2C(C)C)CC1 ZINC000159849403 529025600 /nfs/dbraw/zinc/02/56/00/529025600.db2.gz YORWBSNDDJYVFB-UHFFFAOYSA-N 1 1 333.476 2.926 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000159754886 529026704 /nfs/dbraw/zinc/02/67/04/529026704.db2.gz KNCHOQAKMNGGBU-RBUKOAKNSA-N 1 1 345.487 2.892 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2ccc(OC3CCCC3)nc2)CC1 ZINC000159607567 529027962 /nfs/dbraw/zinc/02/79/62/529027962.db2.gz MAAAUBWIKKGUPL-UHFFFAOYSA-N 1 1 346.475 2.640 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)CC1 ZINC000159933069 529029767 /nfs/dbraw/zinc/02/97/67/529029767.db2.gz YPRXKXPDBFKQAZ-INIZCTEOSA-N 1 1 341.459 2.671 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](COCC(C)C)c2ccco2)CC1 ZINC000159792008 529031044 /nfs/dbraw/zinc/03/10/44/529031044.db2.gz VFEBUHVWALIHOO-MRXNPFEDSA-N 1 1 337.464 2.731 20 70 EFIDMO CC[C@@H](CNC(=O)N1CCC[N@@H+](CC)CC1)Oc1cccc(F)c1 ZINC000159960345 529478983 /nfs/dbraw/zinc/47/89/83/529478983.db2.gz ALSNMGZQZGGEGS-INIZCTEOSA-N 1 1 337.439 2.720 20 70 EFIDMO CCc1cc2c(C[N@@H+](C)C[C@H]3CCC[C@@H]3O)cc(=O)oc2cc1O ZINC000159832593 529570519 /nfs/dbraw/zinc/57/05/19/529570519.db2.gz ZPGFNPMYSQVBTO-CJNGLKHVSA-N 1 1 331.412 2.654 20 70 EFIDMO CCc1nc(CN(C)CCC2CCN(c3cc[nH+]cc3)CC2)n[nH]1 ZINC000160232084 529735448 /nfs/dbraw/zinc/73/54/48/529735448.db2.gz SFFJOUCSLYHQLU-UHFFFAOYSA-N 1 1 328.464 2.501 20 70 EFIDMO CN(C)c1ccc(C(=O)NCC[N@@H+](C)Cc2ccccc2)c(F)c1 ZINC000160678014 282285811 /nfs/dbraw/zinc/28/58/11/282285811.db2.gz CVENIQKSVPSRNL-UHFFFAOYSA-N 1 1 329.419 2.754 20 70 EFIDMO CN(C)c1cccc(C[N@H+](C)CC(=O)NCc2ccc(F)cc2)c1 ZINC000159855533 529788839 /nfs/dbraw/zinc/78/88/39/529788839.db2.gz NUFYHHLBMXNWSZ-UHFFFAOYSA-N 1 1 329.419 2.640 20 70 EFIDMO CN(C)c1cccc(C[N@@H+](C)CC(=O)NCc2ccc(F)cc2)c1 ZINC000159855533 529788842 /nfs/dbraw/zinc/78/88/42/529788842.db2.gz NUFYHHLBMXNWSZ-UHFFFAOYSA-N 1 1 329.419 2.640 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cn(C)c2ccccc12 ZINC000160285286 529846583 /nfs/dbraw/zinc/84/65/83/529846583.db2.gz XFUOUITUVLTAAS-UHFFFAOYSA-N 1 1 343.471 2.609 20 70 EFIDMO C[N@H+](Cc1cccc(C(=O)N2CCCCC2)c1)C[C@H]1CCC[C@@H]1O ZINC000159766773 529993323 /nfs/dbraw/zinc/99/33/23/529993323.db2.gz FVVQRBPHNPYWLL-MOPGFXCFSA-N 1 1 330.472 2.906 20 70 EFIDMO COCC1CCN(C(=O)NC[C@H]2CCCC[N@H+]2CC(C)C)CC1 ZINC000160991608 239061390 /nfs/dbraw/zinc/06/13/90/239061390.db2.gz XXBOIJMRYUNMMT-QGZVFWFLSA-N 1 1 325.497 2.565 20 70 EFIDMO COC[C@H](NC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1)C1CC1 ZINC000160244799 533066531 /nfs/dbraw/zinc/06/65/31/533066531.db2.gz ZDPKPDFDKTZZRA-KDOFPFPSSA-N 1 1 347.459 2.626 20 70 EFIDMO C[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1cccc(F)c1 ZINC000160170316 533171901 /nfs/dbraw/zinc/17/19/01/533171901.db2.gz AMQNFXQFIBTFHJ-OAHLLOKOSA-N 1 1 336.451 2.746 20 70 EFIDMO COc1cc2[nH+]c(N[C@H]3CCO[C@H](C4CC4)C3)nc(N)c2cc1OC ZINC000160277035 533177009 /nfs/dbraw/zinc/17/70/09/533177009.db2.gz SFYAYDKDIPSBDP-FZMZJTMJSA-N 1 1 344.415 2.599 20 70 EFIDMO COc1cccc(CNC(=O)C[N@H+](C)Cc2cccc(N(C)C)c2)c1 ZINC000159763565 533489134 /nfs/dbraw/zinc/48/91/34/533489134.db2.gz UVKMHCDCPAIHBN-UHFFFAOYSA-N 1 1 341.455 2.509 20 70 EFIDMO COc1cccc(CNC(=O)C[N@@H+](C)Cc2cccc(N(C)C)c2)c1 ZINC000159763565 533489136 /nfs/dbraw/zinc/48/91/36/533489136.db2.gz UVKMHCDCPAIHBN-UHFFFAOYSA-N 1 1 341.455 2.509 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)N(C)Cc2cccnc2)C[N@H+]1Cc1ccccc1 ZINC000160287738 533609161 /nfs/dbraw/zinc/60/91/61/533609161.db2.gz IJLYEGMCDOOAAV-VQIMIIECSA-N 1 1 338.455 2.886 20 70 EFIDMO C[C@H](CC(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1ccccc1 ZINC000159635161 533621697 /nfs/dbraw/zinc/62/16/97/533621697.db2.gz IQDTYGJCHZDUEM-QGZVFWFLSA-N 1 1 332.488 2.997 20 70 EFIDMO C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000159474478 225225440 /nfs/dbraw/zinc/22/54/40/225225440.db2.gz YEHFCSDHZWGOME-IUCAKERBSA-N 1 1 338.757 2.998 20 70 EFIDMO C[C@H]1C[C@H](NC(=O)N(C)Cc2cscn2)C[N@H+]1Cc1ccccc1 ZINC000159896477 225297874 /nfs/dbraw/zinc/29/78/74/225297874.db2.gz OJERRNCVMQAKPR-HOCLYGCPSA-N 1 1 344.484 2.948 20 70 EFIDMO CN(C(=O)CSc1nccc2ccccc21)[C@H]1CCC[N@@H+](C)C1 ZINC000159912554 225302247 /nfs/dbraw/zinc/30/22/47/225302247.db2.gz HITORAJHXSFDHF-HNNXBMFYSA-N 1 1 329.469 2.880 20 70 EFIDMO Cc1cc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c(F)cc1F ZINC000160264283 225376324 /nfs/dbraw/zinc/37/63/24/225376324.db2.gz PSJKPDSXDBGNQZ-UHFFFAOYSA-N 1 1 340.414 2.704 20 70 EFIDMO C[C@H]1C[C@@H](NC(=O)N(C)Cc2cccnc2)C[N@H+]1Cc1ccccc1 ZINC000160287874 225380995 /nfs/dbraw/zinc/38/09/95/225380995.db2.gz IJLYEGMCDOOAAV-QFBILLFUSA-N 1 1 338.455 2.886 20 70 EFIDMO C[C@H](c1nc(Cc2ccccc2)no1)[NH+]1CCC(C2OCCO2)CC1 ZINC000160176785 225355836 /nfs/dbraw/zinc/35/58/36/225355836.db2.gz AOMGVMRVIXALNN-CQSZACIVSA-N 1 1 343.427 2.806 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc(C(=O)N(C)C)cn1 ZINC000160219880 225364339 /nfs/dbraw/zinc/36/43/39/225364339.db2.gz PFGQQSSKBYWSOM-QAPCUYQASA-N 1 1 338.455 2.716 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc2nnc(C3CC3)n2n1 ZINC000160238078 225366610 /nfs/dbraw/zinc/36/66/10/225366610.db2.gz PRSAWDUSAQUAME-YOEHRIQHSA-N 1 1 348.454 2.934 20 70 EFIDMO C[NH+](C)[C@H](CNC(=O)N1CCc2c(F)cccc2C1)c1ccco1 ZINC000161141033 225556674 /nfs/dbraw/zinc/55/66/74/225556674.db2.gz BHSKLDRXZYBBRQ-MRXNPFEDSA-N 1 1 331.391 2.789 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)C[C@@H]1CCc2ccccc21 ZINC000159877302 544799193 /nfs/dbraw/zinc/79/91/93/544799193.db2.gz WNEKKGBLRDSOHH-SFHVURJKSA-N 1 1 344.499 2.923 20 70 EFIDMO C[NH+]1CCN(CC(=O)N[C@@H](c2cccc(Cl)c2)C2CCCC2)CC1 ZINC000159810675 544799745 /nfs/dbraw/zinc/79/97/45/544799745.db2.gz XBLFLPCNGYLPRP-LJQANCHMSA-N 1 1 349.906 2.935 20 70 EFIDMO CCN(C[C@@H]1CCOC1)C(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159999651 544800311 /nfs/dbraw/zinc/80/03/11/544800311.db2.gz FWFZGRMOYHDYMN-WDSOQIARSA-N 1 1 345.487 2.575 20 70 EFIDMO CCO[C@@H]1CCCN(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000160062290 544801252 /nfs/dbraw/zinc/80/12/52/544801252.db2.gz PACKZPAGLWKYPY-YTQUADARSA-N 1 1 345.487 2.860 20 70 EFIDMO C[C@H](NC[C@H](C1CCCCC1)[NH+](C)C)c1cccc(-n2cnnn2)c1 ZINC000160386913 544804987 /nfs/dbraw/zinc/80/49/87/544804987.db2.gz SBNPHQOIZUNZDO-HNAYVOBHSA-N 1 1 342.491 2.823 20 70 EFIDMO C[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2)[N@@H+](C)C[C@H](O)C1CC1 ZINC000160828115 544809018 /nfs/dbraw/zinc/80/90/18/544809018.db2.gz LQTIDYOWCJQWKL-MDOVXXIYSA-N 1 1 344.499 2.834 20 70 EFIDMO Cc1c(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cccc1C(F)(F)F ZINC000161156984 544811432 /nfs/dbraw/zinc/81/14/32/544811432.db2.gz FLEAVLSWIFAYQS-SMDDNHRTSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1c(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1C(F)(F)F ZINC000161156984 544811436 /nfs/dbraw/zinc/81/14/36/544811436.db2.gz FLEAVLSWIFAYQS-SMDDNHRTSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1ccc(NC(=O)NCc2cccc(C[NH+]3CCOCC3)c2)cn1 ZINC000161383029 544813378 /nfs/dbraw/zinc/81/33/78/544813378.db2.gz KGJRUYLLYZVCJZ-UHFFFAOYSA-N 1 1 340.427 2.544 20 70 EFIDMO COc1ccc(OCCCN2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000161361393 544813989 /nfs/dbraw/zinc/81/39/89/544813989.db2.gz WHSSNUFRABENBC-UHFFFAOYSA-N 1 1 327.428 2.681 20 70 EFIDMO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCCC[C@@H]2CCNS(C)(=O)=O)o1 ZINC000159424047 544795037 /nfs/dbraw/zinc/79/50/37/544795037.db2.gz VGCUNVPXZMKCIC-IIAWOOMASA-N 1 1 340.489 2.697 20 70 EFIDMO CC(C)c1ccc(C(=O)N[C@H](C)C2([NH+]3CCOCC3)CCCC2)cn1 ZINC000159736301 278032451 /nfs/dbraw/zinc/03/24/51/278032451.db2.gz LUMYAMJCNQDQOZ-MRXNPFEDSA-N 1 1 345.487 2.968 20 70 EFIDMO C[C@]1(O)CCCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000160587277 280169628 /nfs/dbraw/zinc/16/96/28/280169628.db2.gz JBXIMPPIJWYTIZ-SFHVURJKSA-N 1 1 349.500 2.614 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)Cc1ccc(Cl)cc1 ZINC000159771522 310691386 /nfs/dbraw/zinc/69/13/86/310691386.db2.gz PXTIJUCJPZKACV-UHFFFAOYSA-N 1 1 338.879 2.699 20 70 EFIDMO Cc1ccccc1OC[C@H](O)C[NH+]1CCN(c2cccs2)CC1 ZINC000160307681 310697292 /nfs/dbraw/zinc/69/72/92/310697292.db2.gz IHGRCDLFDFRXPL-MRXNPFEDSA-N 1 1 332.469 2.618 20 70 EFIDMO CCc1oc(C(=O)OC)cc1C[NH+]1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000161199838 310707210 /nfs/dbraw/zinc/70/72/10/310707210.db2.gz DRYFWQGQXUHRIR-CQSZACIVSA-N 1 1 349.349 2.764 20 70 EFIDMO CS[C@H](C)CC(=O)NCc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000161089139 473205581 /nfs/dbraw/zinc/20/55/81/473205581.db2.gz SIINNOZEFJYGRN-HUUCEWRRSA-N 1 1 336.501 2.665 20 70 EFIDMO CS[C@H](C)CC(=O)NCc1cccc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000161089139 473205583 /nfs/dbraw/zinc/20/55/83/473205583.db2.gz SIINNOZEFJYGRN-HUUCEWRRSA-N 1 1 336.501 2.665 20 70 EFIDMO CC[N@@H+]1CCO[C@@H](C(=O)NC2(c3ccc(F)cc3F)CCCC2)C1 ZINC000161114124 473207983 /nfs/dbraw/zinc/20/79/83/473207983.db2.gz HUZAYHOJAPYLRL-MRXNPFEDSA-N 1 1 338.398 2.571 20 70 EFIDMO CC[N@H+]1CCO[C@@H](C(=O)NC2(c3ccc(F)cc3F)CCCC2)C1 ZINC000161114124 473207986 /nfs/dbraw/zinc/20/79/86/473207986.db2.gz HUZAYHOJAPYLRL-MRXNPFEDSA-N 1 1 338.398 2.571 20 70 EFIDMO COCCC1(CNC(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)CCCC1 ZINC000161125547 473209246 /nfs/dbraw/zinc/20/92/46/473209246.db2.gz AYGWBVSYZACHQG-MRXNPFEDSA-N 1 1 337.508 2.899 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)NCc1ccccc1OC ZINC000161129345 473210155 /nfs/dbraw/zinc/21/01/55/473210155.db2.gz ONDODODFXVFTEN-HNNXBMFYSA-N 1 1 327.428 2.617 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)NCc1ccccc1OC ZINC000161129345 473210158 /nfs/dbraw/zinc/21/01/58/473210158.db2.gz ONDODODFXVFTEN-HNNXBMFYSA-N 1 1 327.428 2.617 20 70 EFIDMO CC(C)[N@@H+]1C[C@H](NC(=O)c2c[nH]nc2-c2ccccc2F)[C@@H](C)C1 ZINC000161134409 473210235 /nfs/dbraw/zinc/21/02/35/473210235.db2.gz PBQJVCXWNDBJHT-LRDDRELGSA-N 1 1 330.407 2.674 20 70 EFIDMO COCCOc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1OC ZINC000161195727 473215861 /nfs/dbraw/zinc/21/58/61/473215861.db2.gz KCEYQWDOPKKCCD-ZOBUZTSGSA-N 1 1 336.476 2.854 20 70 EFIDMO COCCOc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000161195727 473215866 /nfs/dbraw/zinc/21/58/66/473215866.db2.gz KCEYQWDOPKKCCD-ZOBUZTSGSA-N 1 1 336.476 2.854 20 70 EFIDMO CCC[N@@H+](CCO)Cc1cc(Br)c2c(c1)OCCCO2 ZINC000161195324 473216260 /nfs/dbraw/zinc/21/62/60/473216260.db2.gz XHSUJCPRWVMMEZ-UHFFFAOYSA-N 1 1 344.249 2.815 20 70 EFIDMO CCn1cc([C@H](C)NCc2ccccc2C[NH+]2CCC(O)CC2)cn1 ZINC000161197710 473217208 /nfs/dbraw/zinc/21/72/08/473217208.db2.gz ZEBMJRGOXYYJKX-INIZCTEOSA-N 1 1 342.487 2.711 20 70 EFIDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)CCN1CCCC1=O ZINC000161231848 473219713 /nfs/dbraw/zinc/21/97/13/473219713.db2.gz ICAYIDDDDSSCTA-UHFFFAOYSA-N 1 1 326.444 2.564 20 70 EFIDMO CC[N@H+]1CC[C@H](CNC(=O)c2cc(C)nc3ccc(OC)cc32)C1 ZINC000161322509 473226875 /nfs/dbraw/zinc/22/68/75/473226875.db2.gz YMXKNLWXWJEBCM-CQSZACIVSA-N 1 1 327.428 2.623 20 70 EFIDMO CCOCCC1(CNC(=O)NC[C@H]2CCC[N@@H+](CC(C)C)C2)CC1 ZINC000161342447 473228685 /nfs/dbraw/zinc/22/86/85/473228685.db2.gz KTPCENDISYWKKA-QGZVFWFLSA-N 1 1 339.524 2.860 20 70 EFIDMO COc1ccc(C[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)cc1F ZINC000161405850 473232647 /nfs/dbraw/zinc/23/26/47/473232647.db2.gz YKSMAGKZQZBSTN-AWEZNQCLSA-N 1 1 330.407 2.752 20 70 EFIDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)[C@H](C)C(=O)NCC(F)(F)F ZINC000161466265 473237267 /nfs/dbraw/zinc/23/72/67/473237267.db2.gz YJHVSTQKJDPMOX-LLVKDONJSA-N 1 1 348.365 2.593 20 70 EFIDMO Cc1ccc(-c2[nH]nc(NC(=O)C[N@@H+](C)[C@@H]3CCSC3)c2C)o1 ZINC000161469270 473238133 /nfs/dbraw/zinc/23/81/33/473238133.db2.gz VTYUIUNFXFIRQF-GFCCVEGCSA-N 1 1 334.445 2.662 20 70 EFIDMO Cc1ccc(-c2[nH]nc(NC(=O)C[N@H+](C)[C@@H]3CCSC3)c2C)o1 ZINC000161469270 473238136 /nfs/dbraw/zinc/23/81/36/473238136.db2.gz VTYUIUNFXFIRQF-GFCCVEGCSA-N 1 1 334.445 2.662 20 70 EFIDMO C[C@@H](c1cccc(Cl)c1)N1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1 ZINC000159365281 473021372 /nfs/dbraw/zinc/02/13/72/473021372.db2.gz GKHRIWUQVPEZQL-SUMWQHHRSA-N 1 1 335.879 2.815 20 70 EFIDMO C[C@@H](c1cccc(Cl)c1)[NH+]1CCC(N2CCC[C@@H]2C(N)=O)CC1 ZINC000159365281 473021378 /nfs/dbraw/zinc/02/13/78/473021378.db2.gz GKHRIWUQVPEZQL-SUMWQHHRSA-N 1 1 335.879 2.815 20 70 EFIDMO C[N@H+](CC(=O)Nc1nc(-c2cccnc2)cs1)[C@@H]1CCSC1 ZINC000159362279 473022336 /nfs/dbraw/zinc/02/23/36/473022336.db2.gz BSKZFUVIEFFKAU-GFCCVEGCSA-N 1 1 334.470 2.581 20 70 EFIDMO C[N@@H+](CC(=O)Nc1nc(-c2cccnc2)cs1)[C@@H]1CCSC1 ZINC000159362279 473022341 /nfs/dbraw/zinc/02/23/41/473022341.db2.gz BSKZFUVIEFFKAU-GFCCVEGCSA-N 1 1 334.470 2.581 20 70 EFIDMO Cc1cccc(N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)[nH+]1 ZINC000159375969 473023069 /nfs/dbraw/zinc/02/30/69/473023069.db2.gz CCJBMVCWUWUMAV-UHFFFAOYSA-N 1 1 329.831 2.935 20 70 EFIDMO C[C@@H](O)C[N@H+](C)[C@@H](C)C(=O)N(c1nccs1)C1CCCCC1 ZINC000159406213 473025917 /nfs/dbraw/zinc/02/59/17/473025917.db2.gz BZRAPEFYGUZSAR-OLZOCXBDSA-N 1 1 325.478 2.510 20 70 EFIDMO C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)N(c1nccs1)C1CCCCC1 ZINC000159406213 473025922 /nfs/dbraw/zinc/02/59/22/473025922.db2.gz BZRAPEFYGUZSAR-OLZOCXBDSA-N 1 1 325.478 2.510 20 70 EFIDMO CC[C@H](c1ccc(F)cc1)N1CCC([N@@H+]2CCC[C@@H]2C(N)=O)CC1 ZINC000159402125 473026227 /nfs/dbraw/zinc/02/62/27/473026227.db2.gz CGJMPHPNZYPOQL-QZTJIDSGSA-N 1 1 333.451 2.691 20 70 EFIDMO CC[C@H](c1ccc(F)cc1)N1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1 ZINC000159402125 473026235 /nfs/dbraw/zinc/02/62/35/473026235.db2.gz CGJMPHPNZYPOQL-QZTJIDSGSA-N 1 1 333.451 2.691 20 70 EFIDMO C/C(=C/c1ccccc1)C[N@H+]1CCCC[C@@H]1CCNS(C)(=O)=O ZINC000159425185 473027196 /nfs/dbraw/zinc/02/71/96/473027196.db2.gz QMDKYXYZQYVTJA-HRYDCMBCSA-N 1 1 336.501 2.884 20 70 EFIDMO CS(=O)(=O)NCC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1F ZINC000159438461 473028719 /nfs/dbraw/zinc/02/87/19/473028719.db2.gz SJEWJKRLZGYTHB-AWEZNQCLSA-N 1 1 348.871 2.773 20 70 EFIDMO CS(=O)(=O)NCC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1F ZINC000159438461 473028717 /nfs/dbraw/zinc/02/87/17/473028717.db2.gz SJEWJKRLZGYTHB-AWEZNQCLSA-N 1 1 348.871 2.773 20 70 EFIDMO COc1ccccc1[C@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)C1 ZINC000159455097 473029830 /nfs/dbraw/zinc/02/98/30/473029830.db2.gz BEHZOPHCTSQOKC-HOTGVXAUSA-N 1 1 331.460 2.536 20 70 EFIDMO Cc1noc(C2CC[NH+]([C@H]3CCN(c4ccc(C)cc4)C3=O)CC2)n1 ZINC000159496055 473032347 /nfs/dbraw/zinc/03/23/47/473032347.db2.gz RYOLILSEBNWWST-KRWDZBQOSA-N 1 1 340.427 2.671 20 70 EFIDMO Cc1cccc(C[NH+]2CCN(C(=O)[C@H](C)C3CCOCC3)CC2)c1 ZINC000159497309 473033183 /nfs/dbraw/zinc/03/31/83/473033183.db2.gz HFGBEGQVOJSYMG-QGZVFWFLSA-N 1 1 330.472 2.702 20 70 EFIDMO CCNC(=O)c1cccc(NC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c1 ZINC000159615993 473044464 /nfs/dbraw/zinc/04/44/64/473044464.db2.gz HRRNZOIOAPTLNB-YOEHRIQHSA-N 1 1 329.444 2.639 20 70 EFIDMO CCc1c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cnn1CC(C)C ZINC000159726936 473055349 /nfs/dbraw/zinc/05/53/49/473055349.db2.gz FPFJAFXHFASCEX-QAPCUYQASA-N 1 1 332.492 2.658 20 70 EFIDMO CCOc1cc(Cl)ccc1CNC(=O)NC[C@H]1CCC[N@H+]1C ZINC000159720490 473055402 /nfs/dbraw/zinc/05/54/02/473055402.db2.gz SFVIVOUGEPTIFP-CQSZACIVSA-N 1 1 325.840 2.632 20 70 EFIDMO C[N@H+](Cc1cc2c(cc1Br)OCO2)C[C@@H]1CCC[C@@H]1O ZINC000159725419 473055432 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C[C@H](NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000159909125 473071405 /nfs/dbraw/zinc/07/14/05/473071405.db2.gz FAVQNVWLASHINF-RMRDIRSESA-N 1 1 349.519 2.896 20 70 EFIDMO O[C@H](CNCc1ccc(F)c(Cl)c1)C[N@@H+]1CCc2ccccc2C1 ZINC000159951627 473076182 /nfs/dbraw/zinc/07/61/82/473076182.db2.gz DFGXLCYMNVJGOA-QGZVFWFLSA-N 1 1 348.849 2.988 20 70 EFIDMO O[C@H](CNCc1ccc(F)c(Cl)c1)C[N@H+]1CCc2ccccc2C1 ZINC000159951627 473076187 /nfs/dbraw/zinc/07/61/87/473076187.db2.gz DFGXLCYMNVJGOA-QGZVFWFLSA-N 1 1 348.849 2.988 20 70 EFIDMO C[N@@H+](CC(=O)NCCc1ccc2ccccc2c1)[C@H]1CCSC1 ZINC000159989834 473079064 /nfs/dbraw/zinc/07/90/64/473079064.db2.gz LGSSKVLHRSOPIX-SFHVURJKSA-N 1 1 328.481 2.936 20 70 EFIDMO CC[C@@H](C)[C@](C)(O)CNC(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000160004972 473079826 /nfs/dbraw/zinc/07/98/26/473079826.db2.gz MCCGDFJHTYZNFI-IXIUHKBRSA-N 1 1 347.503 2.603 20 70 EFIDMO CC[C@@H](C)[C@@](C)(O)CNC(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000160005235 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CC[N@H+]1CCCN(C(=O)NCC[C@H](C)c2ccc(OC)cc2)CC1 ZINC000159907145 529025389 /nfs/dbraw/zinc/02/53/89/529025389.db2.gz TUZGHYCEYIPDIB-INIZCTEOSA-N 1 1 333.476 2.926 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)CC1 ZINC000159880285 529026683 /nfs/dbraw/zinc/02/66/83/529026683.db2.gz WKRKVZJTZSTYEE-CVEARBPZSA-N 1 1 325.497 2.565 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2cc(Br)cs2)CC1 ZINC000159678578 529027845 /nfs/dbraw/zinc/02/78/45/529027845.db2.gz OCSZDGJDDWBAFB-UHFFFAOYSA-N 1 1 346.294 2.748 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](C)CCc2ccc(OC)cc2)CC1 ZINC000159775045 529029169 /nfs/dbraw/zinc/02/91/69/529029169.db2.gz UHNHWPRBDHRSBC-MRXNPFEDSA-N 1 1 333.476 2.754 20 70 EFIDMO CC[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1ccccc1 ZINC000160317587 529271661 /nfs/dbraw/zinc/27/16/61/529271661.db2.gz UFNCICMAICEYIE-GOSISDBHSA-N 1 1 332.488 2.997 20 70 EFIDMO CC[C@H](CNC(=O)N1CCC[N@@H+](CC)CC1)Oc1cccc(C)c1 ZINC000159951158 529343242 /nfs/dbraw/zinc/34/32/42/529343242.db2.gz NNFBGVLZWJZQON-QGZVFWFLSA-N 1 1 333.476 2.890 20 70 EFIDMO CC[C@H](CNC(=O)N1CCC[N@@H+](CC)CC1)Oc1ccccc1F ZINC000159947097 529343327 /nfs/dbraw/zinc/34/33/27/529343327.db2.gz KAUKILIMGQHLPC-OAHLLOKOSA-N 1 1 337.439 2.720 20 70 EFIDMO CC[C@@H](C)[N@H+](C)CCN[C@@H](C)c1ccc(NS(=O)(=O)CC)cc1 ZINC000160118966 529343739 /nfs/dbraw/zinc/34/37/39/529343739.db2.gz LDDOEGTZPKDZQG-CABCVRRESA-N 1 1 341.521 2.829 20 70 EFIDMO CC[C@@H](C)[N@@H+](C)CCN[C@@H](C)c1ccc(NS(=O)(=O)CC)cc1 ZINC000160118966 529343741 /nfs/dbraw/zinc/34/37/41/529343741.db2.gz LDDOEGTZPKDZQG-CABCVRRESA-N 1 1 341.521 2.829 20 70 EFIDMO CCc1ccc([C@H](C)CC(=O)N(C)CCC[NH+]2CCN(C)CC2)cc1 ZINC000159688513 529719261 /nfs/dbraw/zinc/71/92/61/529719261.db2.gz HWXXWVYHBWQMNL-GOSISDBHSA-N 1 1 345.531 2.839 20 70 EFIDMO C[N@H+](CCC(=O)Nc1c(Cl)cccc1Cl)[C@H](CN)C1CC1 ZINC000160106033 529871271 /nfs/dbraw/zinc/87/12/71/529871271.db2.gz ZANGVGFOEHHIDJ-CYBMUJFWSA-N 1 1 330.259 2.991 20 70 EFIDMO C[N@@H+](CCC(=O)Nc1c(Cl)cccc1Cl)[C@H](CN)C1CC1 ZINC000160106033 529871273 /nfs/dbraw/zinc/87/12/73/529871273.db2.gz ZANGVGFOEHHIDJ-CYBMUJFWSA-N 1 1 330.259 2.991 20 70 EFIDMO C[N@H+](Cc1ccccc1)CC(C)(C)NCc1cc(C(N)=O)cs1 ZINC000159381060 529999873 /nfs/dbraw/zinc/99/98/73/529999873.db2.gz WNIQEMPMYZWANT-UHFFFAOYSA-N 1 1 331.485 2.847 20 70 EFIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NCc1cc(C(N)=O)cs1 ZINC000159381060 529999875 /nfs/dbraw/zinc/99/98/75/529999875.db2.gz WNIQEMPMYZWANT-UHFFFAOYSA-N 1 1 331.485 2.847 20 70 EFIDMO Cc1ccccc1CNC(=O)C[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159860882 239034217 /nfs/dbraw/zinc/03/42/17/239034217.db2.gz NZFUYWFROZDUPM-UHFFFAOYSA-N 1 1 325.456 2.809 20 70 EFIDMO Cc1ccccc1CNC(=O)C[N@H+](C)Cc1cccc(N(C)C)c1 ZINC000159860882 239034223 /nfs/dbraw/zinc/03/42/23/239034223.db2.gz NZFUYWFROZDUPM-UHFFFAOYSA-N 1 1 325.456 2.809 20 70 EFIDMO OCC[N@H+](CCOCC1CC1)Cc1cc(Br)ccc1F ZINC000160342377 239047821 /nfs/dbraw/zinc/04/78/21/239047821.db2.gz MGKCJMWFZUVDRB-UHFFFAOYSA-N 1 1 346.240 2.809 20 70 EFIDMO OCC[N@@H+](CCOCC1CC1)Cc1cc(Br)ccc1F ZINC000160342377 239047828 /nfs/dbraw/zinc/04/78/28/239047828.db2.gz MGKCJMWFZUVDRB-UHFFFAOYSA-N 1 1 346.240 2.809 20 70 EFIDMO C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000159380358 533649472 /nfs/dbraw/zinc/64/94/72/533649472.db2.gz IQQSZIVRYJXZAM-CVEARBPZSA-N 1 1 326.440 2.917 20 70 EFIDMO CCOCCC1(CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000161343373 286046799 /nfs/dbraw/zinc/04/67/99/286046799.db2.gz UNMCGFMPMLCLEJ-AEFFLSMTSA-N 1 1 349.519 2.852 20 70 EFIDMO COc1ccccc1Oc1ccc(CNC(=O)[C@H]2CSC[NH2+]2)cc1 ZINC000159534997 225234742 /nfs/dbraw/zinc/23/47/42/225234742.db2.gz HLXZDNISISTCPT-OAHLLOKOSA-N 1 1 344.436 2.766 20 70 EFIDMO C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000159426249 225214564 /nfs/dbraw/zinc/21/45/64/225214564.db2.gz FLVQGUFRTUVNRW-HOTGVXAUSA-N 1 1 326.440 2.593 20 70 EFIDMO Cc1ccc(NCCCNC(=O)NC[C@H](C)c2nccs2)[nH+]c1 ZINC000159613465 225248862 /nfs/dbraw/zinc/24/88/62/225248862.db2.gz MXUQTWYJHLXTDQ-ZDUSSCGKSA-N 1 1 333.461 2.751 20 70 EFIDMO Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000160271363 225376493 /nfs/dbraw/zinc/37/64/93/225376493.db2.gz OUPPBXQYOCADGW-QXSJWSMHSA-N 1 1 336.501 2.776 20 70 EFIDMO C[C@H]1C[C@H](NC(=O)N(C)CCOCC2CC2)C[N@H+]1Cc1ccccc1 ZINC000160337404 225389884 /nfs/dbraw/zinc/38/98/84/225389884.db2.gz HRTJJGPBXPMPAF-LPHOPBHVSA-N 1 1 345.487 2.717 20 70 EFIDMO Cc1c(CNC(=O)NCc2ccccc2C[N@H+](C)C(C)C)cnn1C ZINC000160147831 225347841 /nfs/dbraw/zinc/34/78/41/225347841.db2.gz XGGRHMVEKRXKJN-UHFFFAOYSA-N 1 1 343.475 2.568 20 70 EFIDMO Cc1cccc([C@@H](C)NC(=O)NC[C@H](C)C[NH+]2CCOCC2)c1C ZINC000160169404 225353077 /nfs/dbraw/zinc/35/30/77/225353077.db2.gz JEUOWOPZYSDHPL-WMLDXEAASA-N 1 1 333.476 2.632 20 70 EFIDMO Cc1noc(C)c1[C@H](C)CC(=O)N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000160184787 225356365 /nfs/dbraw/zinc/35/63/65/225356365.db2.gz SYPFXJWKCUUOCO-CQSZACIVSA-N 1 1 342.443 2.837 20 70 EFIDMO C[C@@H]1CCCC[N@H+]1CCCNS(=O)(=O)Cc1c(F)cccc1F ZINC000160211837 225362022 /nfs/dbraw/zinc/36/20/22/225362022.db2.gz DUEXCNBCPRXMGK-CYBMUJFWSA-N 1 1 346.443 2.649 20 70 EFIDMO COCCc1nsc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000160217267 225363319 /nfs/dbraw/zinc/36/33/19/225363319.db2.gz WZWWFPYUGYNVMK-HIFRSBDPSA-N 1 1 332.473 2.659 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1nc2ccccc2c(=O)[nH]1 ZINC000160228856 225365490 /nfs/dbraw/zinc/36/54/90/225365490.db2.gz RXVYTKMTGDZPBI-KSSFIOAISA-N 1 1 334.423 2.856 20 70 EFIDMO C[C@H](CNC(=O)N[C@@H]1CC[C@@H](C)c2ccccc21)C[NH+]1CCOCC1 ZINC000159825746 544799305 /nfs/dbraw/zinc/79/93/05/544799305.db2.gz XXKUBHXEPXLRAK-GPMSIDNRSA-N 1 1 345.487 2.893 20 70 EFIDMO C[C@H](NC(=O)Nc1ccccc1OC(C)(C)C)[C@H]1C[N@H+](C)CCO1 ZINC000159814206 544799804 /nfs/dbraw/zinc/79/98/04/544799804.db2.gz FHXVEWMXOGCYRL-XJKSGUPXSA-N 1 1 335.448 2.705 20 70 EFIDMO C[C@H](NC(=O)Nc1ccccc1OC(C)(C)C)[C@H]1C[N@@H+](C)CCO1 ZINC000159814206 544799808 /nfs/dbraw/zinc/79/98/08/544799808.db2.gz FHXVEWMXOGCYRL-XJKSGUPXSA-N 1 1 335.448 2.705 20 70 EFIDMO Cc1cc(NC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1OC(C)C ZINC000160046223 544801993 /nfs/dbraw/zinc/80/19/93/544801993.db2.gz MMICEJWGWJHTON-PBHICJAKSA-N 1 1 335.448 2.623 20 70 EFIDMO Cc1cc(NC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1OC(C)C ZINC000160046223 544801998 /nfs/dbraw/zinc/80/19/98/544801998.db2.gz MMICEJWGWJHTON-PBHICJAKSA-N 1 1 335.448 2.623 20 70 EFIDMO CC[N@@H+]1CCN(C(=O)c2ccc(Br)cc2OC)C[C@H]1C ZINC000160683431 544807337 /nfs/dbraw/zinc/80/73/37/544807337.db2.gz LNNLAEVOOZEOEF-LLVKDONJSA-N 1 1 341.249 2.624 20 70 EFIDMO CC[N@H+]1CCN(C(=O)c2ccc(Br)cc2OC)C[C@H]1C ZINC000160683431 544807342 /nfs/dbraw/zinc/80/73/42/544807342.db2.gz LNNLAEVOOZEOEF-LLVKDONJSA-N 1 1 341.249 2.624 20 70 EFIDMO C[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@H](O)C1CC1 ZINC000160750579 544807682 /nfs/dbraw/zinc/80/76/82/544807682.db2.gz HOKYXUNBYPUCFV-HZMBPMFUSA-N 1 1 330.350 2.735 20 70 EFIDMO CCSc1cc(Cl)ccc1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000161282671 544811102 /nfs/dbraw/zinc/81/11/02/544811102.db2.gz KRNVVOUWDYFMAC-SMDDNHRTSA-N 1 1 342.892 2.901 20 70 EFIDMO CCSc1cc(Cl)ccc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000161282671 544811107 /nfs/dbraw/zinc/81/11/07/544811107.db2.gz KRNVVOUWDYFMAC-SMDDNHRTSA-N 1 1 342.892 2.901 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1)C1CCC1 ZINC000161490543 544815047 /nfs/dbraw/zinc/81/50/47/544815047.db2.gz GADPPLAHRVBLRA-OAHLLOKOSA-N 1 1 331.460 2.871 20 70 EFIDMO CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@@H](C)C(=O)N(C)C(C)C ZINC000160034656 276121469 /nfs/dbraw/zinc/12/14/69/276121469.db2.gz DFHAAUONQAVMGJ-KRWDZBQOSA-N 1 1 346.519 2.875 20 70 EFIDMO CCN(C(=O)NC[C@@H]1CCCCO1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159652127 276299839 /nfs/dbraw/zinc/29/98/39/276299839.db2.gz RRLCACOCZQZODA-MOPGFXCFSA-N 1 1 345.487 2.862 20 70 EFIDMO CCn1cc([C@@H](C)[NH2+][C@@H](CN2CCCC2=O)c2ccccc2)cn1 ZINC000160656540 281630130 /nfs/dbraw/zinc/63/01/30/281630130.db2.gz NAAHOSQTIOIBQP-QAPCUYQASA-N 1 1 326.444 2.917 20 70 EFIDMO CC[C@@H](OC1CCCC1)C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000160257637 310696653 /nfs/dbraw/zinc/69/66/53/310696653.db2.gz ZHQCVLFCIRZVKR-QGZVFWFLSA-N 1 1 340.508 2.541 20 70 EFIDMO CC[N@@H+]1CCO[C@H](C(=O)NC2(c3ccc(F)cc3F)CCCC2)C1 ZINC000161114033 473208473 /nfs/dbraw/zinc/20/84/73/473208473.db2.gz HUZAYHOJAPYLRL-INIZCTEOSA-N 1 1 338.398 2.571 20 70 EFIDMO CC[N@H+]1CCO[C@H](C(=O)NC2(c3ccc(F)cc3F)CCCC2)C1 ZINC000161114033 473208476 /nfs/dbraw/zinc/20/84/76/473208476.db2.gz HUZAYHOJAPYLRL-INIZCTEOSA-N 1 1 338.398 2.571 20 70 EFIDMO CC[C@H](NC(=O)NC[C@H](c1ccco1)[NH+](C)C)c1c(C)noc1C ZINC000161141375 473211260 /nfs/dbraw/zinc/21/12/60/473211260.db2.gz OCEOZOOIFJKOST-UONOGXRCSA-N 1 1 334.420 2.938 20 70 EFIDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NCc1ccccc1CO ZINC000161137077 473211335 /nfs/dbraw/zinc/21/13/35/473211335.db2.gz RBVBEBPDHVZRRO-MRXNPFEDSA-N 1 1 333.476 2.633 20 70 EFIDMO CC[C@@H]([NH2+][C@H](C)C(=O)NC(=O)NC1CCCCC1)c1nccs1 ZINC000161171101 473213794 /nfs/dbraw/zinc/21/37/94/473213794.db2.gz OBIMDDQWFFAFPV-DGCLKSJQSA-N 1 1 338.477 2.731 20 70 EFIDMO CCc1ncc(NC(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)cn1 ZINC000161178859 473215128 /nfs/dbraw/zinc/21/51/28/473215128.db2.gz PJAKTLVOPYYSDN-LBPRGKRZSA-N 1 1 345.472 2.669 20 70 EFIDMO CCc1ncc(NC(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)cn1 ZINC000161178859 473215133 /nfs/dbraw/zinc/21/51/33/473215133.db2.gz PJAKTLVOPYYSDN-LBPRGKRZSA-N 1 1 345.472 2.669 20 70 EFIDMO C[C@H](NC(=O)[C@H](C)[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1)c1ccccc1 ZINC000161179340 473215546 /nfs/dbraw/zinc/21/55/46/473215546.db2.gz PTPPAZSXMTVVEV-JSFADZTLSA-N 1 1 330.472 2.879 20 70 EFIDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCc3ccccc3C2)cc1N ZINC000161185535 473216251 /nfs/dbraw/zinc/21/62/51/473216251.db2.gz PKGMDOPSKAFDMT-ZDUSSCGKSA-N 1 1 325.412 2.663 20 70 EFIDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCc3ccccc3C2)cc1N ZINC000161185535 473216255 /nfs/dbraw/zinc/21/62/55/473216255.db2.gz PKGMDOPSKAFDMT-ZDUSSCGKSA-N 1 1 325.412 2.663 20 70 EFIDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2c[nH]nc2-c2ccc(F)cc2)C1 ZINC000161280511 473224223 /nfs/dbraw/zinc/22/42/23/473224223.db2.gz QZAHNNARIVTACE-WBMJQRKESA-N 1 1 330.407 2.674 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@H+](CC(=O)N(C)[C@@H]2CCCC[C@@H]2C)C1 ZINC000161345998 473228095 /nfs/dbraw/zinc/22/80/95/473228095.db2.gz VJUVSQTWVGNSQD-GVDBMIGSSA-N 1 1 347.507 2.515 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@@H+](CC(=O)N(C)[C@@H]2CCCC[C@@H]2C)C1 ZINC000161345998 473228097 /nfs/dbraw/zinc/22/80/97/473228097.db2.gz VJUVSQTWVGNSQD-GVDBMIGSSA-N 1 1 347.507 2.515 20 70 EFIDMO CCO[C@H](C)c1noc(CN2CC[N@H+](C)C[C@@H]2c2ccccc2)n1 ZINC000161340941 473228341 /nfs/dbraw/zinc/22/83/41/473228341.db2.gz KUSMOJJKFHMDHI-GDBMZVCRSA-N 1 1 330.432 2.656 20 70 EFIDMO CCO[C@H](C)c1noc(CN2CC[N@@H+](C)C[C@@H]2c2ccccc2)n1 ZINC000161340941 473228346 /nfs/dbraw/zinc/22/83/46/473228346.db2.gz KUSMOJJKFHMDHI-GDBMZVCRSA-N 1 1 330.432 2.656 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+]3CC[C@H](C)[C@@H]3C)nc(N)c21 ZINC000161408386 473233964 /nfs/dbraw/zinc/23/39/64/473233964.db2.gz ZPOMJCUISINQFQ-UWVGGRQHSA-N 1 1 332.404 2.520 20 70 EFIDMO COc1ccc(NC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)cc1N ZINC000161382627 473230854 /nfs/dbraw/zinc/23/08/54/473230854.db2.gz ZJPPWPZHCQBOJI-QGZVFWFLSA-N 1 1 325.412 2.881 20 70 EFIDMO CC(C)C[C@@H](CNC(=O)c1ccc(C(C)C)nc1)[NH+]1CCOCC1 ZINC000161436618 473235503 /nfs/dbraw/zinc/23/55/03/473235503.db2.gz NNUBMQUSCKITQL-KRWDZBQOSA-N 1 1 333.476 2.682 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](C)[C@H](C)C3(C)CC3)nc(N)c21 ZINC000161495152 473239731 /nfs/dbraw/zinc/23/97/31/473239731.db2.gz BWRQVPGZBSCMBZ-LLVKDONJSA-N 1 1 346.431 2.911 20 70 EFIDMO CCOCCC[N@H+]1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000159384363 473023527 /nfs/dbraw/zinc/02/35/27/473023527.db2.gz QCSRLZSCTZQZHN-CYBMUJFWSA-N 1 1 325.840 2.812 20 70 EFIDMO CC(C)c1ncc(C[N@H+]2CCCC[C@H]2CCNS(C)(=O)=O)s1 ZINC000159377542 473023510 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/nfs/dbraw/zinc/34/30/47/529343047.db2.gz YCHARVGEXDMZBZ-QGZVFWFLSA-N 1 1 333.476 2.890 20 70 EFIDMO CC[NH+]1CCN(C(=O)NCCSc2ccc(Cl)cc2)CC1 ZINC000216920723 581506114 /nfs/dbraw/zinc/50/61/14/581506114.db2.gz QVBXIXMTABPFSX-UHFFFAOYSA-N 1 1 327.881 2.779 20 70 EFIDMO C[C@@]1(O)CCCN(C(=O)Nc2ccccc2C[NH+]2CCSCC2)C1 ZINC000160587405 239054542 /nfs/dbraw/zinc/05/45/42/239054542.db2.gz JBXIMPPIJWYTIZ-GOSISDBHSA-N 1 1 349.500 2.614 20 70 EFIDMO C[C@@H]([NH2+][C@H]1CCCN(c2ccn(C)n2)C1=O)c1cccc(F)c1F ZINC000159441900 206245441 /nfs/dbraw/zinc/24/54/41/206245441.db2.gz FCMNWRXJTOZMIH-RISCZKNCSA-N 1 1 334.370 2.545 20 70 EFIDMO O=C(NCCOc1ccccc1Cl)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000159628623 206256763 /nfs/dbraw/zinc/25/67/63/206256763.db2.gz NEVILYFSKWLHFL-ZDUSSCGKSA-N 1 1 337.851 2.502 20 70 EFIDMO COC[C@H](C)n1c(C)cc(C(=O)C[N@H+](C)C[C@@H]2CCC[C@@H]2O)c1C ZINC000159659704 206257049 /nfs/dbraw/zinc/25/70/49/206257049.db2.gz ZCTRWKFRLISHLJ-ZVZYQTTQSA-N 1 1 336.476 2.588 20 70 EFIDMO COC[C@H](C)n1c(C)cc(C(=O)C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c1C ZINC000159659704 206257051 /nfs/dbraw/zinc/25/70/51/206257051.db2.gz ZCTRWKFRLISHLJ-ZVZYQTTQSA-N 1 1 336.476 2.588 20 70 EFIDMO COc1cc(C(=O)N2CCN(c3cccc(C)[nH+]3)CC2)ccc1C ZINC000159707740 206259771 /nfs/dbraw/zinc/25/97/71/206259771.db2.gz GFHODVSPEHOPJQ-UHFFFAOYSA-N 1 1 325.412 2.669 20 70 EFIDMO C[N@@H+](Cc1nc2sc3c(c2c(N)n1)CCCC3)C[C@@H]1CCC[C@@H]1O ZINC000159734207 206260773 /nfs/dbraw/zinc/26/07/73/206260773.db2.gz ZOLARMLGNDWTQH-AAEUAGOBSA-N 1 1 346.500 2.745 20 70 EFIDMO C[N@H+](Cc1nc2sc3c(c2c(N)n1)CCCC3)C[C@@H]1CCC[C@@H]1O ZINC000159734207 206260778 /nfs/dbraw/zinc/26/07/78/206260778.db2.gz ZOLARMLGNDWTQH-AAEUAGOBSA-N 1 1 346.500 2.745 20 70 EFIDMO COCCOc1ccc(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC000159754994 206262581 /nfs/dbraw/zinc/26/25/81/206262581.db2.gz RYGJYOBYTXHLRA-QAPCUYQASA-N 1 1 347.459 2.660 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](C)CCc2ccc(OC)cc2)CC1 ZINC000159774891 206261938 /nfs/dbraw/zinc/26/19/38/206261938.db2.gz UHNHWPRBDHRSBC-INIZCTEOSA-N 1 1 333.476 2.754 20 70 EFIDMO C[C@@H]1CC(=O)CC[C@H]1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000159843689 206267759 /nfs/dbraw/zinc/26/77/59/206267759.db2.gz LZEJYCFNHVOYBN-DNVCBOLYSA-N 1 1 328.456 2.556 20 70 EFIDMO CCC[C@@H](CCO)CNC(=O)N[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000159926466 206269981 /nfs/dbraw/zinc/26/99/81/206269981.db2.gz JUUQPQZATCEODD-LNLFQRSKSA-N 1 1 347.503 2.747 20 70 EFIDMO C[C@@H]1C[C@H](NC(=O)N(C)Cc2cscn2)C[N@H+]1Cc1ccccc1 ZINC000159896347 206270306 /nfs/dbraw/zinc/27/03/06/206270306.db2.gz OJERRNCVMQAKPR-ZBFHGGJFSA-N 1 1 344.484 2.948 20 70 EFIDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2ccnc(-n3cccn3)c2)C1 ZINC000159939831 206271405 /nfs/dbraw/zinc/27/14/05/206271405.db2.gz RUJPSJZSGHIVBF-MRXNPFEDSA-N 1 1 341.459 2.509 20 70 EFIDMO CCC[C@@H]1CN(C(=O)Nc2ccc(Cl)nc2)CC[N@H+]1CCOC ZINC000160009998 206274444 /nfs/dbraw/zinc/27/44/44/206274444.db2.gz UUJAQGLRHONHSN-CQSZACIVSA-N 1 1 340.855 2.700 20 70 EFIDMO CC[C@@H](C)[N@H+](C)CCN[C@@H](C)CC(=O)Nc1cccnc1Cl ZINC000160060668 206278292 /nfs/dbraw/zinc/27/82/92/206278292.db2.gz ATZQPPCAVXYNLG-QWHCGFSZSA-N 1 1 326.872 2.772 20 70 EFIDMO CC[C@@H](C)[N@@H+](C)CCN[C@@H](C)CC(=O)Nc1cccnc1Cl ZINC000160060668 206278294 /nfs/dbraw/zinc/27/82/94/206278294.db2.gz ATZQPPCAVXYNLG-QWHCGFSZSA-N 1 1 326.872 2.772 20 70 EFIDMO CCc1ccc([C@H](C)CC(=O)NC[C@@H](C)CN2CC[NH+](C)CC2)cc1 ZINC000160109214 206279255 /nfs/dbraw/zinc/27/92/55/206279255.db2.gz PVUZYEPAUROKCP-QZTJIDSGSA-N 1 1 345.531 2.742 20 70 EFIDMO CC[C@H](C)[N@H+](C)CCN[C@@H](C)c1ccc(NS(=O)(=O)CC)cc1 ZINC000160119109 206280957 /nfs/dbraw/zinc/28/09/57/206280957.db2.gz LDDOEGTZPKDZQG-GJZGRUSLSA-N 1 1 341.521 2.829 20 70 EFIDMO CC[C@H](C)[N@@H+](C)CCN[C@@H](C)c1ccc(NS(=O)(=O)CC)cc1 ZINC000160119109 206280959 /nfs/dbraw/zinc/28/09/59/206280959.db2.gz LDDOEGTZPKDZQG-GJZGRUSLSA-N 1 1 341.521 2.829 20 70 EFIDMO C[C@H]1CCCC[N@H+]1CCCNS(=O)(=O)Cc1c(F)cccc1F ZINC000160211976 206285192 /nfs/dbraw/zinc/28/51/92/206285192.db2.gz DUEXCNBCPRXMGK-ZDUSSCGKSA-N 1 1 346.443 2.649 20 70 EFIDMO C[C@H]1C[C@H](NC(=O)N(C)C[C@@H]2CCCOC2)C[N@H+]1Cc1ccccc1 ZINC000160261980 206286740 /nfs/dbraw/zinc/28/67/40/206286740.db2.gz VVIAAYQKWIGPSC-WDSOQIARSA-N 1 1 345.487 2.717 20 70 EFIDMO C[C@H](NCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(-n2cnnn2)cc1 ZINC000160282816 206288245 /nfs/dbraw/zinc/28/82/45/206288245.db2.gz ISNSIDSLJVNPAA-HOTGVXAUSA-N 1 1 328.464 2.577 20 70 EFIDMO C[C@H](NCCC[N@H+]1CCCC[C@@H]1C)c1ccc(-n2cnnn2)cc1 ZINC000160282816 206288250 /nfs/dbraw/zinc/28/82/50/206288250.db2.gz ISNSIDSLJVNPAA-HOTGVXAUSA-N 1 1 328.464 2.577 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)C(C)(C)c1ccccc1 ZINC000160279062 206288431 /nfs/dbraw/zinc/28/84/31/206288431.db2.gz LHFIHRMGJVCVCA-UHFFFAOYSA-N 1 1 332.488 2.781 20 70 EFIDMO CCOc1ccc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc1 ZINC000160274290 206288657 /nfs/dbraw/zinc/28/86/57/206288657.db2.gz HBZJXRPFGBOWOX-UHFFFAOYSA-N 1 1 334.460 2.516 20 70 EFIDMO C[C@@H]1C[C@H](NC(=O)N(C)Cc2ccncc2)C[N@H+]1Cc1ccccc1 ZINC000160347824 206290877 /nfs/dbraw/zinc/29/08/77/206290877.db2.gz GWYVIBSRGLDIOO-APWZRJJASA-N 1 1 338.455 2.886 20 70 EFIDMO COCC[N@H+](Cc1cnc(N2CCOCC2)s1)Cc1ccccc1 ZINC000160440902 206298094 /nfs/dbraw/zinc/29/80/94/206298094.db2.gz QGDUIRFRPAOQAB-UHFFFAOYSA-N 1 1 347.484 2.628 20 70 EFIDMO COCC[N@@H+](Cc1cnc(N2CCOCC2)s1)Cc1ccccc1 ZINC000160440902 206298100 /nfs/dbraw/zinc/29/81/00/206298100.db2.gz QGDUIRFRPAOQAB-UHFFFAOYSA-N 1 1 347.484 2.628 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(N2CCCC2)nc1 ZINC000160550539 206303105 /nfs/dbraw/zinc/30/31/05/206303105.db2.gz IATLNEPDMNUWHW-QGZVFWFLSA-N 1 1 330.476 2.532 20 70 EFIDMO CC[N@H+](Cc1ccc(OCC(C)C)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000160550743 206303319 /nfs/dbraw/zinc/30/33/19/206303319.db2.gz AIDGCWOKCYVSDS-MRXNPFEDSA-N 1 1 325.474 2.730 20 70 EFIDMO CC[N@@H+](Cc1ccc(OCC(C)C)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000160550743 206303322 /nfs/dbraw/zinc/30/33/22/206303322.db2.gz AIDGCWOKCYVSDS-MRXNPFEDSA-N 1 1 325.474 2.730 20 70 EFIDMO CC(C)S(=O)(=O)CCC[NH+]1CCC([C@@H](O)c2ccccc2)CC1 ZINC000160656181 206307495 /nfs/dbraw/zinc/30/74/95/206307495.db2.gz HKMHIELMWAANMB-SFHVURJKSA-N 1 1 339.501 2.645 20 70 EFIDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000160784057 206312514 /nfs/dbraw/zinc/31/25/14/206312514.db2.gz VCVLQYJOXSNRPW-UHOSZYNNSA-N 1 1 345.487 2.890 20 70 EFIDMO CC[NH+]1CCN(C(=O)N[C@H](c2ccco2)c2ccccc2OC)CC1 ZINC000160784239 206312728 /nfs/dbraw/zinc/31/27/28/206312728.db2.gz SKGZWZNIUMCGGT-SFHVURJKSA-N 1 1 343.427 2.725 20 70 EFIDMO O=C([C@@H]1CCCO1)N1CC[NH+](Cc2cc3ccccc3s2)CC1 ZINC000160978759 206320707 /nfs/dbraw/zinc/32/07/07/206320707.db2.gz AKAGQXRKFWQVFZ-INIZCTEOSA-N 1 1 330.453 2.725 20 70 EFIDMO CC[NH2+]CC1CCN(C(=O)[C@H](c2ccccc2)N(CC)CC)CC1 ZINC000161050516 206324816 /nfs/dbraw/zinc/32/48/16/206324816.db2.gz AKOVJUXMLRMZCP-IBGZPJMESA-N 1 1 331.504 2.918 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000161094995 206328702 /nfs/dbraw/zinc/32/87/02/206328702.db2.gz BBKJOLNFKGLUBZ-CQSZACIVSA-N 1 1 326.400 2.640 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000161094995 206328706 /nfs/dbraw/zinc/32/87/06/206328706.db2.gz BBKJOLNFKGLUBZ-CQSZACIVSA-N 1 1 326.400 2.640 20 70 EFIDMO Cc1[nH]c(=O)ccc1C(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000161445975 206348800 /nfs/dbraw/zinc/34/88/00/206348800.db2.gz SZMHGACFGILKDC-CQSZACIVSA-N 1 1 341.411 2.741 20 70 EFIDMO COc1ccc(Br)c(C[NH2+][C@@H](C)C(=O)N2CCCC2)c1 ZINC000159712144 533260065 /nfs/dbraw/zinc/26/00/65/533260065.db2.gz HKCOINUWZFPXAT-NSHDSACASA-N 1 1 341.249 2.558 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ncc(C(N)=O)cc1Cl ZINC000160243379 225369869 /nfs/dbraw/zinc/36/98/69/225369869.db2.gz AKEQFGUOCLWWDT-LRDDRELGSA-N 1 1 344.846 2.766 20 70 EFIDMO CCCn1ccc2ccc(NC(=O)N[C@H](C)[C@H]3C[N@H+](C)CCO3)cc21 ZINC000159941968 544800453 /nfs/dbraw/zinc/80/04/53/544800453.db2.gz AFENVXOQLOVVAQ-RDTXWAMCSA-N 1 1 344.459 2.892 20 70 EFIDMO CCCn1ccc2ccc(NC(=O)N[C@H](C)[C@H]3C[N@@H+](C)CCO3)cc21 ZINC000159941968 544800458 /nfs/dbraw/zinc/80/04/58/544800458.db2.gz AFENVXOQLOVVAQ-RDTXWAMCSA-N 1 1 344.459 2.892 20 70 EFIDMO C[C@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)[C@@H]1C[N@H+](C)CCO1 ZINC000160024199 544801738 /nfs/dbraw/zinc/80/17/38/544801738.db2.gz XLSFOVQMVLEUEJ-FZMZJTMJSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)[C@@H]1C[N@@H+](C)CCO1 ZINC000160024199 544801741 /nfs/dbraw/zinc/80/17/41/544801741.db2.gz XLSFOVQMVLEUEJ-FZMZJTMJSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)[C@@H]1C[N@H+](C)CCO1 ZINC000160024305 544801789 /nfs/dbraw/zinc/80/17/89/544801789.db2.gz XLSFOVQMVLEUEJ-RISCZKNCSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)[C@@H]1C[N@@H+](C)CCO1 ZINC000160024305 544801793 /nfs/dbraw/zinc/80/17/93/544801793.db2.gz XLSFOVQMVLEUEJ-RISCZKNCSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC[C@@H](C1CCCCC1)[NH+](C)C)c1cccc(-n2cnnn2)c1 ZINC000160386802 544805216 /nfs/dbraw/zinc/80/52/16/544805216.db2.gz SBNPHQOIZUNZDO-BEFAXECRSA-N 1 1 342.491 2.823 20 70 EFIDMO CSc1ccc(NC(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc1Cl ZINC000160347708 544805492 /nfs/dbraw/zinc/80/54/92/544805492.db2.gz QTGRVQUEKKEQTN-GWCFXTLKSA-N 1 1 343.880 2.903 20 70 EFIDMO CSc1ccc(NC(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1Cl ZINC000160347708 544805495 /nfs/dbraw/zinc/80/54/95/544805495.db2.gz QTGRVQUEKKEQTN-GWCFXTLKSA-N 1 1 343.880 2.903 20 70 EFIDMO O=C1NC2(CCCC2)C(=O)N1CC[N@@H+](CC1CC1)C1CCCCC1 ZINC000160418797 544805555 /nfs/dbraw/zinc/80/55/55/544805555.db2.gz YKZSJSWXYZKXLC-UHFFFAOYSA-N 1 1 333.476 2.896 20 70 EFIDMO CCOc1cc(Cl)ccc1NC(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000160572792 544807963 /nfs/dbraw/zinc/80/79/63/544807963.db2.gz NQFJSKGBUNCXGL-ABAIWWIYSA-N 1 1 341.839 2.579 20 70 EFIDMO CCOc1cc(Cl)ccc1NC(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000160572792 544807967 /nfs/dbraw/zinc/80/79/67/544807967.db2.gz NQFJSKGBUNCXGL-ABAIWWIYSA-N 1 1 341.839 2.579 20 70 EFIDMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCCC[C@@H]2CCNS(C)(=O)=O)o1 ZINC000159423793 544794877 /nfs/dbraw/zinc/79/48/77/544794877.db2.gz VGCUNVPXZMKCIC-FMKPAKJESA-N 1 1 340.489 2.697 20 70 EFIDMO CCCC(=O)Nc1cccc(CNC(=O)N2CCC[N@@H+](CC)CC2)c1 ZINC000159643837 544797242 /nfs/dbraw/zinc/79/72/42/544797242.db2.gz LYGIRZCJKSODDK-UHFFFAOYSA-N 1 1 346.475 2.662 20 70 EFIDMO Cc1nccc(NC(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2)c1Cl ZINC000159573983 544797277 /nfs/dbraw/zinc/79/72/77/544797277.db2.gz RIISETWOOQYXRX-AWEZNQCLSA-N 1 1 340.855 2.522 20 70 EFIDMO OC[C@H]1CCCC[N@@H+]1Cc1cc2c(cc1Br)OCO2 ZINC000159774496 275049943 /nfs/dbraw/zinc/04/99/43/275049943.db2.gz XCOYOAHHAIPNCG-LLVKDONJSA-N 1 1 328.206 2.525 20 70 EFIDMO OC[C@H]1CCCC[N@H+]1Cc1cc2c(cc1Br)OCO2 ZINC000159774496 275049945 /nfs/dbraw/zinc/04/99/45/275049945.db2.gz XCOYOAHHAIPNCG-LLVKDONJSA-N 1 1 328.206 2.525 20 70 EFIDMO Cc1cnccc1CCNC(=O)N[C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000159937290 279026608 /nfs/dbraw/zinc/02/66/08/279026608.db2.gz VSMMZIZYHLUJMX-HLLBOEOZSA-N 1 1 332.492 2.598 20 70 EFIDMO CC[C@@H](CNC(=O)N1CCO[C@@H](C)[C@@H]1C)[N@H+]1CCc2ccccc2C1 ZINC000159871654 280142300 /nfs/dbraw/zinc/14/23/00/280142300.db2.gz MSCRMZKVLPLEHG-BXWFABGCSA-N 1 1 345.487 2.642 20 70 EFIDMO C[C@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1ccccc1F ZINC000159720843 310690858 /nfs/dbraw/zinc/69/08/58/310690858.db2.gz XHTBXMYXZQCIGM-HNNXBMFYSA-N 1 1 336.451 2.746 20 70 EFIDMO COc1cccc(N2CC[NH+](Cc3ccccc3NC(C)=O)CC2)c1 ZINC000160695035 310701935 /nfs/dbraw/zinc/70/19/35/310701935.db2.gz QBYUQFDDAHOFTC-UHFFFAOYSA-N 1 1 339.439 2.976 20 70 EFIDMO CCN(C(=O)NCc1ncoc1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000161118581 473209207 /nfs/dbraw/zinc/20/92/07/473209207.db2.gz SHZLRJKUYIGVQL-KRWDZBQOSA-N 1 1 342.443 2.789 20 70 EFIDMO CC[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)c1c(C)noc1C ZINC000161141155 473210861 /nfs/dbraw/zinc/21/08/61/473210861.db2.gz OCEOZOOIFJKOST-KBPBESRZSA-N 1 1 334.420 2.938 20 70 EFIDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCc3ccccc3C2)cc1N ZINC000161185669 473215739 /nfs/dbraw/zinc/21/57/39/473215739.db2.gz PKGMDOPSKAFDMT-CYBMUJFWSA-N 1 1 325.412 2.663 20 70 EFIDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCc3ccccc3C2)cc1N ZINC000161185669 473215742 /nfs/dbraw/zinc/21/57/42/473215742.db2.gz PKGMDOPSKAFDMT-CYBMUJFWSA-N 1 1 325.412 2.663 20 70 EFIDMO CCc1cccc(OCC[NH+]2CCN(Cc3ccncc3)CC2)c1 ZINC000161191917 473216170 /nfs/dbraw/zinc/21/61/70/473216170.db2.gz CXAUWJWNDCCQLE-UHFFFAOYSA-N 1 1 325.456 2.841 20 70 EFIDMO Cc1nnc(C[N@H+](C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)o1 ZINC000161228923 473219248 /nfs/dbraw/zinc/21/92/48/473219248.db2.gz NSTHDPNQYKSCHV-UHFFFAOYSA-N 1 1 329.379 2.972 20 70 EFIDMO Cc1nnc(C[N@@H+](C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)o1 ZINC000161228923 473219254 /nfs/dbraw/zinc/21/92/54/473219254.db2.gz NSTHDPNQYKSCHV-UHFFFAOYSA-N 1 1 329.379 2.972 20 70 EFIDMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc(C)nc3ccc(OC)cc32)C1 ZINC000161322621 473226349 /nfs/dbraw/zinc/22/63/49/473226349.db2.gz YMXKNLWXWJEBCM-AWEZNQCLSA-N 1 1 327.428 2.623 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@@H+]([C@@H](C)C(=O)NCC2CCCCC2)C1 ZINC000161329014 473226411 /nfs/dbraw/zinc/22/64/11/473226411.db2.gz WYJQTCKLENDNRY-RDJZCZTQSA-N 1 1 347.507 2.562 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@H+]([C@@H](C)C(=O)NCC2CCCCC2)C1 ZINC000161329014 473226416 /nfs/dbraw/zinc/22/64/16/473226416.db2.gz WYJQTCKLENDNRY-RDJZCZTQSA-N 1 1 347.507 2.562 20 70 EFIDMO COc1ccc(OC)c(C[N@H+]2CCC[C@@H](c3nnc4n3CCC4)C2)c1 ZINC000161405128 473233039 /nfs/dbraw/zinc/23/30/39/473233039.db2.gz CXUHDIRYVUUNEC-CQSZACIVSA-N 1 1 342.443 2.621 20 70 EFIDMO c1nn(-c2ccccc2)cc1C[N@H+]1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000161402012 473233067 /nfs/dbraw/zinc/23/30/67/473233067.db2.gz DEELYYVCYGWUSB-QGZVFWFLSA-N 1 1 348.454 2.790 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@@H+]([C@@H](C)C(=O)N(C)c2ccccc2)C1 ZINC000161420620 473234887 /nfs/dbraw/zinc/23/48/87/473234887.db2.gz HDOJCHJLKQPIJM-HOTGVXAUSA-N 1 1 341.459 2.529 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@H+]([C@@H](C)C(=O)N(C)c2ccccc2)C1 ZINC000161420620 473234888 /nfs/dbraw/zinc/23/48/88/473234888.db2.gz HDOJCHJLKQPIJM-HOTGVXAUSA-N 1 1 341.459 2.529 20 70 EFIDMO CN(CCOCc1ccccc1)C(=O)C[N@H+](C)Cc1ccccc1 ZINC000161431601 473235219 /nfs/dbraw/zinc/23/52/19/473235219.db2.gz LJUNKLLFKSROQY-UHFFFAOYSA-N 1 1 326.440 2.794 20 70 EFIDMO CN(CCOCc1ccccc1)C(=O)C[N@@H+](C)Cc1ccccc1 ZINC000161431601 473235221 /nfs/dbraw/zinc/23/52/21/473235221.db2.gz LJUNKLLFKSROQY-UHFFFAOYSA-N 1 1 326.440 2.794 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1csc([C@H]2CCCO2)n1 ZINC000161479430 473239264 /nfs/dbraw/zinc/23/92/64/473239264.db2.gz XKOIVQWSHQRSDZ-UKRRQHHQSA-N 1 1 337.489 2.845 20 70 EFIDMO C[N@@H+](CCCNC(=O)N[C@H]1CCOC(C)(C)C1)C1CCCCC1 ZINC000161491939 473239970 /nfs/dbraw/zinc/23/99/70/473239970.db2.gz KYSMWCNCCFTTET-HNNXBMFYSA-N 1 1 325.497 2.898 20 70 EFIDMO CCOCCC[N@H+]1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000159384222 473023105 /nfs/dbraw/zinc/02/31/05/473023105.db2.gz QCSRLZSCTZQZHN-ZDUSSCGKSA-N 1 1 325.840 2.812 20 70 EFIDMO Cc1ccc(C[C@H](C)NC(=O)NC[C@H](C)C[NH+]2CCOCC2)c(C)c1 ZINC000159475815 473030874 /nfs/dbraw/zinc/03/08/74/473030874.db2.gz XILPRVIUAFYOQE-WMZOPIPTSA-N 1 1 347.503 2.502 20 70 EFIDMO Cc1ccc(C[C@@H](C)NC(=O)NC[C@H](C)C[NH+]2CCOCC2)c(C)c1 ZINC000159475676 473031243 /nfs/dbraw/zinc/03/12/43/473031243.db2.gz XILPRVIUAFYOQE-FUHWJXTLSA-N 1 1 347.503 2.502 20 70 EFIDMO CC(C)[N@@H+]1C[C@H](NC(=O)c2cccc(Nc3cnn(C)c3)c2)[C@@H](C)C1 ZINC000159476947 473031867 /nfs/dbraw/zinc/03/18/67/473031867.db2.gz WCTNKUANQVMSDE-KSSFIOAISA-N 1 1 341.459 2.622 20 70 EFIDMO O=C(CC[N@H+]1CCO[C@@]2(CCc3ccccc32)C1)N1CCCCC1 ZINC000159567323 473039836 /nfs/dbraw/zinc/03/98/36/473039836.db2.gz FJJKBUCHYIZBPL-FQEVSTJZSA-N 1 1 328.456 2.563 20 70 EFIDMO O=C(c1cccc(Cl)c1)N1CCC[N@@H+](CCOCC2CC2)CC1 ZINC000159582454 473041183 /nfs/dbraw/zinc/04/11/83/473041183.db2.gz KENQOCJROUXYID-UHFFFAOYSA-N 1 1 336.863 2.915 20 70 EFIDMO O=C(CC[N@H+]1CCO[C@@]2(CCc3ccccc32)C1)NC1CCCC1 ZINC000159610493 473043853 /nfs/dbraw/zinc/04/38/53/473043853.db2.gz ZRGFXPAVRJXSQI-FQEVSTJZSA-N 1 1 328.456 2.609 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2cccnc2OC2CCCC2)CC1 ZINC000159607720 473044492 /nfs/dbraw/zinc/04/44/92/473044492.db2.gz FQFZVBCHXCVRHE-UHFFFAOYSA-N 1 1 346.475 2.640 20 70 EFIDMO CC(C)c1ccc(C[C@H](C)NC(=O)NCCC[NH+]2CCOCC2)cc1 ZINC000159654993 473048052 /nfs/dbraw/zinc/04/80/52/473048052.db2.gz VIDQWABGZRUEQF-KRWDZBQOSA-N 1 1 347.503 2.763 20 70 EFIDMO CC[N@@H+]1CCc2nc(NC(=O)/C=C/c3cncc(C)c3)sc2C1 ZINC000159648372 473048247 /nfs/dbraw/zinc/04/82/47/473048247.db2.gz BMKPSUKYOYRBOX-SNAWJCMRSA-N 1 1 328.441 2.876 20 70 EFIDMO CC[N@H+]1CCc2nc(NC(=O)/C=C/c3cncc(C)c3)sc2C1 ZINC000159648372 473048255 /nfs/dbraw/zinc/04/82/55/473048255.db2.gz BMKPSUKYOYRBOX-SNAWJCMRSA-N 1 1 328.441 2.876 20 70 EFIDMO CCCCS[C@H](C)C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159706148 473052559 /nfs/dbraw/zinc/05/25/59/473052559.db2.gz VWNNBIJRWLXAHD-OAHLLOKOSA-N 1 1 330.538 2.725 20 70 EFIDMO Cc1c(CNC[C@@H](C(C)C)[N@H+]2CCc3ccccc3C2)cnn1C ZINC000159758689 473057973 /nfs/dbraw/zinc/05/79/73/473057973.db2.gz ZPEVKJKLXLCGEL-FQEVSTJZSA-N 1 1 326.488 2.901 20 70 EFIDMO Cc1ccccc1[C@H](NC(=O)NC[C@H](C)C[NH+]1CCOCC1)C(C)C ZINC000159766787 473058759 /nfs/dbraw/zinc/05/87/59/473058759.db2.gz SAAVVFTXMJOOTI-QFBILLFUSA-N 1 1 347.503 2.960 20 70 EFIDMO COc1ccc(Cl)cc1CN(C)C(=O)C[N@@H+](C)[C@H]1CCSC1 ZINC000159807722 473061543 /nfs/dbraw/zinc/06/15/43/473061543.db2.gz UOFHSEYDUUYGGM-AWEZNQCLSA-N 1 1 342.892 2.744 20 70 EFIDMO CCOc1cc(Cl)ccc1CNC(=O)NC[C@H]1CCC[N@@H+](C)C1 ZINC000159808697 473062110 /nfs/dbraw/zinc/06/21/10/473062110.db2.gz WUINPALNXLSVCP-CYBMUJFWSA-N 1 1 339.867 2.880 20 70 EFIDMO COc1cccc(CNC(=O)C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)c1 ZINC000159810445 473062985 /nfs/dbraw/zinc/06/29/85/473062985.db2.gz PPIDSNZLGCTTFP-LJQANCHMSA-N 1 1 339.439 2.852 20 70 EFIDMO COc1cccc(CNC(=O)C[N@H+]2CCC[C@@H]2c2cccc(C)n2)c1 ZINC000159810445 473062992 /nfs/dbraw/zinc/06/29/92/473062992.db2.gz PPIDSNZLGCTTFP-LJQANCHMSA-N 1 1 339.439 2.852 20 70 EFIDMO CC[C@H](CNC(=O)N1CCO[C@H](C)[C@@H]1C)[N@H+]1CCc2ccccc2C1 ZINC000159871539 473068478 /nfs/dbraw/zinc/06/84/78/473068478.db2.gz MSCRMZKVLPLEHG-FRQCXROJSA-N 1 1 345.487 2.642 20 70 EFIDMO Cc1[nH]c2ccccc2c1C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159969395 473076726 /nfs/dbraw/zinc/07/67/26/473076726.db2.gz TVSGAYUWRJNRJD-UHFFFAOYSA-N 1 1 343.471 2.907 20 70 EFIDMO CCOCCC1(CNC(=O)N2CCC[N@@H+](CC)CC2)CCCC1 ZINC000159988726 473078830 /nfs/dbraw/zinc/07/88/30/473078830.db2.gz VOPIBCSVEMLCPG-UHFFFAOYSA-N 1 1 325.497 2.711 20 70 EFIDMO CCOC[C@@H]1CCN(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000160019506 473081023 /nfs/dbraw/zinc/08/10/23/473081023.db2.gz RIOBFKQMQFXIBJ-QXAKKESOSA-N 1 1 345.487 2.717 20 70 EFIDMO Cc1cn(-c2ccccc2Cl)nc1C(=O)NCC[N@H+](C)C(C)C ZINC000160136791 473090706 /nfs/dbraw/zinc/09/07/06/473090706.db2.gz WBJSMKODRUPGPP-UHFFFAOYSA-N 1 1 334.851 2.904 20 70 EFIDMO CC(C)[N@@H+](C)CCNC(=O)CSc1cccc(Br)c1 ZINC000160137796 473091168 /nfs/dbraw/zinc/09/11/68/473091168.db2.gz QNAABRVJXVRLGN-UHFFFAOYSA-N 1 1 345.306 2.998 20 70 EFIDMO CCC[C@@H]([NH2+][C@H](C)c1cnccn1)C(=O)N1CCc2sccc2C1 ZINC000160172853 473093608 /nfs/dbraw/zinc/09/36/08/473093608.db2.gz MNNPPLQWZBGHMF-UKRRQHHQSA-N 1 1 344.484 2.942 20 70 EFIDMO CCC[C@H]([NH2+][C@H](C)c1cnccn1)C(=O)N1CCc2sccc2C1 ZINC000160172733 473093963 /nfs/dbraw/zinc/09/39/63/473093963.db2.gz MNNPPLQWZBGHMF-HIFRSBDPSA-N 1 1 344.484 2.942 20 70 EFIDMO CCC[C@H]1CN(C(=O)NCc2ccc(C)s2)CC[N@H+]1CCOC ZINC000160173058 473093977 /nfs/dbraw/zinc/09/39/77/473093977.db2.gz CCXYSQRGUDRZRH-HNNXBMFYSA-N 1 1 339.505 2.699 20 70 EFIDMO COc1ccccc1CNC(=O)C[N@@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000160227953 473098466 /nfs/dbraw/zinc/09/84/66/473098466.db2.gz REYYKHNEMVCMCW-GOSISDBHSA-N 1 1 339.439 2.852 20 70 EFIDMO COc1ccccc1CNC(=O)C[N@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000160227953 473098473 /nfs/dbraw/zinc/09/84/73/473098473.db2.gz REYYKHNEMVCMCW-GOSISDBHSA-N 1 1 339.439 2.852 20 70 EFIDMO CC[N@H+](CC(=O)NCc1ccc(F)cc1)Cc1ccc2c[nH]nc2c1 ZINC000160231445 473099458 /nfs/dbraw/zinc/09/94/58/473099458.db2.gz RLQXUUSIZJRPCG-UHFFFAOYSA-N 1 1 340.402 2.840 20 70 EFIDMO CC[N@@H+](CC(=O)NCc1ccc(F)cc1)Cc1ccc2c[nH]nc2c1 ZINC000160231445 473099466 /nfs/dbraw/zinc/09/94/66/473099466.db2.gz RLQXUUSIZJRPCG-UHFFFAOYSA-N 1 1 340.402 2.840 20 70 EFIDMO C[C@@H](O)C[C@H](CNC(=O)C[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC000160243292 473100461 /nfs/dbraw/zinc/10/04/61/473100461.db2.gz MPRCXTBNTBASOC-YLJYHZDGSA-N 1 1 340.467 2.789 20 70 EFIDMO C[C@@H](O)C[C@H](CNC(=O)C[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC000160243292 473100465 /nfs/dbraw/zinc/10/04/65/473100465.db2.gz MPRCXTBNTBASOC-YLJYHZDGSA-N 1 1 340.467 2.789 20 70 EFIDMO CCc1ccc([C@H](CO)NC(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc1 ZINC000160247357 473101259 /nfs/dbraw/zinc/10/12/59/473101259.db2.gz ZIXUKIYJAWTAKR-MOPGFXCFSA-N 1 1 347.503 2.702 20 70 EFIDMO COC(=O)c1csc(NC(=O)N(C)CCCn2cc[nH+]c2C)c1 ZINC000160318273 473106838 /nfs/dbraw/zinc/10/68/38/473106838.db2.gz ZQFQTFGNZFDOEP-UHFFFAOYSA-N 1 1 336.417 2.594 20 70 EFIDMO CC[C@H](COC)NC(=O)N(CC)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160337149 473110265 /nfs/dbraw/zinc/11/02/65/473110265.db2.gz FGIKWKYKTNGYHX-MSOLQXFVSA-N 1 1 333.476 2.717 20 70 EFIDMO NC(=O)[C@@H]1CCC[N@@H+]1Cc1cccc(OCc2ccc(F)cc2)c1 ZINC000160364687 473112297 /nfs/dbraw/zinc/11/22/97/473112297.db2.gz PUBPEQOZFRUYTD-SFHVURJKSA-N 1 1 328.387 2.854 20 70 EFIDMO NC(=O)[C@@H]1CCC[N@H+]1Cc1cccc(OCc2ccc(F)cc2)c1 ZINC000160364687 473112303 /nfs/dbraw/zinc/11/23/03/473112303.db2.gz PUBPEQOZFRUYTD-SFHVURJKSA-N 1 1 328.387 2.854 20 70 EFIDMO Cc1nc2ccccn2c1C[N@H+]1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000160443283 473125588 /nfs/dbraw/zinc/12/55/88/473125588.db2.gz XOLIUGHQRRVELE-OAHLLOKOSA-N 1 1 336.443 2.560 20 70 EFIDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2c2nc(C(C)(C)C)ns2)C[C@@H](C)O1 ZINC000160486422 473131432 /nfs/dbraw/zinc/13/14/32/473131432.db2.gz YROYGKVFOWWEKX-MCIONIFRSA-N 1 1 338.521 2.914 20 70 EFIDMO CCC[N@@H+](C)C[C@@H]1CCN([C@@H]2CCCN(c3ccccc3F)C2=O)C1 ZINC000160493546 473132834 /nfs/dbraw/zinc/13/28/34/473132834.db2.gz RPJWNZZJDLCQQN-QFBILLFUSA-N 1 1 347.478 2.985 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(C(F)(F)F)nc1 ZINC000160561950 473142312 /nfs/dbraw/zinc/14/23/12/473142312.db2.gz MXQVAWXQORPARE-CYBMUJFWSA-N 1 1 329.366 2.951 20 70 EFIDMO CC[N@H+](Cc1cccc(-c2ccncc2)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160564985 473143718 /nfs/dbraw/zinc/14/37/18/473143718.db2.gz ZMKMCFVDZRPWPK-GOSISDBHSA-N 1 1 330.453 2.758 20 70 EFIDMO CC[N@@H+](Cc1cccc(-c2ccncc2)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160564985 473143723 /nfs/dbraw/zinc/14/37/23/473143723.db2.gz ZMKMCFVDZRPWPK-GOSISDBHSA-N 1 1 330.453 2.758 20 70 EFIDMO CNC(=O)C1CC[NH+]([C@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)CC1 ZINC000160611365 473150356 /nfs/dbraw/zinc/15/03/56/473150356.db2.gz IKOVMVLLPUNGRV-CQSZACIVSA-N 1 1 342.443 2.872 20 70 EFIDMO O=C(CC[N@@H+]1CCCC[C@H]1c1nnc2n1CCCC2)N1CCCCC1 ZINC000160613175 473150883 /nfs/dbraw/zinc/15/08/83/473150883.db2.gz LVOSKKLXJIVTHC-INIZCTEOSA-N 1 1 345.491 2.544 20 70 EFIDMO O=C(CC[N@H+]1CCCC[C@H]1c1nnc2n1CCCC2)N1CCCCC1 ZINC000160613175 473150890 /nfs/dbraw/zinc/15/08/90/473150890.db2.gz LVOSKKLXJIVTHC-INIZCTEOSA-N 1 1 345.491 2.544 20 70 EFIDMO COc1ccccc1CN(C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)C1CC1 ZINC000160657635 473157581 /nfs/dbraw/zinc/15/75/81/473157581.db2.gz OSISZMFQVZIJRD-QGZVFWFLSA-N 1 1 343.471 2.854 20 70 EFIDMO COc1cc(OC)cc(N2CC[C@@H]([NH2+][C@H](C)c3ccoc3)C2=O)c1 ZINC000160678187 473160255 /nfs/dbraw/zinc/16/02/55/473160255.db2.gz PJHOMZMIWAZLOX-SJKOYZFVSA-N 1 1 330.384 2.753 20 70 EFIDMO O=C1CC[C@@H]2C[N@H+](Cc3cc(F)cc(Br)c3)CC[C@H]2N1 ZINC000160740399 473168450 /nfs/dbraw/zinc/16/84/50/473168450.db2.gz VUGNEGPZAUUNSK-BXUZGUMPSA-N 1 1 341.224 2.689 20 70 EFIDMO O=C1CC[C@@H]2C[N@@H+](Cc3cc(F)cc(Br)c3)CC[C@H]2N1 ZINC000160740399 473168454 /nfs/dbraw/zinc/16/84/54/473168454.db2.gz VUGNEGPZAUUNSK-BXUZGUMPSA-N 1 1 341.224 2.689 20 70 EFIDMO COCCc1nsc(N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)n1 ZINC000160843477 473182570 /nfs/dbraw/zinc/18/25/70/473182570.db2.gz JNVDYRSANSANFY-DZGCQCFKSA-N 1 1 332.473 2.802 20 70 EFIDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000160858759 473183987 /nfs/dbraw/zinc/18/39/87/473183987.db2.gz UKCARCQGZQUQPT-QYZOEREBSA-N 1 1 345.487 2.888 20 70 EFIDMO O=C(NCCCNc1ccccc1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000160879891 473186580 /nfs/dbraw/zinc/18/65/80/473186580.db2.gz GWPJWPAAWSWDSE-QGZVFWFLSA-N 1 1 330.476 2.805 20 70 EFIDMO Cc1ccc(OC[C@H](O)C[N@H+]2CC[C@]3(O)CCCC[C@@H]3C2)c(C)c1 ZINC000160884175 473186608 /nfs/dbraw/zinc/18/66/08/473186608.db2.gz WBDFIUNPUASNOM-QWFCFKBJSA-N 1 1 333.472 2.670 20 70 EFIDMO C[C@@H]1CCC[C@@H](C(=O)NCc2cccc(C[NH+]3CCOCC3)c2)C1 ZINC000160977375 473195693 /nfs/dbraw/zinc/19/56/93/473195693.db2.gz RWUZYQKGGANLKI-VQIMIIECSA-N 1 1 330.472 2.961 20 70 EFIDMO C[C@@H]1CN(C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(Cn2ccccc2=O)cc1 ZINC000161062597 473203491 /nfs/dbraw/zinc/20/34/91/473203491.db2.gz KRHRUPGOGNGDMS-FUHIMQAGSA-N 1 1 339.483 2.715 20 70 EFIDMO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000161062597 473203494 /nfs/dbraw/zinc/20/34/94/473203494.db2.gz KRHRUPGOGNGDMS-FUHIMQAGSA-N 1 1 339.483 2.715 20 70 EFIDMO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000161062597 473203500 /nfs/dbraw/zinc/20/35/00/473203500.db2.gz KRHRUPGOGNGDMS-FUHIMQAGSA-N 1 1 339.483 2.715 20 70 EFIDMO CN(C(=O)CN1CC[N@H+](C)C[C@@H]1c1ccccc1)C1CCCCC1 ZINC000216733293 523820900 /nfs/dbraw/zinc/82/09/00/523820900.db2.gz YBLLHIONKRGPLB-LJQANCHMSA-N 1 1 329.488 2.766 20 70 EFIDMO CN(C(=O)CN1CC[N@@H+](C)C[C@@H]1c1ccccc1)C1CCCCC1 ZINC000216733293 523820908 /nfs/dbraw/zinc/82/09/08/523820908.db2.gz YBLLHIONKRGPLB-LJQANCHMSA-N 1 1 329.488 2.766 20 70 EFIDMO Cc1cccc([C@H]2CCC[N@@H+]2CC(=O)NCc2ccccc2F)n1 ZINC000159985036 524896585 /nfs/dbraw/zinc/89/65/85/524896585.db2.gz IBCDNCJPNDDZGL-GOSISDBHSA-N 1 1 327.403 2.982 20 70 EFIDMO Cc1cccc([C@H]2CCC[N@H+]2CC(=O)NCc2ccccc2F)n1 ZINC000159985036 524896589 /nfs/dbraw/zinc/89/65/89/524896589.db2.gz IBCDNCJPNDDZGL-GOSISDBHSA-N 1 1 327.403 2.982 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H](C)Oc2cccc(Cl)c2)CC1 ZINC000159918361 529024265 /nfs/dbraw/zinc/02/42/65/529024265.db2.gz UCTQNODZYPZQRR-CQSZACIVSA-N 1 1 339.867 2.845 20 70 EFIDMO CC[N@H+]1CCC[C@H]1CNC(=O)NCC(C)(C)c1cccc(OC)c1 ZINC000160327435 529105110 /nfs/dbraw/zinc/10/51/10/529105110.db2.gz HDCKQMRMTKSGNY-INIZCTEOSA-N 1 1 333.476 2.756 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc2ccccc2o1 ZINC000159674891 529846261 /nfs/dbraw/zinc/84/62/61/529846261.db2.gz COBPMNZJRINFDC-UHFFFAOYSA-N 1 1 330.428 2.863 20 70 EFIDMO C[N@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)[C@H](CN)C1CC1 ZINC000160067766 529871391 /nfs/dbraw/zinc/87/13/91/529871391.db2.gz GMEAYMKXMFOBLZ-CQSZACIVSA-N 1 1 330.259 2.991 20 70 EFIDMO C[N@@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)[C@H](CN)C1CC1 ZINC000160067766 529871393 /nfs/dbraw/zinc/87/13/93/529871393.db2.gz GMEAYMKXMFOBLZ-CQSZACIVSA-N 1 1 330.259 2.991 20 70 EFIDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)Nc1ccn(CC(F)(F)F)n1 ZINC000160456931 529931689 /nfs/dbraw/zinc/93/16/89/529931689.db2.gz PIRORZNEIOCCJQ-GFCCVEGCSA-N 1 1 347.385 2.784 20 70 EFIDMO C[C@@H](C(=O)NCc1cccs1)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159864031 533285475 /nfs/dbraw/zinc/28/54/75/533285475.db2.gz GBNODRSOERVQEP-AWEZNQCLSA-N 1 1 331.485 2.951 20 70 EFIDMO C[C@@H]([NH2+][C@@H]1CCCN(c2cnn(C)c2)C1=O)c1cccc(F)c1F ZINC000159515217 533521521 /nfs/dbraw/zinc/52/15/21/533521521.db2.gz FGTIIUYWPKTESC-IAQYHMDHSA-N 1 1 334.370 2.545 20 70 EFIDMO COc1ccc(C[N@@H+](C)Cc2ccccc2OCC(=O)N(C)C)cc1 ZINC000159862855 533543823 /nfs/dbraw/zinc/54/38/23/533543823.db2.gz XHYPHWPGILDAIQ-UHFFFAOYSA-N 1 1 342.439 2.794 20 70 EFIDMO Cc1cccc(N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)[nH+]1 ZINC000159369801 225203962 /nfs/dbraw/zinc/20/39/62/225203962.db2.gz JTAMHBFEJUWMIL-UHFFFAOYSA-N 1 1 334.423 2.763 20 70 EFIDMO Cc1cc(=O)oc2cc(OCC[N@H+](C)C[C@@H]3CCC[C@@H]3O)ccc12 ZINC000159743665 225269161 /nfs/dbraw/zinc/26/91/61/225269161.db2.gz ABSNCZPKPMNWOI-YOEHRIQHSA-N 1 1 331.412 2.573 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCCCC(C)(C)CO ZINC000159743870 225269314 /nfs/dbraw/zinc/26/93/14/225269314.db2.gz MKJDWJCMQXQDKL-WMZOPIPTSA-N 1 1 347.503 2.605 20 70 EFIDMO C[C@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159804771 225281917 /nfs/dbraw/zinc/28/19/17/225281917.db2.gz SLUPCIQTKLCXEF-GJYPPUQNSA-N 1 1 345.487 2.707 20 70 EFIDMO c1ccc(-c2noc(CCCSCC[NH+]3CCOCC3)n2)cc1 ZINC000159962451 225310389 /nfs/dbraw/zinc/31/03/89/225310389.db2.gz MELHACVWNJRZEB-UHFFFAOYSA-N 1 1 333.457 2.735 20 70 EFIDMO C[C@H]1C[N@H+](Cc2cccc(CNC(=O)NC3(C)CCC3)c2)CCO1 ZINC000159996198 225316849 /nfs/dbraw/zinc/31/68/49/225316849.db2.gz HMFVUFPHAJYFKZ-HNNXBMFYSA-N 1 1 331.460 2.649 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2cccc(CNC(=O)NC3(C)CCC3)c2)CCO1 ZINC000159996198 225316852 /nfs/dbraw/zinc/31/68/52/225316852.db2.gz HMFVUFPHAJYFKZ-HNNXBMFYSA-N 1 1 331.460 2.649 20 70 EFIDMO Fc1cccc(F)c1-n1ccc(CSCC[NH+]2CCOCC2)n1 ZINC000160003686 225318175 /nfs/dbraw/zinc/31/81/75/225318175.db2.gz SIAJJJNWGOLRQZ-UHFFFAOYSA-N 1 1 339.411 2.716 20 70 EFIDMO Cc1cccc([C@H](C)NC(=O)NC[C@@H](C)C[NH+]2CCOCC2)c1C ZINC000160169286 225353051 /nfs/dbraw/zinc/35/30/51/225353051.db2.gz JEUOWOPZYSDHPL-PBHICJAKSA-N 1 1 333.476 2.632 20 70 EFIDMO C[C@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1cccc(F)c1 ZINC000160170171 225353895 /nfs/dbraw/zinc/35/38/95/225353895.db2.gz AMQNFXQFIBTFHJ-HNNXBMFYSA-N 1 1 336.451 2.746 20 70 EFIDMO Cc1[nH+]ccn1CCCCNC(=O)Nc1ccn(CC(F)(F)F)n1 ZINC000160822720 225484105 /nfs/dbraw/zinc/48/41/05/225484105.db2.gz VRWNXTNEAWGJPT-UHFFFAOYSA-N 1 1 344.341 2.552 20 70 EFIDMO C[C@H](CNC(=O)N[C@@H]1CC[C@H](C)c2ccccc21)C[NH+]1CCOCC1 ZINC000159825877 544799279 /nfs/dbraw/zinc/79/92/79/544799279.db2.gz XXKUBHXEPXLRAK-JTDSTZFVSA-N 1 1 345.487 2.893 20 70 EFIDMO C[C@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)[C@H]1C[N@H+](C)CCO1 ZINC000160024428 544802035 /nfs/dbraw/zinc/80/20/35/544802035.db2.gz XLSFOVQMVLEUEJ-SMDDNHRTSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)[C@H]1C[N@@H+](C)CCO1 ZINC000160024428 544802039 /nfs/dbraw/zinc/80/20/39/544802039.db2.gz XLSFOVQMVLEUEJ-SMDDNHRTSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccccc1CC(F)(F)F)[C@@H]1C[N@H+](C)CCO1 ZINC000160116715 544802731 /nfs/dbraw/zinc/80/27/31/544802731.db2.gz OMTFPKNKTLGTSC-RISCZKNCSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccccc1CC(F)(F)F)[C@@H]1C[N@@H+](C)CCO1 ZINC000160116715 544802735 /nfs/dbraw/zinc/80/27/35/544802735.db2.gz OMTFPKNKTLGTSC-RISCZKNCSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)[C@H]1C[N@H+](C)CCO1 ZINC000160178941 544802902 /nfs/dbraw/zinc/80/29/02/544802902.db2.gz CBSLLMLJKBCENZ-BXUZGUMPSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)[C@H]1C[N@@H+](C)CCO1 ZINC000160178941 544802906 /nfs/dbraw/zinc/80/29/06/544802906.db2.gz CBSLLMLJKBCENZ-BXUZGUMPSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1cc(-c2ccccc2)ns1)[C@@H]1C[N@H+](C)CCO1 ZINC000160152428 544803085 /nfs/dbraw/zinc/80/30/85/544803085.db2.gz RLYGXKZUEKFFQT-DOMZBBRYSA-N 1 1 346.456 2.651 20 70 EFIDMO C[C@@H](NC(=O)Nc1cc(-c2ccccc2)ns1)[C@@H]1C[N@@H+](C)CCO1 ZINC000160152428 544803089 /nfs/dbraw/zinc/80/30/89/544803089.db2.gz RLYGXKZUEKFFQT-DOMZBBRYSA-N 1 1 346.456 2.651 20 70 EFIDMO C[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@H](O)C1CC1 ZINC000160750713 544807816 /nfs/dbraw/zinc/80/78/16/544807816.db2.gz HOKYXUNBYPUCFV-YGRLFVJLSA-N 1 1 330.350 2.735 20 70 EFIDMO CCOCCC[N@H+]1CC[C@H](NC(=O)C[C@@H](C)c2ccncc2)[C@H](C)C1 ZINC000160624954 544808000 /nfs/dbraw/zinc/80/80/00/544808000.db2.gz OZTWQMDCSLAMAJ-LMMKCTJWSA-N 1 1 347.503 2.828 20 70 EFIDMO C[N@@H+](CC(=O)Nc1nc(-c2cccs2)cs1)C[C@@H](O)C1CC1 ZINC000160760031 544808569 /nfs/dbraw/zinc/80/85/69/544808569.db2.gz QDAZLRNQASRAOX-GFCCVEGCSA-N 1 1 337.470 2.513 20 70 EFIDMO C[N@H+](CC(=O)Nc1nc(-c2cccs2)cs1)C[C@@H](O)C1CC1 ZINC000160760031 544808573 /nfs/dbraw/zinc/80/85/73/544808573.db2.gz QDAZLRNQASRAOX-GFCCVEGCSA-N 1 1 337.470 2.513 20 70 EFIDMO C[N@H+](CCCCS(C)(=O)=O)Cc1ccccc1OC(F)(F)F ZINC000161331771 544813461 /nfs/dbraw/zinc/81/34/61/544813461.db2.gz NPHPUGIQMVCOPK-UHFFFAOYSA-N 1 1 339.379 2.842 20 70 EFIDMO C[N@@H+](CCCCS(C)(=O)=O)Cc1ccccc1OC(F)(F)F ZINC000161331771 544813466 /nfs/dbraw/zinc/81/34/66/544813466.db2.gz NPHPUGIQMVCOPK-UHFFFAOYSA-N 1 1 339.379 2.842 20 70 EFIDMO C[C@H](NC(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1)C1CCC1 ZINC000161490419 544815213 /nfs/dbraw/zinc/81/52/13/544815213.db2.gz GADPPLAHRVBLRA-HNNXBMFYSA-N 1 1 331.460 2.871 20 70 EFIDMO COc1ccccc1[C@@H]([NH3+])C(=O)N1CC[C@H](c2ccccc2OC)C1 ZINC000160377753 273022060 /nfs/dbraw/zinc/02/20/60/273022060.db2.gz YYSSKORNOVOJFN-IFXJQAMLSA-N 1 1 340.423 2.720 20 70 EFIDMO COc1ccccc1[C@H]([NH3+])C(=O)N1CC[C@H](c2ccccc2OC)C1 ZINC000160377957 273022068 /nfs/dbraw/zinc/02/20/68/273022068.db2.gz YYSSKORNOVOJFN-LIRRHRJNSA-N 1 1 340.423 2.720 20 70 EFIDMO C[N@@H+]1CCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)[C@H](c2ccccc2)C1 ZINC000160359770 290016518 /nfs/dbraw/zinc/01/65/18/290016518.db2.gz FZUPFWQEYOZZJL-QYZOEREBSA-N 1 1 343.471 2.642 20 70 EFIDMO C[N@H+]1CCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)[C@H](c2ccccc2)C1 ZINC000160359770 290016521 /nfs/dbraw/zinc/01/65/21/290016521.db2.gz FZUPFWQEYOZZJL-QYZOEREBSA-N 1 1 343.471 2.642 20 70 EFIDMO CCS[C@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)C(C)C ZINC000160345268 310697928 /nfs/dbraw/zinc/69/79/28/310697928.db2.gz KTVHSMKUXSMNPE-HNNXBMFYSA-N 1 1 330.538 2.581 20 70 EFIDMO COCCOc1ccc([C@H](C)[NH2+][C@H](C)c2cnccn2)cc1OC ZINC000161219002 310707279 /nfs/dbraw/zinc/70/72/79/310707279.db2.gz MGEWTQAAMADFJA-UONOGXRCSA-N 1 1 331.416 2.922 20 70 EFIDMO CS[C@H](C)CC(=O)NCc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000161089256 473205525 /nfs/dbraw/zinc/20/55/25/473205525.db2.gz SIINNOZEFJYGRN-LSDHHAIUSA-N 1 1 336.501 2.665 20 70 EFIDMO CS[C@H](C)CC(=O)NCc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000161089256 473205530 /nfs/dbraw/zinc/20/55/30/473205530.db2.gz SIINNOZEFJYGRN-LSDHHAIUSA-N 1 1 336.501 2.665 20 70 EFIDMO CC[NH2+]CC1CCN(C(=O)c2cn[nH]c2-c2ccccc2F)CC1 ZINC000161094452 473206142 /nfs/dbraw/zinc/20/61/42/473206142.db2.gz NFBKTRHGYUPYFP-UHFFFAOYSA-N 1 1 330.407 2.678 20 70 EFIDMO Cn1cnc2cc(C(=O)Nc3cccc(CC[N@@H+](C)C4CC4)c3)cnc21 ZINC000161099844 473206294 /nfs/dbraw/zinc/20/62/94/473206294.db2.gz BEAFUVMCKSPQLK-UHFFFAOYSA-N 1 1 349.438 2.857 20 70 EFIDMO COCCC1(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000161121021 473209051 /nfs/dbraw/zinc/20/90/51/473209051.db2.gz OCVWZDVYYDWDGF-HNNXBMFYSA-N 1 1 336.501 2.893 20 70 EFIDMO CCC[N@H+](Cc1cc2cc(OC)ccc2o1)[C@H]1CCS(=O)(=O)C1 ZINC000161121094 473209579 /nfs/dbraw/zinc/20/95/79/473209579.db2.gz GBLRRJDXHQREFL-AWEZNQCLSA-N 1 1 337.441 2.841 20 70 EFIDMO CCC[N@@H+](Cc1cc2cc(OC)ccc2o1)[C@H]1CCS(=O)(=O)C1 ZINC000161121094 473209585 /nfs/dbraw/zinc/20/95/85/473209585.db2.gz GBLRRJDXHQREFL-AWEZNQCLSA-N 1 1 337.441 2.841 20 70 EFIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCO[C@@H](c2cccs2)C1 ZINC000161126532 473210231 /nfs/dbraw/zinc/21/02/31/473210231.db2.gz MLSZUHLVJCXOAC-GDBMZVCRSA-N 1 1 349.500 2.848 20 70 EFIDMO Cc1ccc(C)c(OCC[NH+]2CCN(Cc3ccncc3)CC2)c1 ZINC000161176382 473215085 /nfs/dbraw/zinc/21/50/85/473215085.db2.gz RWHZWSVHVKARDC-UHFFFAOYSA-N 1 1 325.456 2.895 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)NCCc1ccc(F)cc1 ZINC000161197065 473217176 /nfs/dbraw/zinc/21/71/76/473217176.db2.gz RMPACKNDTZZLMU-HNNXBMFYSA-N 1 1 329.419 2.790 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)NCCc1ccc(F)cc1 ZINC000161197065 473217182 /nfs/dbraw/zinc/21/71/82/473217182.db2.gz RMPACKNDTZZLMU-HNNXBMFYSA-N 1 1 329.419 2.790 20 70 EFIDMO Cc1nnc(C[N@H+](C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)n1C ZINC000161226557 473218972 /nfs/dbraw/zinc/21/89/72/473218972.db2.gz WEBOORQJMKIHNY-UHFFFAOYSA-N 1 1 342.422 2.717 20 70 EFIDMO Cc1nnc(C[N@@H+](C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)n1C ZINC000161226557 473218978 /nfs/dbraw/zinc/21/89/78/473218978.db2.gz WEBOORQJMKIHNY-UHFFFAOYSA-N 1 1 342.422 2.717 20 70 EFIDMO CN(C(=O)C[N@@H+](C)CCCc1cc(-c2ccccc2)n[nH]1)C1CC1 ZINC000161240489 473220004 /nfs/dbraw/zinc/22/00/04/473220004.db2.gz DVRLXFXJUABCIM-UHFFFAOYSA-N 1 1 326.444 2.562 20 70 EFIDMO CC(C)Oc1cncc(C(=O)NCC[N@@H+]2CCc3sccc3C2)c1 ZINC000161254527 473220620 /nfs/dbraw/zinc/22/06/20/473220620.db2.gz NBTHTXGDTDOMON-UHFFFAOYSA-N 1 1 345.468 2.718 20 70 EFIDMO CC(C)Oc1cncc(C(=O)NCC[N@H+]2CCc3sccc3C2)c1 ZINC000161254527 473220622 /nfs/dbraw/zinc/22/06/22/473220622.db2.gz NBTHTXGDTDOMON-UHFFFAOYSA-N 1 1 345.468 2.718 20 70 EFIDMO COC(=O)c1ccc(C[NH+]2CCC([C@H](O)C(F)(F)F)CC2)cc1F ZINC000161252952 473221154 /nfs/dbraw/zinc/22/11/54/473221154.db2.gz FMDGSXBDKGWNMO-AWEZNQCLSA-N 1 1 349.324 2.748 20 70 EFIDMO Cc1cc(C(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)ncn1 ZINC000161276175 473222405 /nfs/dbraw/zinc/22/24/05/473222405.db2.gz BKYBOQIOHZWFJM-UHFFFAOYSA-N 1 1 346.434 2.896 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@@H+]([C@@H](C)C(=O)NC2CCC(C)CC2)C1 ZINC000161282737 473223719 /nfs/dbraw/zinc/22/37/19/473223719.db2.gz AVOSCCFVDLDIMG-YZUHTNEWSA-N 1 1 347.507 2.561 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@H+]([C@@H](C)C(=O)NC2CCC(C)CC2)C1 ZINC000161282737 473223725 /nfs/dbraw/zinc/22/37/25/473223725.db2.gz AVOSCCFVDLDIMG-YZUHTNEWSA-N 1 1 347.507 2.561 20 70 EFIDMO CCOCCC1(CNC(=O)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)CC1 ZINC000161342352 473228037 /nfs/dbraw/zinc/22/80/37/473228037.db2.gz KTPCENDISYWKKA-KRWDZBQOSA-N 1 1 339.524 2.860 20 70 EFIDMO Cc1noc(-c2ccccc2C(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)n1 ZINC000161406718 473232703 /nfs/dbraw/zinc/23/27/03/473232703.db2.gz VMOIMSOQEMOQIE-LRDDRELGSA-N 1 1 328.416 2.504 20 70 EFIDMO CCCOc1cccc(CCNC(=O)C[N@@H+](C)[C@@H]2CCSC2)c1 ZINC000161450549 473235919 /nfs/dbraw/zinc/23/59/19/473235919.db2.gz IFGOGHNOUOCIMT-MRXNPFEDSA-N 1 1 336.501 2.571 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CC(C)c1ccc(CCNC(=O)C[N@@H+](C)C[C@H]2CCC[C@@H]2O)cc1 ZINC000159845035 473066030 /nfs/dbraw/zinc/06/60/30/473066030.db2.gz RFXSXHNZHWEUJL-MOPGFXCFSA-N 1 1 332.488 2.562 20 70 EFIDMO C[C@@H]1CN(C)[C@@H](C)C[C@H]1[NH2+]CCC1CCN(CC(F)(F)F)CC1 ZINC000159990447 473078663 /nfs/dbraw/zinc/07/86/63/473078663.db2.gz TXYFQSJIZVCKSH-IJEWVQPXSA-N 1 1 335.458 2.969 20 70 EFIDMO C[C@H]1C[C@@H](NC(=O)NCCOc2ccccc2Cl)C[N@H+]1C1CC1 ZINC000159999836 473079717 /nfs/dbraw/zinc/07/97/17/473079717.db2.gz WEQVMZZNBJZZLC-QWHCGFSZSA-N 1 1 337.851 2.643 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)NCCOc2ccccc2Cl)C[N@H+]1C1CC1 ZINC000159999700 473079994 /nfs/dbraw/zinc/07/99/94/473079994.db2.gz WEQVMZZNBJZZLC-CHWSQXEVSA-N 1 1 337.851 2.643 20 70 EFIDMO CCN(C[C@H]1CCCO1)C(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000160028309 473080991 /nfs/dbraw/zinc/08/09/91/473080991.db2.gz BWCABKVDQISRIK-UHOSZYNNSA-N 1 1 345.487 2.717 20 70 EFIDMO CCCn1c(C)nnc1CN(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160092500 473086807 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Cc1ccc(N2CCC(C(=O)NCCc3cccc(O)c3)CC2)[nH+]c1 ZINC000160229574 473098925 /nfs/dbraw/zinc/09/89/25/473098925.db2.gz FPBZVEUVWBBBIH-UHFFFAOYSA-N 1 1 339.439 2.671 20 70 EFIDMO CCc1ccc([C@@H](CO)NC(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc1 ZINC000160247226 473100430 /nfs/dbraw/zinc/10/04/30/473100430.db2.gz ZIXUKIYJAWTAKR-RTBURBONSA-N 1 1 347.503 2.702 20 70 EFIDMO C[C@@H](O)C[C@@H](CNC(=O)C[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC000160243024 473100934 /nfs/dbraw/zinc/10/09/34/473100934.db2.gz MPRCXTBNTBASOC-XLIONFOSSA-N 1 1 340.467 2.789 20 70 EFIDMO C[C@@H](O)C[C@@H](CNC(=O)C[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC000160243024 473100941 /nfs/dbraw/zinc/10/09/41/473100941.db2.gz MPRCXTBNTBASOC-XLIONFOSSA-N 1 1 340.467 2.789 20 70 EFIDMO Cc1noc(C)c1[C@@H](C)CNC(=O)NC[C@H]1CC[N@H+](CC(C)C)C1 ZINC000160248158 473100968 /nfs/dbraw/zinc/10/09/68/473100968.db2.gz PQBYJGACNJXUOD-XJKSGUPXSA-N 1 1 336.480 2.672 20 70 EFIDMO C[C@H](CNC(=O)NCC(C)(C)Cc1ccccc1)C[NH+]1CCOCC1 ZINC000160268220 473102784 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C[C@H](c1nc(Cc2ccccc2)no1)[N@H+]1CCC[C@H](CCC(N)=O)C1 ZINC000160333184 473110311 /nfs/dbraw/zinc/11/03/11/473110311.db2.gz MWBGWTAIHKDTOT-GDBMZVCRSA-N 1 1 342.443 2.699 20 70 EFIDMO CC(=O)Nc1ccc(/C=C/C(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cc1 ZINC000160385928 473115677 /nfs/dbraw/zinc/11/56/77/473115677.db2.gz OPCCFGMYXWHBGH-UFUQCMIWSA-N 1 1 343.471 2.895 20 70 EFIDMO CCCC1(CNC(=O)NCCCCN2CC[NH+](CC)CC2)CCC1 ZINC000160403181 473118987 /nfs/dbraw/zinc/11/89/87/473118987.db2.gz TXRJISOLIFAQDX-UHFFFAOYSA-N 1 1 338.540 2.674 20 70 EFIDMO COC(=O)c1ccc(NC(=O)N(C)CCCn2cc[nH+]c2C)cc1F ZINC000160418819 473121148 /nfs/dbraw/zinc/12/11/48/473121148.db2.gz IBYBOGAHLYOSJN-UHFFFAOYSA-N 1 1 348.378 2.671 20 70 EFIDMO CCN(C(=O)NCC(C)(C)OC)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160431359 473124433 /nfs/dbraw/zinc/12/44/33/473124433.db2.gz HEZUAEJYHKGLIC-QGZVFWFLSA-N 1 1 333.476 2.717 20 70 EFIDMO Cc1ccc(-c2n[nH]c(NC(=O)c3cccc(C[NH+](C)C)c3)n2)o1 ZINC000160431709 473124455 /nfs/dbraw/zinc/12/44/55/473124455.db2.gz 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Cc1ccccc1OCC[N@H+](C)[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000160508026 473135469 /nfs/dbraw/zinc/13/54/69/473135469.db2.gz WKYGHJDHIUSYFC-AWEZNQCLSA-N 1 1 344.377 2.859 20 70 EFIDMO CCCC[N@H+](CCC(=O)c1ccc(C)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000160531794 473138092 /nfs/dbraw/zinc/13/80/92/473138092.db2.gz IGIJCVWMIPDVQV-KRWDZBQOSA-N 1 1 337.485 2.857 20 70 EFIDMO CCCC[N@@H+](CCC(=O)c1ccc(C)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000160531794 473138096 /nfs/dbraw/zinc/13/80/96/473138096.db2.gz IGIJCVWMIPDVQV-KRWDZBQOSA-N 1 1 337.485 2.857 20 70 EFIDMO CC[N@H+](Cc1cc(C)c(OC(F)F)c(C)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160547700 473140225 /nfs/dbraw/zinc/14/02/25/473140225.db2.gz SCFFRQPMSLPHJC-CQSZACIVSA-N 1 1 347.427 2.914 20 70 EFIDMO CC[N@@H+](Cc1cc(C)c(OC(F)F)c(C)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000160547700 473140229 /nfs/dbraw/zinc/14/02/29/473140229.db2.gz SCFFRQPMSLPHJC-CQSZACIVSA-N 1 1 347.427 2.914 20 70 EFIDMO Cn1cncc1C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC000160549106 473140611 /nfs/dbraw/zinc/14/06/11/473140611.db2.gz LRHVEEABLPPQQZ-YIONKMFJSA-N 1 1 334.464 2.782 20 70 EFIDMO CCN(C(=O)NCc1ccn(C)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160575378 473144874 /nfs/dbraw/zinc/14/48/74/473144874.db2.gz LCEHSRFPNCYZKY-LJQANCHMSA-N 1 1 340.471 2.831 20 70 EFIDMO CN(Cc1cccn1C)C(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1 ZINC000160583499 473146837 /nfs/dbraw/zinc/14/68/37/473146837.db2.gz XHFFALBFBWKBEP-SFHVURJKSA-N 1 1 329.419 2.787 20 70 EFIDMO CN(Cc1cccn1C)C(=O)[C@@H]1CCC[N@H+]1Cc1ccc(F)cc1 ZINC000160583499 473146845 /nfs/dbraw/zinc/14/68/45/473146845.db2.gz XHFFALBFBWKBEP-SFHVURJKSA-N 1 1 329.419 2.787 20 70 EFIDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cccc(-c3nc[nH]n3)c2)C1 ZINC000160596205 473147531 /nfs/dbraw/zinc/14/75/31/473147531.db2.gz MIYPLVHLSVIORK-HNNXBMFYSA-N 1 1 341.459 2.714 20 70 EFIDMO C[C@H]1CCC[N@H+](CCCCNC(=O)c2cccc(-c3nnc[nH]3)c2)C1 ZINC000160596205 473147538 /nfs/dbraw/zinc/14/75/38/473147538.db2.gz MIYPLVHLSVIORK-HNNXBMFYSA-N 1 1 341.459 2.714 20 70 EFIDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cccc(-c3nnc[nH]3)c2)C1 ZINC000160596205 473147545 /nfs/dbraw/zinc/14/75/45/473147545.db2.gz MIYPLVHLSVIORK-HNNXBMFYSA-N 1 1 341.459 2.714 20 70 EFIDMO O=C(CC[N@@H+]1CCCC[C@@H]1c1nnc2n1CCCC2)N1CCCCC1 ZINC000160613031 473150276 /nfs/dbraw/zinc/15/02/76/473150276.db2.gz LVOSKKLXJIVTHC-MRXNPFEDSA-N 1 1 345.491 2.544 20 70 EFIDMO O=C(CC[N@H+]1CCCC[C@@H]1c1nnc2n1CCCC2)N1CCCCC1 ZINC000160613031 473150283 /nfs/dbraw/zinc/15/02/83/473150283.db2.gz LVOSKKLXJIVTHC-MRXNPFEDSA-N 1 1 345.491 2.544 20 70 EFIDMO CCc1cc(=O)[nH]c(CN2CCC[N@@H+](Cc3ccc(F)cc3)CC2)n1 ZINC000160633177 473154108 /nfs/dbraw/zinc/15/41/08/473154108.db2.gz XQJWXFWJRUKPEM-UHFFFAOYSA-N 1 1 344.434 2.592 20 70 EFIDMO CN(C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)[C@@H]1CCc2ccccc2C1 ZINC000160627572 473154176 /nfs/dbraw/zinc/15/41/76/473154176.db2.gz JAOHJWVIMJIGSE-RTBURBONSA-N 1 1 327.472 2.670 20 70 EFIDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1ccn(CC(F)(F)F)n1 ZINC000160628572 473154222 /nfs/dbraw/zinc/15/42/22/473154222.db2.gz HJFPVWOODYBQKG-GFCCVEGCSA-N 1 1 347.385 2.831 20 70 EFIDMO CN(C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)[C@@H]1CCc2ccccc2C1 ZINC000160627831 473154461 /nfs/dbraw/zinc/15/44/61/473154461.db2.gz JAOHJWVIMJIGSE-RBUKOAKNSA-N 1 1 327.472 2.670 20 70 EFIDMO CCN(C(=O)NC[C@]1(C)CCCO1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160665886 473157341 /nfs/dbraw/zinc/15/73/41/473157341.db2.gz HRWUYEKMVSYQBQ-QUCCMNQESA-N 1 1 345.487 2.862 20 70 EFIDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N1CCSC[C@H]1c1ccccc1 ZINC000160668406 473158862 /nfs/dbraw/zinc/15/88/62/473158862.db2.gz RBKDHGSXTSNVMW-ROUUACIJSA-N 1 1 345.512 2.970 20 70 EFIDMO COc1cc(OC)cc(N2CC[C@@H]([NH2+][C@@H](C)c3ccoc3)C2=O)c1 ZINC000160678061 473160429 /nfs/dbraw/zinc/16/04/29/473160429.db2.gz PJHOMZMIWAZLOX-YVEFUNNKSA-N 1 1 330.384 2.753 20 70 EFIDMO Cc1nc2c(s1)[C@@H](N(C)C(=O)N[C@@H]1CC[N@@H+](CC3CC3)C1)CCC2 ZINC000160685713 473160631 /nfs/dbraw/zinc/16/06/31/473160631.db2.gz YEWMUTJWTKDOEE-ZBFHGGJFSA-N 1 1 348.516 2.955 20 70 EFIDMO CCO[C@H]1C[C@@H](N(C)C(=O)NC[C@@H](c2ccco2)[NH+](C)C)C12CCC2 ZINC000160694108 473161624 /nfs/dbraw/zinc/16/16/24/473161624.db2.gz RGQHOCHMGBEHFD-UAGQMJEPSA-N 1 1 349.475 2.871 20 70 EFIDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N(Cc1ccc(F)cc1)C1CC1 ZINC000160718922 473166377 /nfs/dbraw/zinc/16/63/77/473166377.db2.gz RQEMVVDQPWKGEN-QGZVFWFLSA-N 1 1 331.435 2.984 20 70 EFIDMO C/C=C(\C=C\C(=O)Nc1cccc(C[N@@H+]2CCC[C@H]2C(N)=O)c1)CC ZINC000160777520 473173388 /nfs/dbraw/zinc/17/33/88/473173388.db2.gz ORHHXUKWQKAIGS-JUSHWHATSA-N 1 1 341.455 2.987 20 70 EFIDMO C/C=C(\C=C\C(=O)Nc1cccc(C[N@H+]2CCC[C@H]2C(N)=O)c1)CC ZINC000160777520 473173392 /nfs/dbraw/zinc/17/33/92/473173392.db2.gz ORHHXUKWQKAIGS-JUSHWHATSA-N 1 1 341.455 2.987 20 70 EFIDMO COc1cc(/C=C/C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)ccc1F ZINC000160770776 473173796 /nfs/dbraw/zinc/17/37/96/473173796.db2.gz UOPFOHGZGKZCOW-YFZXXLGGSA-N 1 1 332.419 2.790 20 70 EFIDMO CC[NH+]1CCN(C(=O)N[C@@H](c2ccco2)c2ccccc2OC)CC1 ZINC000160784348 473174781 /nfs/dbraw/zinc/17/47/81/473174781.db2.gz SKGZWZNIUMCGGT-GOSISDBHSA-N 1 1 343.427 2.725 20 70 EFIDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCc2ccccc2CC1 ZINC000160792758 473176289 /nfs/dbraw/zinc/17/62/89/473176289.db2.gz OEKJBCONXTUOBA-SFHVURJKSA-N 1 1 327.472 2.814 20 70 EFIDMO Cc1cc(C)cc(OC[C@H](O)C[N@H+]2CC[C@]3(O)CCCC[C@@H]3C2)c1 ZINC000160887599 473186526 /nfs/dbraw/zinc/18/65/26/473186526.db2.gz HMLCWIGBJBGDJB-QWFCFKBJSA-N 1 1 333.472 2.670 20 70 EFIDMO CN(Cc1ccc2c(c1)OCO2)C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000160907100 473189406 /nfs/dbraw/zinc/18/94/06/473189406.db2.gz IBTAKCYVXQINEU-OAHLLOKOSA-N 1 1 345.443 2.574 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N[C@@H](CO)c1ccccc1 ZINC000160915592 473190708 /nfs/dbraw/zinc/19/07/08/473190708.db2.gz SWRLQHOKVQUOTM-ROUUACIJSA-N 1 1 333.476 2.530 20 70 EFIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CC[C@H](Nc2ccccc2)C1 ZINC000160912066 473191033 /nfs/dbraw/zinc/19/10/33/473191033.db2.gz YCDBRLGTYRYUAY-ZWKOTPCHSA-N 1 1 342.487 2.899 20 70 EFIDMO O=C(NC[C@@H]1CCC[N@@H+](Cc2cnc3ccccn23)C1)c1ccccc1 ZINC000160959870 473194374 /nfs/dbraw/zinc/19/43/74/473194374.db2.gz RXOQDZSOSRSCBW-KRWDZBQOSA-N 1 1 348.450 2.976 20 70 EFIDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1ccncc1C ZINC000161014980 473199185 /nfs/dbraw/zinc/19/91/85/473199185.db2.gz LAOJQUXHGTYZNI-GOSISDBHSA-N 1 1 332.492 2.886 20 70 EFIDMO Cc1ccc(CNC(=O)[C@H](C)[N@H+]2CC[C@]3(O)CCCC[C@@H]3C2)cc1 ZINC000161049120 473201979 /nfs/dbraw/zinc/20/19/79/473201979.db2.gz VTZWDGPFSRFXHW-ILZDJORESA-N 1 1 330.472 2.627 20 70 EFIDMO C[C@H]1CC(=O)CC[C@@H]1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000159843577 534164386 /nfs/dbraw/zinc/16/43/86/534164386.db2.gz LZEJYCFNHVOYBN-KXBFYZLASA-N 1 1 328.456 2.556 20 70 EFIDMO CC(=O)NC[C@H]1CCC[N@@H+]([C@@H](C)c2nc(Cc3ccccc3)no2)C1 ZINC000159731861 526790359 /nfs/dbraw/zinc/79/03/59/526790359.db2.gz BFWIFXWBMOACPV-WMLDXEAASA-N 1 1 342.443 2.570 20 70 EFIDMO CC(=O)NC[C@H]1CCC[N@H+]([C@@H](C)c2nc(Cc3ccccc3)no2)C1 ZINC000159731861 526790364 /nfs/dbraw/zinc/79/03/64/526790364.db2.gz BFWIFXWBMOACPV-WMLDXEAASA-N 1 1 342.443 2.570 20 70 EFIDMO NC(=O)c1cccc(C[NH2+]Cc2ccc(F)cc2Br)c1 ZINC000218129464 527081999 /nfs/dbraw/zinc/08/19/99/527081999.db2.gz RDGHJGOBULGRDL-UHFFFAOYSA-N 1 1 337.192 2.977 20 70 EFIDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)NCc2ccnc(OC(C)C)c2)C1 ZINC000160248808 528021793 /nfs/dbraw/zinc/02/17/93/528021793.db2.gz MCFBGOBYKUTPBL-KRWDZBQOSA-N 1 1 348.491 2.646 20 70 EFIDMO CCN(CC)C(=O)[C@H](C)[N@@H+](CC)CC1CCN(c2ccccn2)CC1 ZINC000160069369 528057664 /nfs/dbraw/zinc/05/76/64/528057664.db2.gz ATOAYDZUFRMTAL-KRWDZBQOSA-N 1 1 346.519 2.877 20 70 EFIDMO CCC[N@@H+](C[C@@H](O)COCC(C)C)[C@@H](C)C(=O)Nc1ccccc1 ZINC000159990552 528118520 /nfs/dbraw/zinc/11/85/20/528118520.db2.gz UWSNRTMNZWXVNZ-FUHWJXTLSA-N 1 1 336.476 2.759 20 70 EFIDMO CCC[C@H](CCO)CNC(=O)NC[C@@H]1CCCC[N@H+]1CC(C)C ZINC000160910932 528118811 /nfs/dbraw/zinc/11/88/11/528118811.db2.gz FWTGXTYIJDBDQN-SJORKVTESA-N 1 1 327.513 2.595 20 70 EFIDMO CCC[N@@H+](C[C@H](O)COCC(C)C)[C@@H](C)C(=O)Nc1ccccc1 ZINC000159990430 528125142 /nfs/dbraw/zinc/12/51/42/528125142.db2.gz UWSNRTMNZWXVNZ-WMZOPIPTSA-N 1 1 336.476 2.759 20 70 EFIDMO CCC[N@H+]1CC[C@H](CNC(=O)NCCOc2ccccc2Cl)C1 ZINC000159764513 528257640 /nfs/dbraw/zinc/25/76/40/528257640.db2.gz QSDIMHDYYDHZLD-CQSZACIVSA-N 1 1 339.867 2.750 20 70 EFIDMO CC(C)n1ncc2cc(C[NH+]3CCC(CC(N)=O)CC3)c(Cl)nc21 ZINC000159736906 528662609 /nfs/dbraw/zinc/66/26/09/528662609.db2.gz KFSRMBMDMGLXBQ-UHFFFAOYSA-N 1 1 349.866 2.753 20 70 EFIDMO CCC[C@@H](CCO)CNC(=O)NC[C@@H]1CCCC[N@H+]1CC(C)C ZINC000160910805 528931608 /nfs/dbraw/zinc/93/16/08/528931608.db2.gz FWTGXTYIJDBDQN-IRXDYDNUSA-N 1 1 327.513 2.595 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCCCCOCCc2ccccc2)CC1 ZINC000159698772 529026070 /nfs/dbraw/zinc/02/60/70/529026070.db2.gz JBZLMLWGDILJCH-UHFFFAOYSA-N 1 1 347.503 2.763 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2cccc(OCC(F)F)c2)CC1 ZINC000159801670 529027613 /nfs/dbraw/zinc/02/76/13/529027613.db2.gz NPFFQEHPAZINEG-UHFFFAOYSA-N 1 1 341.402 2.568 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2ccccc2OCC(C)C)CC1 ZINC000159727243 529029072 /nfs/dbraw/zinc/02/90/72/529029072.db2.gz MMEUWMSVPRZHEE-UHFFFAOYSA-N 1 1 333.476 2.959 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CC1 ZINC000159933208 529031563 /nfs/dbraw/zinc/03/15/63/529031563.db2.gz YPRXKXPDBFKQAZ-MRXNPFEDSA-N 1 1 341.459 2.671 20 70 EFIDMO CC[N@H+]1CCC[C@@H]1CNC(=O)NCC(C)(C)c1cccc(OC)c1 ZINC000160327273 529077816 /nfs/dbraw/zinc/07/78/16/529077816.db2.gz HDCKQMRMTKSGNY-MRXNPFEDSA-N 1 1 333.476 2.756 20 70 EFIDMO CC[N@H+]1CCC[C@H]1CNC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000159747289 529104251 /nfs/dbraw/zinc/10/42/51/529104251.db2.gz KATAXPLAHQARQI-SQNIBIBYSA-N 1 1 331.460 2.690 20 70 EFIDMO CC[N@H+]1CCC[C@H]1CNC(=O)Cc1cccc(OC(F)(F)F)c1 ZINC000159905974 529104603 /nfs/dbraw/zinc/10/46/03/529104603.db2.gz KGRWCWZWJDVCRU-ZDUSSCGKSA-N 1 1 330.350 2.728 20 70 EFIDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc2c([nH]c1=O)CCCCC2 ZINC000160245334 529201706 /nfs/dbraw/zinc/20/17/06/529201706.db2.gz IXGLCRFGHMINNJ-INIZCTEOSA-N 1 1 345.487 2.638 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc2ccccc2[nH]1 ZINC000160315452 529846329 /nfs/dbraw/zinc/84/63/29/529846329.db2.gz DMIIHZBRLATQIH-UHFFFAOYSA-N 1 1 329.444 2.598 20 70 EFIDMO C[N@@H+](CCOc1ccc(F)cc1)[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000160360847 529925631 /nfs/dbraw/zinc/92/56/31/529925631.db2.gz BCQJABFLUFZWFQ-CQSZACIVSA-N 1 1 348.340 2.690 20 70 EFIDMO C[N@H+](Cc1cccc(C(=O)N2CCCCC2)c1)C[C@@H]1CCC[C@@H]1O ZINC000159766657 529993212 /nfs/dbraw/zinc/99/32/12/529993212.db2.gz FVVQRBPHNPYWLL-OALUTQOASA-N 1 1 330.472 2.906 20 70 EFIDMO COCC1CCN(C(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)CC1 ZINC000160991752 239062045 /nfs/dbraw/zinc/06/20/45/239062045.db2.gz XXBOIJMRYUNMMT-KRWDZBQOSA-N 1 1 325.497 2.565 20 70 EFIDMO Cc1c(C(=O)NCCNc2cccc(C)[nH+]2)cnn1CCC(C)C ZINC000161120649 239064270 /nfs/dbraw/zinc/06/42/70/239064270.db2.gz DFYYBKPRBVKABI-UHFFFAOYSA-N 1 1 329.448 2.783 20 70 EFIDMO O=C(NCCC[NH+]1CCOCC1)Nc1ccccc1C(F)(F)F ZINC000217304203 241243968 /nfs/dbraw/zinc/24/39/68/241243968.db2.gz OYKGONCMICYDFH-UHFFFAOYSA-N 1 1 331.338 2.549 20 70 EFIDMO COc1ccccc1[C@H]([NH3+])C(=O)N1CCSC2(CCCCC2)C1 ZINC000161450650 533015384 /nfs/dbraw/zinc/01/53/84/533015384.db2.gz XTSIAIWFZBJLRG-INIZCTEOSA-N 1 1 334.485 2.973 20 70 EFIDMO COc1cc2[nH+]c(N[C@@H]3CCO[C@H](C4CC4)C3)nc(N)c2cc1OC ZINC000160276907 533177333 /nfs/dbraw/zinc/17/73/33/533177333.db2.gz SFYAYDKDIPSBDP-RISCZKNCSA-N 1 1 344.415 2.599 20 70 EFIDMO COc1cc2[nH+]c(N[C@H]3CCO[C@@H](C4CC4)C3)nc(N)c2cc1OC ZINC000160277279 533178178 /nfs/dbraw/zinc/17/81/78/533178178.db2.gz SFYAYDKDIPSBDP-SMDDNHRTSA-N 1 1 344.415 2.599 20 70 EFIDMO C[C@@H](C(=O)Nc1ccc(N2CCCC2)cc1)[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159804665 533324414 /nfs/dbraw/zinc/32/44/14/533324414.db2.gz SLUPCIQTKLCXEF-BXWFABGCSA-N 1 1 345.487 2.707 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccncc2)C[N@H+]1Cc1ccccc1 ZINC000160348085 533609622 /nfs/dbraw/zinc/60/96/22/533609622.db2.gz GWYVIBSRGLDIOO-VQIMIIECSA-N 1 1 338.455 2.886 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)N(C)Cc2nccs2)C[N@H+]1Cc1ccccc1 ZINC000160335984 533610742 /nfs/dbraw/zinc/61/07/42/533610742.db2.gz JJNJKROWVKXEFP-GDBMZVCRSA-N 1 1 344.484 2.948 20 70 EFIDMO C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000159513062 533648677 /nfs/dbraw/zinc/64/86/77/533648677.db2.gz ZHYIYNFAVCJDNQ-CVEARBPZSA-N 1 1 342.439 2.905 20 70 EFIDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cccc(=O)n3C)cc2)C1 ZINC000159998353 225317405 /nfs/dbraw/zinc/31/74/05/225317405.db2.gz OZIGGBFCJQOODE-HNNXBMFYSA-N 1 1 339.439 2.870 20 70 EFIDMO C[C@H](CNC(=O)NCc1ccc(O)c(F)c1)[N@@H+](C)Cc1ccccc1 ZINC000159590158 225244642 /nfs/dbraw/zinc/24/46/42/225244642.db2.gz PMSQBMCNXJUTFW-CQSZACIVSA-N 1 1 345.418 2.851 20 70 EFIDMO Cc1ccc(NCCCNC(=O)NC[C@@H](C)c2nccs2)[nH+]c1 ZINC000159613353 225249018 /nfs/dbraw/zinc/24/90/18/225249018.db2.gz MXUQTWYJHLXTDQ-CYBMUJFWSA-N 1 1 333.461 2.751 20 70 EFIDMO Cc1ccc(C(=O)CC[N@H+]2CCC[C@@H](CN3CCOCC3)C2)cc1 ZINC000159634013 225252304 /nfs/dbraw/zinc/25/23/04/225252304.db2.gz UHSMFLMOVIXAOQ-GOSISDBHSA-N 1 1 330.472 2.612 20 70 EFIDMO Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000160271451 225376416 /nfs/dbraw/zinc/37/64/16/225376416.db2.gz OUPPBXQYOCADGW-FZKCQIBNSA-N 1 1 336.501 2.776 20 70 EFIDMO CCOc1ccccc1C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000160317049 225387047 /nfs/dbraw/zinc/38/70/47/225387047.db2.gz MLZOTMMGJKODDB-UHFFFAOYSA-N 1 1 334.460 2.516 20 70 EFIDMO C[C@H]1C[C@H](NC(=O)N(C)Cc2ccccn2)C[N@H+]1Cc1ccccc1 ZINC000160059668 225328262 /nfs/dbraw/zinc/32/82/62/225328262.db2.gz BDVAHZHNXCJPBJ-LPHOPBHVSA-N 1 1 338.455 2.886 20 70 EFIDMO Cc1cccc([C@@H](C)NC(=O)NC[C@@H](C)C[NH+]2CCOCC2)c1C ZINC000160169132 225353426 /nfs/dbraw/zinc/35/34/26/225353426.db2.gz JEUOWOPZYSDHPL-RHSMWYFYSA-N 1 1 333.476 2.632 20 70 EFIDMO Cc1noc(C)c1[C@@H](C)CC(=O)N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000160184910 225356461 /nfs/dbraw/zinc/35/64/61/225356461.db2.gz SYPFXJWKCUUOCO-AWEZNQCLSA-N 1 1 342.443 2.837 20 70 EFIDMO O[C@H](COc1ccccc1Cl)C[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000161122560 225551879 /nfs/dbraw/zinc/55/18/79/225551879.db2.gz SBTGUMJUQBRFBN-RVKKMQEKSA-N 1 1 339.863 2.707 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccc2c1CCC2 ZINC000159846639 544799826 /nfs/dbraw/zinc/79/98/26/544799826.db2.gz RBSDDJIUVWUYPT-UHFFFAOYSA-N 1 1 330.472 2.606 20 70 EFIDMO C[C@H](NC(=O)Nc1cc(-c2ccccc2)ns1)[C@@H]1C[N@H+](C)CCO1 ZINC000160152293 544802673 /nfs/dbraw/zinc/80/26/73/544802673.db2.gz RLYGXKZUEKFFQT-WFASDCNBSA-N 1 1 346.456 2.651 20 70 EFIDMO C[C@H](NC(=O)Nc1cc(-c2ccccc2)ns1)[C@@H]1C[N@@H+](C)CCO1 ZINC000160152293 544802677 /nfs/dbraw/zinc/80/26/77/544802677.db2.gz RLYGXKZUEKFFQT-WFASDCNBSA-N 1 1 346.456 2.651 20 70 EFIDMO CC(C)CCOc1ccc(NC(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc1 ZINC000160279586 544804264 /nfs/dbraw/zinc/80/42/64/544804264.db2.gz UIQKLZWXDLUTHB-YJBOKZPZSA-N 1 1 349.475 2.952 20 70 EFIDMO CC(C)CCOc1ccc(NC(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1 ZINC000160279586 544804270 /nfs/dbraw/zinc/80/42/70/544804270.db2.gz UIQKLZWXDLUTHB-YJBOKZPZSA-N 1 1 349.475 2.952 20 70 EFIDMO C[C@H](NC(=O)Nc1ccc2nc(C3CC3)oc2c1)[C@@H]1C[N@H+](C)CCO1 ZINC000160402219 544805049 /nfs/dbraw/zinc/80/50/49/544805049.db2.gz XKKHXWFIRJOWIJ-ZBEGNZNMSA-N 1 1 344.415 2.546 20 70 EFIDMO C[C@H](NC(=O)Nc1ccc2nc(C3CC3)oc2c1)[C@@H]1C[N@@H+](C)CCO1 ZINC000160402219 544805056 /nfs/dbraw/zinc/80/50/56/544805056.db2.gz XKKHXWFIRJOWIJ-ZBEGNZNMSA-N 1 1 344.415 2.546 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1coc(Br)c1 ZINC000160444695 544805380 /nfs/dbraw/zinc/80/53/80/544805380.db2.gz UCNRBMOXKBPBAG-GFCCVEGCSA-N 1 1 329.238 2.892 20 70 EFIDMO C[C@@H](CC(=O)NCC[N@@H+](C)Cc1ccc(F)cc1)c1ccncc1 ZINC000161255873 544811219 /nfs/dbraw/zinc/81/12/19/544811219.db2.gz YJXFXIQSZAGXPF-HNNXBMFYSA-N 1 1 329.419 2.963 20 70 EFIDMO CCSc1cc(Cl)ccc1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000161282793 544811476 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C[C@@H]1CCC[N@H+](Cc2nc3ccc(Br)cc3[nH]2)[C@@H]1CO ZINC000160943217 274291511 /nfs/dbraw/zinc/29/15/11/274291511.db2.gz MWEGHHXYWAFXIS-QMTHXVAHSA-N 1 1 338.249 2.918 20 70 EFIDMO C[C@@H]1CCC[N@@H+](Cc2nc3ccc(Br)cc3[nH]2)[C@@H]1CO ZINC000160943217 274291512 /nfs/dbraw/zinc/29/15/12/274291512.db2.gz MWEGHHXYWAFXIS-QMTHXVAHSA-N 1 1 338.249 2.918 20 70 EFIDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2c2cnc3ccccc3n2)C[C@H](C)O1 ZINC000160475632 274350312 /nfs/dbraw/zinc/35/03/12/274350312.db2.gz YZPFMFVYWHZGRL-XHSDSOJGSA-N 1 1 326.444 2.708 20 70 EFIDMO O=C1[C@@H]([N@H+]2CC[C@]3(CCOC3)C2)CCN1c1ccc(Cl)c(F)c1 ZINC000161026507 275028231 /nfs/dbraw/zinc/02/82/31/275028231.db2.gz VDJIMRHNYCXFGS-RDJZCZTQSA-N 1 1 338.810 2.697 20 70 EFIDMO CCC[C@@H]1CN(C(=O)N[C@@H]2CCCc3occc32)CC[N@H+]1CCOC ZINC000160432126 276030328 /nfs/dbraw/zinc/03/03/28/276030328.db2.gz NTIVHGJLBFMKHO-NVXWUHKLSA-N 1 1 349.475 2.799 20 70 EFIDMO COc1ccccc1[C@H](CNC(=O)N1CC[C@@H](C)[C@@H](C)C1)[NH+](C)C ZINC000159850631 310692179 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CCC[N@H+](Cc1cc2cc(OC)ccc2o1)[C@@H]1CCS(=O)(=O)C1 ZINC000161120961 473209417 /nfs/dbraw/zinc/20/94/17/473209417.db2.gz GBLRRJDXHQREFL-CQSZACIVSA-N 1 1 337.441 2.841 20 70 EFIDMO CCC[N@@H+](Cc1cc2cc(OC)ccc2o1)[C@@H]1CCS(=O)(=O)C1 ZINC000161120961 473209419 /nfs/dbraw/zinc/20/94/19/473209419.db2.gz GBLRRJDXHQREFL-CQSZACIVSA-N 1 1 337.441 2.841 20 70 EFIDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2c[nH]nc2-c2ccccc2F)C1 ZINC000161134298 473210578 /nfs/dbraw/zinc/21/05/78/473210578.db2.gz PBQJVCXWNDBJHT-WBMJQRKESA-N 1 1 330.407 2.674 20 70 EFIDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCO[C@@H](c2cccs2)C1 ZINC000161126791 473210627 /nfs/dbraw/zinc/21/06/27/473210627.db2.gz MLSZUHLVJCXOAC-GOEBONIOSA-N 1 1 349.500 2.848 20 70 EFIDMO Cc1nc(C[NH+]2CCC(CNC(=O)NC3(C)CCC3)CC2)oc1C ZINC000161185192 473216519 /nfs/dbraw/zinc/21/65/19/473216519.db2.gz GZRQRNIPFYRMKG-UHFFFAOYSA-N 1 1 334.464 2.745 20 70 EFIDMO COCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cnccn2)cc1OC ZINC000161218866 473217921 /nfs/dbraw/zinc/21/79/21/473217921.db2.gz MGEWTQAAMADFJA-KGLIPLIRSA-N 1 1 331.416 2.922 20 70 EFIDMO Cc1cc(NC(=O)C[NH+]2CCC(C)(O)CC2)ccc1Br ZINC000161209881 473218230 /nfs/dbraw/zinc/21/82/30/473218230.db2.gz YJBPUVPFJBSXPN-UHFFFAOYSA-N 1 1 341.249 2.543 20 70 EFIDMO CCN(c1ccc(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)cn1)C(C)C ZINC000161224668 473218791 /nfs/dbraw/zinc/21/87/91/473218791.db2.gz KCYUKGUBRSZCCC-DOTOQJQBSA-N 1 1 332.492 2.775 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@H+](CC(=O)Nc2ccc(C)c(C)c2)C1 ZINC000161322485 473226371 /nfs/dbraw/zinc/22/63/71/473226371.db2.gz WCDCLRFYEHPLSK-INIZCTEOSA-N 1 1 341.459 2.733 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(C)c(C)c2)C1 ZINC000161322485 473226375 /nfs/dbraw/zinc/22/63/75/473226375.db2.gz WCDCLRFYEHPLSK-INIZCTEOSA-N 1 1 341.459 2.733 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)N(C)c2ccccc2)C1 ZINC000161420505 473234275 /nfs/dbraw/zinc/23/42/75/473234275.db2.gz HDOJCHJLKQPIJM-JKSUJKDBSA-N 1 1 341.459 2.529 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@H+]([C@@H](C)C(=O)N(C)c2ccccc2)C1 ZINC000161420505 473234280 /nfs/dbraw/zinc/23/42/80/473234280.db2.gz HDOJCHJLKQPIJM-JKSUJKDBSA-N 1 1 341.459 2.529 20 70 EFIDMO COC(=O)c1ccc([C@H](C)[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)o1 ZINC000161430368 473234479 /nfs/dbraw/zinc/23/44/79/473234479.db2.gz CJFMKPSVYMJFIY-STQMWFEESA-N 1 1 344.415 2.545 20 70 EFIDMO Cc1ccc(F)c(OCC(=O)NCC[N@H+](C)Cc2ccccc2)c1 ZINC000161450307 473236271 /nfs/dbraw/zinc/23/62/71/473236271.db2.gz UHLOLIDGUJSGMH-UHFFFAOYSA-N 1 1 330.403 2.761 20 70 EFIDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)[C@@H](C)C(=O)NC1CCCC1 ZINC000161465088 473237445 /nfs/dbraw/zinc/23/74/45/473237445.db2.gz BMMVYUXLGVQASC-AWEZNQCLSA-N 1 1 334.460 2.973 20 70 EFIDMO CNS(=O)(=O)c1cccc([C@@H](C)[NH2+][C@@H](C)c2cncc(F)c2)c1 ZINC000161473751 473237937 /nfs/dbraw/zinc/23/79/37/473237937.db2.gz NERRKOOQUMNVSH-NEPJUHHUSA-N 1 1 337.420 2.541 20 70 EFIDMO COCc1ccccc1NC(=O)N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000161488338 473239244 /nfs/dbraw/zinc/23/92/44/473239244.db2.gz MXJYVVNJRBAINZ-UHFFFAOYSA-N 1 1 340.427 2.891 20 70 EFIDMO CS(=O)(=O)NCC[C@H]1CCCC[N@H+]1Cc1coc2ccccc12 ZINC000159392588 473024720 /nfs/dbraw/zinc/02/47/20/473024720.db2.gz XDDHZMNKTBTHRV-OAHLLOKOSA-N 1 1 336.457 2.727 20 70 EFIDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2c(C)nc3ccccn32)C1 ZINC000159543692 473037505 /nfs/dbraw/zinc/03/75/05/473037505.db2.gz YPWIBOWPFBQQFE-MRXNPFEDSA-N 1 1 328.460 2.771 20 70 EFIDMO CC(C)[C@H](CNC(=O)C[N@@H+](C)[C@@H]1CCSC1)Nc1ccccc1 ZINC000159559245 473038934 /nfs/dbraw/zinc/03/89/34/473038934.db2.gz HTXVRNSLQKRNJD-SJORKVTESA-N 1 1 335.517 2.677 20 70 EFIDMO CC(C)[C@@H](CNC(=O)C[N@@H+](C)[C@@H]1CCSC1)Nc1ccccc1 ZINC000159559094 473038970 /nfs/dbraw/zinc/03/89/70/473038970.db2.gz HTXVRNSLQKRNJD-IAGOWNOFSA-N 1 1 335.517 2.677 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1cccc(-c2nc[nH]n2)c1 ZINC000159579235 473041332 /nfs/dbraw/zinc/04/13/32/473041332.db2.gz DHVHEKKVGJVFMO-QGZVFWFLSA-N 1 1 341.459 2.712 20 70 EFIDMO CC(C)C[N@@H+]1CCCC[C@@H]1CNC(=O)c1cccc(-c2nnc[nH]2)c1 ZINC000159579235 473041334 /nfs/dbraw/zinc/04/13/34/473041334.db2.gz DHVHEKKVGJVFMO-QGZVFWFLSA-N 1 1 341.459 2.712 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1cccc(-c2nnc[nH]2)c1 ZINC000159579235 473041342 /nfs/dbraw/zinc/04/13/42/473041342.db2.gz DHVHEKKVGJVFMO-QGZVFWFLSA-N 1 1 341.459 2.712 20 70 EFIDMO C[C@H](CCNC(=O)N(C)CC1CCOCC1)[N@@H+](C)Cc1ccccc1 ZINC000159629440 473045684 /nfs/dbraw/zinc/04/56/84/473045684.db2.gz NSVFFDSSGHKADP-QGZVFWFLSA-N 1 1 347.503 2.965 20 70 EFIDMO C[N@@H+](C[C@@H]1CCC[C@@H]1O)[C@H](C(=O)N1CCCCC1)c1ccccc1 ZINC000159659400 473048767 /nfs/dbraw/zinc/04/87/67/473048767.db2.gz AEQSUJNRCMIJNO-FHWLQOOXSA-N 1 1 330.472 2.833 20 70 EFIDMO CC(C)CCn1ccc(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)n1 ZINC000159663625 473049946 /nfs/dbraw/zinc/04/99/46/473049946.db2.gz VGVHTFXUNAOGKH-JKSUJKDBSA-N 1 1 333.480 2.877 20 70 EFIDMO COc1ccccc1C[NH+]1CCN(Cc2cnc3ccccn23)CC1 ZINC000159680367 473050865 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20 70 EFIDMO CC[N@@H+](CC(=O)N[C@H](c1ccco1)c1ccccc1OC)C1CC1 ZINC000159730442 527916493 /nfs/dbraw/zinc/91/64/93/527916493.db2.gz IOJGNRHJMQYFMW-IBGZPJMESA-N 1 1 328.412 2.978 20 70 EFIDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)C(=O)Nc2ccccc2C(C)C)C1 ZINC000159412786 528018668 /nfs/dbraw/zinc/01/86/68/528018668.db2.gz DSTIMJYHWCYKRK-INIZCTEOSA-N 1 1 345.487 2.843 20 70 EFIDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)C(=O)Nc2ccc(C(C)C)cc2)C1 ZINC000159446693 528019737 /nfs/dbraw/zinc/01/97/37/528019737.db2.gz SMKFFRFZSCOYAD-INIZCTEOSA-N 1 1 345.487 2.843 20 70 EFIDMO CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@@H]1CCN(C(C)C)C1=O ZINC000160024784 528348847 /nfs/dbraw/zinc/34/88/47/528348847.db2.gz RJNYDYFIJXBJTB-GOSISDBHSA-N 1 1 344.503 2.629 20 70 EFIDMO CCCCNC(=O)[C@@H](C)[N@@H+](CC)CC1CCN(c2ccccn2)CC1 ZINC000160032686 528523283 /nfs/dbraw/zinc/52/32/83/528523283.db2.gz ZVXHIDCXQLFBRM-QGZVFWFLSA-N 1 1 346.519 2.925 20 70 EFIDMO CC(C)C[C@H](CNC(=O)c1ccc(C(C)C)nc1)[NH+]1CCOCC1 ZINC000161436751 528529203 /nfs/dbraw/zinc/52/92/03/528529203.db2.gz NNUBMQUSCKITQL-QGZVFWFLSA-N 1 1 333.476 2.682 20 70 EFIDMO CCCOC(=O)[C@@H](C)[NH+]1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000160226451 528578456 /nfs/dbraw/zinc/57/84/56/528578456.db2.gz KLSLFLAIFVPOKA-CYBMUJFWSA-N 1 1 336.407 2.818 20 70 EFIDMO CCCO[C@H]1CCC[N@H+]([C@@H]2CCCN(CC(F)(F)F)C2=O)CC1 ZINC000160110548 528611452 /nfs/dbraw/zinc/61/14/52/528611452.db2.gz XRONAPJCURZYDP-UONOGXRCSA-N 1 1 336.398 2.821 20 70 EFIDMO CCOCCN(CC)C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000160005534 528719792 /nfs/dbraw/zinc/71/97/92/528719792.db2.gz ADUHMLHECHKEIV-FUHWJXTLSA-N 1 1 333.476 2.575 20 70 EFIDMO CCOc1ccccc1[C@@H](CC)NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159503428 528757105 /nfs/dbraw/zinc/75/71/05/528757105.db2.gz JASOOGMGTOOVFO-JQHSSLGASA-N 1 1 348.487 2.745 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)NCCc1ccccc1C ZINC000161079661 528848706 /nfs/dbraw/zinc/84/87/06/528848706.db2.gz DZKMFDGCYPNHQL-KRWDZBQOSA-N 1 1 325.456 2.959 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)NCCc1ccccc1C ZINC000161079661 528848718 /nfs/dbraw/zinc/84/87/18/528848718.db2.gz DZKMFDGCYPNHQL-KRWDZBQOSA-N 1 1 325.456 2.959 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2cc(-c3ccccc3)on2)CC1 ZINC000159803924 529027689 /nfs/dbraw/zinc/02/76/89/529027689.db2.gz LECLQFIDZZSZEB-UHFFFAOYSA-N 1 1 328.416 2.579 20 70 EFIDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1[nH]c(-c2cccc(OC)c2)nc1C ZINC000160330236 529080402 /nfs/dbraw/zinc/08/04/02/529080402.db2.gz XUNPETMIVWCDDR-OAHLLOKOSA-N 1 1 342.443 2.608 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc2[nH]ccc2c1 ZINC000160063228 529846432 /nfs/dbraw/zinc/84/64/32/529846432.db2.gz WGYDVEOEBRZIFK-UHFFFAOYSA-N 1 1 329.444 2.598 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(Cl)s1 ZINC000159773392 529846450 /nfs/dbraw/zinc/84/64/50/529846450.db2.gz ZSIFEXGUFOYQOJ-UHFFFAOYSA-N 1 1 330.881 2.832 20 70 EFIDMO C[N@@H+](CCCNC(=O)c1ccnc(-n2cccn2)c1)C1CCCCC1 ZINC000159442729 529891444 /nfs/dbraw/zinc/89/14/44/529891444.db2.gz SCKZGPSNPNVKDF-UHFFFAOYSA-N 1 1 341.459 2.652 20 70 EFIDMO CN(CC[N@@H+](C)[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccccc1 ZINC000160087404 529903907 /nfs/dbraw/zinc/90/39/07/529903907.db2.gz HMZKZOWUMUERFT-OAHLLOKOSA-N 1 1 343.393 2.608 20 70 EFIDMO CN1CCC([NH2+][C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CC1 ZINC000159569640 530050624 /nfs/dbraw/zinc/05/06/24/530050624.db2.gz GDNRGLBTWOPZNC-HXUWFJFHSA-N 1 1 337.467 2.920 20 70 EFIDMO COc1ccc(Br)c(C[NH2+][C@@H](C)C(=O)NC(C)(C)C)c1 ZINC000159711594 533258754 /nfs/dbraw/zinc/25/87/54/533258754.db2.gz GWUWNEQZOXBVBT-JTQLQIEISA-N 1 1 343.265 2.851 20 70 EFIDMO COC[C@@H](NC(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1)C1CC1 ZINC000160245039 533358058 /nfs/dbraw/zinc/35/80/58/533358058.db2.gz ZDPKPDFDKTZZRA-RDTXWAMCSA-N 1 1 347.459 2.626 20 70 EFIDMO COc1ccc(C[N@H+](C)Cc2cnc(N3CCOCC3)s2)cc1 ZINC000159852290 533544568 /nfs/dbraw/zinc/54/45/68/533544568.db2.gz MDZFGJJQTWHJGW-UHFFFAOYSA-N 1 1 333.457 2.620 20 70 EFIDMO COc1ccc(C[N@@H+](C)Cc2cnc(N3CCOCC3)s2)cc1 ZINC000159852290 533544573 /nfs/dbraw/zinc/54/45/73/533544573.db2.gz MDZFGJJQTWHJGW-UHFFFAOYSA-N 1 1 333.457 2.620 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccn2)C[N@H+]1Cc1ccccc1 ZINC000160059836 533609664 /nfs/dbraw/zinc/60/96/64/533609664.db2.gz BDVAHZHNXCJPBJ-VQIMIIECSA-N 1 1 338.455 2.886 20 70 EFIDMO Cc1ccc(C(=O)CC[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)cc1 ZINC000159538721 225236203 /nfs/dbraw/zinc/23/62/03/225236203.db2.gz WKKAUVGVPJGTLO-KRWDZBQOSA-N 1 1 338.455 2.985 20 70 EFIDMO Cc1ccc(C(=O)CC[N@H+]2CCC[C@@H](c3nnc4n3CCC4)C2)cc1 ZINC000159538870 225236344 /nfs/dbraw/zinc/23/63/44/225236344.db2.gz WKKAUVGVPJGTLO-QGZVFWFLSA-N 1 1 338.455 2.985 20 70 EFIDMO CCn1c(C)cc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1C ZINC000159794779 225280011 /nfs/dbraw/zinc/28/00/11/225280011.db2.gz BPZYQYRSGVNECB-UHFFFAOYSA-N 1 1 335.492 2.555 20 70 EFIDMO C[C@@H]1CC(=O)CC[C@@H]1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000159843451 225288131 /nfs/dbraw/zinc/28/81/31/225288131.db2.gz LZEJYCFNHVOYBN-BEFAXECRSA-N 1 1 328.456 2.556 20 70 EFIDMO Cc1ccsc1CNC(=O)C[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159884433 225295739 /nfs/dbraw/zinc/29/57/39/225295739.db2.gz ODADJZRIUWLGHP-UHFFFAOYSA-N 1 1 331.485 2.871 20 70 EFIDMO Cc1ccsc1CNC(=O)C[N@H+](C)Cc1cccc(N(C)C)c1 ZINC000159884433 225295744 /nfs/dbraw/zinc/29/57/44/225295744.db2.gz ODADJZRIUWLGHP-UHFFFAOYSA-N 1 1 331.485 2.871 20 70 EFIDMO C[C@H](Sc1ccncc1)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159939341 225307377 /nfs/dbraw/zinc/30/73/77/225307377.db2.gz SMIXZKQDIIGHPE-RDJZCZTQSA-N 1 1 341.480 2.953 20 70 EFIDMO C[C@@H]1C[N@H+](Cc2cccc(CNC(=O)NC3(C)CCC3)c2)CCO1 ZINC000159996078 225316820 /nfs/dbraw/zinc/31/68/20/225316820.db2.gz HMFVUFPHAJYFKZ-OAHLLOKOSA-N 1 1 331.460 2.649 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2cccc(CNC(=O)NC3(C)CCC3)c2)CCO1 ZINC000159996078 225316825 /nfs/dbraw/zinc/31/68/25/225316825.db2.gz HMFVUFPHAJYFKZ-OAHLLOKOSA-N 1 1 331.460 2.649 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N(C)[C@@H]1CCSC1 ZINC000160024485 225320873 /nfs/dbraw/zinc/32/08/73/225320873.db2.gz LBFIFVKEULMJJG-UAGQMJEPSA-N 1 1 333.501 2.654 20 70 EFIDMO Cc1ccc2cc(C(=O)N(C)CC(C)(C)C[NH+]3CCOCC3)[nH]c2c1 ZINC000159678788 225260206 /nfs/dbraw/zinc/26/02/06/225260206.db2.gz UYRIWEGPSDEKOK-UHFFFAOYSA-N 1 1 343.471 2.907 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ncc(C(N)=O)cc1Cl ZINC000160243247 225369537 /nfs/dbraw/zinc/36/95/37/225369537.db2.gz AKEQFGUOCLWWDT-WBMJQRKESA-N 1 1 344.846 2.766 20 70 EFIDMO C[C@H]1C[C@H](NC(=O)N(C)Cc2cccnc2)C[N@H+]1Cc1ccccc1 ZINC000160287607 225380419 /nfs/dbraw/zinc/38/04/19/225380419.db2.gz IJLYEGMCDOOAAV-LPHOPBHVSA-N 1 1 338.455 2.886 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccccc1OC(C)(C)C)[C@@H]1C[N@H+](C)CCO1 ZINC000159814075 544799171 /nfs/dbraw/zinc/79/91/71/544799171.db2.gz FHXVEWMXOGCYRL-CJNGLKHVSA-N 1 1 335.448 2.705 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccccc1OC(C)(C)C)[C@@H]1C[N@@H+](C)CCO1 ZINC000159814075 544799177 /nfs/dbraw/zinc/79/91/77/544799177.db2.gz FHXVEWMXOGCYRL-CJNGLKHVSA-N 1 1 335.448 2.705 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccccc1OC(C)(C)C)[C@H]1C[N@H+](C)CCO1 ZINC000159814340 544799774 /nfs/dbraw/zinc/79/97/74/544799774.db2.gz FHXVEWMXOGCYRL-CZUORRHYSA-N 1 1 335.448 2.705 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccccc1OC(C)(C)C)[C@H]1C[N@@H+](C)CCO1 ZINC000159814340 544799781 /nfs/dbraw/zinc/79/97/81/544799781.db2.gz FHXVEWMXOGCYRL-CZUORRHYSA-N 1 1 335.448 2.705 20 70 EFIDMO C[C@@H](NC(=O)Nc1cc(-c2ccccc2)ns1)[C@H]1C[N@H+](C)CCO1 ZINC000160152683 544802779 /nfs/dbraw/zinc/80/27/79/544802779.db2.gz RLYGXKZUEKFFQT-IUODEOHRSA-N 1 1 346.456 2.651 20 70 EFIDMO C[C@@H](NC(=O)Nc1cc(-c2ccccc2)ns1)[C@H]1C[N@@H+](C)CCO1 ZINC000160152683 544802784 /nfs/dbraw/zinc/80/27/84/544802784.db2.gz RLYGXKZUEKFFQT-IUODEOHRSA-N 1 1 346.456 2.651 20 70 EFIDMO C[C@@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)[C@@H]1C[N@H+](C)CCO1 ZINC000160178673 544803225 /nfs/dbraw/zinc/80/32/25/544803225.db2.gz CBSLLMLJKBCENZ-RISCZKNCSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)[C@@H]1C[N@@H+](C)CCO1 ZINC000160178673 544803231 /nfs/dbraw/zinc/80/32/31/544803231.db2.gz CBSLLMLJKBCENZ-RISCZKNCSA-N 1 1 345.365 2.632 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)CCc1ccccc1F ZINC000160281085 544804012 /nfs/dbraw/zinc/80/40/12/544804012.db2.gz GNBRRYMLHMGITH-UHFFFAOYSA-N 1 1 336.451 2.575 20 70 EFIDMO Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000160299306 544804282 /nfs/dbraw/zinc/80/42/82/544804282.db2.gz QFBULCQQAONOKF-RISCZKNCSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000160299306 544804287 /nfs/dbraw/zinc/80/42/87/544804287.db2.gz QFBULCQQAONOKF-RISCZKNCSA-N 1 1 345.365 2.854 20 70 EFIDMO C[C@@H](NC[C@H](C1CCCCC1)[NH+](C)C)c1cccc(-n2cnnn2)c1 ZINC000160387038 544805440 /nfs/dbraw/zinc/80/54/40/544805440.db2.gz SBNPHQOIZUNZDO-DNVCBOLYSA-N 1 1 342.491 2.823 20 70 EFIDMO CCOc1cc(Cl)ccc1NC(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000160572655 544807255 /nfs/dbraw/zinc/80/72/55/544807255.db2.gz NQFJSKGBUNCXGL-NHYWBVRUSA-N 1 1 341.839 2.579 20 70 EFIDMO CCOc1cc(Cl)ccc1NC(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000160572655 544807259 /nfs/dbraw/zinc/80/72/59/544807259.db2.gz NQFJSKGBUNCXGL-NHYWBVRUSA-N 1 1 341.839 2.579 20 70 EFIDMO CCOc1cc(Cl)ccc1NC(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000160573044 544807502 /nfs/dbraw/zinc/80/75/02/544807502.db2.gz NQFJSKGBUNCXGL-IAQYHMDHSA-N 1 1 341.839 2.579 20 70 EFIDMO CCOc1cc(Cl)ccc1NC(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000160573044 544807505 /nfs/dbraw/zinc/80/75/05/544807505.db2.gz NQFJSKGBUNCXGL-IAQYHMDHSA-N 1 1 341.839 2.579 20 70 EFIDMO CCO[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H](c2ccco2)[NH+](C)C)C12CCC2 ZINC000160693998 279801652 /nfs/dbraw/zinc/80/16/52/279801652.db2.gz RGQHOCHMGBEHFD-USXIJHARSA-N 1 1 349.475 2.871 20 70 EFIDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cccc(=O)n3C)cc2)C1 ZINC000159998210 533691686 /nfs/dbraw/zinc/69/16/86/533691686.db2.gz OZIGGBFCJQOODE-OAHLLOKOSA-N 1 1 339.439 2.870 20 70 EFIDMO CCC(CC)(C[NH3+])C(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1 ZINC000161261751 282070987 /nfs/dbraw/zinc/07/09/87/282070987.db2.gz RNXVRXRKOYTRJI-SFHVURJKSA-N 1 1 347.503 2.713 20 70 EFIDMO CCC(CC)(C[NH3+])C(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1 ZINC000161261855 282071454 /nfs/dbraw/zinc/07/14/54/282071454.db2.gz RNXVRXRKOYTRJI-GOSISDBHSA-N 1 1 347.503 2.713 20 70 EFIDMO COc1ccccc1[C@@H]([NH3+])C(=O)N1CCSC2(CCCCC2)C1 ZINC000161450767 295385109 /nfs/dbraw/zinc/38/51/09/295385109.db2.gz XTSIAIWFZBJLRG-MRXNPFEDSA-N 1 1 334.485 2.973 20 70 EFIDMO CCOCC[NH+]1CCN(C(=O)C[C@@H](C)c2ccc(CC)cc2)CC1 ZINC000159728141 310690825 /nfs/dbraw/zinc/69/08/25/310690825.db2.gz SIZWPPXFMIIROJ-QGZVFWFLSA-N 1 1 332.488 2.923 20 70 EFIDMO CCCOc1ccc(OCCSCC[NH+]2CCOCC2)cc1 ZINC000159837477 310691977 /nfs/dbraw/zinc/69/19/77/310691977.db2.gz IBDUYEYRLFGXHO-UHFFFAOYSA-N 1 1 325.474 2.920 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)CCc1ccc(F)cc1 ZINC000160272388 310697061 /nfs/dbraw/zinc/69/70/61/310697061.db2.gz OOMKDGHNLXLMGX-UHFFFAOYSA-N 1 1 336.451 2.575 20 70 EFIDMO CCn1nc(C)c(C[NH+]2CCN(c3cccc(OC)c3)CC2)c1C ZINC000160686824 310701691 /nfs/dbraw/zinc/70/16/91/310701691.db2.gz IWHIYEDLPUJKRP-UHFFFAOYSA-N 1 1 328.460 2.851 20 70 EFIDMO COC(=O)c1ccc(C[NH+]2CCC([C@@H](O)C(F)(F)F)CC2)cc1F ZINC000161253088 310707596 /nfs/dbraw/zinc/70/75/96/310707596.db2.gz FMDGSXBDKGWNMO-CQSZACIVSA-N 1 1 349.324 2.748 20 70 EFIDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCO[C@H](c2cccs2)C1 ZINC000161126651 473210489 /nfs/dbraw/zinc/21/04/89/473210489.db2.gz MLSZUHLVJCXOAC-HOCLYGCPSA-N 1 1 349.500 2.848 20 70 EFIDMO CN(C)c1cc[nH+]c(N2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)n1 ZINC000161135401 473211004 /nfs/dbraw/zinc/21/10/04/473211004.db2.gz VNZXUWSUFGXLOW-CVEARBPZSA-N 1 1 330.407 2.774 20 70 EFIDMO C[C@H](C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)C1CCOCC1 ZINC000161170431 473213908 /nfs/dbraw/zinc/21/39/08/473213908.db2.gz JNMRRNHBROBDDO-KRWDZBQOSA-N 1 1 330.472 2.784 20 70 EFIDMO CC[C@H]([NH2+][C@@H](C)C(=O)NC(=O)NC1CCCCC1)c1nccs1 ZINC000161170719 473214049 /nfs/dbraw/zinc/21/40/49/473214049.db2.gz OBIMDDQWFFAFPV-AAEUAGOBSA-N 1 1 338.477 2.731 20 70 EFIDMO COCC[N@@H+](C)CCNC(=O)CCc1cc(Cl)cc(Cl)c1 ZINC000161176735 473215322 /nfs/dbraw/zinc/21/53/22/473215322.db2.gz VELGGMYYWZXGNL-UHFFFAOYSA-N 1 1 333.259 2.620 20 70 EFIDMO COCCOc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1OC ZINC000161195388 473216394 /nfs/dbraw/zinc/21/63/94/473216394.db2.gz KCEYQWDOPKKCCD-HLLBOEOZSA-N 1 1 336.476 2.854 20 70 EFIDMO COCCOc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1OC ZINC000161195388 473216397 /nfs/dbraw/zinc/21/63/97/473216397.db2.gz KCEYQWDOPKKCCD-HLLBOEOZSA-N 1 1 336.476 2.854 20 70 EFIDMO Cc1noc(C[N@H+](C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)n1 ZINC000161227791 473218417 /nfs/dbraw/zinc/21/84/17/473218417.db2.gz VPGHSENISQJKOT-UHFFFAOYSA-N 1 1 329.379 2.972 20 70 EFIDMO Cc1noc(C[N@@H+](C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)n1 ZINC000161227791 473218422 /nfs/dbraw/zinc/21/84/22/473218422.db2.gz VPGHSENISQJKOT-UHFFFAOYSA-N 1 1 329.379 2.972 20 70 EFIDMO CC(C)NC(=O)C[N@@H+](C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000161229533 473218606 /nfs/dbraw/zinc/21/86/06/473218606.db2.gz RFNPSWRIUDAFRM-UHFFFAOYSA-N 1 1 332.423 2.605 20 70 EFIDMO CCN(c1ccc(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)cn1)C(C)C ZINC000161224809 473218650 /nfs/dbraw/zinc/21/86/50/473218650.db2.gz KCYUKGUBRSZCCC-RDJZCZTQSA-N 1 1 332.492 2.775 20 70 EFIDMO CC[NH+](CC)CCN(CC(C)C)C(=O)c1cccc(-c2nnc[nH]2)c1 ZINC000161231225 473218670 /nfs/dbraw/zinc/21/86/70/473218670.db2.gz XWOCLXZOOGGTJU-UHFFFAOYSA-N 1 1 343.475 2.912 20 70 EFIDMO C[C@H](C(=O)NC[C@@H]1CC[N@@H+](C)C1)c1ccc(Br)cc1 ZINC000161258998 473220998 /nfs/dbraw/zinc/22/09/98/473220998.db2.gz BMJCPFXLCCHOQN-RYUDHWBXSA-N 1 1 325.250 2.621 20 70 EFIDMO Cc1ccc(F)c(OCC(=O)NCC[N@@H+]2CCc3sccc3C2)c1 ZINC000161251876 473221047 /nfs/dbraw/zinc/22/10/47/473221047.db2.gz DIXZPAMEZXPWJR-UHFFFAOYSA-N 1 1 348.443 2.749 20 70 EFIDMO Cc1ccc(F)c(OCC(=O)NCC[N@H+]2CCc3sccc3C2)c1 ZINC000161251876 473221052 /nfs/dbraw/zinc/22/10/52/473221052.db2.gz DIXZPAMEZXPWJR-UHFFFAOYSA-N 1 1 348.443 2.749 20 70 EFIDMO Cc1cn(-c2ccccc2Cl)nc1C(=O)NC[C@H]1CC[N@H+](C)C1 ZINC000161260135 473221443 /nfs/dbraw/zinc/22/14/43/473221443.db2.gz NKJWLBCXUDGAOW-CYBMUJFWSA-N 1 1 332.835 2.516 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+]3C[C@H](C)CC[C@@H]3C)nc(N)c21 ZINC000161340738 473227252 /nfs/dbraw/zinc/22/72/52/473227252.db2.gz RLXMESSKLRWWGD-MNOVXSKESA-N 1 1 346.431 2.911 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+]3C[C@H](C)CC[C@@H]3C)nc(N)c21 ZINC000161340738 473227257 /nfs/dbraw/zinc/22/72/57/473227257.db2.gz RLXMESSKLRWWGD-MNOVXSKESA-N 1 1 346.431 2.911 20 70 EFIDMO Cc1cc(C(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)nn1-c1ccccc1 ZINC000161334852 473227497 /nfs/dbraw/zinc/22/74/97/473227497.db2.gz FQWZLNVNVAKUCD-KBXCAEBGSA-N 1 1 326.444 2.639 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2C)C1 ZINC000161332002 473227627 /nfs/dbraw/zinc/22/76/27/473227627.db2.gz PNNZILFPMQHQNP-HOTGVXAUSA-N 1 1 341.459 2.813 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccccc2C)C1 ZINC000161332002 473227632 /nfs/dbraw/zinc/22/76/32/473227632.db2.gz PNNZILFPMQHQNP-HOTGVXAUSA-N 1 1 341.459 2.813 20 70 EFIDMO CCO[C@@H](C)c1noc(CN2CC[N@H+](C)C[C@@H]2c2ccccc2)n1 ZINC000161340840 473228411 /nfs/dbraw/zinc/22/84/11/473228411.db2.gz KUSMOJJKFHMDHI-GOEBONIOSA-N 1 1 330.432 2.656 20 70 EFIDMO CCO[C@@H](C)c1noc(CN2CC[N@@H+](C)C[C@@H]2c2ccccc2)n1 ZINC000161340840 473228416 /nfs/dbraw/zinc/22/84/16/473228416.db2.gz KUSMOJJKFHMDHI-GOEBONIOSA-N 1 1 330.432 2.656 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+]3CC[C@@H](C)[C@@H]3C)nc(N)c21 ZINC000161408515 473233330 /nfs/dbraw/zinc/23/33/30/473233330.db2.gz ZPOMJCUISINQFQ-ZJUUUORDSA-N 1 1 332.404 2.520 20 70 EFIDMO Cc1ccsc1CCCC(=O)NCCCCN1CC[NH+](C)CC1 ZINC000161459568 473236946 /nfs/dbraw/zinc/23/69/46/473236946.db2.gz FNGNDJCLQPIENG-UHFFFAOYSA-N 1 1 337.533 2.523 20 70 EFIDMO CN(C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1)[C@H]1CCSC1 ZINC000161489707 473238989 /nfs/dbraw/zinc/23/89/89/473238989.db2.gz FRBPSBFUJATTSE-KRWDZBQOSA-N 1 1 349.500 2.531 20 70 EFIDMO C[N@H+](CC(=O)Nc1nc(-c2cccnc2)cs1)[C@H]1CCSC1 ZINC000159362428 473021557 /nfs/dbraw/zinc/02/15/57/473021557.db2.gz BSKZFUVIEFFKAU-LBPRGKRZSA-N 1 1 334.470 2.581 20 70 EFIDMO C[N@@H+](CC(=O)Nc1nc(-c2cccnc2)cs1)[C@H]1CCSC1 ZINC000159362428 473021561 /nfs/dbraw/zinc/02/15/61/473021561.db2.gz BSKZFUVIEFFKAU-LBPRGKRZSA-N 1 1 334.470 2.581 20 70 EFIDMO C[C@@H](O)C[N@H+](C)[C@@H](C)C(=O)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000159406933 473025528 /nfs/dbraw/zinc/02/55/28/473025528.db2.gz XHJBKKFRRQMMPX-MNOVXSKESA-N 1 1 337.420 2.589 20 70 EFIDMO C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000159406933 473025535 /nfs/dbraw/zinc/02/55/35/473025535.db2.gz XHJBKKFRRQMMPX-MNOVXSKESA-N 1 1 337.420 2.589 20 70 EFIDMO CCC(CC)c1cc(C(=O)NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)on1 ZINC000159417847 473027439 /nfs/dbraw/zinc/02/74/39/473027439.db2.gz WHHINBRRWKRSLF-OKILXGFUSA-N 1 1 337.464 2.807 20 70 EFIDMO Cc1cc(N2CCCC2)ccc1NC(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000159442491 473028224 /nfs/dbraw/zinc/02/82/24/473028224.db2.gz RSCSFOHZVROCLM-APWZRJJASA-N 1 1 345.487 2.627 20 70 EFIDMO CCCn1c2ccccc2nc1NC(=O)C[N@H+](C)[C@H]1CCSC1 ZINC000159468216 473030653 /nfs/dbraw/zinc/03/06/53/473030653.db2.gz JHKKXFMNNZBPGB-ZDUSSCGKSA-N 1 1 332.473 2.822 20 70 EFIDMO CCCn1c2ccccc2nc1NC(=O)C[N@@H+](C)[C@H]1CCSC1 ZINC000159468216 473030659 /nfs/dbraw/zinc/03/06/59/473030659.db2.gz JHKKXFMNNZBPGB-ZDUSSCGKSA-N 1 1 332.473 2.822 20 70 EFIDMO C[N@H+](Cc1ccc(I)cc1)C[C@H]1CCC[C@@H]1O ZINC000159501721 473033055 /nfs/dbraw/zinc/03/30/55/473033055.db2.gz FINXVVCCTPORCV-OCCSQVGLSA-N 1 1 345.224 2.884 20 70 EFIDMO CC[N@@H+](Cc1ccc(C(=O)N[C@@H](C(=O)OC)C(C)C)cc1)C(C)C ZINC000159539244 473037668 /nfs/dbraw/zinc/03/76/68/473037668.db2.gz FBTITAAQXPFLKT-QGZVFWFLSA-N 1 1 334.460 2.844 20 70 EFIDMO CC[N@@H+](Cc1ccc(C(=O)Nc2c[nH]c(=O)c(C)c2)cc1)C1CC1 ZINC000159550077 473038542 /nfs/dbraw/zinc/03/85/42/473038542.db2.gz OUTYINLFFXCHBC-UHFFFAOYSA-N 1 1 325.412 2.920 20 70 EFIDMO CC[C@H](C)CS(=O)(=O)N1c2ccc(C)cc2[C@H]2C[N@H+](C)CC[C@@H]21 ZINC000159598376 473042319 /nfs/dbraw/zinc/04/23/19/473042319.db2.gz PGQVYKXLJPKZFA-XCRHUMRWSA-N 1 1 336.501 2.979 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc2ccccc2n1C ZINC000159593593 473043298 /nfs/dbraw/zinc/04/32/98/473043298.db2.gz PJOZZNGBLWFXSB-UHFFFAOYSA-N 1 1 343.471 2.609 20 70 EFIDMO CCOCC[NH+]1CCN(C(=O)C[C@H](C)c2ccc(CC)cc2)CC1 ZINC000159727989 473054754 /nfs/dbraw/zinc/05/47/54/473054754.db2.gz SIZWPPXFMIIROJ-KRWDZBQOSA-N 1 1 332.488 2.923 20 70 EFIDMO CCCc1ncc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)s1 ZINC000159738721 473056663 /nfs/dbraw/zinc/05/66/63/473056663.db2.gz MSKCMOJCFARPQV-UHFFFAOYSA-N 1 1 339.505 2.526 20 70 EFIDMO CCOCCC1(CNC(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000159754385 473058160 /nfs/dbraw/zinc/05/81/60/473058160.db2.gz BLBNLEKDUSQJCA-BBWFWOEESA-N 1 1 339.524 2.859 20 70 EFIDMO C[N@@H+](CC(=O)N[C@@H]1CCC[C@@H]1OCc1ccccc1)[C@@H]1CCSC1 ZINC000159763163 473059395 /nfs/dbraw/zinc/05/93/95/473059395.db2.gz UAXWLCLIMVJYKU-KURKYZTESA-N 1 1 348.512 2.678 20 70 EFIDMO C[N@H+](Cc1cc2c(c(Br)c1)OCO2)C[C@H]1CCC[C@@H]1O ZINC000159787931 473060290 /nfs/dbraw/zinc/06/02/90/473060290.db2.gz PZGQQVNSHXQQDA-YPMHNXCESA-N 1 1 342.233 2.771 20 70 EFIDMO C[C@H](C(=O)NCc1ccccc1)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159777163 473060934 /nfs/dbraw/zinc/06/09/34/473060934.db2.gz VROJOJDRTWLROT-MRXNPFEDSA-N 1 1 325.456 2.889 20 70 EFIDMO CCOc1cc(Cl)ccc1CNC(=O)NC[C@@H]1CCC[N@@H+](C)C1 ZINC000159808596 473061873 /nfs/dbraw/zinc/06/18/73/473061873.db2.gz WUINPALNXLSVCP-ZDUSSCGKSA-N 1 1 339.867 2.880 20 70 EFIDMO COc1ccccc1[C@H](CNC(=O)N1CC[C@@H](C)[C@H](C)C1)[NH+](C)C ZINC000159850909 473066478 /nfs/dbraw/zinc/06/64/78/473066478.db2.gz OYRIFVLIFXLWAL-INMHGKMJSA-N 1 1 333.476 2.985 20 70 EFIDMO CCC(CC)[C@@H](CNC(=O)N1CCC2(CCC2)C1)[NH+]1CCOCC1 ZINC000159884208 473068648 /nfs/dbraw/zinc/06/86/48/473068648.db2.gz MSTMPHMCBHIXTK-QGZVFWFLSA-N 1 1 337.508 2.709 20 70 EFIDMO C[N@H+](CC(=O)NCC1(c2ccccc2)CCCC1)C[C@H]1CCC[C@@H]1O ZINC000159871829 473068767 /nfs/dbraw/zinc/06/87/67/473068767.db2.gz NBVWJMMASYCINR-MJGOQNOKSA-N 1 1 344.499 2.707 20 70 EFIDMO Brc1cccc(OCCSCC[NH+]2CCOCC2)c1 ZINC000159883326 473069282 /nfs/dbraw/zinc/06/92/82/473069282.db2.gz MEHPQVZDYRKLOM-UHFFFAOYSA-N 1 1 346.290 2.893 20 70 EFIDMO Cc1ccccc1C1(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)CC1 ZINC000159897986 473069791 /nfs/dbraw/zinc/06/97/91/473069791.db2.gz PFNSNOIANVPZCP-UHFFFAOYSA-N 1 1 344.499 2.843 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2ccccc2OCC2CC2)CC1 ZINC000159891970 473070296 /nfs/dbraw/zinc/07/02/96/473070296.db2.gz UQQOJOLHHNCEIX-UHFFFAOYSA-N 1 1 331.460 2.713 20 70 EFIDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)CCCc2nc(C3CC3)no2)C1 ZINC000159938585 473074172 /nfs/dbraw/zinc/07/41/72/473074172.db2.gz OPBGOXSKMOKWBF-HNNXBMFYSA-N 1 1 348.491 2.898 20 70 EFIDMO Cc1cnccc1CCNC(=O)N[C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000159937186 473074288 /nfs/dbraw/zinc/07/42/88/473074288.db2.gz VSMMZIZYHLUJMX-UXLLHSPISA-N 1 1 332.492 2.598 20 70 EFIDMO CCCNC(=O)[C@H](C)[N@@H+](CC)CC1CCN(c2ccccn2)CC1 ZINC000160003207 473080540 /nfs/dbraw/zinc/08/05/40/473080540.db2.gz XVZPMIJKKVGDRZ-INIZCTEOSA-N 1 1 332.492 2.535 20 70 EFIDMO CC[C@H](C)[C@@](C)(O)CNC(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000160005391 473080653 /nfs/dbraw/zinc/08/06/53/473080653.db2.gz MCCGDFJHTYZNFI-YTXYEVPYSA-N 1 1 347.503 2.603 20 70 EFIDMO CCN(C[C@H]1CCCO1)C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000160028067 473081469 /nfs/dbraw/zinc/08/14/69/473081469.db2.gz BWCABKVDQISRIK-QXAKKESOSA-N 1 1 345.487 2.717 20 70 EFIDMO CCCCCN(CCO)C(=O)N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000160052752 473084578 /nfs/dbraw/zinc/08/45/78/473084578.db2.gz QXTJJWWMIDGCCW-IEBWSBKVSA-N 1 1 347.503 2.844 20 70 EFIDMO C[N@@H+]1[C@@H]2CC[C@H]1CC(N1CCN(c3nc(C(C)(C)C)ns3)CC1)C2 ZINC000160118787 473088315 /nfs/dbraw/zinc/08/83/15/473088315.db2.gz NCQSFSKKEOALIV-YIONKMFJSA-N 1 1 349.548 2.583 20 70 EFIDMO Cc1cc(C(=O)NC[C@@H]2CC[N@H+](C)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000160105165 473088490 /nfs/dbraw/zinc/08/84/90/473088490.db2.gz GEVGDDLHLXAZLO-ZDUSSCGKSA-N 1 1 344.846 2.787 20 70 EFIDMO Cc1cccc([C@H]2CCC[N@@H+]2CCNS(=O)(=O)c2ccccc2)n1 ZINC000160160934 473092432 /nfs/dbraw/zinc/09/24/32/473092432.db2.gz OZZPKDVKUKMJCW-GOSISDBHSA-N 1 1 345.468 2.505 20 70 EFIDMO Cc1cccc([C@H]2CCC[N@H+]2CCNS(=O)(=O)c2ccccc2)n1 ZINC000160160934 473092437 /nfs/dbraw/zinc/09/24/37/473092437.db2.gz OZZPKDVKUKMJCW-GOSISDBHSA-N 1 1 345.468 2.505 20 70 EFIDMO CCCCn1ncc(NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1C ZINC000160195263 473094933 /nfs/dbraw/zinc/09/49/33/473094933.db2.gz UURBXKGIGBOSEH-NVXWUHKLSA-N 1 1 333.480 2.940 20 70 EFIDMO Cc1noc(C)c1[C@H](C)CNC(=O)NC[C@@H]1CC[N@H+](CC(C)C)C1 ZINC000160248017 473100581 /nfs/dbraw/zinc/10/05/81/473100581.db2.gz PQBYJGACNJXUOD-CJNGLKHVSA-N 1 1 336.480 2.672 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)C1(c2cccc(F)c2)CC1 ZINC000160256583 473102667 /nfs/dbraw/zinc/10/26/67/473102667.db2.gz ATDORFAXCSHXKL-UHFFFAOYSA-N 1 1 348.462 2.674 20 70 EFIDMO CCC[C@@H]1CN(C(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)CCO1 ZINC000160273965 473104199 /nfs/dbraw/zinc/10/41/99/473104199.db2.gz PFKZOBHOIACDRP-FGTMMUONSA-N 1 1 339.524 2.955 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNS(=O)(=O)c1cc2ccccc2o1 ZINC000160294847 473105408 /nfs/dbraw/zinc/10/54/08/473105408.db2.gz SDAOBOQRJDKOQA-OAHLLOKOSA-N 1 1 336.457 2.832 20 70 EFIDMO CCOCCC[NH+]1CCN(C(=O)c2ccc(Cl)cc2F)CC1 ZINC000160327881 473108033 /nfs/dbraw/zinc/10/80/33/473108033.db2.gz DLABLACWTNBHPG-UHFFFAOYSA-N 1 1 328.815 2.664 20 70 EFIDMO C[C@H]1C[C@H](NC(=O)N2CCS[C@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC000160323266 473109074 /nfs/dbraw/zinc/10/90/74/473109074.db2.gz OXUYKWXNPXLRAO-UXLLHSPISA-N 1 1 333.501 2.796 20 70 EFIDMO COc1cc(C)ccc1OCC(=O)NC[C@H]1CCC[N@H+]1CC(C)C ZINC000160389786 473115183 /nfs/dbraw/zinc/11/51/83/473115183.db2.gz TWRPGEBGXWEXMP-MRXNPFEDSA-N 1 1 334.460 2.619 20 70 EFIDMO COCC1CCN(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000160399909 473119058 /nfs/dbraw/zinc/11/90/58/473119058.db2.gz FDAUEAKGFSBEJI-LPHOPBHVSA-N 1 1 345.487 2.717 20 70 EFIDMO C[C@@H](NC[C@H](C1CCCCC1)[NH+](C)C)c1ccc(-n2cnnn2)cc1 ZINC000160422093 473120965 /nfs/dbraw/zinc/12/09/65/473120965.db2.gz QLFZEHUDCCBYGU-DNVCBOLYSA-N 1 1 342.491 2.823 20 70 EFIDMO CCSCC[NH+]1CCN(C(=O)c2c(F)cccc2Cl)CC1 ZINC000160463624 473128229 /nfs/dbraw/zinc/12/82/29/473128229.db2.gz AREHKWBUEFQDDQ-UHFFFAOYSA-N 1 1 330.856 2.990 20 70 EFIDMO C[C@H](CN1CCOCC1)[N@@H+](CCOCC1CC1)Cc1ccccc1 ZINC000160457722 473128560 /nfs/dbraw/zinc/12/85/60/473128560.db2.gz XGMWBBOUDTUSTM-GOSISDBHSA-N 1 1 332.488 2.636 20 70 EFIDMO CCCn1c(C)nnc1C[N@@H+]1CC[C@H](CN(CC)CC(F)(F)F)C1 ZINC000160501375 473133674 /nfs/dbraw/zinc/13/36/74/473133674.db2.gz FXJCQADMUCEKSO-CQSZACIVSA-N 1 1 347.429 2.703 20 70 EFIDMO CCCn1c(C)nnc1C[N@H+]1CC[C@H](CN(CC)CC(F)(F)F)C1 ZINC000160501375 473133684 /nfs/dbraw/zinc/13/36/84/473133684.db2.gz FXJCQADMUCEKSO-CQSZACIVSA-N 1 1 347.429 2.703 20 70 EFIDMO Cc1nn(C)c(Cl)c1/C=C/C(=O)NC[C@H]1CCC[N@@H+]1CC(C)C ZINC000160500673 473133734 /nfs/dbraw/zinc/13/37/34/473133734.db2.gz FAGZJDKJXVPMTI-HSBSLETESA-N 1 1 338.883 2.632 20 70 EFIDMO CCOC(=O)C1CCN(C(=O)[C@H](C)[N@@H+](CC)C[C@@H](C)CC)CC1 ZINC000160513219 473135808 /nfs/dbraw/zinc/13/58/08/473135808.db2.gz AWUIDOPYCPJEBJ-GJZGRUSLSA-N 1 1 326.481 2.545 20 70 EFIDMO CC[C@@H](C)C[N@H+](CC)[C@@H](C)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000160519088 473137263 /nfs/dbraw/zinc/13/72/63/473137263.db2.gz GWRYERMEIMVZSB-KGLIPLIRSA-N 1 1 340.489 2.785 20 70 EFIDMO CC[C@@H](C)C[N@@H+](CC)[C@@H](C)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000160519088 473137270 /nfs/dbraw/zinc/13/72/70/473137270.db2.gz GWRYERMEIMVZSB-KGLIPLIRSA-N 1 1 340.489 2.785 20 70 EFIDMO Cc1nn(C)c(N2CCOCC2)c1C[N@H+](C)Cc1ccccc1C ZINC000160528988 473138343 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EFIDMO CCC(CC)(C[NH2+]Cc1nc(-c2ccc(F)cc2)no1)C(=O)OC ZINC000159683401 528692750 /nfs/dbraw/zinc/69/27/50/528692750.db2.gz RYQUAWDTEXNLRQ-UHFFFAOYSA-N 1 1 335.379 2.945 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H](C)COCc2ccccc2)CC1 ZINC000159739505 529025065 /nfs/dbraw/zinc/02/50/65/529025065.db2.gz LCAIGZYDAWXDLL-QGZVFWFLSA-N 1 1 333.476 2.577 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCCCO[C@@H](C)c2ccccc2)CC1 ZINC000159559533 529025477 /nfs/dbraw/zinc/02/54/77/529025477.db2.gz QXRBZWAPCBBRCF-KRWDZBQOSA-N 1 1 333.476 2.892 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2cccc(Br)c2)CC1 ZINC000159778192 529026570 /nfs/dbraw/zinc/02/65/70/529026570.db2.gz HOICXSQPBVAMIB-UHFFFAOYSA-N 1 1 340.265 2.686 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1 ZINC000159566690 529026630 /nfs/dbraw/zinc/02/66/30/529026630.db2.gz RCQVQVAGAVMXPH-UHFFFAOYSA-N 1 1 329.366 2.943 20 70 EFIDMO CC[C@H](C)OCC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000159573173 529184588 /nfs/dbraw/zinc/18/45/88/529184588.db2.gz 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CCC[C@@H](CCO)CNC(=O)N[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000159926187 206270254 /nfs/dbraw/zinc/27/02/54/206270254.db2.gz JUUQPQZATCEODD-JENIJYKNSA-N 1 1 347.503 2.747 20 70 EFIDMO CC[N@H+]1CCC[C@@H]1CNC(=O)Cc1cccc(OC(F)(F)F)c1 ZINC000159905841 206270809 /nfs/dbraw/zinc/27/08/09/206270809.db2.gz KGRWCWZWJDVCRU-CYBMUJFWSA-N 1 1 330.350 2.728 20 70 EFIDMO CCC[C@H](CCO)CNC(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159969022 206272952 /nfs/dbraw/zinc/27/29/52/206272952.db2.gz PNPWSMGSPAZXHV-YQVWRLOYSA-N 1 1 347.503 2.605 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cncc2ccccc21 ZINC000159984053 206273844 /nfs/dbraw/zinc/27/38/44/206273844.db2.gz CPYFPKVPLAKOCA-UHFFFAOYSA-N 1 1 341.455 2.665 20 70 EFIDMO O=C(CCSCC[NH+]1CCOCC1)Nc1cccc(Cl)c1 ZINC000160034881 206276722 /nfs/dbraw/zinc/27/67/22/206276722.db2.gz PFQRVHOHPPBOBZ-UHFFFAOYSA-N 1 1 328.865 2.734 20 70 EFIDMO CCC[C@H]1CN(C(=O)Nc2cccnc2Cl)CC[N@H+]1CCOC ZINC000160005504 206275155 /nfs/dbraw/zinc/27/51/55/206275155.db2.gz AVXXBQBCLPPYIE-ZDUSSCGKSA-N 1 1 340.855 2.700 20 70 EFIDMO CCOCCN(CC)C(=O)N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000160078083 206278967 /nfs/dbraw/zinc/27/89/67/206278967.db2.gz HWLSHOZBJOKEQE-SJLPKXTDSA-N 1 1 333.476 2.717 20 70 EFIDMO C[N@@H+](C[C@H](O)Cc1ccc(C(F)(F)F)cc1)C[C@@H]1CCCOC1 ZINC000160095641 206279340 /nfs/dbraw/zinc/27/93/40/206279340.db2.gz CJDUMQFVMQWNMZ-GOEBONIOSA-N 1 1 331.378 2.967 20 70 EFIDMO C[C@@H](c1nc(Cc2ccccc2)no1)[NH+]1CCC(C2OCCO2)CC1 ZINC000160176685 206283715 /nfs/dbraw/zinc/28/37/15/206283715.db2.gz AOMGVMRVIXALNN-AWEZNQCLSA-N 1 1 343.427 2.806 20 70 EFIDMO CC[N@@H+](Cc1nc2cc(OC)c(OC)cc2c(=O)[nH]1)CC(C)(C)C ZINC000160229457 206284919 /nfs/dbraw/zinc/28/49/19/206284919.db2.gz PMQVWIZOSIGGAO-UHFFFAOYSA-N 1 1 333.432 2.808 20 70 EFIDMO COC[C@H](NC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)C1CC1 ZINC000160244655 206286008 /nfs/dbraw/zinc/28/60/08/206286008.db2.gz ZDPKPDFDKTZZRA-KSSFIOAISA-N 1 1 347.459 2.626 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)C1(c2ccccc2)CC1 ZINC000160319583 206289378 /nfs/dbraw/zinc/28/93/78/206289378.db2.gz WUHZWNHMKCSDID-UHFFFAOYSA-N 1 1 330.472 2.535 20 70 EFIDMO CC[C@H](C)C[N@H+](CC)[C@@H](C)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000160519232 206302207 /nfs/dbraw/zinc/30/22/07/206302207.db2.gz GWRYERMEIMVZSB-KBPBESRZSA-N 1 1 340.489 2.785 20 70 EFIDMO CC[C@H](C)C[N@@H+](CC)[C@@H](C)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000160519232 206302210 /nfs/dbraw/zinc/30/22/10/206302210.db2.gz GWRYERMEIMVZSB-KBPBESRZSA-N 1 1 340.489 2.785 20 70 EFIDMO CC(C)S(=O)(=O)CCC[NH+]1CCC([C@H](O)c2ccccc2)CC1 ZINC000160656071 206307623 /nfs/dbraw/zinc/30/76/23/206307623.db2.gz HKMHIELMWAANMB-GOSISDBHSA-N 1 1 339.501 2.645 20 70 EFIDMO CC[N@@H+](C)C[C@H]1CCN([C@@H]2CCCN(c3ccccc3F)C2=O)C1 ZINC000160679968 206307935 /nfs/dbraw/zinc/30/79/35/206307935.db2.gz IRNFUVWSDDZQOA-CRAIPNDOSA-N 1 1 333.451 2.595 20 70 EFIDMO CCCCOC(=O)CC[N@@H+](C)[C@H](C)c1ccc(-n2cncn2)cc1 ZINC000160707416 206309650 /nfs/dbraw/zinc/30/96/50/206309650.db2.gz DXJSSSOJXIGGPZ-OAHLLOKOSA-N 1 1 330.432 2.994 20 70 EFIDMO O=C([C@H]1CCCO1)N1CC[NH+](Cc2cc3ccccc3s2)CC1 ZINC000160978895 206321078 /nfs/dbraw/zinc/32/10/78/206321078.db2.gz AKAGQXRKFWQVFZ-MRXNPFEDSA-N 1 1 330.453 2.725 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)NCCOc1cccc(C)c1 ZINC000161038073 206324492 /nfs/dbraw/zinc/32/44/92/206324492.db2.gz RZCQEQFUQZWTHP-QGZVFWFLSA-N 1 1 341.455 2.796 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)NCCOc1cccc(C)c1 ZINC000161038073 206324496 /nfs/dbraw/zinc/32/44/96/206324496.db2.gz RZCQEQFUQZWTHP-QGZVFWFLSA-N 1 1 341.455 2.796 20 70 EFIDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cccc(-c2nc[nH]n2)c1 ZINC000160593413 206304466 /nfs/dbraw/zinc/30/44/66/206304466.db2.gz FBYODZDWMXDNSS-OAHLLOKOSA-N 1 1 341.459 2.856 20 70 EFIDMO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)c1cccc(-c2nnc[nH]2)c1 ZINC000160593413 206304469 /nfs/dbraw/zinc/30/44/69/206304469.db2.gz FBYODZDWMXDNSS-OAHLLOKOSA-N 1 1 341.459 2.856 20 70 EFIDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cccc(-c2nnc[nH]2)c1 ZINC000160593413 206304472 /nfs/dbraw/zinc/30/44/72/206304472.db2.gz FBYODZDWMXDNSS-OAHLLOKOSA-N 1 1 341.459 2.856 20 70 EFIDMO CC[N@@H+](C)Cc1cccc(CNC(=O)C[C@H]2CSCCS2)c1 ZINC000160596356 206304725 /nfs/dbraw/zinc/30/47/25/206304725.db2.gz YZYLNUIBLOJQJK-INIZCTEOSA-N 1 1 338.542 2.993 20 70 EFIDMO CCC[N@@H+](CCO)Cc1ccc(OCc2ccncc2)c(OC)c1 ZINC000161200827 206334575 /nfs/dbraw/zinc/33/45/75/206334575.db2.gz PQBCNENKAXGFFD-UHFFFAOYSA-N 1 1 330.428 2.874 20 70 EFIDMO CCC[N@@H+](CCO)Cc1ccc(OC)c(OCc2cccnc2)c1 ZINC000161223270 206336064 /nfs/dbraw/zinc/33/60/64/206336064.db2.gz HIKDXRLOORDVKF-UHFFFAOYSA-N 1 1 330.428 2.874 20 70 EFIDMO Cc1nc(CC(=O)NCC[N@@H+]2CCc3sccc3C2)c(C)s1 ZINC000161259879 206338076 /nfs/dbraw/zinc/33/80/76/206338076.db2.gz LKBHPNKWFINIBX-UHFFFAOYSA-N 1 1 335.498 2.538 20 70 EFIDMO Cc1nc(CC(=O)NCC[N@H+]2CCc3sccc3C2)c(C)s1 ZINC000161259879 206338080 /nfs/dbraw/zinc/33/80/80/206338080.db2.gz LKBHPNKWFINIBX-UHFFFAOYSA-N 1 1 335.498 2.538 20 70 EFIDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cnc(-c2ccccc2)nc1C ZINC000161391221 206346281 /nfs/dbraw/zinc/34/62/81/206346281.db2.gz AFBPKNWAHQTNGU-AWEZNQCLSA-N 1 1 326.444 2.912 20 70 EFIDMO C[C@H](NC(=O)N1CCC([N@@H+](C)CCO)CC1)c1cc2ccccc2o1 ZINC000161426851 206347230 /nfs/dbraw/zinc/34/72/30/206347230.db2.gz WHKVPDIMNONWAQ-AWEZNQCLSA-N 1 1 345.443 2.592 20 70 EFIDMO c1ccc(CCN2CC[C@@H](C[NH2+]C3CCC4(CC3)OCCO4)C2)cc1 ZINC000161425973 206348535 /nfs/dbraw/zinc/34/85/35/206348535.db2.gz UGJJMLPWMDCWJO-IBGZPJMESA-N 1 1 344.499 2.826 20 70 EFIDMO Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000160299173 544803975 /nfs/dbraw/zinc/80/39/75/544803975.db2.gz QFBULCQQAONOKF-FZMZJTMJSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000160299173 544803978 /nfs/dbraw/zinc/80/39/78/544803978.db2.gz QFBULCQQAONOKF-FZMZJTMJSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1c(NC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cccc1C(F)(F)F ZINC000161157119 544811325 /nfs/dbraw/zinc/81/13/25/544811325.db2.gz FLEAVLSWIFAYQS-BXUZGUMPSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1c(NC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1C(F)(F)F ZINC000161157119 544811330 /nfs/dbraw/zinc/81/13/30/544811330.db2.gz FLEAVLSWIFAYQS-BXUZGUMPSA-N 1 1 345.365 2.854 20 70 EFIDMO CCC(C)(CC)C(=O)N[C@H](C)C[NH+]1CCN(c2ccccn2)CC1 ZINC000159392404 544795353 /nfs/dbraw/zinc/79/53/53/544795353.db2.gz PTXAHROBCXWBLC-MRXNPFEDSA-N 1 1 332.492 2.535 20 70 EFIDMO C[C@@H](NC1CC[NH+](C2CCCC2)CC1)c1ccc(-n2cnnn2)cc1 ZINC000160502819 278335226 /nfs/dbraw/zinc/33/52/26/278335226.db2.gz MZBIRBIPVGEDPQ-OAHLLOKOSA-N 1 1 340.475 2.720 20 70 EFIDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)C1 ZINC000160913569 279035278 /nfs/dbraw/zinc/03/52/78/279035278.db2.gz IRFNQTIFUZRWQN-UHOSZYNNSA-N 1 1 345.487 2.890 20 70 EFIDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)C1 ZINC000160913698 279038962 /nfs/dbraw/zinc/03/89/62/279038962.db2.gz IRFNQTIFUZRWQN-QRQLOZEOSA-N 1 1 345.487 2.890 20 70 EFIDMO Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc(F)c1F ZINC000159454549 310687447 /nfs/dbraw/zinc/68/74/47/310687447.db2.gz NLMWDZZDAINYNV-GXSJLCMTSA-N 1 1 336.386 2.993 20 70 EFIDMO Cc1cccc(C[NH+]2CCN(C(=O)[C@@H](C)C3CCOCC3)CC2)c1 ZINC000159497173 310688048 /nfs/dbraw/zinc/68/80/48/310688048.db2.gz HFGBEGQVOJSYMG-KRWDZBQOSA-N 1 1 330.472 2.702 20 70 EFIDMO CSc1ccc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc1 ZINC000159590054 310688667 /nfs/dbraw/zinc/68/86/67/310688667.db2.gz ZEMOJPXOSMQKCX-UHFFFAOYSA-N 1 1 336.501 2.839 20 70 EFIDMO COCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cnccn2)cc1OC ZINC000161219130 310707111 /nfs/dbraw/zinc/70/71/11/310707111.db2.gz MGEWTQAAMADFJA-ZIAGYGMSSA-N 1 1 331.416 2.922 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000161133298 473210603 /nfs/dbraw/zinc/21/06/03/473210603.db2.gz DLHHYMOWZPICQW-MAUKXSAKSA-N 1 1 339.439 2.932 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000161133298 473210608 /nfs/dbraw/zinc/21/06/08/473210608.db2.gz DLHHYMOWZPICQW-MAUKXSAKSA-N 1 1 339.439 2.932 20 70 EFIDMO CC[NH+]1CCN(C(=O)c2cnn(-c3cc(C)ccc3C)c2C)CC1 ZINC000161141214 473211445 /nfs/dbraw/zinc/21/14/45/473211445.db2.gz UMKZBGBDSJFRSA-UHFFFAOYSA-N 1 1 326.444 2.575 20 70 EFIDMO CCCS(=O)(=O)CC[N@H+](C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000161240072 473220300 /nfs/dbraw/zinc/22/03/00/473220300.db2.gz SJAGLTILEKGLRN-UHFFFAOYSA-N 1 1 349.500 2.766 20 70 EFIDMO CCCS(=O)(=O)CC[N@@H+](C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000161240072 473220302 /nfs/dbraw/zinc/22/03/02/473220302.db2.gz SJAGLTILEKGLRN-UHFFFAOYSA-N 1 1 349.500 2.766 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc(C)c2)C1 ZINC000161314908 473225458 /nfs/dbraw/zinc/22/54/58/473225458.db2.gz MABNHXTTXGDYHE-JKSUJKDBSA-N 1 1 341.459 2.813 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cccc(C)c2)C1 ZINC000161314908 473225464 /nfs/dbraw/zinc/22/54/64/473225464.db2.gz MABNHXTTXGDYHE-JKSUJKDBSA-N 1 1 341.459 2.813 20 70 EFIDMO CCOC(=O)[C@@H]1CCC[N@@H+]([C@H]2CCCN(c3ccccc3F)C2=O)C1 ZINC000161385400 473231144 /nfs/dbraw/zinc/23/11/44/473231144.db2.gz VCRVUNGKCAHPBZ-PBHICJAKSA-N 1 1 348.418 2.596 20 70 EFIDMO CCOC(=O)[C@@H]1CCC[N@H+]([C@H]2CCCN(c3ccccc3F)C2=O)C1 ZINC000161385400 473231147 /nfs/dbraw/zinc/23/11/47/473231147.db2.gz VCRVUNGKCAHPBZ-PBHICJAKSA-N 1 1 348.418 2.596 20 70 EFIDMO COc1ccc(OC)c(C[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)c1 ZINC000161404983 473232779 /nfs/dbraw/zinc/23/27/79/473232779.db2.gz CXUHDIRYVUUNEC-AWEZNQCLSA-N 1 1 342.443 2.621 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@H+]([C@@H](C)C(=O)N(C)C2CCCCC2)C1 ZINC000161418662 473234634 /nfs/dbraw/zinc/23/46/34/473234634.db2.gz RZPIQBQDVZPUJF-HOTGVXAUSA-N 1 1 347.507 2.657 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2[nH]cnc2c1 ZINC000159368977 473021676 /nfs/dbraw/zinc/02/16/76/473021676.db2.gz QLROMQWFAWYJAD-KUHUBIRLSA-N 1 1 334.423 2.813 20 70 EFIDMO CC(C)c1ncc(C[N@H+]2CCCC[C@@H]2CCNS(C)(=O)=O)s1 ZINC000159377410 473022593 /nfs/dbraw/zinc/02/25/93/473022593.db2.gz GHZOYBLMLGMIBW-CYBMUJFWSA-N 1 1 345.534 2.560 20 70 EFIDMO C[N@H+](Cc1ccccc1)CC(C)(C)NCc1cccc(C(N)=O)c1 ZINC000159388414 473024292 /nfs/dbraw/zinc/02/42/92/473024292.db2.gz ACRDMBWATFVHGI-UHFFFAOYSA-N 1 1 325.456 2.786 20 70 EFIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NCc1cccc(C(N)=O)c1 ZINC000159388414 473024299 /nfs/dbraw/zinc/02/42/99/473024299.db2.gz ACRDMBWATFVHGI-UHFFFAOYSA-N 1 1 325.456 2.786 20 70 EFIDMO COc1nc(C)nc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1C ZINC000159405684 473025991 /nfs/dbraw/zinc/02/59/91/473025991.db2.gz WTRZAXKSRBCCOK-UHFFFAOYSA-N 1 1 327.432 2.886 20 70 EFIDMO Cc1nn(C)c(C)c1NC(=O)[C@H](C)[NH2+][C@@H](C)c1cccc(F)c1F ZINC000159454700 473029326 /nfs/dbraw/zinc/02/93/26/473029326.db2.gz NLMWDZZDAINYNV-ONGXEEELSA-N 1 1 336.386 2.993 20 70 EFIDMO C[N@@H+](CCCCCn1nnc(-c2ccccc2)n1)C[C@@H]1CCC[C@@H]1O ZINC000159455013 473030347 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QUSVOQCXGRSRPT-UHFFFAOYSA-N 1 1 345.256 2.979 20 70 EFIDMO CCCCN(CCCO)C(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159960323 473075919 /nfs/dbraw/zinc/07/59/19/473075919.db2.gz ORFOEBUGBDFVEJ-HKUYNNGSSA-N 1 1 347.503 2.701 20 70 EFIDMO O[C@H](C[NH2+]Cc1cc(Cl)ccc1F)CN1CCc2ccccc2C1 ZINC000159971495 473077725 /nfs/dbraw/zinc/07/77/25/473077725.db2.gz XSCKARVJAUPZBI-GOSISDBHSA-N 1 1 348.849 2.988 20 70 EFIDMO C[C@H](CNC(=O)N(C)Cc1cccn1C)[N@@H+](C)Cc1ccccc1 ZINC000160070176 473085480 /nfs/dbraw/zinc/08/54/80/473085480.db2.gz NZLFIOUVYGKQRW-MRXNPFEDSA-N 1 1 328.460 2.687 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N(C)CC1CCOCC1 ZINC000160171101 473093266 /nfs/dbraw/zinc/09/32/66/473093266.db2.gz MUUDABXWUCXVBZ-KRWDZBQOSA-N 1 1 325.497 2.565 20 70 EFIDMO CCCCn1ncc(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1C ZINC000160195403 473095072 /nfs/dbraw/zinc/09/50/72/473095072.db2.gz UURBXKGIGBOSEH-WBVHZDCISA-N 1 1 333.480 2.940 20 70 EFIDMO CCc1ccc(/C=C/C(=O)N2CCCC[C@@H]2C[NH+]2CCOCC2)o1 ZINC000160241272 473098872 /nfs/dbraw/zinc/09/88/72/473098872.db2.gz BCDBDNUDCJDNDN-ROJDOSBLSA-N 1 1 332.444 2.569 20 70 EFIDMO CC[N@@H+](CC(=O)NCc1ccc(F)cc1)Cc1cccc2c[nH]nc21 ZINC000160233087 473099692 /nfs/dbraw/zinc/09/96/92/473099692.db2.gz PFANZGUKHNCJCO-UHFFFAOYSA-N 1 1 340.402 2.840 20 70 EFIDMO C[C@H](O)C[C@H](CNC(=O)C[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC000160243159 473100705 /nfs/dbraw/zinc/10/07/05/473100705.db2.gz MPRCXTBNTBASOC-FXAWDEMLSA-N 1 1 340.467 2.789 20 70 EFIDMO C[C@H](O)C[C@H](CNC(=O)C[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC000160243159 473100711 /nfs/dbraw/zinc/10/07/11/473100711.db2.gz MPRCXTBNTBASOC-FXAWDEMLSA-N 1 1 340.467 2.789 20 70 EFIDMO CCc1ccc(CC(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc1 ZINC000160259972 473101668 /nfs/dbraw/zinc/10/16/68/473101668.db2.gz JDMJFRGVQOLGQT-UHFFFAOYSA-N 1 1 332.488 2.608 20 70 EFIDMO CCC[C@H]1CN(C(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)CCO1 ZINC000160274085 473103036 /nfs/dbraw/zinc/10/30/36/473103036.db2.gz PFKZOBHOIACDRP-KSZLIROESA-N 1 1 339.524 2.955 20 70 EFIDMO CCOC(=O)[C@H]1CCC[N@@H+](CC2CCN(C(=O)C(C)(C)C)CC2)C1 ZINC000160279432 473104328 /nfs/dbraw/zinc/10/43/28/473104328.db2.gz XYXZAFWRKXAICE-INIZCTEOSA-N 1 1 338.492 2.546 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(Br)o1 ZINC000160574257 473145294 /nfs/dbraw/zinc/14/52/94/473145294.db2.gz OXYOEPIJRRVVOU-LLVKDONJSA-N 1 1 329.238 2.892 20 70 EFIDMO Cc1cc(C[N@H+]2CCC[C@@H]2C(N)=O)cc(C)c1OCc1ccccn1 ZINC000160317726 473106390 /nfs/dbraw/zinc/10/63/90/473106390.db2.gz OHFUYAWLORNWQB-GOSISDBHSA-N 1 1 339.439 2.727 20 70 EFIDMO Cc1cc(C[N@H+]2CCC[C@H]2C(N)=O)cc(C)c1OCc1ccccn1 ZINC000160317879 473107774 /nfs/dbraw/zinc/10/77/74/473107774.db2.gz OHFUYAWLORNWQB-SFHVURJKSA-N 1 1 339.439 2.727 20 70 EFIDMO Cc1nn(Cc2ccccc2Cl)c(C)c1C[N@@H+]1CCC[C@H]1C(N)=O ZINC000160343643 473109980 /nfs/dbraw/zinc/10/99/80/473109980.db2.gz SBUFQKZRXKSDQG-KRWDZBQOSA-N 1 1 346.862 2.651 20 70 EFIDMO Cc1nn(Cc2ccccc2Cl)c(C)c1C[N@H+]1CCC[C@H]1C(N)=O ZINC000160343643 473109986 /nfs/dbraw/zinc/10/99/86/473109986.db2.gz SBUFQKZRXKSDQG-KRWDZBQOSA-N 1 1 346.862 2.651 20 70 EFIDMO NC(=O)CC[C@@H]1CCC[N@H+](Cc2ncc(-c3ccccc3F)o2)C1 ZINC000160328869 473110101 /nfs/dbraw/zinc/11/01/01/473110101.db2.gz ZJSMERFRUFUUEP-ZDUSSCGKSA-N 1 1 331.391 2.958 20 70 EFIDMO NC(=O)CC[C@@H]1CCC[N@@H+](Cc2ncc(-c3ccccc3F)o2)C1 ZINC000160328869 473110107 /nfs/dbraw/zinc/11/01/07/473110107.db2.gz ZJSMERFRUFUUEP-ZDUSSCGKSA-N 1 1 331.391 2.958 20 70 EFIDMO C[C@@H](c1nc(Cc2ccccc2)no1)[N@@H+]1CCC[C@H](CCC(N)=O)C1 ZINC000160333048 473110607 /nfs/dbraw/zinc/11/06/07/473110607.db2.gz MWBGWTAIHKDTOT-GOEBONIOSA-N 1 1 342.443 2.699 20 70 EFIDMO C[C@@H](c1nc(Cc2ccccc2)no1)[N@H+]1CCC[C@H](CCC(N)=O)C1 ZINC000160333048 473110612 /nfs/dbraw/zinc/11/06/12/473110612.db2.gz MWBGWTAIHKDTOT-GOEBONIOSA-N 1 1 342.443 2.699 20 70 EFIDMO COCC1CCN(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000160400042 473118508 /nfs/dbraw/zinc/11/85/08/473118508.db2.gz FDAUEAKGFSBEJI-VQIMIIECSA-N 1 1 345.487 2.717 20 70 EFIDMO CCC[C@H]1CN(C(=O)N[C@@H]2CCCc3occc32)CC[N@H+]1CCOC ZINC000160432213 473124552 /nfs/dbraw/zinc/12/45/52/473124552.db2.gz NTIVHGJLBFMKHO-DOTOQJQBSA-N 1 1 349.475 2.799 20 70 EFIDMO CCC[N@@H+](Cc1c(C)nn(C)c1N1CCOCC1)Cc1ccccc1 ZINC000160481924 473130930 /nfs/dbraw/zinc/13/09/30/473130930.db2.gz DFFVMFLPEZUWBT-UHFFFAOYSA-N 1 1 342.487 2.977 20 70 EFIDMO CCc1cc(=O)[nH]c(C[N@H+]2CCC[C@H](C(=O)Nc3ccccc3)C2)n1 ZINC000160607070 473151322 /nfs/dbraw/zinc/15/13/22/473151322.db2.gz AACGXXCUFCNPBW-AWEZNQCLSA-N 1 1 340.427 2.595 20 70 EFIDMO CCCC1(CNC(=O)c2ccc(C[NH+]3CCN(C)CC3)cc2)CC1 ZINC000160633658 473154301 /nfs/dbraw/zinc/15/43/01/473154301.db2.gz DMKFOZOVGJUERI-UHFFFAOYSA-N 1 1 329.488 2.744 20 70 EFIDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N(Cc1cccc(F)c1)C1CC1 ZINC000160636386 473155457 /nfs/dbraw/zinc/15/54/57/473155457.db2.gz HDTZWCOVZFBWOZ-QGZVFWFLSA-N 1 1 331.435 2.984 20 70 EFIDMO Cc1[nH+]ccn1CCCN(C)C(=O)Nc1ccn(CC(F)(F)F)n1 ZINC000160645941 473156722 /nfs/dbraw/zinc/15/67/22/473156722.db2.gz YTEUHEOMKHRXHA-UHFFFAOYSA-N 1 1 344.341 2.504 20 70 EFIDMO CN(C)[C@H](CNC(=O)c1ccc(C[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000160661056 473157386 /nfs/dbraw/zinc/15/73/86/473157386.db2.gz ITFQNYMKUPQVSK-LJQANCHMSA-N 1 1 343.446 2.920 20 70 EFIDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N1CCSC[C@@H]1c1ccccc1 ZINC000160668534 473158890 /nfs/dbraw/zinc/15/88/90/473158890.db2.gz RBKDHGSXTSNVMW-ZWKOTPCHSA-N 1 1 345.512 2.970 20 70 EFIDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N1CCSC[C@@H]1c1ccccc1 ZINC000160668284 473159067 /nfs/dbraw/zinc/15/90/67/473159067.db2.gz RBKDHGSXTSNVMW-QZTJIDSGSA-N 1 1 345.512 2.970 20 70 EFIDMO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)c2cccc(-c3nnc[nH]3)c2)C1 ZINC000160670970 473159269 /nfs/dbraw/zinc/15/92/69/473159269.db2.gz IELMBNZSZALUJI-HUUCEWRRSA-N 1 1 341.459 2.570 20 70 EFIDMO O=C1CC[C@@H]2C[N@H+](Cc3ccc(F)cc3Br)CC[C@H]2N1 ZINC000160741556 473169331 /nfs/dbraw/zinc/16/93/31/473169331.db2.gz LVAJGFXXYKSEPO-BXUZGUMPSA-N 1 1 341.224 2.689 20 70 EFIDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(F)cc3Br)CC[C@H]2N1 ZINC000160741556 473169336 /nfs/dbraw/zinc/16/93/36/473169336.db2.gz LVAJGFXXYKSEPO-BXUZGUMPSA-N 1 1 341.224 2.689 20 70 EFIDMO Cc1nc(C(C)(C)NC(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)sc1C ZINC000160746282 473169574 /nfs/dbraw/zinc/16/95/74/473169574.db2.gz GFHILALNSIIIEI-CQSZACIVSA-N 1 1 336.505 2.779 20 70 EFIDMO Cc1nc(C(C)(C)NC(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)sc1C ZINC000160746395 473169902 /nfs/dbraw/zinc/16/99/02/473169902.db2.gz GFHILALNSIIIEI-AWEZNQCLSA-N 1 1 336.505 2.779 20 70 EFIDMO CCS[C@@H]1CCCCN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)C1 ZINC000160747366 473169995 /nfs/dbraw/zinc/16/99/95/473169995.db2.gz WYBNLPTWSYXLOE-HZPDHXFCSA-N 1 1 325.522 2.788 20 70 EFIDMO C[C@@H]1C[N@H+](CCCNC(=O)c2nc3ccccc3s2)C[C@H](C)O1 ZINC000160786967 473174425 /nfs/dbraw/zinc/17/44/25/473174425.db2.gz DXZSSRAWYOWBKS-BETUJISGSA-N 1 1 333.457 2.525 20 70 EFIDMO Cc1nsc(N2CCC[N@H+](Cc3c(C)nc4ccccn43)CC2)n1 ZINC000160853043 473183928 /nfs/dbraw/zinc/18/39/28/473183928.db2.gz SEURIINFHBEYSX-UHFFFAOYSA-N 1 1 342.472 2.515 20 70 EFIDMO Cc1nsc(N2CCC[N@@H+](Cc3c(C)nc4ccccn43)CC2)n1 ZINC000160853043 473183933 /nfs/dbraw/zinc/18/39/33/473183933.db2.gz SEURIINFHBEYSX-UHFFFAOYSA-N 1 1 342.472 2.515 20 70 EFIDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N(Cc1cccnc1)C1CC1 ZINC000160862344 473185266 /nfs/dbraw/zinc/18/52/66/473185266.db2.gz CURCPAXCHVCYHU-INIZCTEOSA-N 1 1 328.460 2.773 20 70 EFIDMO CCCO[C@@H]1CCCN(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)CC1 ZINC000160879358 473187040 /nfs/dbraw/zinc/18/70/40/473187040.db2.gz HDZYHVMGDAKNSH-FUHWJXTLSA-N 1 1 337.508 2.994 20 70 EFIDMO CCCCN1CCc2ccc(NC(=O)[C@@H]3C[N@H+](CC)CCO3)cc21 ZINC000160953420 473194070 /nfs/dbraw/zinc/19/40/70/473194070.db2.gz PRUCTZNURYADGB-SFHVURJKSA-N 1 1 331.460 2.508 20 70 EFIDMO CCCCN1CCc2ccc(NC(=O)[C@@H]3C[N@@H+](CC)CCO3)cc21 ZINC000160953420 473194073 /nfs/dbraw/zinc/19/40/73/473194073.db2.gz PRUCTZNURYADGB-SFHVURJKSA-N 1 1 331.460 2.508 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N1CCC(n2ccnc2)CC1 ZINC000160967182 473195435 /nfs/dbraw/zinc/19/54/35/473195435.db2.gz GJZXSPRRIAXCRI-SFHVURJKSA-N 1 1 347.507 2.740 20 70 EFIDMO C[C@H]1CCC[C@H](C(=O)NCc2cccc(C[NH+]3CCOCC3)c2)C1 ZINC000160977237 473195474 /nfs/dbraw/zinc/19/54/74/473195474.db2.gz RWUZYQKGGANLKI-LPHOPBHVSA-N 1 1 330.472 2.961 20 70 EFIDMO C[C@@H]1CN(C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(Cn2ccccc2=O)cc1 ZINC000161062206 473203448 /nfs/dbraw/zinc/20/34/48/473203448.db2.gz KRHRUPGOGNGDMS-HLIPFELVSA-N 1 1 339.483 2.715 20 70 EFIDMO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000161062206 473203454 /nfs/dbraw/zinc/20/34/54/473203454.db2.gz KRHRUPGOGNGDMS-HLIPFELVSA-N 1 1 339.483 2.715 20 70 EFIDMO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000161062206 473203458 /nfs/dbraw/zinc/20/34/58/473203458.db2.gz KRHRUPGOGNGDMS-HLIPFELVSA-N 1 1 339.483 2.715 20 70 EFIDMO CCNC(=O)c1ccc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)nc1 ZINC000160229166 528261922 /nfs/dbraw/zinc/26/19/22/528261922.db2.gz AKVMQDOFMYBMRK-YJBOKZPZSA-N 1 1 338.455 2.764 20 70 EFIDMO CC(C)[NH+]1CCN(C(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)CC1 ZINC000160054658 529039910 /nfs/dbraw/zinc/03/99/10/529039910.db2.gz FZWDSHDOTPJBDN-UHFFFAOYSA-N 1 1 345.487 2.629 20 70 EFIDMO CCc1cc2c(C[N@@H+](C)C[C@@H]3CCC[C@@H]3O)cc(=O)oc2cc1O ZINC000159832436 529570078 /nfs/dbraw/zinc/57/00/78/529570078.db2.gz ZPGFNPMYSQVBTO-BBRMVZONSA-N 1 1 331.412 2.654 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)CCCc1cccs1 ZINC000159789356 529846077 /nfs/dbraw/zinc/84/60/77/529846077.db2.gz KKIDSZRQERFHTD-UHFFFAOYSA-N 1 1 338.517 2.888 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)C1(c2ccccc2)CCC1 ZINC000159822523 529846158 /nfs/dbraw/zinc/84/61/58/529846158.db2.gz OZSZVOWYKZJAMA-UHFFFAOYSA-N 1 1 344.499 2.925 20 70 EFIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCCC[C@H]1c1ncc[nH]1 ZINC000160814032 284053844 /nfs/dbraw/zinc/05/38/44/284053844.db2.gz KSGXSHUYDDNAKK-ZBFHGGJFSA-N 1 1 331.464 2.663 20 70 EFIDMO COC[C@@H](NC(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1)C1CC1 ZINC000160244928 533357890 /nfs/dbraw/zinc/35/78/90/533357890.db2.gz ZDPKPDFDKTZZRA-KBXCAEBGSA-N 1 1 347.459 2.626 20 70 EFIDMO COc1ccc(C(F)(F)C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC000159728479 533369009 /nfs/dbraw/zinc/36/90/09/533369009.db2.gz WEHUHDFAFYGWCV-BBRMVZONSA-N 1 1 338.398 2.730 20 70 EFIDMO COc1ccc(C)cc1NC(=O)[C@@H](c1ccccc1)[N@H+](C)C[C@@H](C)O ZINC000159561744 533400863 /nfs/dbraw/zinc/40/08/63/533400863.db2.gz JMNSSQBRWBCQIE-DNVCBOLYSA-N 1 1 342.439 2.996 20 70 EFIDMO COc1ccc(C)cc1NC(=O)[C@@H](c1ccccc1)[N@@H+](C)C[C@@H](C)O ZINC000159561744 533400869 /nfs/dbraw/zinc/40/08/69/533400869.db2.gz JMNSSQBRWBCQIE-DNVCBOLYSA-N 1 1 342.439 2.996 20 70 EFIDMO CS(=O)(=O)NCC[C@H]1CCCC[N@H+]1Cc1ccc2ncccc2c1 ZINC000159408638 533400852 /nfs/dbraw/zinc/40/08/52/533400852.db2.gz WYNIQKMOFRATFR-QGZVFWFLSA-N 1 1 347.484 2.529 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)N(C)CCOCC2CC2)C[N@H+]1Cc1ccccc1 ZINC000160337528 533607319 /nfs/dbraw/zinc/60/73/19/533607319.db2.gz HRTJJGPBXPMPAF-VQIMIIECSA-N 1 1 345.487 2.717 20 70 EFIDMO C[C@@H]1C[C@@H](NC(=O)N(C)Cc2cscn2)C[N@H+]1Cc1ccccc1 ZINC000159896587 533610657 /nfs/dbraw/zinc/61/06/57/533610657.db2.gz OJERRNCVMQAKPR-GDBMZVCRSA-N 1 1 344.484 2.948 20 70 EFIDMO Cc1ccc(C)c(CC(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000160282245 533654053 /nfs/dbraw/zinc/65/40/53/533654053.db2.gz JRYNZLNSAKUARM-UHFFFAOYSA-N 1 1 332.488 2.663 20 70 EFIDMO C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000159380214 225204978 /nfs/dbraw/zinc/20/49/78/225204978.db2.gz IQQSZIVRYJXZAM-HOTGVXAUSA-N 1 1 326.440 2.917 20 70 EFIDMO Cc1[nH+]ccn1CCCCNC(=O)N1CCc2cccc(F)c2C1 ZINC000159379724 225205815 /nfs/dbraw/zinc/20/58/15/225205815.db2.gz WOHJGNRVWNLYTO-UHFFFAOYSA-N 1 1 330.407 2.879 20 70 EFIDMO Cc1c(/C=C/C(=O)NCc2ccccc2C[N@H+](C)C(C)C)cnn1C ZINC000159772517 225274786 /nfs/dbraw/zinc/27/47/86/225274786.db2.gz KBPHWTAVSOLCQC-ZHACJKMWSA-N 1 1 340.471 2.898 20 70 EFIDMO C[NH+](C)CCN(Cc1cccs1)C(=O)c1cccc2[nH]cnc21 ZINC000159833978 225287148 /nfs/dbraw/zinc/28/71/48/225287148.db2.gz LFESAUSEBDQMIA-UHFFFAOYSA-N 1 1 328.441 2.828 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N(C)Cc1ccccn1 ZINC000159977704 225312962 /nfs/dbraw/zinc/31/29/62/225312962.db2.gz ZLGBNFUMFKDZGV-APWZRJJASA-N 1 1 338.455 2.744 20 70 EFIDMO Cc1ccc(C(=O)CC[N@@H+]2CCC[C@@H]2C(=O)NCc2ccco2)cc1 ZINC000159660603 225256879 /nfs/dbraw/zinc/25/68/79/225256879.db2.gz LVEDKJQKKCSTLO-GOSISDBHSA-N 1 1 340.423 2.942 20 70 EFIDMO Cc1ccc(C(=O)CC[N@H+]2CCC[C@@H]2C(=O)NCc2ccco2)cc1 ZINC000159660603 225256884 /nfs/dbraw/zinc/25/68/84/225256884.db2.gz LVEDKJQKKCSTLO-GOSISDBHSA-N 1 1 340.423 2.942 20 70 EFIDMO COc1ccc(Cl)cc1CC(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000160283545 225380465 /nfs/dbraw/zinc/38/04/65/225380465.db2.gz ACASJXFLQSPVNQ-AWEZNQCLSA-N 1 1 336.819 2.903 20 70 EFIDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2ncccc2O)CC1 ZINC000160155433 225349150 /nfs/dbraw/zinc/34/91/50/225349150.db2.gz JFTJKBVBYMCVGA-HNNXBMFYSA-N 1 1 331.460 2.904 20 70 EFIDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2ncccc2O)CC1 ZINC000160155282 225350425 /nfs/dbraw/zinc/35/04/25/225350425.db2.gz JFTJKBVBYMCVGA-OAHLLOKOSA-N 1 1 331.460 2.904 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)C[C@H]1CCc2ccccc21 ZINC000159877441 544799859 /nfs/dbraw/zinc/79/98/59/544799859.db2.gz WNEKKGBLRDSOHH-GOSISDBHSA-N 1 1 344.499 2.923 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)[C@H]1C[N@H+](C)CCO1 ZINC000160024542 544801466 /nfs/dbraw/zinc/80/14/66/544801466.db2.gz XLSFOVQMVLEUEJ-BXUZGUMPSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)[C@H]1C[N@@H+](C)CCO1 ZINC000160024542 544801472 /nfs/dbraw/zinc/80/14/72/544801472.db2.gz XLSFOVQMVLEUEJ-BXUZGUMPSA-N 1 1 345.365 2.632 20 70 EFIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)NCCc1cscn1 ZINC000160071012 544801548 /nfs/dbraw/zinc/80/15/48/544801548.db2.gz UNIDQLKHSADVEA-UHFFFAOYSA-N 1 1 346.500 2.895 20 70 EFIDMO C[C@H](NC(=O)Nc1ccccc1CC(F)(F)F)[C@@H]1C[N@H+](C)CCO1 ZINC000160116591 544802485 /nfs/dbraw/zinc/80/24/85/544802485.db2.gz OMTFPKNKTLGTSC-FZMZJTMJSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@H](NC(=O)Nc1ccccc1CC(F)(F)F)[C@@H]1C[N@@H+](C)CCO1 ZINC000160116591 544802489 /nfs/dbraw/zinc/80/24/89/544802489.db2.gz OMTFPKNKTLGTSC-FZMZJTMJSA-N 1 1 345.365 2.632 20 70 EFIDMO Cc1cc(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)ccc1C(F)(F)F ZINC000160175112 544802602 /nfs/dbraw/zinc/80/26/02/544802602.db2.gz CRFBVVASQGSRDA-SMDDNHRTSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1cc(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1C(F)(F)F ZINC000160175112 544802603 /nfs/dbraw/zinc/80/26/03/544802603.db2.gz CRFBVVASQGSRDA-SMDDNHRTSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1cc(NC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1C(F)(F)F ZINC000160175003 544802867 /nfs/dbraw/zinc/80/28/67/544802867.db2.gz CRFBVVASQGSRDA-RISCZKNCSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1cc(NC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1C(F)(F)F ZINC000160175003 544802870 /nfs/dbraw/zinc/80/28/70/544802870.db2.gz CRFBVVASQGSRDA-RISCZKNCSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000160299449 544804096 /nfs/dbraw/zinc/80/40/96/544804096.db2.gz QFBULCQQAONOKF-SMDDNHRTSA-N 1 1 345.365 2.854 20 70 EFIDMO Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000160299449 544804098 /nfs/dbraw/zinc/80/40/98/544804098.db2.gz QFBULCQQAONOKF-SMDDNHRTSA-N 1 1 345.365 2.854 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccc2nc(C3CC3)oc2c1)[C@H]1C[N@H+](C)CCO1 ZINC000160402628 544805855 /nfs/dbraw/zinc/80/58/55/544805855.db2.gz XKKHXWFIRJOWIJ-BDJLRTHQSA-N 1 1 344.415 2.546 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccc2nc(C3CC3)oc2c1)[C@H]1C[N@@H+](C)CCO1 ZINC000160402628 544805859 /nfs/dbraw/zinc/80/58/59/544805859.db2.gz XKKHXWFIRJOWIJ-BDJLRTHQSA-N 1 1 344.415 2.546 20 70 EFIDMO CC[N@@H+]1CCN(C(=O)c2ccc(Br)cc2OC)C[C@@H]1C ZINC000160683285 544807845 /nfs/dbraw/zinc/80/78/45/544807845.db2.gz LNNLAEVOOZEOEF-NSHDSACASA-N 1 1 341.249 2.624 20 70 EFIDMO CC[N@H+]1CCN(C(=O)c2ccc(Br)cc2OC)C[C@@H]1C ZINC000160683285 544807847 /nfs/dbraw/zinc/80/78/47/544807847.db2.gz LNNLAEVOOZEOEF-NSHDSACASA-N 1 1 341.249 2.624 20 70 EFIDMO CCOCCC1(CNC(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)CCCC1 ZINC000161106203 544810092 /nfs/dbraw/zinc/81/00/92/544810092.db2.gz OFXYBXKIEHCIKH-QGZVFWFLSA-N 1 1 337.508 2.757 20 70 EFIDMO C[N@H+](CCCCS(C)(=O)=O)Cc1ccc(Br)s1 ZINC000161223535 544811190 /nfs/dbraw/zinc/81/11/90/544811190.db2.gz OXMLUVRJWFKALQ-UHFFFAOYSA-N 1 1 340.308 2.767 20 70 EFIDMO C[N@@H+](CCCCS(C)(=O)=O)Cc1ccc(Br)s1 ZINC000161223535 544811195 /nfs/dbraw/zinc/81/11/95/544811195.db2.gz OXMLUVRJWFKALQ-UHFFFAOYSA-N 1 1 340.308 2.767 20 70 EFIDMO COc1ccc([C@@H]2CCC[N@@H+]2CCCCS(C)(=O)=O)c(OC)c1 ZINC000161279431 544811528 /nfs/dbraw/zinc/81/15/28/544811528.db2.gz OFRWKIQWBTTYST-INIZCTEOSA-N 1 1 341.473 2.666 20 70 EFIDMO COc1ccc([C@@H]2CCC[N@H+]2CCCCS(C)(=O)=O)c(OC)c1 ZINC000161279431 544811535 /nfs/dbraw/zinc/81/15/35/544811535.db2.gz OFRWKIQWBTTYST-INIZCTEOSA-N 1 1 341.473 2.666 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)N1CCc2sccc2C1 ZINC000161040397 276142739 /nfs/dbraw/zinc/14/27/39/276142739.db2.gz HNVJRCJONFQOSB-CQSZACIVSA-N 1 1 329.469 2.938 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)N1CCc2sccc2C1 ZINC000161040397 276142740 /nfs/dbraw/zinc/14/27/40/276142740.db2.gz HNVJRCJONFQOSB-CQSZACIVSA-N 1 1 329.469 2.938 20 70 EFIDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)NCC1(CCOC)CCCC1 ZINC000160103100 279271641 /nfs/dbraw/zinc/27/16/41/279271641.db2.gz XDIPZADASVVIAQ-MRXNPFEDSA-N 1 1 325.497 2.757 20 70 EFIDMO C[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1ccccc1F ZINC000159720953 310690848 /nfs/dbraw/zinc/69/08/48/310690848.db2.gz XHTBXMYXZQCIGM-OAHLLOKOSA-N 1 1 336.451 2.746 20 70 EFIDMO CN(C)[C@@H](CNC(=O)c1ccc(C[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000160660939 310701200 /nfs/dbraw/zinc/70/12/00/310701200.db2.gz ITFQNYMKUPQVSK-IBGZPJMESA-N 1 1 343.446 2.920 20 70 EFIDMO COc1cccc(N2CC[NH+](Cc3cnn(C(C)(C)C)c3)CC2)c1 ZINC000160697923 310701866 /nfs/dbraw/zinc/70/18/66/310701866.db2.gz QPGUEXZOCRLQIJ-UHFFFAOYSA-N 1 1 328.460 2.969 20 70 EFIDMO CCc1c(C(=O)N(C)CCCn2cc[nH+]c2C)cnn1CC(C)C ZINC000160974541 310704483 /nfs/dbraw/zinc/70/44/83/310704483.db2.gz QEROKQSGTOWYDB-UHFFFAOYSA-N 1 1 331.464 2.769 20 70 EFIDMO Cc1ccccc1CCNC(=O)[C@H](C)[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000161115012 473208508 /nfs/dbraw/zinc/20/85/08/473208508.db2.gz GNOAWPHBLTUQML-FBBABVLZSA-N 1 1 344.499 2.669 20 70 EFIDMO C[NH+](C)[C@@H](CNC(=O)N1CCc2c(F)cccc2C1)c1ccco1 ZINC000161140912 473211277 /nfs/dbraw/zinc/21/12/77/473211277.db2.gz BHSKLDRXZYBBRQ-INIZCTEOSA-N 1 1 331.391 2.789 20 70 EFIDMO CCOCCCN1CC[C@H]([NH2+]CCc2ccc3c(c2)OCO3)[C@H](C)C1 ZINC000161123584 473209346 /nfs/dbraw/zinc/20/93/46/473209346.db2.gz OLIZXJUQPSCTFT-AEFFLSMTSA-N 1 1 348.487 2.684 20 70 EFIDMO CCOCCCN1CC[C@@H]([NH2+]CCc2ccc3c(c2)OCO3)[C@H](C)C1 ZINC000161123732 473209616 /nfs/dbraw/zinc/20/96/16/473209616.db2.gz OLIZXJUQPSCTFT-SJLPKXTDSA-N 1 1 348.487 2.684 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000161133435 473210325 /nfs/dbraw/zinc/21/03/25/473210325.db2.gz DLHHYMOWZPICQW-CRAIPNDOSA-N 1 1 339.439 2.932 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000161133435 473210329 /nfs/dbraw/zinc/21/03/29/473210329.db2.gz DLHHYMOWZPICQW-CRAIPNDOSA-N 1 1 339.439 2.932 20 70 EFIDMO CN(C)C(=O)c1ccc(C[N@H+](C)CCOc2ccc(Cl)cc2)[nH]1 ZINC000161155370 473213485 /nfs/dbraw/zinc/21/34/85/473213485.db2.gz GZRNLYWUTNUJMR-UHFFFAOYSA-N 1 1 335.835 2.881 20 70 EFIDMO CN(C)C(=O)c1ccc(C[N@@H+](C)CCOc2ccc(Cl)cc2)[nH]1 ZINC000161155370 473213491 /nfs/dbraw/zinc/21/34/91/473213491.db2.gz GZRNLYWUTNUJMR-UHFFFAOYSA-N 1 1 335.835 2.881 20 70 EFIDMO CC[C@@H]([NH2+][C@@H](C)C(=O)NC(=O)NC1CCCCC1)c1nccs1 ZINC000161170851 473214056 /nfs/dbraw/zinc/21/40/56/473214056.db2.gz OBIMDDQWFFAFPV-WCQYABFASA-N 1 1 338.477 2.731 20 70 EFIDMO C[C@@H](C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1)C1CCOCC1 ZINC000161170568 473214349 /nfs/dbraw/zinc/21/43/49/473214349.db2.gz JNMRRNHBROBDDO-QGZVFWFLSA-N 1 1 330.472 2.784 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+]3CC[C@H](C)C[C@@H]3C)nc(N)c21 ZINC000161214702 473218016 /nfs/dbraw/zinc/21/80/16/473218016.db2.gz MNLXBQHOOZQQII-QWRGUYRKSA-N 1 1 346.431 2.911 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+]3CC[C@H](C)C[C@@H]3C)nc(N)c21 ZINC000161214702 473218019 /nfs/dbraw/zinc/21/80/19/473218019.db2.gz MNLXBQHOOZQQII-QWRGUYRKSA-N 1 1 346.431 2.911 20 70 EFIDMO CC1(O)CC[NH+](Cc2cc3c(cc2Br)OCCO3)CC1 ZINC000161228256 473219142 /nfs/dbraw/zinc/21/91/42/473219142.db2.gz FRWXIMQIHHYOBB-UHFFFAOYSA-N 1 1 342.233 2.567 20 70 EFIDMO Cc1ccc(S(=O)(=O)N2CCC(Nc3cc(C)cc[nH+]3)CC2)cc1 ZINC000161241042 473219980 /nfs/dbraw/zinc/21/99/80/473219980.db2.gz HZQVJIZNNNFJMY-UHFFFAOYSA-N 1 1 345.468 2.964 20 70 EFIDMO O=C(c1cccc(F)n1)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000161283732 473223509 /nfs/dbraw/zinc/22/35/09/473223509.db2.gz AFMUOGTWKOMDHV-UHFFFAOYSA-N 1 1 331.366 2.708 20 70 EFIDMO O=C(c1cccc(F)n1)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000161283732 473223513 /nfs/dbraw/zinc/22/35/13/473223513.db2.gz AFMUOGTWKOMDHV-UHFFFAOYSA-N 1 1 331.366 2.708 20 70 EFIDMO COC(=O)c1ccc([C@@H](C)[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)o1 ZINC000161430495 473234866 /nfs/dbraw/zinc/23/48/66/473234866.db2.gz CJFMKPSVYMJFIY-OLZOCXBDSA-N 1 1 344.415 2.545 20 70 EFIDMO CCc1c(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cnn1CC(C)C ZINC000161480294 473239104 /nfs/dbraw/zinc/23/91/04/473239104.db2.gz MUHPCCNJFHZWHO-MRXNPFEDSA-N 1 1 334.508 2.952 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2[nH]cnc2c1 ZINC000159369118 473021837 /nfs/dbraw/zinc/02/18/37/473021837.db2.gz QLROMQWFAWYJAD-LIRRHRJNSA-N 1 1 334.423 2.813 20 70 EFIDMO CCCn1c2ccccc2nc1NC(=O)C[N@H+](C)[C@@H]1CCSC1 ZINC000159468067 473031337 /nfs/dbraw/zinc/03/13/37/473031337.db2.gz JHKKXFMNNZBPGB-CYBMUJFWSA-N 1 1 332.473 2.822 20 70 EFIDMO CCCn1c2ccccc2nc1NC(=O)C[N@@H+](C)[C@@H]1CCSC1 ZINC000159468067 473031346 /nfs/dbraw/zinc/03/13/46/473031346.db2.gz JHKKXFMNNZBPGB-CYBMUJFWSA-N 1 1 332.473 2.822 20 70 EFIDMO COc1cccc(NC(=O)[C@H](c2ccccc2)[N@H+](C)C[C@H](C)O)c1 ZINC000159525206 473035913 /nfs/dbraw/zinc/03/59/13/473035913.db2.gz UZLUIJILZLKKRN-KSSFIOAISA-N 1 1 328.412 2.688 20 70 EFIDMO COc1cccc(NC(=O)[C@H](c2ccccc2)[N@@H+](C)C[C@H](C)O)c1 ZINC000159525206 473035919 /nfs/dbraw/zinc/03/59/19/473035919.db2.gz UZLUIJILZLKKRN-KSSFIOAISA-N 1 1 328.412 2.688 20 70 EFIDMO Cc1cc(C[N@@H+]2C[C@H](C(N)=O)CC[C@@H]2C)sc1Br ZINC000159594735 473043026 /nfs/dbraw/zinc/04/30/26/473043026.db2.gz GUXTXRRMIFNVOW-VHSXEESVSA-N 1 1 331.279 2.905 20 70 EFIDMO CCC[C@@H]1CN(C(=O)NCCC[N@H+]2CCc3ccccc3C2)CCO1 ZINC000159633475 473046419 /nfs/dbraw/zinc/04/64/19/473046419.db2.gz WMFDJLVVGFGQTG-LJQANCHMSA-N 1 1 345.487 2.645 20 70 EFIDMO CC(C)CCn1ccc(NC(=O)NC[C@H](c2ccco2)[NH+](C)C)n1 ZINC000159653128 473047875 /nfs/dbraw/zinc/04/78/75/473047875.db2.gz ZKNPKGQYNHESMJ-CQSZACIVSA-N 1 1 333.436 2.947 20 70 EFIDMO CC(C)CCn1ccc(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)n1 ZINC000159663527 473049805 /nfs/dbraw/zinc/04/98/05/473049805.db2.gz VGVHTFXUNAOGKH-CVEARBPZSA-N 1 1 333.480 2.877 20 70 EFIDMO CC[C@H](CC(=O)N(C)CCC[NH+]1CCN(C)CC1)c1ccc(C)cc1 ZINC000159686422 473051118 /nfs/dbraw/zinc/05/11/18/473051118.db2.gz XZGXMJIUKMZYMH-LJQANCHMSA-N 1 1 345.531 2.975 20 70 EFIDMO COCc1cccc(NC(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)c1 ZINC000159679402 473051217 /nfs/dbraw/zinc/05/12/17/473051217.db2.gz WXMOTJPAZSYDPR-UHFFFAOYSA-N 1 1 340.427 2.891 20 70 EFIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)NC[C@]1(C)CCCO1 ZINC000159700595 473051920 /nfs/dbraw/zinc/05/19/20/473051920.db2.gz CSUKGINSRFVUNW-IBGZPJMESA-N 1 1 333.476 2.765 20 70 EFIDMO CCc1c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cnn1CC(C)C ZINC000159727092 473055325 /nfs/dbraw/zinc/05/53/25/473055325.db2.gz FPFJAFXHFASCEX-MAUKXSAKSA-N 1 1 332.492 2.658 20 70 EFIDMO COCCOc1ccc(CNC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cc1 ZINC000159722634 473055676 /nfs/dbraw/zinc/05/56/76/473055676.db2.gz JXUJSOWMDLXTPE-HKUYNNGSSA-N 1 1 346.471 2.593 20 70 EFIDMO O=S(=O)(c1ccc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)o1)N1CCCC1 ZINC000159737491 473056766 /nfs/dbraw/zinc/05/67/66/473056766.db2.gz HOKRQYXEHBATPM-HOCLYGCPSA-N 1 1 338.473 2.829 20 70 EFIDMO CC(C)c1ccc(C(=O)N[C@@H](C)C2([NH+]3CCOCC3)CCCC2)cn1 ZINC000159736145 473057138 /nfs/dbraw/zinc/05/71/38/473057138.db2.gz LUMYAMJCNQDQOZ-INIZCTEOSA-N 1 1 345.487 2.968 20 70 EFIDMO CC(C)[N@@H+](Cc1cnc(N2CCN(C)CC2)nc1)C1CCCCC1 ZINC000159770164 473059276 /nfs/dbraw/zinc/05/92/76/473059276.db2.gz CGCVBEZSHRPRNO-UHFFFAOYSA-N 1 1 331.508 2.772 20 70 EFIDMO CC(C)[C@H](Cc1ccccc1)C(=O)NCCCCN1CC[NH+](C)CC1 ZINC000159781398 473060526 /nfs/dbraw/zinc/06/05/26/473060526.db2.gz NLHNPXLTZQSXDY-FQEVSTJZSA-N 1 1 345.531 2.645 20 70 EFIDMO COc1cccc(CNC(=O)C[N@@H+]2CCC[C@H]2c2cccc(C)n2)c1 ZINC000159810342 473063303 /nfs/dbraw/zinc/06/33/03/473063303.db2.gz PPIDSNZLGCTTFP-IBGZPJMESA-N 1 1 339.439 2.852 20 70 EFIDMO COc1cccc(CNC(=O)C[N@H+]2CCC[C@H]2c2cccc(C)n2)c1 ZINC000159810342 473063311 /nfs/dbraw/zinc/06/33/11/473063311.db2.gz PPIDSNZLGCTTFP-IBGZPJMESA-N 1 1 339.439 2.852 20 70 EFIDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc(Cl)nc2C)cn1 ZINC000159865512 473068049 /nfs/dbraw/zinc/06/80/49/473068049.db2.gz LBNNUVRGEWZJOE-UHFFFAOYSA-N 1 1 341.802 2.863 20 70 EFIDMO CCOC(=O)c1ccc(N2CCC[N@@H+](CCCOC(C)C)CC2)nc1 ZINC000159923505 473073156 /nfs/dbraw/zinc/07/31/56/473073156.db2.gz VCLMBZSNTPGLFC-UHFFFAOYSA-N 1 1 349.475 2.586 20 70 EFIDMO CCCC[N@@H+](C)CCNC(=O)c1ccccc1CSc1nc[nH]n1 ZINC000159949775 473075027 /nfs/dbraw/zinc/07/50/27/473075027.db2.gz UAOQVODENUKBSU-UHFFFAOYSA-N 1 1 347.488 2.559 20 70 EFIDMO O[C@@H](C[NH2+]Cc1cc(Cl)ccc1F)CN1CCc2ccccc2C1 ZINC000159971633 473077529 /nfs/dbraw/zinc/07/75/29/473077529.db2.gz XSCKARVJAUPZBI-SFHVURJKSA-N 1 1 348.849 2.988 20 70 EFIDMO C[C@@H]1CN(C)[C@H](C)C[C@@H]1[NH2+]CCC1CCN(CC(F)(F)F)CC1 ZINC000159990068 473078166 /nfs/dbraw/zinc/07/81/66/473078166.db2.gz TXYFQSJIZVCKSH-FMKPAKJESA-N 1 1 335.458 2.969 20 70 EFIDMO Cc1cccc([C@@H]2CCC[N@@H+]2CC(=O)NCc2ccccc2F)n1 ZINC000159984912 473079046 /nfs/dbraw/zinc/07/90/46/473079046.db2.gz IBCDNCJPNDDZGL-SFHVURJKSA-N 1 1 327.403 2.982 20 70 EFIDMO Cc1cccc([C@@H]2CCC[N@H+]2CC(=O)NCc2ccccc2F)n1 ZINC000159984912 473079051 /nfs/dbraw/zinc/07/90/51/473079051.db2.gz IBCDNCJPNDDZGL-SFHVURJKSA-N 1 1 327.403 2.982 20 70 EFIDMO CCn1nccc1C[NH2+]Cc1ccccc1CN1C[C@@H](C)O[C@H](C)C1 ZINC000160092366 473087128 /nfs/dbraw/zinc/08/71/28/473087128.db2.gz LASVLKIFONDSNM-IAGOWNOFSA-N 1 1 342.487 2.802 20 70 EFIDMO CC[N@@H+](CCNC(=O)c1ccccc1CSc1nc[nH]n1)C(C)C ZINC000160175343 473093479 /nfs/dbraw/zinc/09/34/79/473093479.db2.gz DDIQLGSALHANGP-UHFFFAOYSA-N 1 1 347.488 2.557 20 70 EFIDMO CCC[C@@H]1CN(C(=O)NCc2ccc(C)s2)CC[N@H+]1CCOC ZINC000160172922 473093834 /nfs/dbraw/zinc/09/38/34/473093834.db2.gz CCXYSQRGUDRZRH-OAHLLOKOSA-N 1 1 339.505 2.699 20 70 EFIDMO C[C@H](O)C[C@@H](CNC(=O)C[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC000160242873 473100185 /nfs/dbraw/zinc/10/01/85/473100185.db2.gz MPRCXTBNTBASOC-PXNSSMCTSA-N 1 1 340.467 2.789 20 70 EFIDMO C[C@H](O)C[C@@H](CNC(=O)C[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC000160242873 473100190 /nfs/dbraw/zinc/10/01/90/473100190.db2.gz MPRCXTBNTBASOC-PXNSSMCTSA-N 1 1 340.467 2.789 20 70 EFIDMO CCS[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)C(C)C ZINC000160345406 473109744 /nfs/dbraw/zinc/10/97/44/473109744.db2.gz KTVHSMKUXSMNPE-OAHLLOKOSA-N 1 1 330.538 2.581 20 70 EFIDMO CC[C@@H](COC)NC(=O)N(CC)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160336759 473110729 /nfs/dbraw/zinc/11/07/29/473110729.db2.gz FGIKWKYKTNGYHX-ZWKOTPCHSA-N 1 1 333.476 2.717 20 70 EFIDMO CC/C(=C/C(=O)NCCC[NH+]1CCN(CC)CC1)c1ccc(C)cc1 ZINC000160444105 473125624 /nfs/dbraw/zinc/12/56/24/473125624.db2.gz XLRNCMHOXOBJMQ-ZPHPHTNESA-N 1 1 343.515 2.932 20 70 EFIDMO COC(=O)CCn1nc(C)c(C[N@H+](C)Cc2cccc(F)c2)c1C ZINC000160463368 473128596 /nfs/dbraw/zinc/12/85/96/473128596.db2.gz MVSGCOIVHRUHIH-UHFFFAOYSA-N 1 1 333.407 2.834 20 70 EFIDMO COC(=O)CCn1nc(C)c(C[N@@H+](C)Cc2cccc(F)c2)c1C ZINC000160463368 473128607 /nfs/dbraw/zinc/12/86/07/473128607.db2.gz MVSGCOIVHRUHIH-UHFFFAOYSA-N 1 1 333.407 2.834 20 70 EFIDMO Cc1nc(CC(=O)N2CC[NH+](CCc3ccccc3)CC2)c(C)s1 ZINC000160468085 473128790 /nfs/dbraw/zinc/12/87/90/473128790.db2.gz VPQYWNUNDWYCLS-UHFFFAOYSA-N 1 1 343.496 2.689 20 70 EFIDMO CC(C)c1ccc(C(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)cn1 ZINC000160473214 473129883 /nfs/dbraw/zinc/12/98/83/473129883.db2.gz KEYKSTWENQXXRJ-GJZGRUSLSA-N 1 1 333.476 2.823 20 70 EFIDMO CC(C)c1ccc(C(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cn1 ZINC000160473091 473129907 /nfs/dbraw/zinc/12/99/07/473129907.db2.gz KEYKSTWENQXXRJ-GASCZTMLSA-N 1 1 333.476 2.823 20 70 EFIDMO CC(C)c1ccc(C(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cn1 ZINC000160473091 473129912 /nfs/dbraw/zinc/12/99/12/473129912.db2.gz KEYKSTWENQXXRJ-GASCZTMLSA-N 1 1 333.476 2.823 20 70 EFIDMO COCCOc1cccc(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)c1 ZINC000160487277 473133094 /nfs/dbraw/zinc/13/30/94/473133094.db2.gz SPGDSKDCLWILNZ-QGZVFWFLSA-N 1 1 334.460 2.562 20 70 EFIDMO CCOC(=O)C[C@H](C)NC(=O)c1ccc(C[N@@H+](CC)C(C)C)cc1 ZINC000160521554 473137151 /nfs/dbraw/zinc/13/71/51/473137151.db2.gz ZIQXXUBXSMBYOL-HNNXBMFYSA-N 1 1 334.460 2.988 20 70 EFIDMO Cc1cccc(C)c1OC[C@H](O)C[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160551024 473141034 /nfs/dbraw/zinc/14/10/34/473141034.db2.gz NTOBGZUMCGSYBH-QWFCFKBJSA-N 1 1 333.472 2.670 20 70 EFIDMO C[C@@H](C(=O)NCCc1csc(C(C)(C)C)n1)[NH+]1CCSCC1 ZINC000160642366 473154896 /nfs/dbraw/zinc/15/48/96/473154896.db2.gz IIDWEOBGWUVZOS-LBPRGKRZSA-N 1 1 341.546 2.537 20 70 EFIDMO O=C(Nc1cnn(Cc2ccccc2)c1)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000160635463 473155284 /nfs/dbraw/zinc/15/52/84/473155284.db2.gz MRCRJMXRVWTWSQ-QGZVFWFLSA-N 1 1 339.443 2.537 20 70 EFIDMO CCn1cc([C@H](C)[NH2+][C@@H](CN2CCCC2=O)c2ccccc2)cn1 ZINC000160656652 473157316 /nfs/dbraw/zinc/15/73/16/473157316.db2.gz NAAHOSQTIOIBQP-YJBOKZPZSA-N 1 1 326.444 2.917 20 70 EFIDMO Cc1ccc2c(c1)[C@H](NC(=O)NC[C@H](c1ccco1)[NH+](C)C)CO2 ZINC000160694509 473161597 /nfs/dbraw/zinc/16/15/97/473161597.db2.gz UMXYHKRQEYUJOL-HUUCEWRRSA-N 1 1 329.400 2.624 20 70 EFIDMO Cc1ccc2c(c1)[C@@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)CO2 ZINC000160694353 473162270 /nfs/dbraw/zinc/16/22/70/473162270.db2.gz UMXYHKRQEYUJOL-GJZGRUSLSA-N 1 1 329.400 2.624 20 70 EFIDMO CN(Cc1cccn1C)C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000160703713 473163048 /nfs/dbraw/zinc/16/30/48/473163048.db2.gz VXIKBWITDBGKQR-SFHVURJKSA-N 1 1 340.471 2.831 20 70 EFIDMO CN(Cc1cccn1C)C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000160703844 473163723 /nfs/dbraw/zinc/16/37/23/473163723.db2.gz VXIKBWITDBGKQR-GOSISDBHSA-N 1 1 340.471 2.831 20 70 EFIDMO CCC1(C(=O)NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)CCCC1 ZINC000160747571 473170136 /nfs/dbraw/zinc/17/01/36/473170136.db2.gz RJKXKHGIVVFSHI-MSOLQXFVSA-N 1 1 330.472 2.708 20 70 EFIDMO CCCC[N@@H+](Cc1cccc(-n2cccn2)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160755501 473170774 /nfs/dbraw/zinc/17/07/74/473170774.db2.gz VXLKCEGUUQQOLM-SFHVURJKSA-N 1 1 347.484 2.662 20 70 EFIDMO COc1ccc2c(c1)CCN2C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000160784969 473174695 /nfs/dbraw/zinc/17/46/95/473174695.db2.gz KVZKRYSKPRYBIF-HNNXBMFYSA-N 1 1 329.444 2.784 20 70 EFIDMO CN(C)c1ncc(C[N@H+](C)Cc2ccc(Br)cc2)cn1 ZINC000160801929 473176125 /nfs/dbraw/zinc/17/61/25/473176125.db2.gz AMZFQIQRTMJCLD-UHFFFAOYSA-N 1 1 335.249 2.937 20 70 EFIDMO CN(C)c1ncc(C[N@@H+](C)Cc2ccc(Br)cc2)cn1 ZINC000160801929 473176131 /nfs/dbraw/zinc/17/61/31/473176131.db2.gz AMZFQIQRTMJCLD-UHFFFAOYSA-N 1 1 335.249 2.937 20 70 EFIDMO COCCc1nsc(N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)n1 ZINC000160843211 473181777 /nfs/dbraw/zinc/18/17/77/473181777.db2.gz JNVDYRSANSANFY-ZFWWWQNUSA-N 1 1 332.473 2.802 20 70 EFIDMO COC(=O)c1csc(NC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1 ZINC000160879217 473187417 /nfs/dbraw/zinc/18/74/17/473187417.db2.gz UACJKJAOQNKYNJ-CYBMUJFWSA-N 1 1 339.461 2.873 20 70 EFIDMO COC(C[N@@H+](C[C@H](O)COc1cccc2ccccc21)C(C)C)OC ZINC000160927185 473191812 /nfs/dbraw/zinc/19/18/12/473191812.db2.gz IGQCRZXODVBGDE-KRWDZBQOSA-N 1 1 347.455 2.909 20 70 EFIDMO CC[C@H]([NH2+][C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(F)cc1F ZINC000160936767 473192276 /nfs/dbraw/zinc/19/22/76/473192276.db2.gz QHJOGQHNMAWDRN-JKSUJKDBSA-N 1 1 334.370 2.545 20 70 EFIDMO C[C@@H]1CCC[C@H](C(=O)NCc2cccc(C[NH+]3CCOCC3)c2)C1 ZINC000160977102 473195502 /nfs/dbraw/zinc/19/55/02/473195502.db2.gz RWUZYQKGGANLKI-APWZRJJASA-N 1 1 330.472 2.961 20 70 EFIDMO CC(C)S(=O)(=O)CCC[N@@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000160980892 473196375 /nfs/dbraw/zinc/19/63/75/473196375.db2.gz GPZPFTZDONCMCG-SFHVURJKSA-N 1 1 339.501 2.881 20 70 EFIDMO CC(C)S(=O)(=O)CCC[N@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000160980892 473196380 /nfs/dbraw/zinc/19/63/80/473196380.db2.gz GPZPFTZDONCMCG-SFHVURJKSA-N 1 1 339.501 2.881 20 70 EFIDMO O=C(Nc1cccc(CSC2CCOCC2)c1)[C@H]1CSC[NH2+]1 ZINC000160998674 473198305 /nfs/dbraw/zinc/19/83/05/473198305.db2.gz BPDFKVFKOLORDS-OAHLLOKOSA-N 1 1 338.498 2.700 20 70 EFIDMO CCc1nnc(NC(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000161053304 473202847 /nfs/dbraw/zinc/20/28/47/473202847.db2.gz GMFVIXWCCYKAKM-JSGCOSHPSA-N 1 1 345.472 2.743 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)NCc1cccc(OC)c1 ZINC000161057392 473203019 /nfs/dbraw/zinc/20/30/19/473203019.db2.gz MXNJPQGCRZJJMB-HNNXBMFYSA-N 1 1 327.428 2.617 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)NCc1cccc(OC)c1 ZINC000161057392 473203024 /nfs/dbraw/zinc/20/30/24/473203024.db2.gz MXNJPQGCRZJJMB-HNNXBMFYSA-N 1 1 327.428 2.617 20 70 EFIDMO C[C@@H]1CN(C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(Cn2ccccc2=O)cc1 ZINC000161062309 473203808 /nfs/dbraw/zinc/20/38/08/473203808.db2.gz KRHRUPGOGNGDMS-UWVAXJGDSA-N 1 1 339.483 2.715 20 70 EFIDMO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000161062309 473203813 /nfs/dbraw/zinc/20/38/13/473203813.db2.gz KRHRUPGOGNGDMS-UWVAXJGDSA-N 1 1 339.483 2.715 20 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521926396 /nfs/dbraw/zinc/92/63/96/521926396.db2.gz UOPFOHGZGKZCOW-UTDDRVLSSA-N 1 1 332.419 2.790 20 70 EFIDMO C[N@@H+](CCCOc1ccc2ccccc2c1)CCN1CCOCC1 ZINC000217162893 522781137 /nfs/dbraw/zinc/78/11/37/522781137.db2.gz AKYSNZPLKJSOHI-UHFFFAOYSA-N 1 1 328.456 2.873 20 70 EFIDMO C[C@@H](C(=O)N1C[C@H](C)C[C@H](C)C1)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000216831816 524146229 /nfs/dbraw/zinc/14/62/29/524146229.db2.gz AELKSCLNGLNJRT-ZNMIVQPWSA-N 1 1 332.444 2.740 20 70 EFIDMO C[C@@H](C(=O)N1C[C@H](C)C[C@H](C)C1)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000216831816 524146233 /nfs/dbraw/zinc/14/62/33/524146233.db2.gz AELKSCLNGLNJRT-ZNMIVQPWSA-N 1 1 332.444 2.740 20 70 EFIDMO Cc1cccc(C)c1OCCCNC(=O)NC[C@@H](C)[N@@H+](C)C1CC1 ZINC000216915755 524312209 /nfs/dbraw/zinc/31/22/09/524312209.db2.gz YEVHZYAKYSNDCI-MRXNPFEDSA-N 1 1 333.476 2.854 20 70 EFIDMO CSc1ccc(Cl)c(C(=O)N2CC[NH+](CC(C)(C)O)CC2)c1 ZINC000216956034 526011713 /nfs/dbraw/zinc/01/17/13/526011713.db2.gz XPXHRMIVNUDRFR-UHFFFAOYSA-N 1 1 342.892 2.591 20 70 EFIDMO CC(C)(C)c1nsc(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)n1 ZINC000160151954 526907069 /nfs/dbraw/zinc/90/70/69/526907069.db2.gz JKQNXKLXPBOQCC-LSDHHAIUSA-N 1 1 346.500 2.883 20 70 EFIDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cn(C)nc2-c2cccs2)C1 ZINC000159778842 528020908 /nfs/dbraw/zinc/02/09/08/528020908.db2.gz IEZNSJNHSACHCY-AWEZNQCLSA-N 1 1 346.500 2.856 20 70 EFIDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCc3cccc(F)c3C2)C1 ZINC000159930555 528024162 /nfs/dbraw/zinc/02/41/62/528024162.db2.gz XXMMJTACVYJYAL-OAHLLOKOSA-N 1 1 333.451 2.871 20 70 EFIDMO CC(C)c1cc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)no1 ZINC000159858934 528041475 /nfs/dbraw/zinc/04/14/75/528041475.db2.gz GLPLDNSOQXHBEB-UHFFFAOYSA-N 1 1 330.388 2.550 20 70 EFIDMO CC[NH+](CC)CCOc1ccc(CN[C@H](C)c2cnn(C)c2)cc1 ZINC000160276710 528151786 /nfs/dbraw/zinc/15/17/86/528151786.db2.gz MNBNGXXRPUOLDI-MRXNPFEDSA-N 1 1 330.476 2.992 20 70 EFIDMO CCOc1c(Cl)cc(C[NH+]2CCC(CC(N)=O)CC2)cc1OC ZINC000159735925 528170390 /nfs/dbraw/zinc/17/03/90/528170390.db2.gz BGVVHBBKJQHVEQ-UHFFFAOYSA-N 1 1 340.851 2.835 20 70 EFIDMO CCCOC(=O)[C@H](C)[NH+]1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000160226586 528578618 /nfs/dbraw/zinc/57/86/18/528578618.db2.gz KLSLFLAIFVPOKA-ZDUSSCGKSA-N 1 1 336.407 2.818 20 70 EFIDMO CCCc1cc(NC[C@H]2CCC[N@@H+](CC(C)C)C2)n2ncnc2n1 ZINC000161300172 528610524 /nfs/dbraw/zinc/61/05/24/528610524.db2.gz AWHQCLRZVSDIMP-OAHLLOKOSA-N 1 1 330.480 2.857 20 70 EFIDMO CCC(CC)(C[NH2+]Cc1nc(-c2ccc(OC)cc2)no1)C(=O)OC ZINC000159683979 528692818 /nfs/dbraw/zinc/69/28/18/528692818.db2.gz AGYVKSHAKQTZJJ-UHFFFAOYSA-N 1 1 347.415 2.814 20 70 EFIDMO CCOC[C@@H]1CCN(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000160019765 528935078 /nfs/dbraw/zinc/93/50/78/528935078.db2.gz RIOBFKQMQFXIBJ-UHOSZYNNSA-N 1 1 345.487 2.717 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCCCO[C@H](C)c2ccccc2)CC1 ZINC000159559676 529025324 /nfs/dbraw/zinc/02/53/24/529025324.db2.gz QXRBZWAPCBBRCF-QGZVFWFLSA-N 1 1 333.476 2.892 20 70 EFIDMO CCOC[C@H]1CCN(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000160019625 529026750 /nfs/dbraw/zinc/02/67/50/529026750.db2.gz RIOBFKQMQFXIBJ-YTQUADARSA-N 1 1 345.487 2.717 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@H](C)COCc2ccccc2)CC1 ZINC000159739651 529026873 /nfs/dbraw/zinc/02/68/73/529026873.db2.gz LCAIGZYDAWXDLL-KRWDZBQOSA-N 1 1 333.476 2.577 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2cc(C)ccc2OC(F)F)CC1 ZINC000159970004 529027301 /nfs/dbraw/zinc/02/73/01/529027301.db2.gz QIAWXGURXABLMZ-UHFFFAOYSA-N 1 1 341.402 2.834 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)CC1 ZINC000159934540 529030695 /nfs/dbraw/zinc/03/06/95/529030695.db2.gz UKDFFGNSHPZZCC-MRXNPFEDSA-N 1 1 341.459 2.671 20 70 EFIDMO CC[C@H](CNC(=O)N1CCC[N@@H+](CC)CC1)Oc1cccc(F)c1 ZINC000159960456 529343310 /nfs/dbraw/zinc/34/33/10/529343310.db2.gz ALSNMGZQZGGEGS-MRXNPFEDSA-N 1 1 337.439 2.720 20 70 EFIDMO CC[C@@H](C)OCC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000159573054 529376745 /nfs/dbraw/zinc/37/67/45/529376745.db2.gz FGJOKLMUJYNVME-CYBMUJFWSA-N 1 1 340.414 2.861 20 70 EFIDMO CCc1ccc([C@H](C)CC(=O)NC[C@H](C)CN2CC[NH+](C)CC2)cc1 ZINC000160109533 529719591 /nfs/dbraw/zinc/71/95/91/529719591.db2.gz PVUZYEPAUROKCP-ZWKOTPCHSA-N 1 1 345.531 2.742 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000160117119 529845867 /nfs/dbraw/zinc/84/58/67/529845867.db2.gz FYTWAOZAYXJUFK-ZWKOTPCHSA-N 1 1 348.462 2.746 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)Cc1c[nH]c2ccccc12 ZINC000160274552 529845920 /nfs/dbraw/zinc/84/59/20/529845920.db2.gz TYGVTMDORIYESV-UHFFFAOYSA-N 1 1 343.471 2.527 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)[C@H]1C[C@H]1c1ccc(F)cc1 ZINC000160117250 529846220 /nfs/dbraw/zinc/84/62/20/529846220.db2.gz FYTWAOZAYXJUFK-ROUUACIJSA-N 1 1 348.462 2.746 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc2cc[nH]c2c1 ZINC000159931591 529846245 /nfs/dbraw/zinc/84/62/45/529846245.db2.gz JZGWJKYPEVCUIN-UHFFFAOYSA-N 1 1 329.444 2.598 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(Cl)cc1F ZINC000159927848 529846297 /nfs/dbraw/zinc/84/62/97/529846297.db2.gz YHTOJJQTYDYOEL-UHFFFAOYSA-N 1 1 342.842 2.910 20 70 EFIDMO C[N@@H+](CCOc1ccc(F)cc1)[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000160360987 529925681 /nfs/dbraw/zinc/92/56/81/529925681.db2.gz BCQJABFLUFZWFQ-AWEZNQCLSA-N 1 1 348.340 2.690 20 70 EFIDMO C[N@@H+](C[C@H](O)Cc1ccc(C(F)(F)F)cc1)C[C@H]1CCCOC1 ZINC000160095783 529961276 /nfs/dbraw/zinc/96/12/76/529961276.db2.gz CJDUMQFVMQWNMZ-GDBMZVCRSA-N 1 1 331.378 2.967 20 70 EFIDMO Cn1ccc(CNC(=O)NC(C)(C)C[N@@H+](C)Cc2ccccc2)c1 ZINC000159453479 529999255 /nfs/dbraw/zinc/99/92/55/529999255.db2.gz SRWZSRKPYCAEMQ-UHFFFAOYSA-N 1 1 328.460 2.735 20 70 EFIDMO O=C1NC2(CCCC2)C(=O)N1CC[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000159394601 239025852 /nfs/dbraw/zinc/02/58/52/239025852.db2.gz VRVBKIQBDWUWPK-INIZCTEOSA-N 1 1 333.476 2.896 20 70 EFIDMO Cc1[nH+]ccn1CCCN(C)C(=O)Nc1ccn(CCC(C)C)n1 ZINC000160529203 239050553 /nfs/dbraw/zinc/05/05/53/239050553.db2.gz DLGSFNDSGYBMAG-UHFFFAOYSA-N 1 1 332.452 2.988 20 70 EFIDMO COC[C@H]1CCCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000159920360 533131912 /nfs/dbraw/zinc/13/19/12/533131912.db2.gz VHNDULNFFBXBFM-NEWSRXKRSA-N 1 1 345.487 2.575 20 70 EFIDMO COCC1CCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000159956396 533170689 /nfs/dbraw/zinc/17/06/89/533170689.db2.gz QPRAQFYOFRFMTK-APWZRJJASA-N 1 1 345.487 2.575 20 70 EFIDMO COc1ccc(C)cc1NC(=O)[C@H](c1ccccc1)[N@H+](C)C[C@@H](C)O ZINC000159561883 533403113 /nfs/dbraw/zinc/40/31/13/533403113.db2.gz JMNSSQBRWBCQIE-BEFAXECRSA-N 1 1 342.439 2.996 20 70 EFIDMO COc1ccc(C)cc1NC(=O)[C@H](c1ccccc1)[N@@H+](C)C[C@@H](C)O ZINC000159561883 533403117 /nfs/dbraw/zinc/40/31/17/533403117.db2.gz JMNSSQBRWBCQIE-BEFAXECRSA-N 1 1 342.439 2.996 20 70 EFIDMO COC(=O)CCn1nc(C)c(C[N@@H+](C)Cc2ccc(OC)cc2)c1C ZINC000159859965 533464078 /nfs/dbraw/zinc/46/40/78/533464078.db2.gz CRPVRIXQPCJKPA-UHFFFAOYSA-N 1 1 345.443 2.704 20 70 EFIDMO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)C(=O)NC(=O)NC(C)(C)C ZINC000159422354 533534137 /nfs/dbraw/zinc/53/41/37/533534137.db2.gz VJOPXQIDPVUCSK-NXEZZACHSA-N 1 1 327.375 2.628 20 70 EFIDMO C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000159426389 533650336 /nfs/dbraw/zinc/65/03/36/533650336.db2.gz FLVQGUFRTUVNRW-CVEARBPZSA-N 1 1 326.440 2.593 20 70 EFIDMO O=C(c1cc(-c2cccs2)[nH]n1)N1CCC([NH2+]CC2CC2)CC1 ZINC000159735613 225269857 /nfs/dbraw/zinc/26/98/57/225269857.db2.gz XEUXBNNBKQRZLO-UHFFFAOYSA-N 1 1 330.457 2.742 20 70 EFIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ncnc2nc(N)ccc21 ZINC000160247819 225372398 /nfs/dbraw/zinc/37/23/98/225372398.db2.gz SFBMVIDUVGEBNT-BBRMVZONSA-N 1 1 334.427 2.539 20 70 EFIDMO C[NH+]1CCN(CC(=O)N[C@H](c2cccc(Cl)c2)C2CCCC2)CC1 ZINC000159810784 544799605 /nfs/dbraw/zinc/79/96/05/544799605.db2.gz XBLFLPCNGYLPRP-IBGZPJMESA-N 1 1 349.906 2.935 20 70 EFIDMO Cc1cc(NC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)ccc1OC(C)C ZINC000160046507 544801231 /nfs/dbraw/zinc/80/12/31/544801231.db2.gz MMICEJWGWJHTON-RHSMWYFYSA-N 1 1 335.448 2.623 20 70 EFIDMO Cc1cc(NC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1OC(C)C ZINC000160046507 544801237 /nfs/dbraw/zinc/80/12/37/544801237.db2.gz MMICEJWGWJHTON-RHSMWYFYSA-N 1 1 335.448 2.623 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccccc1CC(F)(F)F)[C@H]1C[N@H+](C)CCO1 ZINC000160116975 544802758 /nfs/dbraw/zinc/80/27/58/544802758.db2.gz OMTFPKNKTLGTSC-BXUZGUMPSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccccc1CC(F)(F)F)[C@H]1C[N@@H+](C)CCO1 ZINC000160116975 544802762 /nfs/dbraw/zinc/80/27/62/544802762.db2.gz OMTFPKNKTLGTSC-BXUZGUMPSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)[C@H]1C[N@H+](C)CCO1 ZINC000160178818 544803002 /nfs/dbraw/zinc/80/30/02/544803002.db2.gz CBSLLMLJKBCENZ-SMDDNHRTSA-N 1 1 345.365 2.632 20 70 EFIDMO C[C@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)[C@H]1C[N@@H+](C)CCO1 ZINC000160178818 544803006 /nfs/dbraw/zinc/80/30/06/544803006.db2.gz CBSLLMLJKBCENZ-SMDDNHRTSA-N 1 1 345.365 2.632 20 70 EFIDMO Cc1nn(C)c2sc(C(=O)NC[C@H]3CCC[N@@H+]3CC(C)C)cc12 ZINC000160391419 544804835 /nfs/dbraw/zinc/80/48/35/544804835.db2.gz IJDJEIIQXQLUEN-CYBMUJFWSA-N 1 1 334.489 2.793 20 70 EFIDMO CSc1ccc(NC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1Cl ZINC000160348106 544805296 /nfs/dbraw/zinc/80/52/96/544805296.db2.gz QTGRVQUEKKEQTN-ZWNOBZJWSA-N 1 1 343.880 2.903 20 70 EFIDMO CSc1ccc(NC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1Cl ZINC000160348106 544805300 /nfs/dbraw/zinc/80/53/00/544805300.db2.gz QTGRVQUEKKEQTN-ZWNOBZJWSA-N 1 1 343.880 2.903 20 70 EFIDMO C[N@@H+](CC(=O)Nc1nc(-c2cccs2)cs1)C[C@H](O)C1CC1 ZINC000160759906 544808393 /nfs/dbraw/zinc/80/83/93/544808393.db2.gz QDAZLRNQASRAOX-LBPRGKRZSA-N 1 1 337.470 2.513 20 70 EFIDMO C[N@H+](CC(=O)Nc1nc(-c2cccs2)cs1)C[C@H](O)C1CC1 ZINC000160759906 544808399 /nfs/dbraw/zinc/80/83/99/544808399.db2.gz QDAZLRNQASRAOX-LBPRGKRZSA-N 1 1 337.470 2.513 20 70 EFIDMO C[C@H](NC(=O)[C@H](C)[N@@H+](C)C[C@H](O)C1CC1)c1ccc2c(c1)CCCC2 ZINC000160828381 544808635 /nfs/dbraw/zinc/80/86/35/544808635.db2.gz LQTIDYOWCJQWKL-AVYPCKFXSA-N 1 1 344.499 2.834 20 70 EFIDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc(N3CCCC3)c(F)c2)C1 ZINC000161305785 544812553 /nfs/dbraw/zinc/81/25/53/544812553.db2.gz PKOJUAREVCRWKS-PBHICJAKSA-N 1 1 333.451 2.884 20 70 EFIDMO CCN(C(=O)N[C@@H](COC)C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160883088 279003016 /nfs/dbraw/zinc/00/30/16/279003016.db2.gz BSCOBTOSOMYUBE-OALUTQOASA-N 1 1 345.487 2.717 20 70 EFIDMO CC[N@@H+](C)C[C@@H]1CCN([C@@H]2CCCN(c3ccccc3F)C2=O)C1 ZINC000160679833 279037287 /nfs/dbraw/zinc/03/72/87/279037287.db2.gz IRNFUVWSDDZQOA-MAUKXSAKSA-N 1 1 333.451 2.595 20 70 EFIDMO CCCCS[C@@H](C)C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000159705999 310690570 /nfs/dbraw/zinc/69/05/70/310690570.db2.gz VWNNBIJRWLXAHD-HNNXBMFYSA-N 1 1 330.538 2.725 20 70 EFIDMO Cc1oc2ccccc2c1C[NH+]1CCN(C(=O)[C@@H]2CCCO2)CC1 ZINC000161001776 310704771 /nfs/dbraw/zinc/70/47/71/310704771.db2.gz LVZYNRHUMAOZLI-SFHVURJKSA-N 1 1 328.412 2.564 20 70 EFIDMO COc1ccccc1SCC(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000161052806 310705227 /nfs/dbraw/zinc/70/52/27/310705227.db2.gz UCGLKXPPOQYJEY-CYBMUJFWSA-N 1 1 334.441 2.799 20 70 EFIDMO C[N@@H+](CC(=O)Nc1ccccc1Br)[C@@H]1CCCC[C@@H]1O ZINC000161083981 473205298 /nfs/dbraw/zinc/20/52/98/473205298.db2.gz CFTUSVGYKAAPKQ-KGLIPLIRSA-N 1 1 341.249 2.623 20 70 EFIDMO Cc1cnccc1CCNC(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000161118486 473208123 /nfs/dbraw/zinc/20/81/23/473208123.db2.gz MTFPFMLJXUPQRE-QGZVFWFLSA-N 1 1 340.471 2.752 20 70 EFIDMO Cc1cnccc1CCNC(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000161118612 473209359 /nfs/dbraw/zinc/20/93/59/473209359.db2.gz MTFPFMLJXUPQRE-KRWDZBQOSA-N 1 1 340.471 2.752 20 70 EFIDMO CCc1oc(C(=O)OC)cc1C[NH+]1CCC([C@H](O)C(F)(F)F)CC1 ZINC000161199723 473217453 /nfs/dbraw/zinc/21/74/53/473217453.db2.gz DRYFWQGQXUHRIR-AWEZNQCLSA-N 1 1 349.349 2.764 20 70 EFIDMO Cc1cc(Br)ccc1NC(=O)C[NH+]1CCC(C)(O)CC1 ZINC000161213620 473217816 /nfs/dbraw/zinc/21/78/16/473217816.db2.gz IAGZFOWIVPCQGA-UHFFFAOYSA-N 1 1 341.249 2.543 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1cccc(-n2ccnn2)c1 ZINC000161216365 473218142 /nfs/dbraw/zinc/21/81/42/473218142.db2.gz DIUBBALIVJLJPR-SFHVURJKSA-N 1 1 341.459 2.508 20 70 EFIDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)n[nH]1)CCN1CCCC1=O ZINC000161226695 473218460 /nfs/dbraw/zinc/21/84/60/473218460.db2.gz YGRCCMWIIRLMLS-UHFFFAOYSA-N 1 1 344.434 2.703 20 70 EFIDMO Cc1cn(-c2ccccc2Cl)nc1C(=O)NC[C@@H]1CC[N@H+](C)C1 ZINC000161260013 473221548 /nfs/dbraw/zinc/22/15/48/473221548.db2.gz NKJWLBCXUDGAOW-ZDUSSCGKSA-N 1 1 332.835 2.516 20 70 EFIDMO C[C@@H](C(=O)NC[C@H]1CC[N@@H+](C)C1)c1ccc(Br)cc1 ZINC000161259330 473222060 /nfs/dbraw/zinc/22/20/60/473222060.db2.gz BMJCPFXLCCHOQN-VXGBXAGGSA-N 1 1 325.250 2.621 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@@H+]([C@@H](C)c2nc(C(C)(C)C)no2)C1 ZINC000161275397 473222554 /nfs/dbraw/zinc/22/25/54/473222554.db2.gz ZGNNHHJQLJOETE-STQMWFEESA-N 1 1 332.452 2.919 20 70 EFIDMO CCn1cnnc1[C@H]1CCC[N@H+]([C@@H](C)c2nc(C(C)(C)C)no2)C1 ZINC000161275397 473222561 /nfs/dbraw/zinc/22/25/61/473222561.db2.gz ZGNNHHJQLJOETE-STQMWFEESA-N 1 1 332.452 2.919 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)NC2CCC(C)CC2)C1 ZINC000161282629 473223645 /nfs/dbraw/zinc/22/36/45/473223645.db2.gz AVOSCCFVDLDIMG-VUROTCPHSA-N 1 1 347.507 2.561 20 70 EFIDMO CCn1cnnc1[C@@H]1CCC[N@H+]([C@@H](C)C(=O)NC2CCC(C)CC2)C1 ZINC000161282629 473223649 /nfs/dbraw/zinc/22/36/49/473223649.db2.gz AVOSCCFVDLDIMG-VUROTCPHSA-N 1 1 347.507 2.561 20 70 EFIDMO Cc1cc(C(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)nn1-c1ccccc1 ZINC000161334984 473227546 /nfs/dbraw/zinc/22/75/46/473227546.db2.gz FQWZLNVNVAKUCD-KSSFIOAISA-N 1 1 326.444 2.639 20 70 EFIDMO CCc1cccc(NC(=O)C[N@H+]2CCC[C@@H](c3nncn3CC)C2)c1 ZINC000161341272 473228230 /nfs/dbraw/zinc/22/82/30/473228230.db2.gz SJTZBMDHJYJABQ-MRXNPFEDSA-N 1 1 341.459 2.679 20 70 EFIDMO CCc1cccc(NC(=O)C[N@@H+]2CCC[C@@H](c3nncn3CC)C2)c1 ZINC000161341272 473228233 /nfs/dbraw/zinc/22/82/33/473228233.db2.gz SJTZBMDHJYJABQ-MRXNPFEDSA-N 1 1 341.459 2.679 20 70 EFIDMO CC(C)OC[C@@H](O)C[N@@H+](C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000161358648 473229390 /nfs/dbraw/zinc/22/93/90/473229390.db2.gz SGVOULXRNLRFHS-SFHVURJKSA-N 1 1 331.460 2.727 20 70 EFIDMO Cc1noc(-c2ccccc2C(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)n1 ZINC000161406604 473233031 /nfs/dbraw/zinc/23/30/31/473233031.db2.gz VMOIMSOQEMOQIE-BLLLJJGKSA-N 1 1 328.416 2.504 20 70 EFIDMO CC(C)Oc1cncc(C(=O)NCC[N@@H+](C)Cc2ccccc2)c1 ZINC000161451271 473236471 /nfs/dbraw/zinc/23/64/71/473236471.db2.gz HTSLJYFXJFKWII-UHFFFAOYSA-N 1 1 327.428 2.731 20 70 EFIDMO CNS(=O)(=O)c1cccc([C@H](C)[NH2+][C@H](C)c2cncc(F)c2)c1 ZINC000161473874 473238097 /nfs/dbraw/zinc/23/80/97/473238097.db2.gz NERRKOOQUMNVSH-NWDGAFQWSA-N 1 1 337.420 2.541 20 70 EFIDMO O=C(Nc1ccc(Cl)cn1)[C@H]1CCC[N@@H+](CCOCC2CC2)C1 ZINC000159382290 473023655 /nfs/dbraw/zinc/02/36/55/473023655.db2.gz JEHZREWMGASVPW-AWEZNQCLSA-N 1 1 337.851 2.812 20 70 EFIDMO C[C@H](O)C[N@H+](C)[C@@H](C)C(=O)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000159406815 473025944 /nfs/dbraw/zinc/02/59/44/473025944.db2.gz XHJBKKFRRQMMPX-QWRGUYRKSA-N 1 1 337.420 2.589 20 70 EFIDMO C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000159406815 473025948 /nfs/dbraw/zinc/02/59/48/473025948.db2.gz XHJBKKFRRQMMPX-QWRGUYRKSA-N 1 1 337.420 2.589 20 70 EFIDMO O[C@@H](COc1ccccc1)C[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159430330 473027358 /nfs/dbraw/zinc/02/73/58/473027358.db2.gz UPXMUVFHMKLATE-WIYYLYMNSA-N 1 1 339.435 2.600 20 70 EFIDMO O[C@@H](COc1ccccc1)C[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000159430330 473027363 /nfs/dbraw/zinc/02/73/63/473027363.db2.gz UPXMUVFHMKLATE-WIYYLYMNSA-N 1 1 339.435 2.600 20 70 EFIDMO C/C(=C/c1ccccc1)C[N@H+]1CCCC[C@H]1CCNS(C)(=O)=O ZINC000159425327 473027541 /nfs/dbraw/zinc/02/75/41/473027541.db2.gz QMDKYXYZQYVTJA-BROZXCPCSA-N 1 1 336.501 2.884 20 70 EFIDMO Cc1cc(N2CCCC2)ccc1NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159442351 473028839 /nfs/dbraw/zinc/02/88/39/473028839.db2.gz RSCSFOHZVROCLM-LPHOPBHVSA-N 1 1 345.487 2.627 20 70 EFIDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)NC[C@@H]1CCOc2ccccc21 ZINC000159466986 473029238 /nfs/dbraw/zinc/02/92/38/473029238.db2.gz ITGLSNKVAVZUKK-DOTOQJQBSA-N 1 1 331.460 2.534 20 70 EFIDMO Cc1ccc(-c2csc(NC(=O)[C@H](C)[N@@H+](C)C[C@@H](C)O)n2)cc1 ZINC000159447794 473029517 /nfs/dbraw/zinc/02/95/17/473029517.db2.gz CXNJPYKTTQMIEH-OLZOCXBDSA-N 1 1 333.457 2.758 20 70 EFIDMO Cc1ccc(-c2csc(NC(=O)[C@H](C)[N@H+](C)C[C@@H](C)O)n2)cc1 ZINC000159447794 473029527 /nfs/dbraw/zinc/02/95/27/473029527.db2.gz CXNJPYKTTQMIEH-OLZOCXBDSA-N 1 1 333.457 2.758 20 70 EFIDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2cccc(Nc3cnn(C)c3)c2)C1 ZINC000159476812 473031443 /nfs/dbraw/zinc/03/14/43/473031443.db2.gz WCTNKUANQVMSDE-KDOFPFPSSA-N 1 1 341.459 2.622 20 70 EFIDMO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000159490942 473032733 /nfs/dbraw/zinc/03/27/33/473032733.db2.gz DVZOCRYBMQEBNH-GHMZBOCLSA-N 1 1 347.365 2.742 20 70 EFIDMO COc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+](C)C[C@@H](C)O)cc1 ZINC000159499681 473032914 /nfs/dbraw/zinc/03/29/14/473032914.db2.gz RHXFJCBNGLNQSC-KDOFPFPSSA-N 1 1 328.412 2.688 20 70 EFIDMO COc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+](C)C[C@@H](C)O)cc1 ZINC000159499681 473032921 /nfs/dbraw/zinc/03/29/21/473032921.db2.gz RHXFJCBNGLNQSC-KDOFPFPSSA-N 1 1 328.412 2.688 20 70 EFIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCCCOCC1CC1 ZINC000159513992 473034561 /nfs/dbraw/zinc/03/45/61/473034561.db2.gz VRFZUBXJGHQZCJ-APWZRJJASA-N 1 1 345.487 2.623 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccc2cc[nH]c21 ZINC000159584536 473041693 /nfs/dbraw/zinc/04/16/93/473041693.db2.gz FOFOAFMBORLIMD-UHFFFAOYSA-N 1 1 329.444 2.598 20 70 EFIDMO Cc1[nH+]ccn1CCCN(C)C(=O)Nc1ccc2c(c1)N(C)CCO2 ZINC000159636040 473046488 /nfs/dbraw/zinc/04/64/88/473046488.db2.gz CXRLVBKXZYVQHI-UHFFFAOYSA-N 1 1 343.431 2.574 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](C)c2cc(OC)c(OC)cc2C)CC1 ZINC000159633188 473047127 /nfs/dbraw/zinc/04/71/27/473047127.db2.gz FYPUMDVHAHJNDU-OAHLLOKOSA-N 1 1 349.475 2.810 20 70 EFIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)NCCn1cccc1 ZINC000159638848 473047635 /nfs/dbraw/zinc/04/76/35/473047635.db2.gz XDPQCKNFGHWAGU-UHFFFAOYSA-N 1 1 328.460 2.698 20 70 EFIDMO COC(=O)CC[N@@H+](CC1CCN(C(=O)C(C)(C)C)CC1)C(C)C ZINC000159665021 473049633 /nfs/dbraw/zinc/04/96/33/473049633.db2.gz MXUIKESVVFTVHX-UHFFFAOYSA-N 1 1 326.481 2.545 20 70 EFIDMO CC[C@@H](CC(=O)N(C)CCC[NH+]1CCN(C)CC1)c1ccc(C)cc1 ZINC000159686316 473051334 /nfs/dbraw/zinc/05/13/34/473051334.db2.gz XZGXMJIUKMZYMH-IBGZPJMESA-N 1 1 345.531 2.975 20 70 EFIDMO COc1ccc(Br)c(C[NH2+][C@H](C)C(=O)N2CCCC2)c1 ZINC000159712273 473054081 /nfs/dbraw/zinc/05/40/81/473054081.db2.gz HKCOINUWZFPXAT-LLVKDONJSA-N 1 1 341.249 2.558 20 70 EFIDMO Cc1c(CNC[C@H](C(C)C)[N@H+]2CCc3ccccc3C2)cnn1C ZINC000159758806 473058263 /nfs/dbraw/zinc/05/82/63/473058263.db2.gz ZPEVKJKLXLCGEL-HXUWFJFHSA-N 1 1 326.488 2.901 20 70 EFIDMO Cc1noc(C)c1[C@H](C)CNC(=O)N[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000159748142 473058451 /nfs/dbraw/zinc/05/84/51/473058451.db2.gz LQLXZDNNBMPFLO-BFHYXJOUSA-N 1 1 336.480 2.815 20 70 EFIDMO CC(C)[C@@H](Cc1ccccc1)C(=O)NCCCCN1CC[NH+](C)CC1 ZINC000159781274 473061191 /nfs/dbraw/zinc/06/11/91/473061191.db2.gz NLHNPXLTZQSXDY-HXUWFJFHSA-N 1 1 345.531 2.645 20 70 EFIDMO C[N@H+](CC(=O)NCC1(c2ccccc2)CCCC1)C[C@@H]1CCC[C@@H]1O ZINC000159871712 473068875 /nfs/dbraw/zinc/06/88/75/473068875.db2.gz NBVWJMMASYCINR-HKUYNNGSSA-N 1 1 344.499 2.707 20 70 EFIDMO CCCC1(CNC(=O)NC[C@@H](C(C)C)N2CC[NH+](C)CC2)CCC1 ZINC000159909421 473071497 /nfs/dbraw/zinc/07/14/97/473071497.db2.gz CZFLIZQMEOJAKF-KRWDZBQOSA-N 1 1 338.540 2.528 20 70 EFIDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CCc3cccc(F)c3C2)C1 ZINC000159930721 473072592 /nfs/dbraw/zinc/07/25/92/473072592.db2.gz XXMMJTACVYJYAL-HNNXBMFYSA-N 1 1 333.451 2.871 20 70 EFIDMO CNC(=O)[C@H](C)C[N@H+](C)Cc1nc(-c2c(F)cccc2F)cs1 ZINC000159988972 473078197 /nfs/dbraw/zinc/07/81/97/473078197.db2.gz HBIMDERXXJMEQJ-SNVBAGLBSA-N 1 1 339.411 2.902 20 70 EFIDMO CNC(=O)[C@H](C)C[N@@H+](C)Cc1nc(-c2c(F)cccc2F)cs1 ZINC000159988972 473078203 /nfs/dbraw/zinc/07/82/03/473078203.db2.gz HBIMDERXXJMEQJ-SNVBAGLBSA-N 1 1 339.411 2.902 20 70 EFIDMO CCSCc1cccc(NC(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)c1 ZINC000160028373 473081403 /nfs/dbraw/zinc/08/14/03/473081403.db2.gz YYZMBGSGOPTFGL-BBRMVZONSA-N 1 1 337.489 2.780 20 70 EFIDMO CCSCc1cccc(NC(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)c1 ZINC000160028373 473081409 /nfs/dbraw/zinc/08/14/09/473081409.db2.gz YYZMBGSGOPTFGL-BBRMVZONSA-N 1 1 337.489 2.780 20 70 EFIDMO CCSCc1cccc(NC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)c1 ZINC000160028501 473081891 /nfs/dbraw/zinc/08/18/91/473081891.db2.gz YYZMBGSGOPTFGL-CJNGLKHVSA-N 1 1 337.489 2.780 20 70 EFIDMO CCSCc1cccc(NC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)c1 ZINC000160028501 473081898 /nfs/dbraw/zinc/08/18/98/473081898.db2.gz YYZMBGSGOPTFGL-CJNGLKHVSA-N 1 1 337.489 2.780 20 70 EFIDMO CCn1nccc1C[NH2+]Cc1ccccc1CN1C[C@H](C)O[C@@H](C)C1 ZINC000160092483 473086521 /nfs/dbraw/zinc/08/65/21/473086521.db2.gz LASVLKIFONDSNM-IRXDYDNUSA-N 1 1 342.487 2.802 20 70 EFIDMO C[C@@H]1C[C@H](NC(=O)N(CCCCO)C2CC2)C[N@H+]1Cc1ccccc1 ZINC000160119057 473088004 /nfs/dbraw/zinc/08/80/04/473088004.db2.gz VPWVCSQBJNVQJH-AEFFLSMTSA-N 1 1 345.487 2.596 20 70 EFIDMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3F)n2)C1 ZINC000160131715 473089731 /nfs/dbraw/zinc/08/97/31/473089731.db2.gz GHXDTXGAQUVTMZ-ZDUSSCGKSA-N 1 1 348.397 2.531 20 70 EFIDMO Cc1cccc([C@H]2CCC[N@@H+]2CC(=O)NCCOc2ccccc2)n1 ZINC000160127183 473089774 /nfs/dbraw/zinc/08/97/74/473089774.db2.gz RUSNLTRTWLYXAL-LJQANCHMSA-N 1 1 339.439 2.722 20 70 EFIDMO Cc1cccc([C@H]2CCC[N@H+]2CC(=O)NCCOc2ccccc2)n1 ZINC000160127183 473089779 /nfs/dbraw/zinc/08/97/79/473089779.db2.gz RUSNLTRTWLYXAL-LJQANCHMSA-N 1 1 339.439 2.722 20 70 EFIDMO COC[C@H](NC(=O)NC(C)(C)C[N@@H+](C)Cc1ccccc1)C1CC1 ZINC000160202268 473096291 /nfs/dbraw/zinc/09/62/91/473096291.db2.gz NRKVVVYGMOOWNN-KRWDZBQOSA-N 1 1 333.476 2.621 20 70 EFIDMO COc1ccccc1CNC(=O)C[N@@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000160227813 473097703 /nfs/dbraw/zinc/09/77/03/473097703.db2.gz REYYKHNEMVCMCW-SFHVURJKSA-N 1 1 339.439 2.852 20 70 EFIDMO COc1ccccc1CNC(=O)C[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000160227813 473097706 /nfs/dbraw/zinc/09/77/06/473097706.db2.gz REYYKHNEMVCMCW-SFHVURJKSA-N 1 1 339.439 2.852 20 70 EFIDMO Cc1noc(C)c1[C@@H](C)CNC(=O)NC[C@@H]1CC[N@H+](CC(C)C)C1 ZINC000160247889 473101274 /nfs/dbraw/zinc/10/12/74/473101274.db2.gz PQBYJGACNJXUOD-BBRMVZONSA-N 1 1 336.480 2.672 20 70 EFIDMO COc1cccc(C2(NC(=O)NCC[N@H+]3CCC[C@@H](C)C3)CC2)c1 ZINC000160276104 473103401 /nfs/dbraw/zinc/10/34/01/473103401.db2.gz JHYPCPPMPNWFBI-OAHLLOKOSA-N 1 1 331.460 2.715 20 70 EFIDMO Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NC[C@@H](C(C)C)[NH+]1CCOCC1 ZINC000160304061 473104980 /nfs/dbraw/zinc/10/49/80/473104980.db2.gz FMQLBPPATOFPDA-PMPSAXMXSA-N 1 1 336.501 2.633 20 70 EFIDMO Cc1cccc([C@H]2CCC[N@H+]2CC(=O)NCCOCCC(C)C)n1 ZINC000160288706 473105898 /nfs/dbraw/zinc/10/58/98/473105898.db2.gz DOZHMMLWKLGBBB-GOSISDBHSA-N 1 1 333.476 2.706 20 70 EFIDMO Cc1cccc([C@H]2CCC[N@@H+]2CC(=O)NCCOCCC(C)C)n1 ZINC000160288706 473105902 /nfs/dbraw/zinc/10/59/02/473105902.db2.gz DOZHMMLWKLGBBB-GOSISDBHSA-N 1 1 333.476 2.706 20 70 EFIDMO CC(C)c1ncc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)s1 ZINC000160306121 473107813 /nfs/dbraw/zinc/10/78/13/473107813.db2.gz XFVBOYHDNZMPKS-UHFFFAOYSA-N 1 1 339.505 2.697 20 70 EFIDMO Cc1nn(Cc2ccccc2Cl)c(C)c1C[N@@H+]1CCC[C@@H]1C(N)=O ZINC000160343517 473109763 /nfs/dbraw/zinc/10/97/63/473109763.db2.gz SBUFQKZRXKSDQG-QGZVFWFLSA-N 1 1 346.862 2.651 20 70 EFIDMO Cc1nn(Cc2ccccc2Cl)c(C)c1C[N@H+]1CCC[C@@H]1C(N)=O ZINC000160343517 473109769 /nfs/dbraw/zinc/10/97/69/473109769.db2.gz SBUFQKZRXKSDQG-QGZVFWFLSA-N 1 1 346.862 2.651 20 70 EFIDMO Cc1cccc([C@@H](C)C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000160348207 473111620 /nfs/dbraw/zinc/11/16/20/473111620.db2.gz CECFQLALTOWLRP-QGZVFWFLSA-N 1 1 332.488 2.915 20 70 EFIDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2c2nc(C(C)(C)C)ns2)C[C@H](C)O1 ZINC000160486162 473131846 /nfs/dbraw/zinc/13/18/46/473131846.db2.gz YROYGKVFOWWEKX-MJBXVCDLSA-N 1 1 338.521 2.914 20 70 EFIDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2c2nc(C(C)(C)C)ns2)C[C@H](C)O1 ZINC000160486162 473131852 /nfs/dbraw/zinc/13/18/52/473131852.db2.gz YROYGKVFOWWEKX-MJBXVCDLSA-N 1 1 338.521 2.914 20 70 EFIDMO C[C@@H]([NH2+]CC(=O)NCC(F)(F)F)c1ccccc1OC(F)(F)F ZINC000160532901 473138245 /nfs/dbraw/zinc/13/82/45/473138245.db2.gz PSVVMDIRHGTVSF-MRVPVSSYSA-N 1 1 344.255 2.914 20 70 EFIDMO CC[N@H+](Cc1cc(C)c(OC(F)F)c(C)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160547840 473141146 /nfs/dbraw/zinc/14/11/46/473141146.db2.gz SCFFRQPMSLPHJC-AWEZNQCLSA-N 1 1 347.427 2.914 20 70 EFIDMO CC[N@@H+](Cc1cc(C)c(OC(F)F)c(C)c1)[C@H]1CCS(=O)(=O)C1 ZINC000160547840 473141151 /nfs/dbraw/zinc/14/11/51/473141151.db2.gz SCFFRQPMSLPHJC-AWEZNQCLSA-N 1 1 347.427 2.914 20 70 EFIDMO CC[C@@H](C)C[N@@H+](CC)Cc1nnc2n1c1ccccc1c(=O)n2CC ZINC000160567114 473143853 /nfs/dbraw/zinc/14/38/53/473143853.db2.gz GFFAINSTEGTSSR-CQSZACIVSA-N 1 1 341.459 2.932 20 70 EFIDMO CCC(CC)CNC(=O)N1CCC[C@H]1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000160575885 473145054 /nfs/dbraw/zinc/14/50/54/473145054.db2.gz KEUCKQNDFRNFKB-UXLLHSPISA-N 1 1 325.497 2.706 20 70 EFIDMO CCC(CC)CNC(=O)N1CCC[C@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000160575885 473145060 /nfs/dbraw/zinc/14/50/60/473145060.db2.gz KEUCKQNDFRNFKB-UXLLHSPISA-N 1 1 325.497 2.706 20 70 EFIDMO CC[N@@H+](C)Cc1cccc(CNC(=O)C[C@@H]2CSCCS2)c1 ZINC000160596257 473148104 /nfs/dbraw/zinc/14/81/04/473148104.db2.gz YZYLNUIBLOJQJK-MRXNPFEDSA-N 1 1 338.542 2.993 20 70 EFIDMO C[C@@H]([NH2+]CC(=O)NCC(F)(F)F)c1ccc(F)cc1OC(F)F ZINC000160615025 473152129 /nfs/dbraw/zinc/15/21/29/473152129.db2.gz BTAJWKBROUBKQI-SSDOTTSWSA-N 1 1 344.255 2.756 20 70 EFIDMO CN(C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)[C@H]1CCc2ccccc2C1 ZINC000160627686 473153817 /nfs/dbraw/zinc/15/38/17/473153817.db2.gz JAOHJWVIMJIGSE-MOPGFXCFSA-N 1 1 327.472 2.670 20 70 EFIDMO CCN(C(=O)NC[C@]1(C)CCCO1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160666001 473157900 /nfs/dbraw/zinc/15/79/00/473157900.db2.gz HRWUYEKMVSYQBQ-ICSRJNTNSA-N 1 1 345.487 2.862 20 70 EFIDMO CC[N@H+]1CCC[C@H]1CNC(=O)Cc1cccc(OCC(F)(F)F)c1 ZINC000160700811 473163144 /nfs/dbraw/zinc/16/31/44/473163144.db2.gz AHSNNWAGMHBGRI-AWEZNQCLSA-N 1 1 344.377 2.771 20 70 EFIDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)N[C@@H]1CCO[C@H](c3ccccc3)C1)C2 ZINC000160743209 473170014 /nfs/dbraw/zinc/17/00/14/473170014.db2.gz YVPVXJZSZBXMIK-HCXYKTFWSA-N 1 1 343.471 2.785 20 70 EFIDMO Cc1ccc2c(c1)[C@@H](NC(=O)NCCC[N@@H+]1CCCC[C@@H]1C)CO2 ZINC000160791717 473174654 /nfs/dbraw/zinc/17/46/54/473174654.db2.gz BIPKOCDZJFSHTJ-RDJZCZTQSA-N 1 1 331.460 2.992 20 70 EFIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCc2ccccc2CC1 ZINC000160792639 473176697 /nfs/dbraw/zinc/17/66/97/473176697.db2.gz OEKJBCONXTUOBA-GOSISDBHSA-N 1 1 327.472 2.814 20 70 EFIDMO COc1ccc2[nH]cc(C3CC[NH+](Cc4nncn4C)CC3)c2c1 ZINC000160841782 473182636 /nfs/dbraw/zinc/18/26/36/473182636.db2.gz HLNCLPQITKRWIC-UHFFFAOYSA-N 1 1 325.416 2.685 20 70 EFIDMO CO[C@@H]1CCC[C@H]1NC(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000160852099 473184028 /nfs/dbraw/zinc/18/40/28/473184028.db2.gz AZGMOELWAJTIPY-KZNAEPCWSA-N 1 1 331.460 2.518 20 70 EFIDMO CCCO[C@H]1CCCN(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)CC1 ZINC000160879486 473186759 /nfs/dbraw/zinc/18/67/59/473186759.db2.gz HDZYHVMGDAKNSH-WMZOPIPTSA-N 1 1 337.508 2.994 20 70 EFIDMO COc1ccc(CNC(=O)C[NH2+][C@H](C)c2ccc(OC)cc2F)cc1 ZINC000160960523 473194547 /nfs/dbraw/zinc/19/45/47/473194547.db2.gz PHNDOJVXZSREJX-CYBMUJFWSA-N 1 1 346.402 2.810 20 70 EFIDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2cc(C(=O)OC)cs2)C1 ZINC000160963087 473195313 /nfs/dbraw/zinc/19/53/13/473195313.db2.gz FBMFVOYDDGFLPF-GFCCVEGCSA-N 1 1 339.461 2.730 20 70 EFIDMO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@H+](Cc2cnc3ccccn23)C1 ZINC000160972749 473195704 /nfs/dbraw/zinc/19/57/04/473195704.db2.gz HVZISDXVMKQIPA-AWEZNQCLSA-N 1 1 330.432 2.776 20 70 EFIDMO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@@H+](Cc2cnc3ccccn23)C1 ZINC000160972749 473195710 /nfs/dbraw/zinc/19/57/10/473195710.db2.gz HVZISDXVMKQIPA-AWEZNQCLSA-N 1 1 330.432 2.776 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC(c2cc[nH]n2)CC1 ZINC000160972987 473195717 /nfs/dbraw/zinc/19/57/17/473195717.db2.gz BQGGFCLNYJFHJM-QGZVFWFLSA-N 1 1 347.507 2.809 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](C)C[C@H](C)CC)nc(N)c21 ZINC000161047491 473201386 /nfs/dbraw/zinc/20/13/86/473201386.db2.gz PTVFTQJABSZKNJ-SNVBAGLBSA-N 1 1 334.420 2.768 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](C)C[C@@H](C)CC)nc(N)c21 ZINC000161047609 473201486 /nfs/dbraw/zinc/20/14/86/473201486.db2.gz PTVFTQJABSZKNJ-JTQLQIEISA-N 1 1 334.420 2.768 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)N1CCc2sccc2C1 ZINC000161040263 473202004 /nfs/dbraw/zinc/20/20/04/473202004.db2.gz HNVJRCJONFQOSB-AWEZNQCLSA-N 1 1 329.469 2.938 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)N1CCc2sccc2C1 ZINC000161040263 473202010 /nfs/dbraw/zinc/20/20/10/473202010.db2.gz HNVJRCJONFQOSB-AWEZNQCLSA-N 1 1 329.469 2.938 20 70 EFIDMO C[C@@H]1CN(C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(Cn2ccccc2=O)cc1 ZINC000161062435 473203582 /nfs/dbraw/zinc/20/35/82/473203582.db2.gz KRHRUPGOGNGDMS-MBOZVWFJSA-N 1 1 339.483 2.715 20 70 EFIDMO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000161062435 473203586 /nfs/dbraw/zinc/20/35/86/473203586.db2.gz KRHRUPGOGNGDMS-MBOZVWFJSA-N 1 1 339.483 2.715 20 70 EFIDMO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000161062435 473203590 /nfs/dbraw/zinc/20/35/90/473203590.db2.gz KRHRUPGOGNGDMS-MBOZVWFJSA-N 1 1 339.483 2.715 20 70 EFIDMO CCC[N@H+](Cc1cc2cc(F)ccc2o1)[C@H]1CCS(=O)(=O)C1 ZINC000161076471 473204468 /nfs/dbraw/zinc/20/44/68/473204468.db2.gz WNEJZSCRRPXNNN-AWEZNQCLSA-N 1 1 325.405 2.971 20 70 EFIDMO CCC[N@@H+](Cc1cc2cc(F)ccc2o1)[C@H]1CCS(=O)(=O)C1 ZINC000161076471 473204471 /nfs/dbraw/zinc/20/44/71/473204471.db2.gz WNEJZSCRRPXNNN-AWEZNQCLSA-N 1 1 325.405 2.971 20 70 EFIDMO C[C@H](NC1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(-n2cnnn2)cc1 ZINC000159638221 533793138 /nfs/dbraw/zinc/79/31/38/533793138.db2.gz OTOSCJMYJXLGKW-ZDUSSCGKSA-N 1 1 328.464 2.622 20 70 EFIDMO C[C@@H]1C[C@H](NC(=O)N(C)Cc2nccs2)C[N@H+]1Cc1ccccc1 ZINC000160335701 533917703 /nfs/dbraw/zinc/91/77/03/533917703.db2.gz JJNJKROWVKXEFP-ZBFHGGJFSA-N 1 1 344.484 2.948 20 70 EFIDMO C[C@@H](CNC(=O)NCc1ccc(O)c(F)c1)[N@@H+](C)Cc1ccccc1 ZINC000159590015 533970529 /nfs/dbraw/zinc/97/05/29/533970529.db2.gz PMSQBMCNXJUTFW-AWEZNQCLSA-N 1 1 345.418 2.851 20 70 EFIDMO C[C@@H]1CCO[C@@H]1C(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000159880674 534110783 /nfs/dbraw/zinc/11/07/83/534110783.db2.gz ZNPILFFLAGBQPH-APWZRJJASA-N 1 1 330.472 2.782 20 70 EFIDMO COc1ccc2c(c1)CCN2C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000160784827 518162806 /nfs/dbraw/zinc/16/28/06/518162806.db2.gz KVZKRYSKPRYBIF-OAHLLOKOSA-N 1 1 329.444 2.784 20 70 EFIDMO Cc1ccsc1CCCC(=O)NC[C@H](C(C)C)[NH+]1CCOCC1 ZINC000160303680 534462117 /nfs/dbraw/zinc/46/21/17/534462117.db2.gz QWQVOXFNRAIISA-MRXNPFEDSA-N 1 1 338.517 2.852 20 70 EFIDMO Cc1noc([C@H]2CCC[N@@H+]([C@H]3CCN(c4ccc(C)cc4)C3=O)C2)n1 ZINC000159492918 534479411 /nfs/dbraw/zinc/47/94/11/534479411.db2.gz ZWWIHGIZXLYKQS-RDJZCZTQSA-N 1 1 340.427 2.671 20 70 EFIDMO Cc1noc([C@H]2CCC[N@H+]([C@H]3CCN(c4ccc(C)cc4)C3=O)C2)n1 ZINC000159492918 534479420 /nfs/dbraw/zinc/47/94/20/534479420.db2.gz ZWWIHGIZXLYKQS-RDJZCZTQSA-N 1 1 340.427 2.671 20 70 EFIDMO CCC[N@@H+](CCCC(=O)OC)CC(=O)Nc1ccc(Cl)cc1 ZINC000217229244 521652317 /nfs/dbraw/zinc/65/23/17/521652317.db2.gz VBWRBEBUMPITNX-UHFFFAOYSA-N 1 1 326.824 2.944 20 70 EFIDMO CCc1nn(C)c(Cl)c1C(=O)Nc1ccc(-n2cc[nH+]c2C)nc1 ZINC000160726710 522664764 /nfs/dbraw/zinc/66/47/64/522664764.db2.gz MKZLGCLMZHJWJW-UHFFFAOYSA-N 1 1 344.806 2.777 20 70 EFIDMO C[N@@H+]1CCN(CC(=O)N2CCCc3ccccc32)[C@@H](c2ccccc2)C1 ZINC000216731541 523891519 /nfs/dbraw/zinc/89/15/19/523891519.db2.gz KNRFVTDDPVVFKB-OAQYLSRUSA-N 1 1 349.478 2.955 20 70 EFIDMO C[N@H+]1CCN(CC(=O)N2CCCc3ccccc32)[C@@H](c2ccccc2)C1 ZINC000216731541 523891522 /nfs/dbraw/zinc/89/15/22/523891522.db2.gz KNRFVTDDPVVFKB-OAQYLSRUSA-N 1 1 349.478 2.955 20 70 EFIDMO Cc1ccn(-c2ccc(N[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C)nn2)n1 ZINC000160219194 534852583 /nfs/dbraw/zinc/85/25/83/534852583.db2.gz RBIQDNYOWCNONB-YJBOKZPZSA-N 1 1 348.454 2.903 20 70 EFIDMO Cc1ccc(C(=O)CC[NH+]2CCN(c3nc(C)cc(C)n3)CC2)cc1 ZINC000160887179 526044260 /nfs/dbraw/zinc/04/42/60/526044260.db2.gz OVFNVRRXBBPIDJ-UHFFFAOYSA-N 1 1 338.455 2.797 20 70 EFIDMO CC(C)(C)c1nsc(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)n1 ZINC000160151818 526906278 /nfs/dbraw/zinc/90/62/78/526906278.db2.gz JKQNXKLXPBOQCC-CABCVRRESA-N 1 1 346.500 2.883 20 70 EFIDMO CCCN(C(=O)c1cccs1)C1CC[NH+](Cc2cncn2C)CC1 ZINC000159780804 527792264 /nfs/dbraw/zinc/79/22/64/527792264.db2.gz HOHCCHPOWFIUJT-UHFFFAOYSA-N 1 1 346.500 2.998 20 70 EFIDMO CCCC(=O)Nc1ccc(CNC(=O)N2CCC[N@@H+](CC)CC2)cc1 ZINC000159643306 527957662 /nfs/dbraw/zinc/95/76/62/527957662.db2.gz LHKIQCKGQACWII-UHFFFAOYSA-N 1 1 346.475 2.662 20 70 EFIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N(C[C@@H]1CCOC1)C1CC1 ZINC000160995616 527962803 /nfs/dbraw/zinc/96/28/03/527962803.db2.gz TVCCVRZMYNMTHS-FUHWJXTLSA-N 1 1 337.508 2.707 20 70 EFIDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)C(=O)Nc2cccc(C(C)C)c2)C1 ZINC000159448838 528023503 /nfs/dbraw/zinc/02/35/03/528023503.db2.gz QYNKDIIXPXGWPH-MRXNPFEDSA-N 1 1 345.487 2.843 20 70 EFIDMO CC(C)c1ccc(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)cn1 ZINC000159879635 528068363 /nfs/dbraw/zinc/06/83/63/528068363.db2.gz WFEXPMJCOZNPGG-UHFFFAOYSA-N 1 1 345.487 2.970 20 70 EFIDMO CCC[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000160159826 528240532 /nfs/dbraw/zinc/24/05/32/528240532.db2.gz PVPSSFPANPIQBU-PVAVHDDUSA-N 1 1 349.544 2.874 20 70 EFIDMO CCC[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000160159826 528240536 /nfs/dbraw/zinc/24/05/36/528240536.db2.gz PVPSSFPANPIQBU-PVAVHDDUSA-N 1 1 349.544 2.874 20 70 EFIDMO CCOc1cc(C[NH+]2CCC(CC(N)=O)CC2)cc(Cl)c1OC ZINC000159719829 528263406 /nfs/dbraw/zinc/26/34/06/528263406.db2.gz NFYSVZWFCPQOGA-UHFFFAOYSA-N 1 1 340.851 2.835 20 70 EFIDMO CCOCCC[N@@H+](CCO)Cc1cc(Br)ccc1F ZINC000160343071 528657624 /nfs/dbraw/zinc/65/76/24/528657624.db2.gz WYERSUAOTPRNNW-UHFFFAOYSA-N 1 1 334.229 2.809 20 70 EFIDMO CC(C)n1nccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159828988 528683782 /nfs/dbraw/zinc/68/37/82/528683782.db2.gz QXVVPDYPGIQHIB-OAHLLOKOSA-N 1 1 343.475 2.989 20 70 EFIDMO CC(C)n1nccc1NC(=O)[C@H](C)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159829111 528685541 /nfs/dbraw/zinc/68/55/41/528685541.db2.gz QXVVPDYPGIQHIB-HNNXBMFYSA-N 1 1 343.475 2.989 20 70 EFIDMO CCC[C@@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000160159712 529019475 /nfs/dbraw/zinc/01/94/75/529019475.db2.gz PVPSSFPANPIQBU-DJIMGWMZSA-N 1 1 349.544 2.874 20 70 EFIDMO CCC[C@@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000160159712 529019479 /nfs/dbraw/zinc/01/94/79/529019479.db2.gz PVPSSFPANPIQBU-DJIMGWMZSA-N 1 1 349.544 2.874 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1 ZINC000159833883 529025124 /nfs/dbraw/zinc/02/51/24/529025124.db2.gz RHBXAKRQIOGJRJ-UHFFFAOYSA-N 1 1 328.460 2.838 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2ccc(-c3csc(C)n3)o2)CC1 ZINC000159566366 529026941 /nfs/dbraw/zinc/02/69/41/529026941.db2.gz ISYQVXNLMPWHIX-UHFFFAOYSA-N 1 1 348.472 2.949 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@H](C)Oc2ccc(Cl)cc2)CC1 ZINC000159926918 529027230 /nfs/dbraw/zinc/02/72/30/529027230.db2.gz HFECCJVTAOREBP-AWEZNQCLSA-N 1 1 339.867 2.845 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCc2ccc(OC)c(Cl)c2)CC1 ZINC000160007342 529027325 /nfs/dbraw/zinc/02/73/25/529027325.db2.gz LOAQEAABRYRACD-UHFFFAOYSA-N 1 1 325.840 2.586 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)CC1 ZINC000159871363 529028424 /nfs/dbraw/zinc/02/84/24/529028424.db2.gz ADHWKWJYCMLGCQ-QGZVFWFLSA-N 1 1 348.466 2.532 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](c2ccc(OC)cc2)C2CC2)CC1 ZINC000159569497 529030848 /nfs/dbraw/zinc/03/08/48/529030848.db2.gz PANSLMSWQOCGDL-SFHVURJKSA-N 1 1 331.460 2.884 20 70 EFIDMO CC[N@H+]1CCC[C@@H]1CNC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000159747149 529078833 /nfs/dbraw/zinc/07/88/33/529078833.db2.gz KATAXPLAHQARQI-KURKYZTESA-N 1 1 331.460 2.690 20 70 EFIDMO CCN1CC[NH+](CCCNC(=O)[C@H](Cc2ccccc2)C(C)C)CC1 ZINC000159809100 529144621 /nfs/dbraw/zinc/14/46/21/529144621.db2.gz KZADGYZPHWRHHM-HXUWFJFHSA-N 1 1 345.531 2.645 20 70 EFIDMO CN1CCN(C(=O)C[N@H+](C)Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000216666163 545559558 /nfs/dbraw/zinc/55/95/58/545559558.db2.gz OOCHSEYZISUIIO-UHFFFAOYSA-N 1 1 337.467 2.559 20 70 EFIDMO CN1CCN(C(=O)C[N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000216666163 545559563 /nfs/dbraw/zinc/55/95/63/545559563.db2.gz OOCHSEYZISUIIO-UHFFFAOYSA-N 1 1 337.467 2.559 20 70 EFIDMO C[N@H+](CC(=O)Nc1ccccc1C(F)(F)F)C[C@@H]1CCC[C@@H]1O ZINC000159775647 529839068 /nfs/dbraw/zinc/83/90/68/529839068.db2.gz HOVNSEFCBYCHMB-FZMZJTMJSA-N 1 1 330.350 2.737 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)CCCOc1ccccc1 ZINC000160319027 529845996 /nfs/dbraw/zinc/84/59/96/529845996.db2.gz WSCFUMJWBASNET-UHFFFAOYSA-N 1 1 348.487 2.662 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)Cc1ccccc1Cl ZINC000160276500 529846214 /nfs/dbraw/zinc/84/62/14/529846214.db2.gz QSJQXKBFCMGGCI-UHFFFAOYSA-N 1 1 338.879 2.699 20 70 EFIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc(Cl)c(Cl)[nH]1 ZINC000160115374 529846218 /nfs/dbraw/zinc/84/62/18/529846218.db2.gz GFTPXJQAQVWJRT-UHFFFAOYSA-N 1 1 348.274 2.752 20 70 EFIDMO COC[C@H]1CCCN(C(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)C1 ZINC000160937648 239059427 /nfs/dbraw/zinc/05/94/27/239059427.db2.gz CUDWQLRLIGYJDA-IRXDYDNUSA-N 1 1 325.497 2.565 20 70 EFIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000160814158 284053788 /nfs/dbraw/zinc/05/37/88/284053788.db2.gz KSGXSHUYDDNAKK-GDBMZVCRSA-N 1 1 331.464 2.663 20 70 EFIDMO C[C@@H](NC[C@@H](C1CCCCC1)[NH+](C)C)c1ccc(-n2cnnn2)cc1 ZINC000160421843 296127517 /nfs/dbraw/zinc/12/75/17/296127517.db2.gz QLFZEHUDCCBYGU-BEFAXECRSA-N 1 1 342.491 2.823 20 70 EFIDMO COC[C@H](NC(=O)Nc1ccccc1C[NH+]1CCSCC1)C1CC1 ZINC000159711742 533066059 /nfs/dbraw/zinc/06/60/59/533066059.db2.gz RDUABZCDNNEGGG-KRWDZBQOSA-N 1 1 349.500 2.782 20 70 EFIDMO CSCCCCC(=O)NCc1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000159915513 533542092 /nfs/dbraw/zinc/54/20/92/533542092.db2.gz DPEWEHRJCRHXMS-UHFFFAOYSA-N 1 1 349.544 2.584 20 70 EFIDMO COc1cc(C)cc(CNC(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)c1 ZINC000160246846 533635559 /nfs/dbraw/zinc/63/55/59/533635559.db2.gz ZXDMFNQFGCYVPA-MRXNPFEDSA-N 1 1 333.476 2.781 20 70 EFIDMO Cc1cc(C)c(NC(=O)C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)c(C)c1 ZINC000159396090 225209705 /nfs/dbraw/zinc/20/97/05/225209705.db2.gz XFIPZYFOLTZBFD-KRWDZBQOSA-N 1 1 345.487 2.644 20 70 EFIDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc2[nH]cnc21 ZINC000159401056 225210554 /nfs/dbraw/zinc/21/05/54/225210554.db2.gz XWOLSYWLBXWRCS-KRWDZBQOSA-N 1 1 348.450 2.857 20 70 EFIDMO O=C(NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc2nc[nH]c21 ZINC000159401056 225210560 /nfs/dbraw/zinc/21/05/60/225210560.db2.gz XWOLSYWLBXWRCS-KRWDZBQOSA-N 1 1 348.450 2.857 20 70 EFIDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc2nc[nH]c21 ZINC000159401056 225210567 /nfs/dbraw/zinc/21/05/67/225210567.db2.gz XWOLSYWLBXWRCS-KRWDZBQOSA-N 1 1 348.450 2.857 20 70 EFIDMO C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000159468817 225223806 /nfs/dbraw/zinc/22/38/06/225223806.db2.gz NXWQDVDMNCIIAN-IUCAKERBSA-N 1 1 338.757 2.998 20 70 EFIDMO C[C@H]1C[C@@H](NC(=O)N(C)CCOCC2CC2)C[N@H+]1Cc1ccccc1 ZINC000160337647 225391092 /nfs/dbraw/zinc/39/10/92/225391092.db2.gz HRTJJGPBXPMPAF-QFBILLFUSA-N 1 1 345.487 2.717 20 70 EFIDMO C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccccn2)C[N@H+]1Cc1ccccc1 ZINC000160059919 225328687 /nfs/dbraw/zinc/32/86/87/225328687.db2.gz BDVAHZHNXCJPBJ-QFBILLFUSA-N 1 1 338.455 2.886 20 70 EFIDMO Cc1nccc(NC(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1Cl ZINC000159879713 544799032 /nfs/dbraw/zinc/79/90/32/544799032.db2.gz ZYNSKWXTSLMQSL-TXEJJXNPSA-N 1 1 340.855 2.664 20 70 EFIDMO C[C@H](NC(=O)Nc1ccccc1OC(C)(C)C)[C@@H]1C[N@H+](C)CCO1 ZINC000159813942 544799507 /nfs/dbraw/zinc/79/95/07/544799507.db2.gz FHXVEWMXOGCYRL-BBRMVZONSA-N 1 1 335.448 2.705 20 70 EFIDMO C[C@H](NC(=O)Nc1ccccc1OC(C)(C)C)[C@@H]1C[N@@H+](C)CCO1 ZINC000159813942 544799512 /nfs/dbraw/zinc/79/95/12/544799512.db2.gz FHXVEWMXOGCYRL-BBRMVZONSA-N 1 1 335.448 2.705 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H](OC)c2ccccc2Cl)CC1 ZINC000160001358 544800434 /nfs/dbraw/zinc/80/04/34/544800434.db2.gz ZKUOSOYSQSMSAY-MRXNPFEDSA-N 1 1 339.867 2.765 20 70 EFIDMO C[C@H](NC1CC[NH+](C2CCCC2)CC1)c1cccc(-n2cnnn2)c1 ZINC000160457367 544805802 /nfs/dbraw/zinc/80/58/02/544805802.db2.gz FCEYISRUFFWANN-HNNXBMFYSA-N 1 1 340.475 2.720 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccc2nc(C3CC3)oc2c1)[C@@H]1C[N@H+](C)CCO1 ZINC000160402344 544805838 /nfs/dbraw/zinc/80/58/38/544805838.db2.gz XKKHXWFIRJOWIJ-BZNIZROVSA-N 1 1 344.415 2.546 20 70 EFIDMO C[C@@H](NC(=O)Nc1ccc2nc(C3CC3)oc2c1)[C@@H]1C[N@@H+](C)CCO1 ZINC000160402344 544805840 /nfs/dbraw/zinc/80/58/40/544805840.db2.gz XKKHXWFIRJOWIJ-BZNIZROVSA-N 1 1 344.415 2.546 20 70 EFIDMO CCSc1cc(Cl)ccc1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000161282580 544811007 /nfs/dbraw/zinc/81/10/07/544811007.db2.gz KRNVVOUWDYFMAC-RISCZKNCSA-N 1 1 342.892 2.901 20 70 EFIDMO CCSc1cc(Cl)ccc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000161282580 544811011 /nfs/dbraw/zinc/81/10/11/544811011.db2.gz KRNVVOUWDYFMAC-RISCZKNCSA-N 1 1 342.892 2.901 20 70 EFIDMO CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@@H](C)C(=O)NCC(C)C ZINC000160018157 276341793 /nfs/dbraw/zinc/34/17/93/276341793.db2.gz BCVYISZPBWRKKE-KRWDZBQOSA-N 1 1 346.519 2.781 20 70 EFIDMO Cc1csc2nc(C)nc(N3CCC[C@@H]3C[NH+]3CCOCC3)c12 ZINC000160392103 302455819 /nfs/dbraw/zinc/45/58/19/302455819.db2.gz YLQQLVZQWMWNPF-CQSZACIVSA-N 1 1 332.473 2.609 20 70 EFIDMO CCC(CC)[C@H](CNC(=O)N1CCC2(CCC2)C1)[NH+]1CCOCC1 ZINC000159884329 310692601 /nfs/dbraw/zinc/69/26/01/310692601.db2.gz MSTMPHMCBHIXTK-KRWDZBQOSA-N 1 1 337.508 2.709 20 70 EFIDMO CCOCC[NH+]1CCN(Cc2ncc(-c3ccccc3)s2)CC1 ZINC000159918159 310692906 /nfs/dbraw/zinc/69/29/06/310692906.db2.gz BYCSBYQJWPWSMJ-UHFFFAOYSA-N 1 1 331.485 2.964 20 70 EFIDMO COc1cccc([C@H](C)C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000160338566 310697487 /nfs/dbraw/zinc/69/74/87/310697487.db2.gz DCQWFUDQLOREBP-INIZCTEOSA-N 1 1 348.487 2.616 20 70 EFIDMO CCSCC[NH+]1CCN(C(=O)c2ccc(Cl)cc2F)CC1 ZINC000160326994 310697690 /nfs/dbraw/zinc/69/76/90/310697690.db2.gz DLSLEOIKWJMHIR-UHFFFAOYSA-N 1 1 330.856 2.990 20 70 EFIDMO Cc1ccc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c(Br)c1 ZINC000161121020 473209237 /nfs/dbraw/zinc/20/92/37/473209237.db2.gz OGTLUEFSKMWOLR-LBPRGKRZSA-N 1 1 337.261 2.972 20 70 EFIDMO CC[C@@H](NC(=O)NC[C@H](c1ccco1)[NH+](C)C)c1c(C)noc1C ZINC000161141459 473211306 /nfs/dbraw/zinc/21/13/06/473211306.db2.gz OCEOZOOIFJKOST-ZIAGYGMSSA-N 1 1 334.420 2.938 20 70 EFIDMO C[N@@H+](CCCNC(=O)NCc1ccccc1CO)Cc1ccccc1 ZINC000161122273 473209458 /nfs/dbraw/zinc/20/94/58/473209458.db2.gz HNJKCDZYQMZYMM-UHFFFAOYSA-N 1 1 341.455 2.500 20 70 EFIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCO[C@H](c2cccs2)C1 ZINC000161126403 473210364 /nfs/dbraw/zinc/21/03/64/473210364.db2.gz MLSZUHLVJCXOAC-ZBFHGGJFSA-N 1 1 349.500 2.848 20 70 EFIDMO CC[C@@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)c1c(C)noc1C ZINC000161141275 473211496 /nfs/dbraw/zinc/21/14/96/473211496.db2.gz OCEOZOOIFJKOST-KGLIPLIRSA-N 1 1 334.420 2.938 20 70 EFIDMO CCN(C(=O)NCC1(OC)CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000161167173 473213768 /nfs/dbraw/zinc/21/37/68/473213768.db2.gz SWYMUZVTKMVGBC-GOSISDBHSA-N 1 1 345.487 2.862 20 70 EFIDMO Cc1ccc(C(=O)CC[N@H+](C)CCN(C)C2CC[NH+](C)CC2)cc1 ZINC000161179203 473215362 /nfs/dbraw/zinc/21/53/62/473215362.db2.gz YEGWRXTVQGQPBZ-UHFFFAOYSA-N 1 1 331.504 2.526 20 70 EFIDMO Cc1ccc(C(=O)CCN(C)CCN(C)C2CC[NH+](C)CC2)cc1 ZINC000161179203 473215367 /nfs/dbraw/zinc/21/53/67/473215367.db2.gz YEGWRXTVQGQPBZ-UHFFFAOYSA-N 1 1 331.504 2.526 20 70 EFIDMO C[C@H](C(=O)NC1CC1)[N@@H+](C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000161235138 473219539 /nfs/dbraw/zinc/21/95/39/473219539.db2.gz GGBLMJDPYPODJK-CQSZACIVSA-N 1 1 326.444 2.608 20 70 EFIDMO CC[NH+]1CCC(N(C)C(=O)c2cc(-c3ccc(OC)cc3)[nH]n2)CC1 ZINC000161234277 473219627 /nfs/dbraw/zinc/21/96/27/473219627.db2.gz WTVWITWJOVYMMT-UHFFFAOYSA-N 1 1 342.443 2.642 20 70 EFIDMO CCN(C(=O)NCCOC(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000161242717 473220259 /nfs/dbraw/zinc/22/02/59/473220259.db2.gz GHZSOEFXIUPCLJ-SFHVURJKSA-N 1 1 333.476 2.717 20 70 EFIDMO CCN(C(=O)NCCOC(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000161242602 473220344 /nfs/dbraw/zinc/22/03/44/473220344.db2.gz GHZSOEFXIUPCLJ-GOSISDBHSA-N 1 1 333.476 2.717 20 70 EFIDMO COCCC1(C(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)CC1 ZINC000161370928 473230551 /nfs/dbraw/zinc/23/05/51/473230551.db2.gz GVWWTRKHZZZEIP-UHFFFAOYSA-N 1 1 344.499 2.970 20 70 EFIDMO CCCOc1cccc(CC(=O)NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000161372819 473230903 /nfs/dbraw/zinc/23/09/03/473230903.db2.gz JYXJYEJZJIXODA-CALCHBBNSA-N 1 1 348.487 2.633 20 70 EFIDMO c1nn(-c2ccccc2)cc1C[N@H+]1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000161401884 473232387 /nfs/dbraw/zinc/23/23/87/473232387.db2.gz DEELYYVCYGWUSB-KRWDZBQOSA-N 1 1 348.454 2.790 20 70 EFIDMO COc1ccc(CNC(=O)C[NH2+][C@H](C)c2nc3c(s2)CCC3)cc1 ZINC000161418204 473234533 /nfs/dbraw/zinc/23/45/33/473234533.db2.gz HYKXCPOZEICNLX-GFCCVEGCSA-N 1 1 345.468 2.607 20 70 EFIDMO CC(=O)NC1CCC([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000161425537 473234773 /nfs/dbraw/zinc/23/47/73/473234773.db2.gz CAXFTDYTUDVISZ-MWXLCCTBSA-N 1 1 343.515 2.588 20 70 EFIDMO CCCOc1cccc(CCNC(=O)C[N@@H+](C)[C@H]2CCSC2)c1 ZINC000161450675 473236336 /nfs/dbraw/zinc/23/63/36/473236336.db2.gz IFGOGHNOUOCIMT-INIZCTEOSA-N 1 1 336.501 2.571 20 70 EFIDMO O=C(NCC[NH+]1CCN(c2cccc(Cl)c2)CC1)C1CC=CC1 ZINC000161469739 473238403 /nfs/dbraw/zinc/23/84/03/473238403.db2.gz NGUNZKRFMGFIQR-UHFFFAOYSA-N 1 1 333.863 2.544 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+]3CC[C@H](CC)C3)nc(N)c21 ZINC000161509709 473240857 /nfs/dbraw/zinc/24/08/57/473240857.db2.gz CLHJBYJKKGRWKT-NSHDSACASA-N 1 1 332.404 2.522 20 70 EFIDMO C[C@H](c1cccc(Cl)c1)N1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1 ZINC000159365399 473022107 /nfs/dbraw/zinc/02/21/07/473022107.db2.gz GKHRIWUQVPEZQL-CXAGYDPISA-N 1 1 335.879 2.815 20 70 EFIDMO C[C@H](c1cccc(Cl)c1)[NH+]1CCC(N2CCC[C@@H]2C(N)=O)CC1 ZINC000159365399 473022112 /nfs/dbraw/zinc/02/21/12/473022112.db2.gz GKHRIWUQVPEZQL-CXAGYDPISA-N 1 1 335.879 2.815 20 70 EFIDMO Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[NH2+][C@H](C)c1cccc(F)c1F ZINC000159454826 473029962 /nfs/dbraw/zinc/02/99/62/473029962.db2.gz NLMWDZZDAINYNV-MWLCHTKSSA-N 1 1 336.386 2.993 20 70 EFIDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC(c2cc[nH]n2)CC1 ZINC000159460123 473030283 /nfs/dbraw/zinc/03/02/83/473030283.db2.gz BLKMLZPOQOKEFF-QGZVFWFLSA-N 1 1 347.507 2.953 20 70 EFIDMO C[N@@H+](CCCCCn1nnc(-c2ccccc2)n1)C[C@H]1CCC[C@@H]1O ZINC000159455126 473030378 /nfs/dbraw/zinc/03/03/78/473030378.db2.gz BDMGHENSBXNNAW-MSOLQXFVSA-N 1 1 343.475 2.603 20 70 EFIDMO CCN(CC)C(=O)C[N@H+](C)Cc1ccc(C(=O)OC(C)(C)C)cc1 ZINC000159571702 473039862 /nfs/dbraw/zinc/03/98/62/473039862.db2.gz WBYOHRFIEKAUBL-UHFFFAOYSA-N 1 1 334.460 2.942 20 70 EFIDMO CCN(CC)C(=O)C[N@@H+](C)Cc1ccc(C(=O)OC(C)(C)C)cc1 ZINC000159571702 473039869 /nfs/dbraw/zinc/03/98/69/473039869.db2.gz WBYOHRFIEKAUBL-UHFFFAOYSA-N 1 1 334.460 2.942 20 70 EFIDMO Cc1cc(C[N@@H+]2C[C@@H](C(N)=O)CC[C@@H]2C)sc1Br ZINC000159594868 473042185 /nfs/dbraw/zinc/04/21/85/473042185.db2.gz GUXTXRRMIFNVOW-UWVGGRQHSA-N 1 1 331.279 2.905 20 70 EFIDMO CC[N@@H+](CCOc1ccc(Br)cc1)[C@@H](C)C(=O)N(C)C ZINC000159600083 473043123 /nfs/dbraw/zinc/04/31/23/473043123.db2.gz WAUFWUMHYCSNKP-LBPRGKRZSA-N 1 1 343.265 2.627 20 70 EFIDMO O=C(C[N@H+]1CC[C@@H]2CCCC[C@@H]21)Nc1cccc(C(=O)NC2CC2)c1 ZINC000159593223 473043182 /nfs/dbraw/zinc/04/31/82/473043182.db2.gz UQTODJPENMYSPL-KSSFIOAISA-N 1 1 341.455 2.782 20 70 EFIDMO CCC[C@@H]1CN(C(=O)N[C@@H](C)c2ccccc2)CC[N@H+]1CCOC ZINC000159647343 473048004 /nfs/dbraw/zinc/04/80/04/473048004.db2.gz VQLPLEVIHKLAMC-FUHWJXTLSA-N 1 1 333.476 2.890 20 70 EFIDMO COc1ccc(CCNC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cc1OC ZINC000159675429 473051447 /nfs/dbraw/zinc/05/14/47/473051447.db2.gz MBWYUHCUTAAOTP-IRXDYDNUSA-N 1 1 346.471 2.627 20 70 EFIDMO Cc1cc(C)cc(OCC(=O)N2CCN(c3cccc(C)[nH+]3)CC2)c1 ZINC000159695915 473052916 /nfs/dbraw/zinc/05/29/16/473052916.db2.gz TXHAKXDPNSBOOH-UHFFFAOYSA-N 1 1 339.439 2.734 20 70 EFIDMO C[C@H](CNC(=O)N[C@@H]1CCC[C@@H]1c1ccccc1)C[NH+]1CCOCC1 ZINC000159710078 473053650 /nfs/dbraw/zinc/05/36/50/473053650.db2.gz OXASPEAOUMBHQE-BHIYHBOVSA-N 1 1 345.487 2.590 20 70 EFIDMO CCOCCC1(CNC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)CC1 ZINC000159747625 473058428 /nfs/dbraw/zinc/05/84/28/473058428.db2.gz KHIJXBUSDPHYCZ-JKSUJKDBSA-N 1 1 325.497 2.613 20 70 EFIDMO C[N@@H+](C[C@@H]1CCC[C@@H]1O)[C@@H]1CCCN(c2ccccc2Cl)C1=O ZINC000159808949 473062846 /nfs/dbraw/zinc/06/28/46/473062846.db2.gz WCUZOECESZXZAZ-XKQJLSEDSA-N 1 1 336.863 2.928 20 70 EFIDMO C[C@@H](CNC(=O)CCCc1nc(C2CC2)no1)[N@H+]1CCC[C@H](C)C1 ZINC000159873847 473068940 /nfs/dbraw/zinc/06/89/40/473068940.db2.gz ZHTMNHPVQQASFO-KBPBESRZSA-N 1 1 334.464 2.506 20 70 EFIDMO CCCCN(CCCO)C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000159960199 473075534 /nfs/dbraw/zinc/07/55/34/473075534.db2.gz ORFOEBUGBDFVEJ-PKOBYXMFSA-N 1 1 347.503 2.701 20 70 EFIDMO O[C@@H](CNCc1ccc(F)c(Cl)c1)C[N@@H+]1CCc2ccccc2C1 ZINC000159951772 473075558 /nfs/dbraw/zinc/07/55/58/473075558.db2.gz DFGXLCYMNVJGOA-KRWDZBQOSA-N 1 1 348.849 2.988 20 70 EFIDMO O[C@@H](CNCc1ccc(F)c(Cl)c1)C[N@H+]1CCc2ccccc2C1 ZINC000159951772 473075568 /nfs/dbraw/zinc/07/55/68/473075568.db2.gz DFGXLCYMNVJGOA-KRWDZBQOSA-N 1 1 348.849 2.988 20 70 EFIDMO Cc1cccc([C@H]2CCC[N@H+]2CCN2C(=O)c3ccccc3C2=O)n1 ZINC000159968968 473077427 /nfs/dbraw/zinc/07/74/27/473077427.db2.gz HSXNIBJIIBRFFW-GOSISDBHSA-N 1 1 335.407 2.823 20 70 EFIDMO C[C@@H]1C[C@H](NC(=O)NCCOc2ccccc2Cl)C[N@H+]1C1CC1 ZINC000159999444 473080012 /nfs/dbraw/zinc/08/00/12/473080012.db2.gz WEQVMZZNBJZZLC-OLZOCXBDSA-N 1 1 337.851 2.643 20 70 EFIDMO CN(C[C@@H]1CCC[N@@H+](CCOCC2CC2)C1)C(=O)OC(C)(C)C ZINC000160022180 473081192 /nfs/dbraw/zinc/08/11/92/473081192.db2.gz NSKIFQFWBVLUEB-INIZCTEOSA-N 1 1 326.481 2.992 20 70 EFIDMO CCCCCN(CCO)C(=O)N[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000160052487 473083428 /nfs/dbraw/zinc/08/34/28/473083428.db2.gz QXTJJWWMIDGCCW-PKOBYXMFSA-N 1 1 347.503 2.844 20 70 EFIDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)N2CC[C@H](C)[C@@H](C)C2)C[C@H](C)O1 ZINC000160079443 473085176 /nfs/dbraw/zinc/08/51/76/473085176.db2.gz WKUHCCPMLKHMNW-YHUYYLMFSA-N 1 1 325.497 2.562 20 70 EFIDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)N2CC[C@H](C)[C@@H](C)C2)C[C@H](C)O1 ZINC000160079443 473085182 /nfs/dbraw/zinc/08/51/82/473085182.db2.gz WKUHCCPMLKHMNW-YHUYYLMFSA-N 1 1 325.497 2.562 20 70 EFIDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)N2CC[C@H](C)[C@H](C)C2)C[C@H](C)O1 ZINC000160079696 473086122 /nfs/dbraw/zinc/08/61/22/473086122.db2.gz WKUHCCPMLKHMNW-XUWVNRHRSA-N 1 1 325.497 2.562 20 70 EFIDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)N2CC[C@H](C)[C@H](C)C2)C[C@H](C)O1 ZINC000160079696 473086128 /nfs/dbraw/zinc/08/61/28/473086128.db2.gz WKUHCCPMLKHMNW-XUWVNRHRSA-N 1 1 325.497 2.562 20 70 EFIDMO CCC[C@H]1CN(c2nc(C(C)(C)C)ns2)CC[N@H+]1CCOC ZINC000160170494 473093341 /nfs/dbraw/zinc/09/33/41/473093341.db2.gz LENRVFSAHTZHNW-ZDUSSCGKSA-N 1 1 326.510 2.773 20 70 EFIDMO CCC[C@@H]([NH2+][C@@H](C)c1cnccn1)C(=O)N1CCc2sccc2C1 ZINC000160172585 473094010 /nfs/dbraw/zinc/09/40/10/473094010.db2.gz MNNPPLQWZBGHMF-DZGCQCFKSA-N 1 1 344.484 2.942 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1occc1Br ZINC000160583841 473146091 /nfs/dbraw/zinc/14/60/91/473146091.db2.gz KAJJJFARLIALEH-LLVKDONJSA-N 1 1 329.238 2.892 20 70 EFIDMO Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[N@@H+]1CCC[C@H]1C(N)=O ZINC000160317284 473107724 /nfs/dbraw/zinc/10/77/24/473107724.db2.gz PUMSMUNHBMOYSX-INIZCTEOSA-N 1 1 332.835 2.592 20 70 EFIDMO Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[N@H+]1CCC[C@H]1C(N)=O ZINC000160317284 473107731 /nfs/dbraw/zinc/10/77/31/473107731.db2.gz PUMSMUNHBMOYSX-INIZCTEOSA-N 1 1 332.835 2.592 20 70 EFIDMO C[C@@H]1C[C@H](NC(=O)N2CCS[C@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC000160323210 473109012 /nfs/dbraw/zinc/10/90/12/473109012.db2.gz OXUYKWXNPXLRAO-INMHGKMJSA-N 1 1 333.501 2.796 20 70 EFIDMO C[C@@H]1C[C@H](NC(=O)N(C)CCOCC2CC2)C[N@H+]1Cc1ccccc1 ZINC000160337280 473109935 /nfs/dbraw/zinc/10/99/35/473109935.db2.gz HRTJJGPBXPMPAF-APWZRJJASA-N 1 1 345.487 2.717 20 70 EFIDMO COc1cc(C[N@@H+]2CCC[C@@H]2C(N)=O)ccc1OCc1cccs1 ZINC000160350777 473111455 /nfs/dbraw/zinc/11/14/55/473111455.db2.gz XBXKSTUBZPAMKZ-OAHLLOKOSA-N 1 1 346.452 2.785 20 70 EFIDMO COc1cc(C[N@H+]2CCC[C@@H]2C(N)=O)ccc1OCc1cccs1 ZINC000160350777 473111462 /nfs/dbraw/zinc/11/14/62/473111462.db2.gz XBXKSTUBZPAMKZ-OAHLLOKOSA-N 1 1 346.452 2.785 20 70 EFIDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)Nc1ccn(CC(F)(F)F)n1 ZINC000160457077 473127688 /nfs/dbraw/zinc/12/76/88/473127688.db2.gz PIRORZNEIOCCJQ-LBPRGKRZSA-N 1 1 347.385 2.784 20 70 EFIDMO CC(C)NC(=O)c1ccc(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1 ZINC000160460164 473128513 /nfs/dbraw/zinc/12/85/13/473128513.db2.gz WHEFHMMDQIODPD-HOTGVXAUSA-N 1 1 345.487 2.675 20 70 EFIDMO CCC[N@@H+](Cc1ccccc1)Cc1cnc(N2CCN(C)CC2)nc1 ZINC000160478739 473131637 /nfs/dbraw/zinc/13/16/37/473131637.db2.gz KEULPCYLONOVBS-UHFFFAOYSA-N 1 1 339.487 2.641 20 70 EFIDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccn(CC(F)(F)F)n1 ZINC000160497666 473134521 /nfs/dbraw/zinc/13/45/21/473134521.db2.gz UMEJPGRFGBCKCQ-VXGBXAGGSA-N 1 1 347.385 2.687 20 70 EFIDMO Cc1nc2ccccn2c1C[N@@H+]1CCCN(CC(F)(F)F)CC1 ZINC000160524911 473137696 /nfs/dbraw/zinc/13/76/96/473137696.db2.gz APIXGGJYGFDZAS-UHFFFAOYSA-N 1 1 326.366 2.713 20 70 EFIDMO Cc1nc2ccccn2c1C[N@H+]1CCCN(CC(F)(F)F)CC1 ZINC000160524911 473137701 /nfs/dbraw/zinc/13/77/01/473137701.db2.gz APIXGGJYGFDZAS-UHFFFAOYSA-N 1 1 326.366 2.713 20 70 EFIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(-n2cccn2)cc1 ZINC000160558900 473142336 /nfs/dbraw/zinc/14/23/36/473142336.db2.gz SMSCFZKIBPMLKG-GOSISDBHSA-N 1 1 326.444 2.723 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+](C(C)C)C3CC3)nc(N)c21 ZINC000160577273 473144773 /nfs/dbraw/zinc/14/47/73/473144773.db2.gz OBBVLCNDJFAZNG-UHFFFAOYSA-N 1 1 332.404 2.663 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](C(C)C)C3CC3)nc(N)c21 ZINC000160577273 473144782 /nfs/dbraw/zinc/14/47/82/473144782.db2.gz OBBVLCNDJFAZNG-UHFFFAOYSA-N 1 1 332.404 2.663 20 70 EFIDMO CCC(=O)Nc1cccc(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)c1 ZINC000160592530 473147682 /nfs/dbraw/zinc/14/76/82/473147682.db2.gz VUIKERDIVDHVKU-QGZVFWFLSA-N 1 1 331.460 2.885 20 70 EFIDMO CCOC(=O)C[C@H](C)NC(=O)c1ccc(C[N@@H+](CC)C2CC2)cc1 ZINC000160602288 473149635 /nfs/dbraw/zinc/14/96/35/473149635.db2.gz TZGCFIKPUCNCMN-AWEZNQCLSA-N 1 1 332.444 2.742 20 70 EFIDMO C[C@H]1CCC[C@H](C(=O)NCc2ccc(C[NH+]3CCN(C)CC3)cc2)C1 ZINC000160611378 473151219 /nfs/dbraw/zinc/15/12/19/473151219.db2.gz YXHPPRCSQXHUHG-PXNSSMCTSA-N 1 1 343.515 2.877 20 70 EFIDMO CC(C)CC1(C(=O)NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)CCC1 ZINC000160614449 473151765 /nfs/dbraw/zinc/15/17/65/473151765.db2.gz YZPRTYIWFYXPNB-RBUKOAKNSA-N 1 1 344.499 2.954 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+](C)CCC(C)C)nc(N)c21 ZINC000160635788 473154821 /nfs/dbraw/zinc/15/48/21/473154821.db2.gz FFIBANBCJDTITC-UHFFFAOYSA-N 1 1 334.420 2.768 20 70 EFIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](C)CCC(C)C)nc(N)c21 ZINC000160635788 473154826 /nfs/dbraw/zinc/15/48/26/473154826.db2.gz FFIBANBCJDTITC-UHFFFAOYSA-N 1 1 334.420 2.768 20 70 EFIDMO COc1ccccc1CN(C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)C1CC1 ZINC000160657766 473157855 /nfs/dbraw/zinc/15/78/55/473157855.db2.gz OSISZMFQVZIJRD-KRWDZBQOSA-N 1 1 343.471 2.854 20 70 EFIDMO Cc1nc2c(s1)[C@H](N(C)C(=O)N[C@H]1CC[N@@H+](CC3CC3)C1)CCC2 ZINC000160685834 473160595 /nfs/dbraw/zinc/16/05/95/473160595.db2.gz YEWMUTJWTKDOEE-GOEBONIOSA-N 1 1 348.516 2.955 20 70 EFIDMO CCOc1cccc(C[NH+]2CCN(c3cccc(OC)c3)CC2)n1 ZINC000160689066 473162164 /nfs/dbraw/zinc/16/21/64/473162164.db2.gz SLBWMIZWHSRXOP-UHFFFAOYSA-N 1 1 327.428 2.811 20 70 EFIDMO COc1cccc(N2CC[NH+](Cc3cnc4ccc(C)cn34)CC2)c1 ZINC000160698824 473163541 /nfs/dbraw/zinc/16/35/41/473163541.db2.gz INULAKDBRMZEAD-UHFFFAOYSA-N 1 1 336.439 2.974 20 70 EFIDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N(Cc1ccc(F)cc1)C1CC1 ZINC000160719035 473166123 /nfs/dbraw/zinc/16/61/23/473166123.db2.gz RQEMVVDQPWKGEN-KRWDZBQOSA-N 1 1 331.435 2.984 20 70 EFIDMO O=C1CC[C@@H]2C[N@H+](Cc3cccc(F)c3Br)CC[C@H]2N1 ZINC000160738654 473168901 /nfs/dbraw/zinc/16/89/01/473168901.db2.gz ZAWOBEORLAFQPE-ZWNOBZJWSA-N 1 1 341.224 2.689 20 70 EFIDMO O=C1CC[C@@H]2C[N@@H+](Cc3cccc(F)c3Br)CC[C@H]2N1 ZINC000160738654 473168905 /nfs/dbraw/zinc/16/89/05/473168905.db2.gz ZAWOBEORLAFQPE-ZWNOBZJWSA-N 1 1 341.224 2.689 20 70 EFIDMO O=C1CC[C@@H]2C[N@H+](Cc3ccc(Br)cc3F)CC[C@@H]2N1 ZINC000160741413 473169792 /nfs/dbraw/zinc/16/97/92/473169792.db2.gz ZGZTYAQYZDMCEC-RISCZKNCSA-N 1 1 341.224 2.689 20 70 EFIDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(Br)cc3F)CC[C@@H]2N1 ZINC000160741413 473169797 /nfs/dbraw/zinc/16/97/97/473169797.db2.gz ZGZTYAQYZDMCEC-RISCZKNCSA-N 1 1 341.224 2.689 20 70 EFIDMO CCCC[N@H+](CC1=Cc2ccccc2OC1)[C@H]1CCS(=O)(=O)C1 ZINC000160774947 473173279 /nfs/dbraw/zinc/17/32/79/473173279.db2.gz HCTBEGKBCABUKX-KRWDZBQOSA-N 1 1 335.469 2.752 20 70 EFIDMO CCCC[N@@H+](CC1=Cc2ccccc2OC1)[C@H]1CCS(=O)(=O)C1 ZINC000160774947 473173283 /nfs/dbraw/zinc/17/32/83/473173283.db2.gz HCTBEGKBCABUKX-KRWDZBQOSA-N 1 1 335.469 2.752 20 70 EFIDMO CCCC1(CNC(=O)C[C@H]2C[N@H+](Cc3ccccc3)CCO2)CC1 ZINC000160836689 473181246 /nfs/dbraw/zinc/18/12/46/473181246.db2.gz UMYNKZOFQBCMGQ-SFHVURJKSA-N 1 1 330.472 2.974 20 70 EFIDMO CCCC1(CNC(=O)C[C@H]2C[N@@H+](Cc3ccccc3)CCO2)CC1 ZINC000160836689 473181249 /nfs/dbraw/zinc/18/12/49/473181249.db2.gz UMYNKZOFQBCMGQ-SFHVURJKSA-N 1 1 330.472 2.974 20 70 EFIDMO Cc1c(C(=O)NCC[N@@H+]2CCc3sccc3C2)cnn1CC(C)C ZINC000160907755 473189811 /nfs/dbraw/zinc/18/98/11/473189811.db2.gz GMWXBIINKNIDOJ-UHFFFAOYSA-N 1 1 346.500 2.697 20 70 EFIDMO Cc1c(C(=O)NCC[N@H+]2CCc3sccc3C2)cnn1CC(C)C ZINC000160907755 473189815 /nfs/dbraw/zinc/18/98/15/473189815.db2.gz GMWXBIINKNIDOJ-UHFFFAOYSA-N 1 1 346.500 2.697 20 70 EFIDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CC[C@H](Nc2ccccc2)C1 ZINC000160912321 473190982 /nfs/dbraw/zinc/19/09/82/473190982.db2.gz YCDBRLGTYRYUAY-ROUUACIJSA-N 1 1 342.487 2.899 20 70 EFIDMO COC(C[N@@H+](C[C@@H](O)COc1cccc2ccccc21)C(C)C)OC ZINC000160927304 473191884 /nfs/dbraw/zinc/19/18/84/473191884.db2.gz IGQCRZXODVBGDE-QGZVFWFLSA-N 1 1 347.455 2.909 20 70 EFIDMO COc1ccc(CNC(=O)C[NH2+][C@H](C)c2cccnc2Cl)cc1 ZINC000160971907 473195763 /nfs/dbraw/zinc/19/57/63/473195763.db2.gz DMLLROMOPXEJCG-GFCCVEGCSA-N 1 1 333.819 2.711 20 70 EFIDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@H+](Cc2cnc3ccccn23)C1 ZINC000160972658 473196024 /nfs/dbraw/zinc/19/60/24/473196024.db2.gz HVZISDXVMKQIPA-CQSZACIVSA-N 1 1 330.432 2.776 20 70 EFIDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](Cc2cnc3ccccn23)C1 ZINC000160972658 473196027 /nfs/dbraw/zinc/19/60/27/473196027.db2.gz HVZISDXVMKQIPA-CQSZACIVSA-N 1 1 330.432 2.776 20 70 EFIDMO COc1ccc(NC(=O)C2CCN(c3ccc(C)c[nH+]3)CC2)cc1N ZINC000161013686 473199393 /nfs/dbraw/zinc/19/93/93/473199393.db2.gz LJSJYRJPIBOJNF-UHFFFAOYSA-N 1 1 340.427 2.836 20 70 EFIDMO CCOCCCNC(=O)[C@H](C)[NH2+][C@H](CC)c1ccc(F)cc1F ZINC000161017382 473199409 /nfs/dbraw/zinc/19/94/09/473199409.db2.gz BZVLMPCEBSFBAK-BLLLJJGKSA-N 1 1 328.403 2.937 20 70 EFIDMO CC[N@H+](Cc1ccccn1)[C@@H](C)C(=O)NCCOc1cccc(C)c1 ZINC000161037941 473200486 /nfs/dbraw/zinc/20/04/86/473200486.db2.gz RZCQEQFUQZWTHP-KRWDZBQOSA-N 1 1 341.455 2.796 20 70 EFIDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)C(=O)NCCOc1cccc(C)c1 ZINC000161037941 473200488 /nfs/dbraw/zinc/20/04/88/473200488.db2.gz RZCQEQFUQZWTHP-KRWDZBQOSA-N 1 1 341.455 2.796 20 70 EFIDMO COC(=O)c1csc(NC(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)c1 ZINC000161032686 473200802 /nfs/dbraw/zinc/20/08/02/473200802.db2.gz DWRSTMQEOGSSNP-GFCCVEGCSA-N 1 1 339.461 2.634 20 70 EFIDMO CN(C(=O)c1cnn2c1CCCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000217046205 474141434 /nfs/dbraw/zinc/14/14/34/474141434.db2.gz OYDIPWSIFCHZBH-KRWDZBQOSA-N 1 1 338.455 2.566 20 70 EFIDMO CC[C@H](C)[N@@H+](C)CCNCc1cc2c(c(Br)c1)OCO2 ZINC000217375685 474142685 /nfs/dbraw/zinc/14/26/85/474142685.db2.gz MTZIBIFMJBQMOL-NSHDSACASA-N 1 1 343.265 2.998 20 70 EFIDMO CC[C@H](C)N(C)CC[NH2+]Cc1cc2c(c(Br)c1)OCO2 ZINC000217375685 474142689 /nfs/dbraw/zinc/14/26/89/474142689.db2.gz MTZIBIFMJBQMOL-NSHDSACASA-N 1 1 343.265 2.998 20 70 EFIDMO Cc1ccc(CNC(=O)C[N@@H+](C)Cc2cccc(N(C)C)c2)cc1F ZINC000159784429 533985347 /nfs/dbraw/zinc/98/53/47/533985347.db2.gz GLLQKHIAVGSMAB-UHFFFAOYSA-N 1 1 343.446 2.948 20 70 EFIDMO Cc1ccc(CNC(=O)C[N@H+](C)Cc2cccc(N(C)C)c2)cc1F ZINC000159784429 533985357 /nfs/dbraw/zinc/98/53/57/533985357.db2.gz GLLQKHIAVGSMAB-UHFFFAOYSA-N 1 1 343.446 2.948 20 70 EFIDMO C[C@@H](Sc1ccncc1)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159939483 534020403 /nfs/dbraw/zinc/02/04/03/534020403.db2.gz SMIXZKQDIIGHPE-WBVHZDCISA-N 1 1 341.480 2.953 20 70 EFIDMO COc1ccccc1CC[N@@H+](C)[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000159860252 534034907 /nfs/dbraw/zinc/03/49/07/534034907.db2.gz RYDIGLSOCFBYEN-CQSZACIVSA-N 1 1 344.377 2.723 20 70 EFIDMO C[C@@H](CNC(=O)c1cccc(NC(=O)N(C)C)c1)[N@H+]1CCC[C@@H](C)C1 ZINC000159875635 534043905 /nfs/dbraw/zinc/04/39/05/534043905.db2.gz LIEQDPKXWSPKTF-CABCVRRESA-N 1 1 346.475 2.630 20 70 EFIDMO C[C@H]1CC(=O)CC[C@H]1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000159843811 534166230 /nfs/dbraw/zinc/16/62/30/534166230.db2.gz LZEJYCFNHVOYBN-HNAYVOBHSA-N 1 1 328.456 2.556 20 70 EFIDMO O=C(NCCOc1ccccc1Cl)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000159628732 534392135 /nfs/dbraw/zinc/39/21/35/534392135.db2.gz NEVILYFSKWLHFL-CYBMUJFWSA-N 1 1 337.851 2.502 20 70 EFIDMO Cc1nsc(N2CCC[N@@H+](CCC(=O)c3ccc(C)cc3)CC2)n1 ZINC000159856825 534503557 /nfs/dbraw/zinc/50/35/57/534503557.db2.gz XEPPLLNFZUUTHF-UHFFFAOYSA-N 1 1 344.484 2.940 20 70 EFIDMO CC[N@@H+](C[C@@H](O)Cc1ccccc1)C[C@@H]1COc2ccccc2O1 ZINC000218688761 521217242 /nfs/dbraw/zinc/21/72/42/521217242.db2.gz LWMNWGZBKMCQRW-ZWKOTPCHSA-N 1 1 327.424 2.752 20 70 EFIDMO Cc1cccc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c1Br ZINC000160665683 534608379 /nfs/dbraw/zinc/60/83/79/534608379.db2.gz POVBGEMDJJFFHR-GFCCVEGCSA-N 1 1 337.261 2.972 20 70 EFIDMO Cc1cccn2c(=O)cc(C[N@H+](C)Cc3cccc(N(C)C)c3)nc12 ZINC000159761789 534840897 /nfs/dbraw/zinc/84/08/97/534840897.db2.gz RJLVZVIEYIHXIY-UHFFFAOYSA-N 1 1 336.439 2.701 20 70 EFIDMO Cc1nc(CCNC(=O)NCCC[N@@H+]2CCCC[C@H]2C)sc1C ZINC000160792026 526818314 /nfs/dbraw/zinc/81/83/14/526818314.db2.gz BFWULWYCSRKXPL-CYBMUJFWSA-N 1 1 338.521 2.866 20 70 EFIDMO CCC[C@@H]1CN(C(=O)Nc2cccnc2Cl)CC[N@H+]1CCOC ZINC000160005335 527782196 /nfs/dbraw/zinc/78/21/96/527782196.db2.gz AVXXBQBCLPPYIE-CYBMUJFWSA-N 1 1 340.855 2.700 20 70 EFIDMO CCO[C@@H]1C[C@H](NC(=O)[C@H]([NH3+])c2ccccc2OC)C12CCCC2 ZINC000159553443 527929966 /nfs/dbraw/zinc/92/99/66/527929966.db2.gz RSRRENJOUMSGSI-GVDBMIGSSA-N 1 1 332.444 2.549 20 70 EFIDMO CCN(CC)C(=O)[C@@H](C)[N@@H+](CC)CC1CCN(c2ccccn2)CC1 ZINC000160069244 528048619 /nfs/dbraw/zinc/04/86/19/528048619.db2.gz ATOAYDZUFRMTAL-QGZVFWFLSA-N 1 1 346.519 2.877 20 70 EFIDMO CC(C)CNC(=O)c1cccc(CSCC[NH+]2CCOCC2)c1 ZINC000159851709 528062647 /nfs/dbraw/zinc/06/26/47/528062647.db2.gz PEBSSEGHBIGUOP-UHFFFAOYSA-N 1 1 336.501 2.638 20 70 EFIDMO CCC[C@H](CCO)CNC(=O)N[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000159926618 528120549 /nfs/dbraw/zinc/12/05/49/528120549.db2.gz JUUQPQZATCEODD-SCTDSRPQSA-N 1 1 347.503 2.747 20 70 EFIDMO CCC[N@H+]1CC[C@@H](CNC(=O)NCCOc2ccccc2Cl)C1 ZINC000159764588 528253187 /nfs/dbraw/zinc/25/31/87/528253187.db2.gz QSDIMHDYYDHZLD-AWEZNQCLSA-N 1 1 339.867 2.750 20 70 EFIDMO CCNC(=O)c1ccc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)nc1 ZINC000160229027 528259785 /nfs/dbraw/zinc/25/97/85/528259785.db2.gz AKVMQDOFMYBMRK-MAUKXSAKSA-N 1 1 338.455 2.764 20 70 EFIDMO CC[NH2+]CC1CCN(C(=O)[C@@H](c2ccccc2)N(CC)CC)CC1 ZINC000161050398 528286924 /nfs/dbraw/zinc/28/69/24/528286924.db2.gz AKOVJUXMLRMZCP-LJQANCHMSA-N 1 1 331.504 2.918 20 70 EFIDMO CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N3CCC4(CCC4)C3)c2C1 ZINC000159461651 528325908 /nfs/dbraw/zinc/32/59/08/528325908.db2.gz WPCDZTIILLDTJF-UHFFFAOYSA-N 1 1 341.455 2.753 20 70 EFIDMO CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N3CCC4(CCC4)C3)c2C1 ZINC000159461651 528325913 /nfs/dbraw/zinc/32/59/13/528325913.db2.gz WPCDZTIILLDTJF-UHFFFAOYSA-N 1 1 341.455 2.753 20 70 EFIDMO CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@H]1CCN(C(C)C)C1=O ZINC000160024928 528348151 /nfs/dbraw/zinc/34/81/51/528348151.db2.gz RJNYDYFIJXBJTB-SFHVURJKSA-N 1 1 344.503 2.629 20 70 EFIDMO CCCCNC(=O)[C@H](C)[N@@H+](CC)CC1CCN(c2ccccn2)CC1 ZINC000160032813 528536881 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CC[N@H+]1CCCN(C(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)CC1 ZINC000159880139 529024905 /nfs/dbraw/zinc/02/49/05/529024905.db2.gz WKRKVZJTZSTYEE-HOTGVXAUSA-N 1 1 325.497 2.565 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)NCCCCOc2ccc(C)cc2)CC1 ZINC000159640280 529025231 /nfs/dbraw/zinc/02/52/31/529025231.db2.gz KXFFUXXZRLUNKK-UHFFFAOYSA-N 1 1 333.476 2.891 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)CC1 ZINC000159993852 529029835 /nfs/dbraw/zinc/02/98/35/529029835.db2.gz RZVGAVCHMXWQEF-AWEZNQCLSA-N 1 1 343.431 2.535 20 70 EFIDMO CC[N@H+]1CCCN(C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)CC1 ZINC000159994016 529031068 /nfs/dbraw/zinc/03/10/68/529031068.db2.gz RZVGAVCHMXWQEF-CQSZACIVSA-N 1 1 343.431 2.535 20 70 EFIDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1ccc(N(C)C)cc1F)C2 ZINC000159558983 529110990 /nfs/dbraw/zinc/11/09/90/529110990.db2.gz CGBHYIAKMSUKFM-GOEBONIOSA-N 1 1 333.451 2.979 20 70 EFIDMO