smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O[C@]1(C[N@@H+]2CCCN(c3nc4ccc(Cl)cc4s3)CC2)CC[NH2+]C1 ZINC000107116907 206016527 /nfs/dbraw/zinc/01/65/27/206016527.db2.gz DGSDMSJJOCPSNR-QGZVFWFLSA-N 2 1 366.918 2.186 10 0 FEAEMP O[C@]1(C[N@H+]2CCCN(c3nc4ccc(Cl)cc4s3)CC2)CC[NH2+]C1 ZINC000107116907 206016531 /nfs/dbraw/zinc/01/65/31/206016531.db2.gz DGSDMSJJOCPSNR-QGZVFWFLSA-N 2 1 366.918 2.186 10 0 FEAEMP CCN(C)[C@@H](C(=O)N1CCCN(Cc2cnn(C)c2)CC1)c1ccccc1 ZINC000109284697 543319922 /nfs/dbraw/zinc/31/99/22/543319922.db2.gz VXHSOQYINTZGNW-HXUWFJFHSA-N 2 1 369.513 2.147 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N[C@@H]2C[NH+](C(C)C)C[C@H]2C)[C@@H](C)C1 ZINC000247458083 549336402 /nfs/dbraw/zinc/33/64/02/549336402.db2.gz UDTOBGBMGIFMKG-ZSYWTGECSA-N 2 1 368.566 2.151 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@H]2C)[C@@H](C)C1 ZINC000247458083 549336403 /nfs/dbraw/zinc/33/64/03/549336403.db2.gz UDTOBGBMGIFMKG-ZSYWTGECSA-N 2 1 368.566 2.151 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)[C@@H](C)C1 ZINC000247458083 549336404 /nfs/dbraw/zinc/33/64/04/549336404.db2.gz UDTOBGBMGIFMKG-ZSYWTGECSA-N 2 1 368.566 2.151 10 0 FEAEMP Cc1nn(C)c(C)c1[C@H]1CCC[N@H+]1CC(=O)NC1CC[NH+](C(C)C)CC1 ZINC000114456714 543516979 /nfs/dbraw/zinc/51/69/79/543516979.db2.gz CYWMQOLTPWPBMH-GOSISDBHSA-N 2 1 361.534 2.163 10 0 FEAEMP Cc1nn(C)c(C)c1[C@H]1CCC[N@@H+]1CC(=O)NC1CC[NH+](C(C)C)CC1 ZINC000114456714 543516981 /nfs/dbraw/zinc/51/69/81/543516981.db2.gz CYWMQOLTPWPBMH-GOSISDBHSA-N 2 1 361.534 2.163 10 0 FEAEMP CCOCC[N@@H+]1CCN(C(=O)c2cccc(C[NH+]3CCCC3)c2)C[C@@H]1C ZINC000117283509 543627342 /nfs/dbraw/zinc/62/73/42/543627342.db2.gz VTONGSTXYLNDPR-SFHVURJKSA-N 2 1 359.514 2.465 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)c2cccc(C[NH+]3CCCC3)c2)C[C@@H]1C ZINC000117283509 543627348 /nfs/dbraw/zinc/62/73/48/543627348.db2.gz VTONGSTXYLNDPR-SFHVURJKSA-N 2 1 359.514 2.465 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)C[C@H]1C ZINC000117468488 543632385 /nfs/dbraw/zinc/63/23/85/543632385.db2.gz RZKAKYWYWNORFU-QUCCMNQESA-N 2 1 374.529 2.186 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)C[C@H]1C ZINC000117468488 543632388 /nfs/dbraw/zinc/63/23/88/543632388.db2.gz RZKAKYWYWNORFU-QUCCMNQESA-N 2 1 374.529 2.186 10 0 FEAEMP CC[C@H]1CN(C(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)CC[N@H+]1CCOC ZINC000117498713 543634192 /nfs/dbraw/zinc/63/41/92/543634192.db2.gz ZAFGMIRQHHEBRW-IRXDYDNUSA-N 2 1 356.555 2.105 10 0 FEAEMP CC[N@@H+](CC(=O)NC[C@H](c1ccc(C)s1)N1CCOCC1)C1CC1 ZINC000153324755 544761794 /nfs/dbraw/zinc/76/17/94/544761794.db2.gz RWUNOUUTFSNTLU-MRXNPFEDSA-N 2 1 351.516 2.030 10 0 FEAEMP Cc1cccc(C)c1OC[C@@H](O)C[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247537626 549352759 /nfs/dbraw/zinc/35/27/59/549352759.db2.gz CQQWAURZKJSKCS-ICSRJNTNSA-N 2 1 364.530 2.068 10 0 FEAEMP C[C@@H](C[NH+]1CCCCC1)NC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190692748 328225039 /nfs/dbraw/zinc/22/50/39/328225039.db2.gz WYWNCCZSUGKLOH-ICSRJNTNSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[N@@H+](CCNC(=O)N1CC[C@H](C[NH+](C)Cc2cccnc2)C1)C1CC1 ZINC000190705199 328226074 /nfs/dbraw/zinc/22/60/74/328226074.db2.gz NPZPEGVCNKWMDS-GOSISDBHSA-N 2 1 359.518 2.029 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cn(C)nc2-c2ccncc2)CC1 ZINC000121145735 326316680 /nfs/dbraw/zinc/31/66/80/326316680.db2.gz TYEFPKDTQXDGOE-INIZCTEOSA-N 2 1 357.502 2.007 10 0 FEAEMP CCC[C@@H](C(=O)NCCC[NH+]1CCN(Cc2ccccc2)CC1)[NH+](C)C ZINC000161530299 327001861 /nfs/dbraw/zinc/00/18/61/327001861.db2.gz ARFLLSWNBIPLSK-FQEVSTJZSA-N 2 1 360.546 2.041 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@@H]4CCC[N@@H+]4C[C@@H]3C)cc2F)CC1 ZINC000172054659 327178134 /nfs/dbraw/zinc/17/81/34/327178134.db2.gz UKLZJEMYSPZMAL-WMZOPIPTSA-N 2 1 374.504 2.276 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@@H]4CCC[N@H+]4C[C@@H]3C)cc2F)CC1 ZINC000172054659 327178135 /nfs/dbraw/zinc/17/81/35/327178135.db2.gz UKLZJEMYSPZMAL-WMZOPIPTSA-N 2 1 374.504 2.276 10 0 FEAEMP C[C@H](c1ccc(NC(=O)N2CC[N@@H+]3CCC[C@@H]3C2)cc1)[NH+]1CCOCC1 ZINC000172250252 327190250 /nfs/dbraw/zinc/19/02/50/327190250.db2.gz ZPTDTWCTRODVLD-VQIMIIECSA-N 2 1 358.486 2.392 10 0 FEAEMP C[C@H](c1ccc(NC(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc1)[NH+]1CCOCC1 ZINC000172250252 327190251 /nfs/dbraw/zinc/19/02/51/327190251.db2.gz ZPTDTWCTRODVLD-VQIMIIECSA-N 2 1 358.486 2.392 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C[C@H]1C ZINC000172323142 327195741 /nfs/dbraw/zinc/19/57/41/327195741.db2.gz JIFBPBQNXZTVPS-GOSISDBHSA-N 2 1 374.529 2.145 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C[C@H]1C ZINC000172323142 327195742 /nfs/dbraw/zinc/19/57/42/327195742.db2.gz JIFBPBQNXZTVPS-GOSISDBHSA-N 2 1 374.529 2.145 10 0 FEAEMP Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3COCC[NH2+]3)cn2)n1 ZINC000261869087 328825450 /nfs/dbraw/zinc/82/54/50/328825450.db2.gz DAJIJRYSRJOGQT-GUDVDZBRSA-N 2 1 355.486 2.131 10 0 FEAEMP Fc1cccc(F)c1N1CC[C@H]([NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)C1 ZINC000261871752 328825798 /nfs/dbraw/zinc/82/57/98/328825798.db2.gz DFHOCZAOHZECFE-JFTQMJAMSA-N 2 1 351.441 2.290 10 0 FEAEMP Cn1cc([C@H]2CC[NH+](CCCC[N@@H+]3CC[C@H](c4cnn(C)c4)C3)C2)cn1 ZINC000158414561 545857481 /nfs/dbraw/zinc/85/74/81/545857481.db2.gz LPAKCHZRANQZAH-ROUUACIJSA-N 2 1 356.518 2.213 10 0 FEAEMP Cc1ccccc1Cc1noc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000175648254 546327189 /nfs/dbraw/zinc/32/71/89/546327189.db2.gz QZJCVTCAIUBXFC-QGZVFWFLSA-N 2 1 372.513 2.493 10 0 FEAEMP Cc1ccccc1Cc1noc(C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000175648254 546327192 /nfs/dbraw/zinc/32/71/92/546327192.db2.gz QZJCVTCAIUBXFC-QGZVFWFLSA-N 2 1 372.513 2.493 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCC[NH+](C)Cc1ccc(F)cc1 ZINC000175946724 546377718 /nfs/dbraw/zinc/37/77/18/546377718.db2.gz SQEXDJWEWKLPQG-GOSISDBHSA-N 2 1 350.482 2.383 10 0 FEAEMP CC[NH+]1CCC[C@@H]1CN(C)C(=O)NCC[N@H+](C)Cc1ccc(F)cc1 ZINC000175946724 546377721 /nfs/dbraw/zinc/37/77/21/546377721.db2.gz SQEXDJWEWKLPQG-GOSISDBHSA-N 2 1 350.482 2.383 10 0 FEAEMP CC[NH+]1CCC[C@@H]1CN(C)C(=O)NCC[N@@H+](C)Cc1ccc(F)cc1 ZINC000175946724 546377724 /nfs/dbraw/zinc/37/77/24/546377724.db2.gz SQEXDJWEWKLPQG-GOSISDBHSA-N 2 1 350.482 2.383 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@H]3CCC[NH+]3CC)c2C1 ZINC000176894037 546503208 /nfs/dbraw/zinc/50/32/08/546503208.db2.gz XKNPRHXENDJTMM-QGZVFWFLSA-N 2 1 372.513 2.293 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@H]3CCC[NH+]3CC)c2C1 ZINC000176894037 546503210 /nfs/dbraw/zinc/50/32/10/546503210.db2.gz XKNPRHXENDJTMM-QGZVFWFLSA-N 2 1 372.513 2.293 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@H]3CCC[N@@H+]3CC)c2C1 ZINC000176894037 546503214 /nfs/dbraw/zinc/50/32/14/546503214.db2.gz XKNPRHXENDJTMM-QGZVFWFLSA-N 2 1 372.513 2.293 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@H]3CCC[N@H+]3CC)c2C1 ZINC000176894037 546503217 /nfs/dbraw/zinc/50/32/17/546503217.db2.gz XKNPRHXENDJTMM-QGZVFWFLSA-N 2 1 372.513 2.293 10 0 FEAEMP CCc1nnc(C[N@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)[nH]1 ZINC000181690011 547361431 /nfs/dbraw/zinc/36/14/31/547361431.db2.gz KXPQDRPMCRMVOQ-GOSISDBHSA-N 2 1 357.502 2.245 10 0 FEAEMP CCc1nnc(C[N@@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)[nH]1 ZINC000181690011 547361434 /nfs/dbraw/zinc/36/14/34/547361434.db2.gz KXPQDRPMCRMVOQ-GOSISDBHSA-N 2 1 357.502 2.245 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(N2CCOCC2)nc1C ZINC000182077330 547433537 /nfs/dbraw/zinc/43/35/37/547433537.db2.gz AAJOEPJQBOOWOV-DLBZAZTESA-N 2 1 373.501 2.317 10 0 FEAEMP Cc1ncsc1CN(C)C[C@@H]1CC[N@@H+](C[C@H](O)COC(C)(C)C)C1 ZINC000195266920 548607354 /nfs/dbraw/zinc/60/73/54/548607354.db2.gz WBJWVBLPTHMLSW-HOTGVXAUSA-N 2 1 355.548 2.381 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CC[NH+](C)CC2)c1 ZINC000245413647 548911430 /nfs/dbraw/zinc/91/14/30/548911430.db2.gz BQADEWOKPAUVSK-RTWAWAEBSA-N 2 1 370.541 2.133 10 0 FEAEMP CNC(=O)c1cccc(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000245962179 549028165 /nfs/dbraw/zinc/02/81/65/549028165.db2.gz SPHYXGNGRKFNQU-RDTXWAMCSA-N 2 1 369.469 2.043 10 0 FEAEMP CNC(=O)c1cccc(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000245962179 549028169 /nfs/dbraw/zinc/02/81/69/549028169.db2.gz SPHYXGNGRKFNQU-RDTXWAMCSA-N 2 1 369.469 2.043 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC1CC[NH+](Cc2ccccn2)CC1 ZINC000246111597 549054467 /nfs/dbraw/zinc/05/44/67/549054467.db2.gz HVBWHOCHEMFVRK-UXHICEINSA-N 2 1 371.529 2.314 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000246116881 549055663 /nfs/dbraw/zinc/05/56/63/549055663.db2.gz IDMWMJWTGRXABJ-WNRNVDISSA-N 2 1 366.550 2.142 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000246116881 549055668 /nfs/dbraw/zinc/05/56/68/549055668.db2.gz IDMWMJWTGRXABJ-WNRNVDISSA-N 2 1 366.550 2.142 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000246724174 549196823 /nfs/dbraw/zinc/19/68/23/549196823.db2.gz AGNHEQQHVDWTAN-OLMNPRSZSA-N 2 1 350.482 2.456 10 0 FEAEMP Cn1cc([C@@H]2CC[NH+](CCCC[N@@H+]3CC[C@@H](c4cnn(C)c4)C3)C2)cn1 ZINC000246977350 549255564 /nfs/dbraw/zinc/25/55/64/549255564.db2.gz LPAKCHZRANQZAH-QZTJIDSGSA-N 2 1 356.518 2.213 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C)C(=O)N(C)Cc2ccccc2)CC1 ZINC000247605809 549366143 /nfs/dbraw/zinc/36/61/43/549366143.db2.gz LPUURABJVNXLIM-QZTJIDSGSA-N 2 1 361.530 2.058 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2ccc(C[NH+]3CCC(CO)CC3)cc2)C1 ZINC000247800534 549381063 /nfs/dbraw/zinc/38/10/63/549381063.db2.gz UYFVPONQXJKIKF-LAUBAEHRSA-N 2 1 373.541 2.349 10 0 FEAEMP C[C@H](C(=O)N[C@@H](C)c1ccccc1)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247807959 549383477 /nfs/dbraw/zinc/38/34/77/549383477.db2.gz TYFBZETYNLMBLR-OKZBNKHCSA-N 2 1 361.530 2.277 10 0 FEAEMP c1nc2n(n1)C[C@@H]([NH2+][C@H]1CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]31)CC2 ZINC000248411166 549431919 /nfs/dbraw/zinc/43/19/19/549431919.db2.gz YYIZJBVCOGJZGD-MUGJNUQGSA-N 2 1 351.498 2.483 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N3C[C@@H]4CCC[NH+]4C[C@H]3C)c2C1 ZINC000249169949 549564881 /nfs/dbraw/zinc/56/48/81/549564881.db2.gz LAPXUYRBTYBWPR-WBVHZDCISA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N3C[C@@H]4CCC[NH+]4C[C@H]3C)c2C1 ZINC000249169949 549564884 /nfs/dbraw/zinc/56/48/84/549564884.db2.gz LAPXUYRBTYBWPR-WBVHZDCISA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N3C[C@@H]4CCC[N@@H+]4C[C@H]3C)c2C1 ZINC000249169949 549564888 /nfs/dbraw/zinc/56/48/88/549564888.db2.gz LAPXUYRBTYBWPR-WBVHZDCISA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N3C[C@@H]4CCC[N@H+]4C[C@H]3C)c2C1 ZINC000249169949 549564892 /nfs/dbraw/zinc/56/48/92/549564892.db2.gz LAPXUYRBTYBWPR-WBVHZDCISA-N 2 1 370.497 2.046 10 0 FEAEMP COC1CC[NH+](C2(CN[C@@H]3CCC[C@H]3[C@H]3COCC[NH2+]3)CCCC2)CC1 ZINC000261886631 549765788 /nfs/dbraw/zinc/76/57/88/549765788.db2.gz FYXOLDNNEWCIRX-VAMGGRTRSA-N 3 1 365.562 2.157 10 0 FEAEMP c1sc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)nc1-c1ccncc1 ZINC000261985669 549777257 /nfs/dbraw/zinc/77/72/57/549777257.db2.gz SAWCEOHVZQWFAP-ZACQAIPSSA-N 2 1 358.511 2.494 10 0 FEAEMP CC[C@@H]1CCCCN1C(=O)[C@H](C)[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000106126560 543204306 /nfs/dbraw/zinc/20/43/06/543204306.db2.gz GUSGBMIIHABZFG-ZIFCJYIRSA-N 2 1 353.551 2.191 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(OCCC[NH+](C)C)cc1 ZINC000113614709 543492793 /nfs/dbraw/zinc/49/27/93/543492793.db2.gz NSCWBESUHGRISF-PKOBYXMFSA-N 2 1 374.529 2.395 10 0 FEAEMP CCCC[NH+]1CCC(NC(=O)N2CC[N@@H+](CCOCC)[C@@H](CC)C2)CC1 ZINC000117042103 543621477 /nfs/dbraw/zinc/62/14/77/543621477.db2.gz OWEIEZPCIWRPDC-IBGZPJMESA-N 2 1 368.566 2.393 10 0 FEAEMP COc1ccccc1[C@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)[NH+]1CCCC1 ZINC000247496883 549345159 /nfs/dbraw/zinc/34/51/59/549345159.db2.gz MSFFBQLKUAYRGU-HKUYNNGSSA-N 2 1 372.513 2.322 10 0 FEAEMP CC[N@@H+](CC(=O)NC[C@H](c1cccs1)N1CCO[C@H](C)C1)C1CC1 ZINC000153326224 544761449 /nfs/dbraw/zinc/76/14/49/544761449.db2.gz DYDFACBFRVKYFA-GDBMZVCRSA-N 2 1 351.516 2.110 10 0 FEAEMP CCN(CC(=O)NC[C@H](c1cccs1)N1CCO[C@H](C)C1)C1CC1 ZINC000153326224 544761452 /nfs/dbraw/zinc/76/14/52/544761452.db2.gz DYDFACBFRVKYFA-GDBMZVCRSA-N 2 1 351.516 2.110 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)NC(=O)NC1CCCCC1 ZINC000154539927 544918491 /nfs/dbraw/zinc/91/84/91/544918491.db2.gz CDUSFBCHLUNBRB-YOEHRIQHSA-N 2 1 361.490 2.203 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@@H](C)C(=O)NC(=O)NC1CCCCC1 ZINC000154539927 544918492 /nfs/dbraw/zinc/91/84/92/544918492.db2.gz CDUSFBCHLUNBRB-YOEHRIQHSA-N 2 1 361.490 2.203 10 0 FEAEMP CC[C@H](C)[C@@H]([NH3+])C(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1 ZINC000236924551 328498292 /nfs/dbraw/zinc/49/82/92/328498292.db2.gz XIUQYNDHZFYXDX-HNAYVOBHSA-N 2 1 358.486 2.285 10 0 FEAEMP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000119428725 326161776 /nfs/dbraw/zinc/16/17/76/326161776.db2.gz YWTSBWBHGMYLIZ-UXHICEINSA-N 2 1 359.514 2.124 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000119428725 326161778 /nfs/dbraw/zinc/16/17/78/326161778.db2.gz YWTSBWBHGMYLIZ-UXHICEINSA-N 2 1 359.514 2.124 10 0 FEAEMP CC(C)C[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000119428725 326161783 /nfs/dbraw/zinc/16/17/83/326161783.db2.gz YWTSBWBHGMYLIZ-UXHICEINSA-N 2 1 359.514 2.124 10 0 FEAEMP CC(C)C[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000119428725 326161785 /nfs/dbraw/zinc/16/17/85/326161785.db2.gz YWTSBWBHGMYLIZ-UXHICEINSA-N 2 1 359.514 2.124 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)c2ccc(C[NH+]3CCC(CO)CC3)cc2)C1 ZINC000163511408 327053330 /nfs/dbraw/zinc/05/33/30/327053330.db2.gz HSOMWJDYGJKZDM-HXUWFJFHSA-N 2 1 359.514 2.105 10 0 FEAEMP [NH3+][C@@H]1CC[C@H](C(=O)Nc2ccc3c(ccn3CC[NH+]3CCOCC3)c2)C1 ZINC000166162175 327080957 /nfs/dbraw/zinc/08/09/57/327080957.db2.gz DYUCAKRGPSRIAI-DLBZAZTESA-N 2 1 356.470 2.039 10 0 FEAEMP CCOc1cc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2O)ccc1OCc1ccccc1 ZINC000263293435 328931102 /nfs/dbraw/zinc/93/11/02/328931102.db2.gz VYPNMYSHDAJZST-RTBURBONSA-N 2 1 356.466 2.334 10 0 FEAEMP COc1cc(OC)cc(Oc2ccc(C[NH2+]C[C@H]3C[NH2+]C[C@@H]3O)cc2)c1 ZINC000263298491 328931346 /nfs/dbraw/zinc/93/13/46/328931346.db2.gz WROLZOJVDALVQS-YWZLYKJASA-N 2 1 358.438 2.166 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N(C)C[C@H]1CCC[N@@H+]1CC)[NH+]1CCOCC1 ZINC000177344731 546597968 /nfs/dbraw/zinc/59/79/68/546597968.db2.gz SDFAQGQOQOGGAO-MOPGFXCFSA-N 2 1 368.566 2.249 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N(C)C[C@H]1CCC[N@H+]1CC)[NH+]1CCOCC1 ZINC000177344731 546597974 /nfs/dbraw/zinc/59/79/74/546597974.db2.gz SDFAQGQOQOGGAO-MOPGFXCFSA-N 2 1 368.566 2.249 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCc1ccc(OCC[NH+](C)C)cc1 ZINC000177389959 546606661 /nfs/dbraw/zinc/60/66/61/546606661.db2.gz IUBWOXDUEMPHDM-SFHVURJKSA-N 2 1 362.518 2.253 10 0 FEAEMP C[N@@H+](CCCN1CC[NH+](C)CC1)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000182955830 547578923 /nfs/dbraw/zinc/57/89/23/547578923.db2.gz KJUUMVCJTMXUFG-SFHVURJKSA-N 2 1 364.921 2.402 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)Nc2ccccc2CN2CCOCC2)C1 ZINC000246272163 549093707 /nfs/dbraw/zinc/09/37/07/549093707.db2.gz ARTASOPGTDHLEL-VQIMIIECSA-N 2 1 360.502 2.369 10 0 FEAEMP C[C@H](CNC(=O)N1CC[N@H+]2CCCC[C@H]2C1)[NH+]1CCc2ccccc2C1 ZINC000246360679 549113553 /nfs/dbraw/zinc/11/35/53/549113553.db2.gz FCZCDNIKXZFHAK-XLIONFOSSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H](CNC(=O)N1CC[NH+]2CCCC[C@H]2C1)[N@@H+]1CCc2ccccc2C1 ZINC000246360679 549113557 /nfs/dbraw/zinc/11/35/57/549113557.db2.gz FCZCDNIKXZFHAK-XLIONFOSSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H](CNC(=O)N1CC[NH+]2CCCC[C@H]2C1)[N@H+]1CCc2ccccc2C1 ZINC000246360679 549113562 /nfs/dbraw/zinc/11/35/62/549113562.db2.gz FCZCDNIKXZFHAK-XLIONFOSSA-N 2 1 356.514 2.313 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000247115340 549285623 /nfs/dbraw/zinc/28/56/23/549285623.db2.gz RKAFRKQFAJUTNZ-RHSMWYFYSA-N 2 1 355.442 2.393 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000247115340 549285628 /nfs/dbraw/zinc/28/56/28/549285628.db2.gz RKAFRKQFAJUTNZ-RHSMWYFYSA-N 2 1 355.442 2.393 10 0 FEAEMP C[C@H]([NH2+][C@H](CO)c1ccccc1)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000248461302 549444323 /nfs/dbraw/zinc/44/43/23/549444323.db2.gz XHSWIYAXYUGLHW-IOMROCGXSA-N 2 1 367.493 2.089 10 0 FEAEMP C[C@H]([NH2+][C@H](CO)c1ccccc1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248461302 549444329 /nfs/dbraw/zinc/44/43/29/549444329.db2.gz XHSWIYAXYUGLHW-IOMROCGXSA-N 2 1 367.493 2.089 10 0 FEAEMP Cc1ccc(C[N@@H+]2CCCN(C(=O)C[NH2+][C@H](C)[C@H]3CCCO3)CC2)cc1 ZINC000248595292 549465091 /nfs/dbraw/zinc/46/50/91/549465091.db2.gz MFWGPXXBBUWAQP-UYAOXDASSA-N 2 1 359.514 2.186 10 0 FEAEMP C([NH2+][C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1)C1(CN2CCOCC2)CCCCC1 ZINC000261841243 549761614 /nfs/dbraw/zinc/76/16/14/549761614.db2.gz AIQSDUOPEXKVDN-VAMGGRTRSA-N 2 1 365.562 2.016 10 0 FEAEMP Cc1csc2nc(C[N@H+]3C[C@@H](C[NH3+])[C@H](c4ccccc4)C3)cc(=O)n12 ZINC000261879062 549765292 /nfs/dbraw/zinc/76/52/92/549765292.db2.gz YILSNCKNJFZVRX-WBVHZDCISA-N 2 1 354.479 2.239 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000263245651 549888877 /nfs/dbraw/zinc/88/88/77/549888877.db2.gz PERICHAMIBBZOJ-RHSMWYFYSA-N 2 1 354.479 2.271 10 0 FEAEMP CC[NH+](CC(=O)[O-])C1CC(N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000263528518 549906874 /nfs/dbraw/zinc/90/68/74/549906874.db2.gz VHNVWUJWZHWNLG-OVZGMEQFSA-N 2 1 359.514 2.424 10 0 FEAEMP CC[NH+](CC(=O)[O-])C1CC(N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000263528518 549906876 /nfs/dbraw/zinc/90/68/76/549906876.db2.gz VHNVWUJWZHWNLG-OVZGMEQFSA-N 2 1 359.514 2.424 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)Nc2cccc(Cl)c2)CC1 ZINC000106126275 543204559 /nfs/dbraw/zinc/20/45/59/543204559.db2.gz HPBOUGJIOMIDCV-AWEZNQCLSA-N 2 1 353.894 2.303 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N[C@@H](C)c2ccccc2)CC1 ZINC000106126700 543204705 /nfs/dbraw/zinc/20/47/05/543204705.db2.gz TYFBZETYNLMBLR-BZSNNMDCSA-N 2 1 361.530 2.277 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)C[C@H]1C ZINC000117478768 543632931 /nfs/dbraw/zinc/63/29/31/543632931.db2.gz SQEGLHHFMMXIKY-GUDVDZBRSA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)C[C@H]1C ZINC000117478768 543632935 /nfs/dbraw/zinc/63/29/35/543632935.db2.gz SQEGLHHFMMXIKY-GUDVDZBRSA-N 2 1 368.566 2.107 10 0 FEAEMP CC(C)[NH+]1CCC(C(=O)N2CC[C@H](C[N@@H+](C)Cc3cccnc3)C2)CC1 ZINC000190591777 328218410 /nfs/dbraw/zinc/21/84/10/328218410.db2.gz JKFKJMZMBGCORG-LJQANCHMSA-N 2 1 358.530 2.482 10 0 FEAEMP C[N@H+](CC(=O)OC(C)(C)C)C1CCN(C(=O)c2ccc3nccn3c2)CC1 ZINC000191909195 328288219 /nfs/dbraw/zinc/28/82/19/328288219.db2.gz GBUHTRNZSFIDSW-UHFFFAOYSA-N 2 1 372.469 2.212 10 0 FEAEMP C[N@@H+](CC(=O)OC(C)(C)C)C1CCN(C(=O)c2ccc3nccn3c2)CC1 ZINC000191909195 328288220 /nfs/dbraw/zinc/28/82/20/328288220.db2.gz GBUHTRNZSFIDSW-UHFFFAOYSA-N 2 1 372.469 2.212 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N[C@@H]2C[NH+](C(C)C)C[C@@H]2C)[C@H](C)C1 ZINC000120875357 326295440 /nfs/dbraw/zinc/29/54/40/326295440.db2.gz UDTOBGBMGIFMKG-YDZRNGNQSA-N 2 1 368.566 2.151 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)[C@H](C)C1 ZINC000120875357 326295441 /nfs/dbraw/zinc/29/54/41/326295441.db2.gz UDTOBGBMGIFMKG-YDZRNGNQSA-N 2 1 368.566 2.151 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)[C@H](C)C1 ZINC000120875357 326295442 /nfs/dbraw/zinc/29/54/42/326295442.db2.gz UDTOBGBMGIFMKG-YDZRNGNQSA-N 2 1 368.566 2.151 10 0 FEAEMP CCC[C@H](C(=O)NCC1CC[NH+](Cc2nc(C)c(C)o2)CC1)[NH+](C)C ZINC000162106704 327017108 /nfs/dbraw/zinc/01/71/08/327017108.db2.gz GJDPTBYNWIVABS-QGZVFWFLSA-N 2 1 350.507 2.350 10 0 FEAEMP O=C(NCC1CC[NH+](Cc2ccccc2)CC1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000171904695 327169454 /nfs/dbraw/zinc/16/94/54/327169454.db2.gz YHHVWDOEIMFWAJ-FQEVSTJZSA-N 2 1 356.514 2.388 10 0 FEAEMP CC[C@H]1CN(C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@H+]1C[C@@H](C)O ZINC000174623553 327339456 /nfs/dbraw/zinc/33/94/56/327339456.db2.gz JLPYUKYLCROOED-XLIONFOSSA-N 2 1 359.514 2.200 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)C[C@@H]2CCC[C@H]2[NH3+])C[C@@H](C)O1 ZINC000261841388 328823533 /nfs/dbraw/zinc/82/35/33/328823533.db2.gz UZQNUXBDCVMJOU-PDOICOKGSA-N 2 1 359.514 2.430 10 0 FEAEMP Clc1cccnc1N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)C1 ZINC000261903304 328828325 /nfs/dbraw/zinc/82/83/25/328828325.db2.gz HXTYGLVSBSOOSU-DIECFANBSA-N 2 1 350.894 2.060 10 0 FEAEMP COc1cc(C[NH2+]C[C@H]2C[NH2+]C[C@H]2O)ccc1OCc1ccc(F)cc1 ZINC000263224685 328926663 /nfs/dbraw/zinc/92/66/63/328926663.db2.gz MPPKELOYJLIRGM-FUHWJXTLSA-N 2 1 360.429 2.083 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000175965059 546380617 /nfs/dbraw/zinc/38/06/17/546380617.db2.gz VIWWEQKAHFYCGS-IBGZPJMESA-N 2 1 355.486 2.498 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCC[N@H+](C)Cc1ccccc1 ZINC000175965059 546380621 /nfs/dbraw/zinc/38/06/21/546380621.db2.gz VIWWEQKAHFYCGS-IBGZPJMESA-N 2 1 355.486 2.498 10 0 FEAEMP CC[N@@H+]1CCC[C@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000194354505 548469710 /nfs/dbraw/zinc/46/97/10/548469710.db2.gz UJDSJWRHCSMZRP-IBGZPJMESA-N 2 1 360.502 2.167 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000194354505 548469711 /nfs/dbraw/zinc/46/97/11/548469711.db2.gz UJDSJWRHCSMZRP-IBGZPJMESA-N 2 1 360.502 2.167 10 0 FEAEMP Cc1cccc(CNC(=O)CN2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)c1 ZINC000195271204 548607527 /nfs/dbraw/zinc/60/75/27/548607527.db2.gz RCCLTCMTJCUSTK-NRFANRHFSA-N 2 1 366.509 2.460 10 0 FEAEMP c1ccc(CN2CC[N@H+]3CCC[C@H]3C2)c(CN2CC[NH+]3CCC[C@H]3C2)c1 ZINC000245896123 549013092 /nfs/dbraw/zinc/01/30/92/549013092.db2.gz SLDXHXACUKOAOZ-VXKWHMMOSA-N 2 1 354.542 2.247 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@@H](C)C1 ZINC000246116893 549055549 /nfs/dbraw/zinc/05/55/49/549055549.db2.gz IDMWMJWTGRXABJ-XDNAFOTISA-N 2 1 366.550 2.142 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@@H](C)C1 ZINC000246116893 549055554 /nfs/dbraw/zinc/05/55/54/549055554.db2.gz IDMWMJWTGRXABJ-XDNAFOTISA-N 2 1 366.550 2.142 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000246116893 549055558 /nfs/dbraw/zinc/05/55/58/549055558.db2.gz IDMWMJWTGRXABJ-XDNAFOTISA-N 2 1 366.550 2.142 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000246116893 549055563 /nfs/dbraw/zinc/05/55/63/549055563.db2.gz IDMWMJWTGRXABJ-XDNAFOTISA-N 2 1 366.550 2.142 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@H]2CC[NH+](CC(C)C)C2)C[C@H]1CC ZINC000246601845 549171902 /nfs/dbraw/zinc/17/19/02/549171902.db2.gz ZPNXTTFFAXVQRB-RTBURBONSA-N 2 1 368.566 2.107 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)C[C@H]1CC ZINC000246601845 549171903 /nfs/dbraw/zinc/17/19/03/549171903.db2.gz ZPNXTTFFAXVQRB-RTBURBONSA-N 2 1 368.566 2.107 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)C[C@H]1CC ZINC000246601845 549171905 /nfs/dbraw/zinc/17/19/05/549171905.db2.gz ZPNXTTFFAXVQRB-RTBURBONSA-N 2 1 368.566 2.107 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(OCC[NH+](C)C)cc1 ZINC000247245953 549305998 /nfs/dbraw/zinc/30/59/98/549305998.db2.gz NHKUNCHTTIRYHT-AEFFLSMTSA-N 2 1 360.502 2.005 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N[C@@H]3C[N@H+](C(C)C)C[C@H]3C)cc2)CC1 ZINC000247337087 549321607 /nfs/dbraw/zinc/32/16/07/549321607.db2.gz NGZIYUVXZPIGBF-YLJYHZDGSA-N 2 1 358.530 2.287 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCCC[NH+]2CCCCC2)CC[N@H+]1C[C@H](C)O ZINC000248484258 549448906 /nfs/dbraw/zinc/44/89/06/549448906.db2.gz JXNPIKGQOOJLHN-RBUKOAKNSA-N 2 1 368.566 2.129 10 0 FEAEMP O=C1CCCN1Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1 ZINC000261938516 549771902 /nfs/dbraw/zinc/77/19/02/549771902.db2.gz MPBMSLMPKKPKSZ-ZCNNSNEGSA-N 2 1 357.498 2.056 10 0 FEAEMP O=C(Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c1)[C@@H]1CCCO1 ZINC000262016363 549780501 /nfs/dbraw/zinc/78/05/01/549780501.db2.gz WCHBPIDEHZITOK-NMLBUPMWSA-N 2 1 373.497 2.051 10 0 FEAEMP O[C@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000263164827 549882905 /nfs/dbraw/zinc/88/29/05/549882905.db2.gz FCSUOHGFLAHMBK-FZMZJTMJSA-N 2 1 368.300 2.243 10 0 FEAEMP O=C([O-])C[N@H+](CC1CC1)C1CC([NH2+]Cc2ccc(-n3ccnc3)cc2)C1 ZINC000263529062 549906949 /nfs/dbraw/zinc/90/69/49/549906949.db2.gz VNEFIZZCAZVOJC-UHFFFAOYSA-N 2 1 354.454 2.290 10 0 FEAEMP O=C([O-])C[N@@H+](CC1CC1)C1CC([NH2+]Cc2ccc(-n3ccnc3)cc2)C1 ZINC000263529062 549906951 /nfs/dbraw/zinc/90/69/51/549906951.db2.gz VNEFIZZCAZVOJC-UHFFFAOYSA-N 2 1 354.454 2.290 10 0 FEAEMP CC[NH+](CC(=O)[O-])C1CC(N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000263528513 549907290 /nfs/dbraw/zinc/90/72/90/549907290.db2.gz VHNVWUJWZHWNLG-FVPXHTFXSA-N 2 1 359.514 2.424 10 0 FEAEMP CC[NH+](CC(=O)[O-])C1CC(N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000263528513 549907294 /nfs/dbraw/zinc/90/72/94/549907294.db2.gz VHNVWUJWZHWNLG-FVPXHTFXSA-N 2 1 359.514 2.424 10 0 FEAEMP Cc1cc(NC[C@@H](O)C[NH+]2CCOCC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000301703743 553673071 /nfs/dbraw/zinc/67/30/71/553673071.db2.gz APEYGCXRKAYMEJ-CYBMUJFWSA-N 2 1 367.396 2.250 10 0 FEAEMP O[C@H](C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CCCO1)COCc1ccco1 ZINC000390985670 558613038 /nfs/dbraw/zinc/61/30/38/558613038.db2.gz XSABQFMTYHTCEF-TZIWHRDSSA-N 2 1 374.481 2.038 10 0 FEAEMP O[C@H](C[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)COCc1ccco1 ZINC000390985670 558613040 /nfs/dbraw/zinc/61/30/40/558613040.db2.gz XSABQFMTYHTCEF-TZIWHRDSSA-N 2 1 374.481 2.038 10 0 FEAEMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000638804399 677150379 /nfs/dbraw/zinc/15/03/79/677150379.db2.gz UJCXINKZEMOQLN-BZUAXINKSA-N 2 1 355.404 2.023 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)[NH+](C)C)c1 ZINC000105083149 543157721 /nfs/dbraw/zinc/15/77/21/543157721.db2.gz ZXROHYIWHWSEAP-MJGOQNOKSA-N 2 1 360.502 2.178 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(OCC[NH+](C)C)cc1 ZINC000113589091 543491320 /nfs/dbraw/zinc/49/13/20/543491320.db2.gz NHKUNCHTTIRYHT-FUHWJXTLSA-N 2 1 360.502 2.005 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)C[C@@H]1C ZINC000117478076 543633353 /nfs/dbraw/zinc/63/33/53/543633353.db2.gz WRDREYKDDUFAHW-ICSRJNTNSA-N 2 1 374.529 2.186 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)C[C@@H]1C ZINC000117478076 543633357 /nfs/dbraw/zinc/63/33/57/543633357.db2.gz WRDREYKDDUFAHW-ICSRJNTNSA-N 2 1 374.529 2.186 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc2c(c1)OCO2 ZINC000154589182 544924860 /nfs/dbraw/zinc/92/48/60/544924860.db2.gz YCBANVIDIVANHF-BBRMVZONSA-N 2 1 356.426 2.412 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1ccc2c(c1)OCO2 ZINC000154589182 544924866 /nfs/dbraw/zinc/92/48/66/544924866.db2.gz YCBANVIDIVANHF-BBRMVZONSA-N 2 1 356.426 2.412 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N(C)C2CCCCC2)CC1 ZINC000155108086 544990739 /nfs/dbraw/zinc/99/07/39/544990739.db2.gz LDXIUOWRJIYHNX-SJORKVTESA-N 2 1 353.551 2.191 10 0 FEAEMP Cn1nccc1C1CC[NH+](CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)CC1 ZINC000184960240 327892019 /nfs/dbraw/zinc/89/20/19/327892019.db2.gz CLQPEDZRMOYFNO-FQEVSTJZSA-N 2 1 369.513 2.019 10 0 FEAEMP [NH3+][C@@H]1CCC[C@H](C(=O)Nc2ccc3c(ccn3CC[NH+]3CCOCC3)c2)C1 ZINC000166162910 327081084 /nfs/dbraw/zinc/08/10/84/327081084.db2.gz AVQMVYCUZUXTPR-ZWKOTPCHSA-N 2 1 370.497 2.430 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@H]4CCC[N@H+]4C[C@@H]3C)cc2)CC1 ZINC000173749309 327281079 /nfs/dbraw/zinc/28/10/79/327281079.db2.gz ZTUKICSSBPCZIX-FXAWDEMLSA-N 2 1 356.514 2.137 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1cccc(OCC[NH+](C)C)c1 ZINC000173755010 327281524 /nfs/dbraw/zinc/28/15/24/327281524.db2.gz DOHPLVYFJRZRCH-RTBURBONSA-N 2 1 374.529 2.395 10 0 FEAEMP CC(C)[C@@H](C(=O)N1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000261643125 328808085 /nfs/dbraw/zinc/80/80/85/328808085.db2.gz FUMIYMWLIJQHCC-LPOYBJAFSA-N 2 1 373.541 2.321 10 0 FEAEMP CN(C)CC[NH2+]Cc1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000020167842 521788689 /nfs/dbraw/zinc/78/86/89/521788689.db2.gz CBMJWMOUGXEZPE-OAQYLSRUSA-N 2 1 371.525 2.210 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000157826390 545789658 /nfs/dbraw/zinc/78/96/58/545789658.db2.gz BFLMGVANRJQHOT-APWZRJJASA-N 2 1 362.518 2.155 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCc2ccccc2OCC[NH+](C)C)C1 ZINC000158918212 545905364 /nfs/dbraw/zinc/90/53/64/545905364.db2.gz QFDODSOSQMXESP-AEFFLSMTSA-N 2 1 362.518 2.155 10 0 FEAEMP CC[N@H+](C)Cc1cccc(CNC(=O)N2C[C@H](C)[C@H]([NH+]3CCOCC3)C2)c1 ZINC000175731174 546341512 /nfs/dbraw/zinc/34/15/12/546341512.db2.gz IZNCWAXYMFITFN-FXAWDEMLSA-N 2 1 374.529 2.000 10 0 FEAEMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2C[C@H](C)[C@H]([NH+]3CCOCC3)C2)c1 ZINC000175731174 546341515 /nfs/dbraw/zinc/34/15/15/546341515.db2.gz IZNCWAXYMFITFN-FXAWDEMLSA-N 2 1 374.529 2.000 10 0 FEAEMP CC[N@@H+](C)[C@@H](C(=O)N(C)CC1CC[NH+](C[C@@H](C)O)CC1)c1ccccc1 ZINC000176861869 546497775 /nfs/dbraw/zinc/49/77/75/546497775.db2.gz DAZAREUENWBZKR-YLJYHZDGSA-N 2 1 361.530 2.231 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(C)C(=O)NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000177392415 546608836 /nfs/dbraw/zinc/60/88/36/546608836.db2.gz SUYBSHVYJVNRJK-FQEVSTJZSA-N 2 1 374.529 2.145 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000177392415 546608838 /nfs/dbraw/zinc/60/88/38/546608838.db2.gz SUYBSHVYJVNRJK-FQEVSTJZSA-N 2 1 374.529 2.145 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@H](c2ccco2)N(C)C)C[C@H]1CC ZINC000246901001 549238884 /nfs/dbraw/zinc/23/88/84/549238884.db2.gz AIIKLLFZBCSNKX-IAGOWNOFSA-N 2 1 366.506 2.025 10 0 FEAEMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N1C[C@H]2CCC[N@@H+]2C[C@H]1C ZINC000246995539 549260423 /nfs/dbraw/zinc/26/04/23/549260423.db2.gz FIPAMPYCVLNQDC-IEBWSBKVSA-N 2 1 371.529 2.447 10 0 FEAEMP CC[NH+](CC)[C@@H](CNC(=O)N1CC[N@H+](CCOC)[C@@H](C)C1)c1ccco1 ZINC000247013454 549265806 /nfs/dbraw/zinc/26/58/06/549265806.db2.gz HFUXBWICSRKFCA-IRXDYDNUSA-N 2 1 366.506 2.025 10 0 FEAEMP CC[NH+](CC)[C@@H](CNC(=O)N1CC[N@@H+](CCOC)[C@@H](C)C1)c1ccco1 ZINC000247013454 549265812 /nfs/dbraw/zinc/26/58/12/549265812.db2.gz HFUXBWICSRKFCA-IRXDYDNUSA-N 2 1 366.506 2.025 10 0 FEAEMP CSC[C@H](O)C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000249279501 549575676 /nfs/dbraw/zinc/57/56/76/549575676.db2.gz OIXIUUJLDFBNIT-RTBURBONSA-N 2 1 352.544 2.088 10 0 FEAEMP Cn1cc(C[NH+]2CCC3(CC[C@@H](C[N@@H+](C)Cc4ccncc4)O3)CC2)cn1 ZINC000257192166 549715382 /nfs/dbraw/zinc/71/53/82/549715382.db2.gz SSKZIHVLTAQPHV-FQEVSTJZSA-N 2 1 369.513 2.461 10 0 FEAEMP Cc1nnc([C@H]2CC3(C[N@@H+]2Cc2ccccc2)CC[NH+](CCO)CC3)o1 ZINC000257191957 549716133 /nfs/dbraw/zinc/71/61/33/549716133.db2.gz RXNXRYCOAZZQCB-GOSISDBHSA-N 2 1 356.470 2.400 10 0 FEAEMP Cc1nnc([C@H]2CC3(C[N@H+]2Cc2ccccc2)CC[NH+](CCO)CC3)o1 ZINC000257191957 549716135 /nfs/dbraw/zinc/71/61/35/549716135.db2.gz RXNXRYCOAZZQCB-GOSISDBHSA-N 2 1 356.470 2.400 10 0 FEAEMP Clc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)cc2c1OCCO2 ZINC000261960062 549774323 /nfs/dbraw/zinc/77/43/23/549774323.db2.gz PKBJWRONDXJJCE-BMFZPTHFSA-N 2 1 352.862 2.358 10 0 FEAEMP CC(C)c1csc([C@H]2CCC[N@@H+](CCC(=O)N3CC[NH2+]CC3)C2)n1 ZINC000262008132 549779866 /nfs/dbraw/zinc/77/98/66/549779866.db2.gz FFJPNWJBKKWLSG-HNNXBMFYSA-N 2 1 350.532 2.268 10 0 FEAEMP O[C@H](C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CCCO1)COCc1ccco1 ZINC000390985662 558613430 /nfs/dbraw/zinc/61/34/30/558613430.db2.gz XSABQFMTYHTCEF-CTNGQTDRSA-N 2 1 374.481 2.038 10 0 FEAEMP O[C@H](C[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)COCc1ccco1 ZINC000390985662 558613432 /nfs/dbraw/zinc/61/34/32/558613432.db2.gz XSABQFMTYHTCEF-CTNGQTDRSA-N 2 1 374.481 2.038 10 0 FEAEMP C[C@@H]1C[C@H](NC(=O)[C@@H]2C[NH2+]C[C@H]2C(F)(F)F)C[N@H+]1Cc1ccccc1 ZINC000653122373 677516705 /nfs/dbraw/zinc/51/67/05/677516705.db2.gz VDCQNENXEWYNNZ-SLBVQIDZSA-N 2 1 355.404 2.164 10 0 FEAEMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2c(C)nn(C)c2OC)CC1 ZINC000093769450 542940523 /nfs/dbraw/zinc/94/05/23/542940523.db2.gz JOMYQXJQMCOSTC-UHFFFAOYSA-N 2 1 352.523 2.308 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C(=O)NC2CC2)c2ccccc2)CC1 ZINC000106125952 543205009 /nfs/dbraw/zinc/20/50/09/543205009.db2.gz HYJLBVRAJWGLER-UZLBHIALSA-N 2 1 359.514 2.031 10 0 FEAEMP Cc1nn(C)c(C)c1[C@@H]1CCC[N@H+]1CC(=O)NC1CC[NH+](C(C)C)CC1 ZINC000114456712 543516801 /nfs/dbraw/zinc/51/68/01/543516801.db2.gz CYWMQOLTPWPBMH-SFHVURJKSA-N 2 1 361.534 2.163 10 0 FEAEMP Cc1nn(C)c(C)c1[C@@H]1CCC[N@@H+]1CC(=O)NC1CC[NH+](C(C)C)CC1 ZINC000114456712 543516805 /nfs/dbraw/zinc/51/68/05/543516805.db2.gz CYWMQOLTPWPBMH-SFHVURJKSA-N 2 1 361.534 2.163 10 0 FEAEMP COC(=O)c1ccc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc1F ZINC000151063282 544501364 /nfs/dbraw/zinc/50/13/64/544501364.db2.gz VXDCIPKRKHYACY-AWEZNQCLSA-N 2 1 352.450 2.137 10 0 FEAEMP C[N@H+](Cc1cccnc1)C[C@H]1CCN(C(=O)NCCC[NH+]2CCCCC2)C1 ZINC000190686695 328224769 /nfs/dbraw/zinc/22/47/69/328224769.db2.gz AZGIYWIJOSXHIR-HXUWFJFHSA-N 2 1 373.545 2.421 10 0 FEAEMP [NH3+][C@@H]1CC[C@@H](C(=O)Nc2ccc3c(ccn3CC[NH+]3CCOCC3)c2)C1 ZINC000166162047 327080917 /nfs/dbraw/zinc/08/09/17/327080917.db2.gz DYUCAKRGPSRIAI-IAGOWNOFSA-N 2 1 356.470 2.039 10 0 FEAEMP [NH3+][C@H]1CCC[C@H](C(=O)Nc2ccc3c(ccn3CC[NH+]3CCOCC3)c2)C1 ZINC000166162689 327081009 /nfs/dbraw/zinc/08/10/09/327081009.db2.gz AVQMVYCUZUXTPR-ROUUACIJSA-N 2 1 370.497 2.430 10 0 FEAEMP CC(C)(CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)[NH+]1CCc2ccccc2C1 ZINC000171901781 327168521 /nfs/dbraw/zinc/16/85/21/327168521.db2.gz PBYCSCDNSHBXAG-IBGZPJMESA-N 2 1 356.514 2.313 10 0 FEAEMP CC(C)(CNC(=O)N1CC[NH+]2CCC[C@H]2C1)[N@@H+]1CCc2ccccc2C1 ZINC000171901781 327168522 /nfs/dbraw/zinc/16/85/22/327168522.db2.gz PBYCSCDNSHBXAG-IBGZPJMESA-N 2 1 356.514 2.313 10 0 FEAEMP CC(C)(CNC(=O)N1CC[NH+]2CCC[C@H]2C1)[N@H+]1CCc2ccccc2C1 ZINC000171901781 327168523 /nfs/dbraw/zinc/16/85/23/327168523.db2.gz PBYCSCDNSHBXAG-IBGZPJMESA-N 2 1 356.514 2.313 10 0 FEAEMP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000173885789 327291424 /nfs/dbraw/zinc/29/14/24/327291424.db2.gz MZYCOYIVJPYZCG-HOCLYGCPSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000173885789 327291425 /nfs/dbraw/zinc/29/14/25/327291425.db2.gz MZYCOYIVJPYZCG-HOCLYGCPSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[NH+](C)C[C@@H]1CC[N@H+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000173885789 327291426 /nfs/dbraw/zinc/29/14/26/327291426.db2.gz MZYCOYIVJPYZCG-HOCLYGCPSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000173885789 327291427 /nfs/dbraw/zinc/29/14/27/327291427.db2.gz MZYCOYIVJPYZCG-HOCLYGCPSA-N 2 1 371.319 2.462 10 0 FEAEMP COc1cccc(N2CC[C@H](C[NH2+][C@@H]3CCC[C@H]3[C@@H]3COCC[NH2+]3)C2)c1 ZINC000261901910 328828086 /nfs/dbraw/zinc/82/80/86/328828086.db2.gz HTVLAPYYIPJZBX-OTNPHJDUSA-N 2 1 359.514 2.268 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCCCCC[NH+]2CCCCC2)C[C@@H]1C ZINC000161625582 546133273 /nfs/dbraw/zinc/13/32/73/546133273.db2.gz LLCBCZJDLBFLQS-SFHVURJKSA-N 2 1 354.539 2.005 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCCCCC[NH+]2CCCCC2)C[C@@H]1C ZINC000161625582 546133275 /nfs/dbraw/zinc/13/32/75/546133275.db2.gz LLCBCZJDLBFLQS-SFHVURJKSA-N 2 1 354.539 2.005 10 0 FEAEMP COc1ccc(NC(=O)NC(=O)C[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)cc1 ZINC000178753102 546844648 /nfs/dbraw/zinc/84/46/48/546844648.db2.gz OUUIILWJEGAIMP-INIZCTEOSA-N 2 1 371.441 2.013 10 0 FEAEMP COc1ccc(NC(=O)NC(=O)C[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)cc1 ZINC000178753102 546844651 /nfs/dbraw/zinc/84/46/51/546844651.db2.gz OUUIILWJEGAIMP-INIZCTEOSA-N 2 1 371.441 2.013 10 0 FEAEMP CCC[C@@H](C(=O)Nc1ccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)cc1)[NH+](C)C ZINC000245513097 548936756 /nfs/dbraw/zinc/93/67/56/548936756.db2.gz OKKARFSMYOHIOG-AEFFLSMTSA-N 2 1 360.502 2.053 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC1CC[NH+](Cc2ccccn2)CC1 ZINC000246111585 549054297 /nfs/dbraw/zinc/05/42/97/549054297.db2.gz HVBWHOCHEMFVRK-PMACEKPBSA-N 2 1 371.529 2.314 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1C[C@H]([NH+]2CCOCC2)[C@@H](C)C1)CC(C)C ZINC000246147430 549062655 /nfs/dbraw/zinc/06/26/55/549062655.db2.gz ONXQREIBYDCEMB-FHWLQOOXSA-N 2 1 368.566 2.105 10 0 FEAEMP c1cc(CN2CC[N@H+]3CCC[C@H]3C2)ccc1CN1CC[NH+]2CCC[C@H]2C1 ZINC000246252048 549089786 /nfs/dbraw/zinc/08/97/86/549089786.db2.gz FNHGOSTUZRKDCX-VXKWHMMOSA-N 2 1 354.542 2.247 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[NH+]2CCC[C@@H](C)C2)CC[N@H+]1CCOC ZINC000247001350 549261546 /nfs/dbraw/zinc/26/15/46/549261546.db2.gz GQGWUIRSACDYID-RTBURBONSA-N 2 1 368.566 2.251 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)CC[NH+]1CCOC ZINC000247001350 549261549 /nfs/dbraw/zinc/26/15/49/549261549.db2.gz GQGWUIRSACDYID-RTBURBONSA-N 2 1 368.566 2.251 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)CC[NH+]1CCOC ZINC000247001350 549261552 /nfs/dbraw/zinc/26/15/52/549261552.db2.gz GQGWUIRSACDYID-RTBURBONSA-N 2 1 368.566 2.251 10 0 FEAEMP C(C[NH+]1CCO[C@@H]2CCCC[C@H]21)OCC[N@@H+]1CCO[C@H]2CCCC[C@H]21 ZINC000247152761 549291926 /nfs/dbraw/zinc/29/19/26/549291926.db2.gz UIPWEEZTJSCMBX-WTGUMLROSA-N 2 1 352.519 2.290 10 0 FEAEMP C(C[NH+]1CCO[C@@H]2CCCC[C@H]21)OCC[N@H+]1CCO[C@H]2CCCC[C@H]21 ZINC000247152761 549291930 /nfs/dbraw/zinc/29/19/30/549291930.db2.gz UIPWEEZTJSCMBX-WTGUMLROSA-N 2 1 352.519 2.290 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)C[C@@H]1C ZINC000247194255 549297488 /nfs/dbraw/zinc/29/74/88/549297488.db2.gz SQEGLHHFMMXIKY-QRVBRYPASA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)C[C@@H]1C ZINC000247194255 549297492 /nfs/dbraw/zinc/29/74/92/549297492.db2.gz SQEGLHHFMMXIKY-QRVBRYPASA-N 2 1 368.566 2.107 10 0 FEAEMP CC[C@@H]1CCCCN1C(=O)[C@@H](C)[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247567635 549360091 /nfs/dbraw/zinc/36/00/91/549360091.db2.gz GUSGBMIIHABZFG-YQVWRLOYSA-N 2 1 353.551 2.191 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2ccc(C[NH+]3CCC(CO)CC3)cc2)C1 ZINC000247800532 549380928 /nfs/dbraw/zinc/38/09/28/549380928.db2.gz UYFVPONQXJKIKF-DYESRHJHSA-N 2 1 373.541 2.349 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N3C[C@H]4CCC[NH+]4C[C@H]3C)c2C1 ZINC000249169947 549563959 /nfs/dbraw/zinc/56/39/59/549563959.db2.gz LAPXUYRBTYBWPR-NVXWUHKLSA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N3C[C@H]4CCC[NH+]4C[C@H]3C)c2C1 ZINC000249169947 549563962 /nfs/dbraw/zinc/56/39/62/549563962.db2.gz LAPXUYRBTYBWPR-NVXWUHKLSA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N3C[C@H]4CCC[N@@H+]4C[C@H]3C)c2C1 ZINC000249169947 549563965 /nfs/dbraw/zinc/56/39/65/549563965.db2.gz LAPXUYRBTYBWPR-NVXWUHKLSA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N3C[C@H]4CCC[N@H+]4C[C@H]3C)c2C1 ZINC000249169947 549563967 /nfs/dbraw/zinc/56/39/67/549563967.db2.gz LAPXUYRBTYBWPR-NVXWUHKLSA-N 2 1 370.497 2.046 10 0 FEAEMP COc1ccccc1[C@@H](CNC(=O)NC[C@H]1CCC[N@H+]1C)[NH+]1CCCC1 ZINC000249741169 549622527 /nfs/dbraw/zinc/62/25/27/549622527.db2.gz IPEIKQCZTGKMLU-SJLPKXTDSA-N 2 1 360.502 2.226 10 0 FEAEMP COc1ccc([C@H](CNC(=O)N2CC[N@H+]3CCC[C@H]3C2)[NH+]2CCCC2)cc1 ZINC000252442351 549665630 /nfs/dbraw/zinc/66/56/30/549665630.db2.gz VAPFZODQEBEKDY-ICSRJNTNSA-N 2 1 372.513 2.322 10 0 FEAEMP CCC[N@H+]1CC[C@@H](CNC(=O)N2CC[C@@H](C[NH+](C)Cc3cccnc3)C2)C1 ZINC000253203030 549680721 /nfs/dbraw/zinc/68/07/21/549680721.db2.gz FFISEDSZYNWODZ-PMACEKPBSA-N 2 1 373.545 2.277 10 0 FEAEMP CCC[NH+]1CC[C@@H](CNC(=O)N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000253203030 549680723 /nfs/dbraw/zinc/68/07/23/549680723.db2.gz FFISEDSZYNWODZ-PMACEKPBSA-N 2 1 373.545 2.277 10 0 FEAEMP CCC[NH+]1CC[C@@H](CNC(=O)N2CC[C@@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000253203030 549680725 /nfs/dbraw/zinc/68/07/25/549680725.db2.gz FFISEDSZYNWODZ-PMACEKPBSA-N 2 1 373.545 2.277 10 0 FEAEMP CN(C)[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1)c1c(F)cccc1F ZINC000261865572 549764284 /nfs/dbraw/zinc/76/42/84/549764284.db2.gz COKYCTIXOVERKZ-HNONPPJISA-N 2 1 353.457 2.314 10 0 FEAEMP COCC[N@H+]1C[C@H](CO)C2(C1)CC[NH+](Cc1ccc(F)c(F)c1)CC2 ZINC000169789532 672322752 /nfs/dbraw/zinc/32/27/52/672322752.db2.gz JHLUWOIQPYLPTA-MRXNPFEDSA-N 2 1 354.441 2.118 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NC2CC[NH+](Cc3ccccn3)CC2)C1 ZINC000247440069 549333514 /nfs/dbraw/zinc/33/35/14/549333514.db2.gz RXWGZDYPBJEAIN-QFBILLFUSA-N 2 1 359.518 2.074 10 0 FEAEMP CCOc1ccc(OCC[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1 ZINC000106125429 543204457 /nfs/dbraw/zinc/20/44/57/543204457.db2.gz FRAQOQAUKMTNEZ-QGZVFWFLSA-N 2 1 350.503 2.489 10 0 FEAEMP CC(C)N(C(=O)C[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1)c1ccccc1 ZINC000106126744 543205056 /nfs/dbraw/zinc/20/50/56/543205056.db2.gz BYODCIYNLCXICZ-SFHVURJKSA-N 2 1 361.530 2.453 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)N2CCC(CCC[N@H+](C)CCOC)CC2)C1 ZINC000129106095 544090585 /nfs/dbraw/zinc/09/05/85/544090585.db2.gz SKTKUHWQPYMVEA-LJQANCHMSA-N 2 1 368.566 2.251 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)N2CCC(CCC[N@@H+](C)CCOC)CC2)C1 ZINC000129106095 544090587 /nfs/dbraw/zinc/09/05/87/544090587.db2.gz SKTKUHWQPYMVEA-LJQANCHMSA-N 2 1 368.566 2.251 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@@H]2CC[NH+](CC(C)C)C2)C[C@@H]1CC ZINC000150757976 544467929 /nfs/dbraw/zinc/46/79/29/544467929.db2.gz ZPNXTTFFAXVQRB-OALUTQOASA-N 2 1 368.566 2.107 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)C[C@@H]1CC ZINC000150757976 544467930 /nfs/dbraw/zinc/46/79/30/544467930.db2.gz ZPNXTTFFAXVQRB-OALUTQOASA-N 2 1 368.566 2.107 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)C[C@@H]1CC ZINC000150757976 544467932 /nfs/dbraw/zinc/46/79/32/544467932.db2.gz ZPNXTTFFAXVQRB-OALUTQOASA-N 2 1 368.566 2.107 10 0 FEAEMP CCC[C@@H](C(=O)N[C@@H]1CC[N@H+](Cc2cc(OC)cc(OC)c2)C1)[NH+](C)C ZINC000153561630 544791331 /nfs/dbraw/zinc/79/13/31/544791331.db2.gz ZBAFSCKPMNLMEU-APWZRJJASA-N 2 1 363.502 2.125 10 0 FEAEMP CCC[C@@H](C(=O)N[C@@H]1CC[N@@H+](Cc2cc(OC)cc(OC)c2)C1)[NH+](C)C ZINC000153561630 544791335 /nfs/dbraw/zinc/79/13/35/544791335.db2.gz ZBAFSCKPMNLMEU-APWZRJJASA-N 2 1 363.502 2.125 10 0 FEAEMP CC1CC[NH+](CCNC(=O)N2CC[C@H](C[N@@H+](C)Cc3cccnc3)C2)CC1 ZINC000190692512 328224927 /nfs/dbraw/zinc/22/49/27/328224927.db2.gz OYTWVHURQSVVTJ-HXUWFJFHSA-N 2 1 373.545 2.277 10 0 FEAEMP Cc1csc([C@H]2CN(CCC[NH+]3CCN(C(C)C)CC3)CCO2)n1 ZINC000191468156 328267176 /nfs/dbraw/zinc/26/71/76/328267176.db2.gz YKFQSYOBBBCAPL-QGZVFWFLSA-N 2 1 352.548 2.241 10 0 FEAEMP COCCOc1cccc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c1 ZINC000121091313 326312669 /nfs/dbraw/zinc/31/26/69/326312669.db2.gz WWLDAFUOLRVNLR-KRWDZBQOSA-N 2 1 350.503 2.236 10 0 FEAEMP COCOc1ccc(OC)cc1C[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000121139306 326316310 /nfs/dbraw/zinc/31/63/10/326316310.db2.gz WYRLTIRBLXCVKN-INIZCTEOSA-N 2 1 366.502 2.203 10 0 FEAEMP CC[NH+](CC)CCOc1ccc(CNC(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000171900713 327168511 /nfs/dbraw/zinc/16/85/11/327168511.db2.gz KTYJRWAIBAOKAJ-LJQANCHMSA-N 2 1 374.529 2.397 10 0 FEAEMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N1CC[NH+]2CCC[C@@H]2C1 ZINC000171907203 327169610 /nfs/dbraw/zinc/16/96/10/327169610.db2.gz AROAXUWFEJQGOE-WOJBJXKFSA-N 2 1 356.514 2.041 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@@H+]2CCC[C@@H]2C1 ZINC000171907203 327169612 /nfs/dbraw/zinc/16/96/12/327169612.db2.gz AROAXUWFEJQGOE-WOJBJXKFSA-N 2 1 356.514 2.041 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000171907203 327169613 /nfs/dbraw/zinc/16/96/13/327169613.db2.gz AROAXUWFEJQGOE-WOJBJXKFSA-N 2 1 356.514 2.041 10 0 FEAEMP C[C@H]1CN(C(=O)NCCCCC[NH+]2CCCCC2)C[C@H]1[NH+]1CCOCC1 ZINC000175800803 327414111 /nfs/dbraw/zinc/41/41/11/327414111.db2.gz MCBILILKTWWTRU-RBUKOAKNSA-N 2 1 366.550 2.005 10 0 FEAEMP Cc1ccc(NC(=O)[C@H](C)C2C[NH2+]C2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000262028836 328836360 /nfs/dbraw/zinc/83/63/60/328836360.db2.gz BIKSLOMMYVHGJX-OAHLLOKOSA-N 2 1 358.486 2.213 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCc2ccccc2OCC[NH+](C)C)[C@@H](C)C1 ZINC000158918355 545904858 /nfs/dbraw/zinc/90/48/58/545904858.db2.gz QFDODSOSQMXESP-WMZOPIPTSA-N 2 1 362.518 2.155 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC[NH+](C(C)C)CC2)C[C@@H]1CC ZINC000172115151 546236912 /nfs/dbraw/zinc/23/69/12/546236912.db2.gz GEIMWAGKLORNLD-SFHVURJKSA-N 2 1 354.539 2.002 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)C[C@@H]1C ZINC000176495943 546454277 /nfs/dbraw/zinc/45/42/77/546454277.db2.gz ZBGRBQYJIXORMS-KRWDZBQOSA-N 2 1 366.550 2.146 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)C[C@@H]1C ZINC000176495943 546454283 /nfs/dbraw/zinc/45/42/83/546454283.db2.gz ZBGRBQYJIXORMS-KRWDZBQOSA-N 2 1 366.550 2.146 10 0 FEAEMP CCS[C@@H](C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000178422886 546792523 /nfs/dbraw/zinc/79/25/23/546792523.db2.gz OPKPFQNBIVUQBZ-KGLIPLIRSA-N 2 1 356.536 2.408 10 0 FEAEMP CCS[C@@H](C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000178422886 546792526 /nfs/dbraw/zinc/79/25/26/546792526.db2.gz OPKPFQNBIVUQBZ-KGLIPLIRSA-N 2 1 356.536 2.408 10 0 FEAEMP COc1cccc([C@H](CNC(=O)NC[C@H]2CCC[N@H+]2C)[NH+]2CCCC2)c1 ZINC000195122578 548581208 /nfs/dbraw/zinc/58/12/08/548581208.db2.gz DHEYMEQWKYMDTJ-MJGOQNOKSA-N 2 1 360.502 2.226 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)C1 ZINC000245652703 548966105 /nfs/dbraw/zinc/96/61/05/548966105.db2.gz FAHHSTIDWCTRFF-QGTPRVQTSA-N 2 1 366.456 2.494 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@H]2CCC[NH+](CC(C)C)C2)CC[N@H+]1CCOC ZINC000246489777 549145068 /nfs/dbraw/zinc/14/50/68/549145068.db2.gz RPWGRSYWBLFGNW-MOPGFXCFSA-N 2 1 368.566 2.107 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)CC[NH+]1CCOC ZINC000246489777 549145071 /nfs/dbraw/zinc/14/50/71/549145071.db2.gz RPWGRSYWBLFGNW-MOPGFXCFSA-N 2 1 368.566 2.107 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@H]2CCC[N@@H+](CC(C)C)C2)CC[NH+]1CCOC ZINC000246489777 549145074 /nfs/dbraw/zinc/14/50/74/549145074.db2.gz RPWGRSYWBLFGNW-MOPGFXCFSA-N 2 1 368.566 2.107 10 0 FEAEMP C[C@H](C(=O)N1CCN(c2ccc(C[NH+](C)C)cn2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000246721954 549196808 /nfs/dbraw/zinc/19/68/08/549196808.db2.gz NGUJFTSNDNYERR-FGTMMUONSA-N 2 1 373.545 2.053 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[NH+]2CCCC[C@H]2C)CC[N@H+]1C[C@@H](C)O ZINC000248453974 549441576 /nfs/dbraw/zinc/44/15/76/549441576.db2.gz LRGSICZVGZGPGB-GUDVDZBRSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@@H+]2CCCC[C@H]2C)CC[NH+]1C[C@@H](C)O ZINC000248453974 549441581 /nfs/dbraw/zinc/44/15/81/549441581.db2.gz LRGSICZVGZGPGB-GUDVDZBRSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@H+]2CCCC[C@H]2C)CC[NH+]1C[C@@H](C)O ZINC000248453974 549441583 /nfs/dbraw/zinc/44/15/83/549441583.db2.gz LRGSICZVGZGPGB-GUDVDZBRSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCC[NH+](C)C2CCCCC2)CC[N@H+]1C[C@H](C)O ZINC000248461137 549443825 /nfs/dbraw/zinc/44/38/25/549443825.db2.gz UCQOCQNLHIMJHL-ROUUACIJSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCC[N@H+](C)C2CCCCC2)CC[NH+]1C[C@H](C)O ZINC000248461137 549443827 /nfs/dbraw/zinc/44/38/27/549443827.db2.gz UCQOCQNLHIMJHL-ROUUACIJSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCC[N@@H+](C)C2CCCCC2)CC[NH+]1C[C@H](C)O ZINC000248461137 549443830 /nfs/dbraw/zinc/44/38/30/549443830.db2.gz UCQOCQNLHIMJHL-ROUUACIJSA-N 2 1 368.566 2.128 10 0 FEAEMP C[C@H](c1nnnn1C1CCCCC1)[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000249271683 549574131 /nfs/dbraw/zinc/57/41/31/549574131.db2.gz JHLJMGMVNKKBJL-JKSUJKDBSA-N 2 1 364.538 2.264 10 0 FEAEMP C[C@H](c1nnnn1C1CCCCC1)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000249271683 549574134 /nfs/dbraw/zinc/57/41/34/549574134.db2.gz JHLJMGMVNKKBJL-JKSUJKDBSA-N 2 1 364.538 2.264 10 0 FEAEMP COCc1cccc(CNC(=O)C[N@@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261889219 549766891 /nfs/dbraw/zinc/76/68/91/549766891.db2.gz ZNKFRONZFDBZNR-RTWAWAEBSA-N 2 1 367.493 2.124 10 0 FEAEMP COCc1cccc(CNC(=O)C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261889219 549766893 /nfs/dbraw/zinc/76/68/93/549766893.db2.gz ZNKFRONZFDBZNR-RTWAWAEBSA-N 2 1 367.493 2.124 10 0 FEAEMP O=C(Nc1cccc(C[NH2+]C[C@H]2C[NH2+]C[C@H]2O)c1)c1ccccc1Cl ZINC000263159757 549882187 /nfs/dbraw/zinc/88/21/87/549882187.db2.gz DRUIINFMRUTQEM-KBXCAEBGSA-N 2 1 359.857 2.262 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccs1 ZINC000263195556 549885247 /nfs/dbraw/zinc/88/52/47/549885247.db2.gz IHXYDELGTKYRJL-SJLPKXTDSA-N 2 1 368.506 2.330 10 0 FEAEMP CC[N@H+]1CC[C@@H](NS(=O)(=O)c2ccc(C[NH2+]C3CCCC3)cc2)C1 ZINC000072317311 541799936 /nfs/dbraw/zinc/79/99/36/541799936.db2.gz HDDYBPBBORAKQQ-QGZVFWFLSA-N 2 1 351.516 2.091 10 0 FEAEMP O=C1CCCN1CCC1CC[NH+](C[C@]2(O)CCC[N@H+]3CCCC[C@@H]32)CC1 ZINC000063846418 205295586 /nfs/dbraw/zinc/29/55/86/205295586.db2.gz HXDBMIVYUXYVCQ-TZIWHRDSSA-N 2 1 363.546 2.090 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1 ZINC000113614933 543493515 /nfs/dbraw/zinc/49/35/15/543493515.db2.gz RPJKSKFEBDWEGA-HLAWJBBLSA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000113614933 543493516 /nfs/dbraw/zinc/49/35/16/543493516.db2.gz RPJKSKFEBDWEGA-HLAWJBBLSA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000113614933 543493517 /nfs/dbraw/zinc/49/35/17/543493517.db2.gz RPJKSKFEBDWEGA-HLAWJBBLSA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)C[C@@H](O)COc2ccccc2Cl)CC1 ZINC000247471073 549338884 /nfs/dbraw/zinc/33/88/84/549338884.db2.gz RRDHBEPNCBCPAA-DOTOQJQBSA-N 2 1 370.921 2.104 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1cccc(OCC[NH+](C)C)c1 ZINC000247497140 549345482 /nfs/dbraw/zinc/34/54/82/549345482.db2.gz USKDJCYMVAWSFZ-WMZOPIPTSA-N 2 1 360.502 2.005 10 0 FEAEMP CCC[C@@H](C(=O)N1CCC[C@H]([N@H+](C)CC(=O)OC(C)(C)C)CC1)[NH+](C)C ZINC000191588461 328273046 /nfs/dbraw/zinc/27/30/46/328273046.db2.gz GIBMIBKFWIYZOK-IRXDYDNUSA-N 2 1 369.550 2.371 10 0 FEAEMP CCC[C@@H](C(=O)N1CCC[C@H]([N@@H+](C)CC(=O)OC(C)(C)C)CC1)[NH+](C)C ZINC000191588461 328273048 /nfs/dbraw/zinc/27/30/48/328273048.db2.gz GIBMIBKFWIYZOK-IRXDYDNUSA-N 2 1 369.550 2.371 10 0 FEAEMP Cc1[nH+]ccn1CCCC[NH+]1CCN(C[C@@H](O)COc2ccccc2)CC1 ZINC000120957624 326302422 /nfs/dbraw/zinc/30/24/22/326302422.db2.gz DDAHDFPVGUDIMZ-HXUWFJFHSA-N 2 1 372.513 2.029 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@@H](C)C(C)(C)C[NH+](C)C)C[C@H]1CC ZINC000121033937 326307676 /nfs/dbraw/zinc/30/76/76/326307676.db2.gz RAIFTEDKNDIGFC-DLBZAZTESA-N 2 1 356.555 2.105 10 0 FEAEMP C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)C(=O)N3CC[C@H]([NH+](C)C)C3)cc2)C1 ZINC000170844821 327102100 /nfs/dbraw/zinc/10/21/00/327102100.db2.gz WJJHPJHLMUAXSN-LPHOPBHVSA-N 2 1 372.513 2.020 10 0 FEAEMP CC(C)[C@@H](C)[N@H+]1Cc2cccc(NC(=O)C(=O)N3CC[C@H]([NH+](C)C)C3)c2C1 ZINC000170843338 327102187 /nfs/dbraw/zinc/10/21/87/327102187.db2.gz OJUQGTNCFWYAIE-WBVHZDCISA-N 2 1 372.513 2.148 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)NC[C@@H]2CC[NH+](CCc3ccccc3)C2)C1 ZINC000171351244 327134238 /nfs/dbraw/zinc/13/42/38/327134238.db2.gz PMBAWMYZCWNIPP-VQTJNVASSA-N 2 1 358.530 2.335 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)C1 ZINC000171351244 327134239 /nfs/dbraw/zinc/13/42/39/327134239.db2.gz PMBAWMYZCWNIPP-VQTJNVASSA-N 2 1 358.530 2.335 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC000171351244 327134240 /nfs/dbraw/zinc/13/42/40/327134240.db2.gz PMBAWMYZCWNIPP-VQTJNVASSA-N 2 1 358.530 2.335 10 0 FEAEMP CC[NH+](CC)CCOc1ccccc1CNC(=O)N1CC[N@H+]2CCC[C@H]2C1 ZINC000171900716 327168667 /nfs/dbraw/zinc/16/86/67/327168667.db2.gz MMUHAIVPIVZTPK-IBGZPJMESA-N 2 1 374.529 2.397 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[N@@H+]3CCC[C@@H]3C2)cc1F ZINC000171904623 327169018 /nfs/dbraw/zinc/16/90/18/327169018.db2.gz NRHIIKZMWVXIFI-MRXNPFEDSA-N 2 1 357.433 2.309 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc1F ZINC000171904623 327169020 /nfs/dbraw/zinc/16/90/20/327169020.db2.gz NRHIIKZMWVXIFI-MRXNPFEDSA-N 2 1 357.433 2.309 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000262065453 328839408 /nfs/dbraw/zinc/83/94/08/328839408.db2.gz BBCCDVGOZHQTOS-UHTWSYAYSA-N 2 1 372.309 2.229 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[C@H]([NH3+])C(C)(C)C3)cc2)C[C@@H](C)O1 ZINC000262091851 328841439 /nfs/dbraw/zinc/84/14/39/328841439.db2.gz UOBJIOPUBXQYSJ-MDZRGWNJSA-N 2 1 359.514 2.495 10 0 FEAEMP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H]2C[NH2+]C[C@H]2O)o1 ZINC000262163480 328847173 /nfs/dbraw/zinc/84/71/73/328847173.db2.gz TXIZZRQVNPLUOP-MAUKXSAKSA-N 2 1 352.438 2.111 10 0 FEAEMP CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)NCc2cccc(C[NH+]3CCOCC3)c2)C1 ZINC000157860662 545792421 /nfs/dbraw/zinc/79/24/21/545792421.db2.gz LODDMNGTEJEYCD-XLIONFOSSA-N 2 1 374.529 2.047 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCc2cccc(C[NH+]3CCOCC3)c2)C1 ZINC000157860662 545792428 /nfs/dbraw/zinc/79/24/28/545792428.db2.gz LODDMNGTEJEYCD-XLIONFOSSA-N 2 1 374.529 2.047 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1ccc(N2CC[NH+](CC)CC2)cc1 ZINC000177014939 546524312 /nfs/dbraw/zinc/52/43/12/546524312.db2.gz XZWGSUXJDZMTLD-FQEVSTJZSA-N 2 1 358.530 2.385 10 0 FEAEMP O=C(c1ccc(C[NH+]2CCC(CO)CC2)cc1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000179761722 547009952 /nfs/dbraw/zinc/00/99/52/547009952.db2.gz NLTWYCCPCFHBPM-NRFANRHFSA-N 2 1 371.525 2.201 10 0 FEAEMP O=C(c1ccc(C[NH+]2CCC(CO)CC2)cc1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000179761722 547009954 /nfs/dbraw/zinc/00/99/54/547009954.db2.gz NLTWYCCPCFHBPM-NRFANRHFSA-N 2 1 371.525 2.201 10 0 FEAEMP CCO[C@@H]1C[C@@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C12CCOCC2 ZINC000186372307 548125877 /nfs/dbraw/zinc/12/58/77/548125877.db2.gz YSLYOQDUMVNOMX-RTBURBONSA-N 2 1 354.535 2.440 10 0 FEAEMP CC(C)[C@@H](C)[N@H+]1Cc2cccc(NC(=O)C(=O)N3CC[C@@H]([NH+](C)C)C3)c2C1 ZINC000246020131 549037410 /nfs/dbraw/zinc/03/74/10/549037410.db2.gz OJUQGTNCFWYAIE-NVXWUHKLSA-N 2 1 372.513 2.148 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)c1 ZINC000246395513 549124215 /nfs/dbraw/zinc/12/42/15/549124215.db2.gz KZRVHIUUIMCLNZ-VQIMIIECSA-N 2 1 374.529 2.312 10 0 FEAEMP C[C@@H]1C[C@H](NC(=O)N2CCO[C@@H](C[NH+](C)C)C2)CC[N@H+]1Cc1ccccc1 ZINC000246517432 549151153 /nfs/dbraw/zinc/15/11/53/549151153.db2.gz OFKYVPOCTDVADY-RLLQIKCJSA-N 2 1 374.529 2.012 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC[NH+]1C[C@@H](C)O ZINC000246919685 549241894 /nfs/dbraw/zinc/24/18/94/549241894.db2.gz QNWKMQZWVQKJRB-HLAWJBBLSA-N 2 1 373.541 2.202 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)C[C@H]1C ZINC000247185476 549296378 /nfs/dbraw/zinc/29/63/78/549296378.db2.gz RZKAKYWYWNORFU-UYAOXDASSA-N 2 1 374.529 2.186 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)C[C@H]1C ZINC000247185476 549296382 /nfs/dbraw/zinc/29/63/82/549296382.db2.gz RZKAKYWYWNORFU-UYAOXDASSA-N 2 1 374.529 2.186 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000248845554 549512816 /nfs/dbraw/zinc/51/28/16/549512816.db2.gz RPWBIPGISBFWMV-ULRHQZHYSA-N 2 1 364.530 2.420 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000248845554 549512818 /nfs/dbraw/zinc/51/28/18/549512818.db2.gz RPWBIPGISBFWMV-ULRHQZHYSA-N 2 1 364.530 2.420 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000248845554 549512821 /nfs/dbraw/zinc/51/28/21/549512821.db2.gz RPWBIPGISBFWMV-ULRHQZHYSA-N 2 1 364.530 2.420 10 0 FEAEMP CC[N@@H+]1CCC[C@@H](NC(=O)NC[C@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000249773033 549628070 /nfs/dbraw/zinc/62/80/70/549628070.db2.gz UHLOZQVDYFIBNY-GOEBONIOSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)NC[C@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000249773033 549628073 /nfs/dbraw/zinc/62/80/73/549628073.db2.gz UHLOZQVDYFIBNY-GOEBONIOSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)C1 ZINC000249773033 549628077 /nfs/dbraw/zinc/62/80/77/549628077.db2.gz UHLOZQVDYFIBNY-GOEBONIOSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)C1 ZINC000249773033 549628081 /nfs/dbraw/zinc/62/80/81/549628081.db2.gz UHLOZQVDYFIBNY-GOEBONIOSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)[C@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000261635188 549737523 /nfs/dbraw/zinc/73/75/23/549737523.db2.gz CBRUIKPMLHPFOB-GOEBONIOSA-N 2 1 354.292 2.224 10 0 FEAEMP COc1ccccc1N1CCC([NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)CC1 ZINC000261972815 549775538 /nfs/dbraw/zinc/77/55/38/549775538.db2.gz QSBYVAGNJOEPKF-QRVBRYPASA-N 2 1 359.514 2.411 10 0 FEAEMP Cc1cc(N2CCC(NC(=O)N[C@@H]3C[N@H+](C(C)C)C[C@H]3C)CC2)nc(C)[nH+]1 ZINC000247390737 549328081 /nfs/dbraw/zinc/32/80/81/549328081.db2.gz QKQFELVKGPRFFC-RDTXWAMCSA-N 2 1 374.533 2.090 10 0 FEAEMP Cc1cc(N2CCC(NC(=O)N[C@@H]3C[N@@H+](C(C)C)C[C@H]3C)CC2)nc(C)[nH+]1 ZINC000247390737 549328084 /nfs/dbraw/zinc/32/80/84/549328084.db2.gz QKQFELVKGPRFFC-RDTXWAMCSA-N 2 1 374.533 2.090 10 0 FEAEMP CCn1c(C)nnc1C[N@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106127180 543204368 /nfs/dbraw/zinc/20/43/68/543204368.db2.gz ZZEWODUMMULFTQ-FQEVSTJZSA-N 2 1 371.529 2.484 10 0 FEAEMP CCn1c(C)nnc1C[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106127180 543204370 /nfs/dbraw/zinc/20/43/70/543204370.db2.gz ZZEWODUMMULFTQ-FQEVSTJZSA-N 2 1 371.529 2.484 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1 ZINC000247470021 549338785 /nfs/dbraw/zinc/33/87/85/549338785.db2.gz RPJKSKFEBDWEGA-HMXCVIKNSA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000247470021 549338788 /nfs/dbraw/zinc/33/87/88/549338788.db2.gz RPJKSKFEBDWEGA-HMXCVIKNSA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000247470021 549338790 /nfs/dbraw/zinc/33/87/90/549338790.db2.gz RPJKSKFEBDWEGA-HMXCVIKNSA-N 2 1 370.541 2.429 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCC2([NH+]3CCSCC3)CCCC2)C1 ZINC000247490723 549342470 /nfs/dbraw/zinc/34/24/70/549342470.db2.gz WVSKYKLZAFHYED-IAGOWNOFSA-N 2 1 368.591 2.376 10 0 FEAEMP COC(=O)c1ccc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1F ZINC000151063333 544501300 /nfs/dbraw/zinc/50/13/00/544501300.db2.gz VXDCIPKRKHYACY-CQSZACIVSA-N 2 1 352.450 2.137 10 0 FEAEMP C[C@H](CNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1)[NH+](C)C1CC1 ZINC000190707553 328226390 /nfs/dbraw/zinc/22/63/90/328226390.db2.gz TVBXXXGBVWGPJX-AEFFLSMTSA-N 2 1 359.518 2.028 10 0 FEAEMP C[C@H](CNC(=O)N1CC[C@@H](C[NH+](C)Cc2cccnc2)C1)[N@H+](C)C1CC1 ZINC000190707553 328226392 /nfs/dbraw/zinc/22/63/92/328226392.db2.gz TVBXXXGBVWGPJX-AEFFLSMTSA-N 2 1 359.518 2.028 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)CC1 ZINC000190915530 328239989 /nfs/dbraw/zinc/23/99/89/328239989.db2.gz OGEPESRBBLFLFG-PGYGNJIDSA-N 2 1 352.519 2.279 10 0 FEAEMP CC(C)[N@H+]1CCO[C@@H](CN2CC[NH+](Cc3cccc4[nH]ccc43)CC2)C1 ZINC000121071682 326311464 /nfs/dbraw/zinc/31/14/64/326311464.db2.gz JRKFTHNVVQXYTR-IBGZPJMESA-N 2 1 356.514 2.395 10 0 FEAEMP COc1ccc(C[N@H+](C)C2CCN(CCn3cccn3)CC2)c(OC)c1 ZINC000121188813 326320310 /nfs/dbraw/zinc/32/03/10/326320310.db2.gz OCVQVTVHMQSZEN-UHFFFAOYSA-N 2 1 358.486 2.497 10 0 FEAEMP Cc1cccc(C)c1OC[C@H](O)C[N@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000170941845 327108984 /nfs/dbraw/zinc/10/89/84/327108984.db2.gz CQQWAURZKJSKCS-UYAOXDASSA-N 2 1 364.530 2.068 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC[NH+]1CCc2ccccc2C1 ZINC000173833171 327287772 /nfs/dbraw/zinc/28/77/72/327287772.db2.gz YDVREAURUOYPPE-VQTJNVASSA-N 2 1 356.514 2.313 10 0 FEAEMP CC[C@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC[N@@H+]1CCc2ccccc2C1 ZINC000173833171 327287774 /nfs/dbraw/zinc/28/77/74/327287774.db2.gz YDVREAURUOYPPE-VQTJNVASSA-N 2 1 356.514 2.313 10 0 FEAEMP CC[C@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000173833171 327287775 /nfs/dbraw/zinc/28/77/75/327287775.db2.gz YDVREAURUOYPPE-VQTJNVASSA-N 2 1 356.514 2.313 10 0 FEAEMP CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000174181928 327311247 /nfs/dbraw/zinc/31/12/47/327311247.db2.gz OCDMGYQOFUZJIV-ZWKOTPCHSA-N 2 1 368.485 2.344 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000174181928 327311249 /nfs/dbraw/zinc/31/12/49/327311249.db2.gz OCDMGYQOFUZJIV-ZWKOTPCHSA-N 2 1 368.485 2.344 10 0 FEAEMP Cc1nc(C[NH+]2CCC(CNC(=O)[C@@H]3CCC[C@@H]3C[NH3+])CC2)cs1 ZINC000261625849 328806671 /nfs/dbraw/zinc/80/66/71/328806671.db2.gz BFPSKUCKAWBLDV-NVXWUHKLSA-N 2 1 350.532 2.155 10 0 FEAEMP O=C(Nc1cccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2O)c1)c1ccccc1Cl ZINC000263159763 328920998 /nfs/dbraw/zinc/92/09/98/328920998.db2.gz DRUIINFMRUTQEM-RDTXWAMCSA-N 2 1 359.857 2.262 10 0 FEAEMP O=C(Nc1cccc(C[NH2+]C[C@H]2C[NH2+]C[C@H]2O)c1)c1ccc(Cl)cc1 ZINC000263178871 328922441 /nfs/dbraw/zinc/92/24/41/328922441.db2.gz GLIIOLVCUGZCHS-MAUKXSAKSA-N 2 1 359.857 2.262 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000263245654 328927908 /nfs/dbraw/zinc/92/79/08/328927908.db2.gz PERICHAMIBBZOJ-WMLDXEAASA-N 2 1 354.479 2.271 10 0 FEAEMP Cc1nccn1C[C@@H]1CCC[N@@H+]1CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000158817559 545897752 /nfs/dbraw/zinc/89/77/52/545897752.db2.gz MOAMDYOCQVFJBR-PMACEKPBSA-N 3 1 369.513 2.075 10 0 FEAEMP CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000177392399 546608446 /nfs/dbraw/zinc/60/84/46/546608446.db2.gz SUYBSHVYJVNRJK-HXUWFJFHSA-N 2 1 374.529 2.145 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000177392399 546608451 /nfs/dbraw/zinc/60/84/51/546608451.db2.gz SUYBSHVYJVNRJK-HXUWFJFHSA-N 2 1 374.529 2.145 10 0 FEAEMP COc1ccc(CN(C)C(=O)C[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)cc1 ZINC000178334246 546776994 /nfs/dbraw/zinc/77/69/94/546776994.db2.gz BFALCHQAVYXDQF-GOSISDBHSA-N 2 1 356.470 2.323 10 0 FEAEMP COc1ccc(CN(C)C(=O)C[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)cc1 ZINC000178334246 546776997 /nfs/dbraw/zinc/77/69/97/546776997.db2.gz BFALCHQAVYXDQF-GOSISDBHSA-N 2 1 356.470 2.323 10 0 FEAEMP COc1cc(OC)c(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c(OC)c1 ZINC000179517152 546969216 /nfs/dbraw/zinc/96/92/16/546969216.db2.gz JBWAYXAGZPTMOJ-OAHLLOKOSA-N 2 1 366.502 2.237 10 0 FEAEMP COCCOc1ccc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1 ZINC000179517526 546970134 /nfs/dbraw/zinc/97/01/34/546970134.db2.gz ABVFYTZENLYSSQ-QGZVFWFLSA-N 2 1 350.503 2.236 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2C)C1 ZINC000194323263 548465737 /nfs/dbraw/zinc/46/57/37/548465737.db2.gz FULIDPYDNXTIEO-KRWDZBQOSA-N 2 1 359.518 2.353 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000194445687 548483758 /nfs/dbraw/zinc/48/37/58/548483758.db2.gz FMPSZBQBCHONJA-YZGWKJHDSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000194445687 548483761 /nfs/dbraw/zinc/48/37/61/548483761.db2.gz FMPSZBQBCHONJA-YZGWKJHDSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194445687 548483765 /nfs/dbraw/zinc/48/37/65/548483765.db2.gz FMPSZBQBCHONJA-YZGWKJHDSA-N 2 1 356.514 2.387 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(OCC[NH+](C)C)cc1 ZINC000246582915 549167211 /nfs/dbraw/zinc/16/72/11/549167211.db2.gz ZUYSQSGPCIYIAN-MOPGFXCFSA-N 2 1 374.529 2.395 10 0 FEAEMP CCS[C@@H](C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000248132526 549408911 /nfs/dbraw/zinc/40/89/11/549408911.db2.gz OPKPFQNBIVUQBZ-KBPBESRZSA-N 2 1 356.536 2.408 10 0 FEAEMP CCS[C@@H](C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000248132526 549408914 /nfs/dbraw/zinc/40/89/14/549408914.db2.gz OPKPFQNBIVUQBZ-KBPBESRZSA-N 2 1 356.536 2.408 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NCC[C@H](C)[NH+]2CCCCC2)C[C@@H]1CC ZINC000248484702 549448811 /nfs/dbraw/zinc/44/88/11/549448811.db2.gz KFQFMZFVHIGABP-OALUTQOASA-N 2 1 368.566 2.393 10 0 FEAEMP COC1CC[NH+](C2(CN[C@@H]3CCC[C@@H]3[C@H]3COCC[NH2+]3)CCCC2)CC1 ZINC000261886632 549766124 /nfs/dbraw/zinc/76/61/24/549766124.db2.gz FYXOLDNNEWCIRX-XUVXKRRUSA-N 3 1 365.562 2.157 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3COCCN3)c2)CCO1 ZINC000261965920 549775552 /nfs/dbraw/zinc/77/55/52/549775552.db2.gz PZMYJYBURGTGKM-CIQXWFTPSA-N 2 1 373.541 2.154 10 0 FEAEMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3COCCN3)c2)CCO1 ZINC000261965920 549775553 /nfs/dbraw/zinc/77/55/53/549775553.db2.gz PZMYJYBURGTGKM-CIQXWFTPSA-N 2 1 373.541 2.154 10 0 FEAEMP CC(C)c1nc(CN(C)C(=O)[C@@H]2CC3(C[N@H+]2C)CC[NH2+]CC3)cs1 ZINC000072410012 670495790 /nfs/dbraw/zinc/49/57/90/670495790.db2.gz AJDZZVDYEHBJLF-HNNXBMFYSA-N 2 1 350.532 2.299 10 0 FEAEMP COc1ccc(Br)cc1C[N@H+]1C[C@@H](CO)C2(C1)CC[NH2+]CC2 ZINC000169782185 672322140 /nfs/dbraw/zinc/32/21/40/672322140.db2.gz BVKAXNJWKKVBTJ-AWEZNQCLSA-N 2 1 369.303 2.252 10 0 FEAEMP C[NH+](C)C[C@@H]1C[N@@H+](C2CCOCC2)C[C@H]1NC(=O)c1cccc(Cl)c1 ZINC000169790878 672322738 /nfs/dbraw/zinc/32/27/38/672322738.db2.gz QSOSJSQXFUFVFG-CRAIPNDOSA-N 2 1 365.905 2.111 10 0 FEAEMP C[NH+](C)C[C@@H]1C[N@H+](C2CCOCC2)C[C@H]1NC(=O)c1cccc(Cl)c1 ZINC000169790878 672322741 /nfs/dbraw/zinc/32/27/41/672322741.db2.gz QSOSJSQXFUFVFG-CRAIPNDOSA-N 2 1 365.905 2.111 10 0 FEAEMP CC(C)(C)c1nn(-c2ccccc2Cl)cc1C[NH2+]C[C@@H]1C[NH2+]C[C@@H]1O ZINC000262197996 672910700 /nfs/dbraw/zinc/91/07/00/672910700.db2.gz ZQEBEMMJUKLJDD-DYVFJYSZSA-N 2 1 362.905 2.493 10 0 FEAEMP CN(C(=O)Cc1ccc(N2C(=[NH2+])NC(=[NH2+])NC2(C)C)cc1)c1ccccc1 ZINC000016954546 132377769 /nfs/dbraw/zinc/37/77/69/132377769.db2.gz FEZCWCBSBPDLPD-UHFFFAOYSA-N 2 1 364.453 2.078 10 0 FEAEMP CC(C)C[C@@H](C[NH+](C)C)NC(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000097216166 543008152 /nfs/dbraw/zinc/00/81/52/543008152.db2.gz MKOLMERCGBIPMM-INIZCTEOSA-N 2 1 352.548 2.382 10 0 FEAEMP CC(C)C[C@@H](C[NH+](C)C)NC(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000097216166 543008155 /nfs/dbraw/zinc/00/81/55/543008155.db2.gz MKOLMERCGBIPMM-INIZCTEOSA-N 2 1 352.548 2.382 10 0 FEAEMP CCN(C)C(=O)CC[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000130351822 544148117 /nfs/dbraw/zinc/14/81/17/544148117.db2.gz BRUHSVJNESVLOA-FQEVSTJZSA-N 2 1 361.530 2.232 10 0 FEAEMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[NH+]2CCC[C@H]2C1 ZINC000247513722 549349242 /nfs/dbraw/zinc/34/92/42/549349242.db2.gz QGSMYJPEVDVVRH-IRXDYDNUSA-N 2 1 362.543 2.450 10 0 FEAEMP O=C(NC[C@@H]1CCC[NH+](Cc2cccs2)C1)N1CC[N@@H+]2CCC[C@H]2C1 ZINC000247513722 549349247 /nfs/dbraw/zinc/34/92/47/549349247.db2.gz QGSMYJPEVDVVRH-IRXDYDNUSA-N 2 1 362.543 2.450 10 0 FEAEMP O=C(NC[C@@H]1CCC[NH+](Cc2cccs2)C1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000247513722 549349252 /nfs/dbraw/zinc/34/92/52/549349252.db2.gz QGSMYJPEVDVVRH-IRXDYDNUSA-N 2 1 362.543 2.450 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N(C)C2CCCCC2)CC1 ZINC000155107972 544990499 /nfs/dbraw/zinc/99/04/99/544990499.db2.gz LDXIUOWRJIYHNX-IRXDYDNUSA-N 2 1 353.551 2.191 10 0 FEAEMP CSC[C@@H](O)C[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000187879766 328052168 /nfs/dbraw/zinc/05/21/68/328052168.db2.gz OIXIUUJLDFBNIT-OALUTQOASA-N 2 1 352.544 2.088 10 0 FEAEMP C[C@H](CNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1)[NH+](C)C1CC1 ZINC000190707517 328226282 /nfs/dbraw/zinc/22/62/82/328226282.db2.gz TVBXXXGBVWGPJX-SJLPKXTDSA-N 2 1 359.518 2.028 10 0 FEAEMP C[C@H](CNC(=O)N1CC[C@H](C[NH+](C)Cc2cccnc2)C1)[N@H+](C)C1CC1 ZINC000190707517 328226283 /nfs/dbraw/zinc/22/62/83/328226283.db2.gz TVBXXXGBVWGPJX-SJLPKXTDSA-N 2 1 359.518 2.028 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CC[NH+](C)CC2)c1 ZINC000173471818 327259725 /nfs/dbraw/zinc/25/97/25/327259725.db2.gz BQADEWOKPAUVSK-LEWJYISDSA-N 2 1 370.541 2.133 10 0 FEAEMP CC(C)c1nn(C)c(N2CCOCC2)c1C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000175012864 327368049 /nfs/dbraw/zinc/36/80/49/327368049.db2.gz GFXFTDWXCNNFMA-IAGOWNOFSA-N 2 1 363.550 2.343 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)CCC[NH+]2CCN(c3ccccc3)CC2)C1 ZINC000171865622 546228353 /nfs/dbraw/zinc/22/83/53/546228353.db2.gz IMTCBSVSOKWOEC-IBGZPJMESA-N 2 1 358.530 2.189 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCC2CC[NH+](CCC(C)C)CC2)C[C@H]1C ZINC000175774492 546347460 /nfs/dbraw/zinc/34/74/60/546347460.db2.gz PKTOZKIRONTXNB-GOSISDBHSA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCC2CC[NH+](CCC(C)C)CC2)C[C@H]1C ZINC000175774492 546347463 /nfs/dbraw/zinc/34/74/63/546347463.db2.gz PKTOZKIRONTXNB-GOSISDBHSA-N 2 1 368.566 2.107 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000178333976 546776771 /nfs/dbraw/zinc/77/67/71/546776771.db2.gz FOVPUJAZOROWIZ-YOEHRIQHSA-N 2 1 370.453 2.454 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000178333976 546776775 /nfs/dbraw/zinc/77/67/75/546776775.db2.gz FOVPUJAZOROWIZ-YOEHRIQHSA-N 2 1 370.453 2.454 10 0 FEAEMP c1cc(CN2CC[N@H+]3CCC[C@@H]3C2)ccc1CN1CC[NH+]2CCC[C@@H]2C1 ZINC000178641395 546825529 /nfs/dbraw/zinc/82/55/29/546825529.db2.gz FNHGOSTUZRKDCX-FGZHOGPDSA-N 2 1 354.542 2.247 10 0 FEAEMP COC(=O)c1ccc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c(F)c1 ZINC000179525661 546971000 /nfs/dbraw/zinc/97/10/00/546971000.db2.gz FYOCCXIFZQSXRW-AWEZNQCLSA-N 2 1 352.450 2.137 10 0 FEAEMP CC[NH+]1CCN(c2cccc(NC(=O)N3CC[N@H+]4CCC[C@H]4C3)c2)CC1 ZINC000184900120 547895835 /nfs/dbraw/zinc/89/58/35/547895835.db2.gz WGGJMMJKKWUQKU-IBGZPJMESA-N 2 1 357.502 2.140 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000245434391 548918866 /nfs/dbraw/zinc/91/88/66/548918866.db2.gz PTPNUTGYCGEXQC-SFTDATJTSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1ccc(CN2CCN(C)CC2)cc1 ZINC000245434391 548918869 /nfs/dbraw/zinc/91/88/69/548918869.db2.gz PTPNUTGYCGEXQC-SFTDATJTSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000245434391 548918873 /nfs/dbraw/zinc/91/88/73/548918873.db2.gz PTPNUTGYCGEXQC-SFTDATJTSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000245434391 548918876 /nfs/dbraw/zinc/91/88/76/548918876.db2.gz PTPNUTGYCGEXQC-SFTDATJTSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000245448609 548924106 /nfs/dbraw/zinc/92/41/06/548924106.db2.gz MZYCOYIVJPYZCG-GOEBONIOSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000245448609 548924112 /nfs/dbraw/zinc/92/41/12/548924112.db2.gz MZYCOYIVJPYZCG-GOEBONIOSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000245448609 548924116 /nfs/dbraw/zinc/92/41/16/548924116.db2.gz MZYCOYIVJPYZCG-GOEBONIOSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000245448609 548924121 /nfs/dbraw/zinc/92/41/21/548924121.db2.gz MZYCOYIVJPYZCG-GOEBONIOSA-N 2 1 371.319 2.462 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)C1 ZINC000245747852 548987698 /nfs/dbraw/zinc/98/76/98/548987698.db2.gz ANFWQCUQWJMVQV-IKGGRYGDSA-N 2 1 350.894 2.431 10 0 FEAEMP CNC(=O)c1cccc(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000245962176 549028066 /nfs/dbraw/zinc/02/80/66/549028066.db2.gz SPHYXGNGRKFNQU-KDOFPFPSSA-N 2 1 369.469 2.043 10 0 FEAEMP CNC(=O)c1cccc(NC(=O)[C@@H](C)[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000245962176 549028067 /nfs/dbraw/zinc/02/80/67/549028067.db2.gz SPHYXGNGRKFNQU-KDOFPFPSSA-N 2 1 369.469 2.043 10 0 FEAEMP CC[N@H+](C)Cc1cccc(CNC(=O)N2C[C@@H](C)[C@@H]([NH+]3CCOCC3)C2)c1 ZINC000246105050 549053615 /nfs/dbraw/zinc/05/36/15/549053615.db2.gz IZNCWAXYMFITFN-XLIONFOSSA-N 2 1 374.529 2.000 10 0 FEAEMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2C[C@@H](C)[C@@H]([NH+]3CCOCC3)C2)c1 ZINC000246105050 549053618 /nfs/dbraw/zinc/05/36/18/549053618.db2.gz IZNCWAXYMFITFN-XLIONFOSSA-N 2 1 374.529 2.000 10 0 FEAEMP C[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000246325474 549106573 /nfs/dbraw/zinc/10/65/73/549106573.db2.gz AWJMRFPPJOIIAY-XLIONFOSSA-N 2 1 372.513 2.262 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000246325474 549106576 /nfs/dbraw/zinc/10/65/76/549106576.db2.gz AWJMRFPPJOIIAY-XLIONFOSSA-N 2 1 372.513 2.262 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)C1 ZINC000246797841 549215874 /nfs/dbraw/zinc/21/58/74/549215874.db2.gz AWAVEDPJYUPQLL-UXLLHSPISA-N 2 1 350.532 2.477 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)C[C@@H]1C ZINC000247235100 549303761 /nfs/dbraw/zinc/30/37/61/549303761.db2.gz WRDREYKDDUFAHW-AZUAARDMSA-N 2 1 374.529 2.186 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)C[C@@H]1C ZINC000247235100 549303763 /nfs/dbraw/zinc/30/37/63/549303763.db2.gz WRDREYKDDUFAHW-AZUAARDMSA-N 2 1 374.529 2.186 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@H]1C)[NH+]1CCOCC1 ZINC000252443791 549665505 /nfs/dbraw/zinc/66/55/05/549665505.db2.gz OZEMXPCFWZJIFF-NEWSRXKRSA-N 2 1 366.550 2.002 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N1C[C@@H]2CCC[N@H+]2C[C@H]1C)[NH+]1CCOCC1 ZINC000252443791 549665506 /nfs/dbraw/zinc/66/55/06/549665506.db2.gz OZEMXPCFWZJIFF-NEWSRXKRSA-N 2 1 366.550 2.002 10 0 FEAEMP [NH3+]C1(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCOCC1 ZINC000261845709 549761746 /nfs/dbraw/zinc/76/17/46/549761746.db2.gz LXJVNIAMMPMDMT-FQEVSTJZSA-N 2 1 357.498 2.009 10 0 FEAEMP C[C@H](C(=O)NCCc1ccccc1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261861212 549763263 /nfs/dbraw/zinc/76/32/63/549763263.db2.gz WJLICKVESLRPJJ-UIFIKXQLSA-N 2 1 351.494 2.408 10 0 FEAEMP C[C@H](C(=O)NCCc1ccccc1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261861212 549763265 /nfs/dbraw/zinc/76/32/65/549763265.db2.gz WJLICKVESLRPJJ-UIFIKXQLSA-N 2 1 351.494 2.408 10 0 FEAEMP COc1cccc(N2CC[C@H](C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3COCC[NH2+]3)C2)c1 ZINC000261901912 549767765 /nfs/dbraw/zinc/76/77/65/549767765.db2.gz HTVLAPYYIPJZBX-RCOXNQKVSA-N 2 1 359.514 2.268 10 0 FEAEMP Clc1cc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)cc2c1OCCO2 ZINC000261936028 549771142 /nfs/dbraw/zinc/77/11/42/549771142.db2.gz MEYVLFUJUWDXLA-OIISXLGYSA-N 2 1 366.889 2.400 10 0 FEAEMP [NH3+]C1(C(=O)NC[C@@H]2CCCC[N@H+]2Cc2cccc(Cl)c2)CCOCC1 ZINC000261929926 549771194 /nfs/dbraw/zinc/77/11/94/549771194.db2.gz WBRHVOFTAOYEIS-KRWDZBQOSA-N 2 1 365.905 2.319 10 0 FEAEMP COc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c(OC)c1OC ZINC000261960094 549774288 /nfs/dbraw/zinc/77/42/88/549774288.db2.gz PLFQGGWLUCZZPX-BBWFWOEESA-N 2 1 364.486 2.002 10 0 FEAEMP CN(Cc1ccccc1Br)C(=O)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000262562534 549828635 /nfs/dbraw/zinc/82/86/35/549828635.db2.gz VVRMYJFMRAPVKO-BJJXKVORSA-N 2 1 366.303 2.077 10 0 FEAEMP CN(Cc1ccccc1Br)C(=O)C[N@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000262562534 549828636 /nfs/dbraw/zinc/82/86/36/549828636.db2.gz VVRMYJFMRAPVKO-BJJXKVORSA-N 2 1 366.303 2.077 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000263164831 549883024 /nfs/dbraw/zinc/88/30/24/549883024.db2.gz FCSUOHGFLAHMBK-SMDDNHRTSA-N 2 1 368.300 2.243 10 0 FEAEMP O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653111063 677516352 /nfs/dbraw/zinc/51/63/52/677516352.db2.gz CHLVJYOGGBAAFI-BZUAXINKSA-N 2 1 355.404 2.165 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653447624 677531399 /nfs/dbraw/zinc/53/13/99/677531399.db2.gz XSJPQIADJXRZHS-FVQBIDKESA-N 2 1 355.404 2.117 10 0 FEAEMP C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653447624 677531400 /nfs/dbraw/zinc/53/14/00/677531400.db2.gz XSJPQIADJXRZHS-FVQBIDKESA-N 2 1 355.404 2.117 10 0 FEAEMP CCCNC(=O)[C@@H](C)[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106127861 543204832 /nfs/dbraw/zinc/20/48/32/543204832.db2.gz KYMJPRJSFHINQG-XLIONFOSSA-N 2 1 361.530 2.279 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[N@@H+]2C[C@H]1C)[NH+]1CCc2sccc2C1 ZINC000113596198 543492304 /nfs/dbraw/zinc/49/23/04/543492304.db2.gz DJXINOAIJQGHCY-BFYDXBDKSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[N@H+]2C[C@H]1C)[NH+]1CCc2sccc2C1 ZINC000113596198 543492307 /nfs/dbraw/zinc/49/23/07/543492307.db2.gz DJXINOAIJQGHCY-BFYDXBDKSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[NH+]2C[C@H]1C)[N@@H+]1CCc2sccc2C1 ZINC000113596198 543492311 /nfs/dbraw/zinc/49/23/11/543492311.db2.gz DJXINOAIJQGHCY-BFYDXBDKSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[NH+]2C[C@H]1C)[N@H+]1CCc2sccc2C1 ZINC000113596198 543492313 /nfs/dbraw/zinc/49/23/13/543492313.db2.gz DJXINOAIJQGHCY-BFYDXBDKSA-N 2 1 362.543 2.373 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@@H]2CCC[NH+]2Cc2ccccc2)CC[N@@H+]1CCOC ZINC000117300298 543628294 /nfs/dbraw/zinc/62/82/94/543628294.db2.gz FLQPJRVXFZNWAO-UXHICEINSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@@H]2CCC[NH+]2Cc2ccccc2)CC[N@H+]1CCOC ZINC000117300298 543628296 /nfs/dbraw/zinc/62/82/96/543628296.db2.gz FLQPJRVXFZNWAO-UXHICEINSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@@H]2CCC[N@@H+]2Cc2ccccc2)CC[NH+]1CCOC ZINC000117300298 543628298 /nfs/dbraw/zinc/62/82/98/543628298.db2.gz FLQPJRVXFZNWAO-UXHICEINSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)CC[NH+]1CCOC ZINC000117300298 543628300 /nfs/dbraw/zinc/62/83/00/543628300.db2.gz FLQPJRVXFZNWAO-UXHICEINSA-N 2 1 359.514 2.220 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)CC[NH+]2CCN(c3ccccc3)CC2)C1 ZINC000247501532 549345988 /nfs/dbraw/zinc/34/59/88/549345988.db2.gz XPUFVUPZWNASEJ-UYAOXDASSA-N 2 1 358.530 2.044 10 0 FEAEMP CC(C)[NH+]1CCN(CCC[N@@H+]2C[C@@H](c3ccsc3)[C@H](CO)C2)CC1 ZINC000192835023 328342818 /nfs/dbraw/zinc/34/28/18/328342818.db2.gz PSWROTMJJQPSGI-OALUTQOASA-N 2 1 351.560 2.172 10 0 FEAEMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[NH+]2CCC[C@@H]2C1 ZINC000171905501 327169376 /nfs/dbraw/zinc/16/93/76/327169376.db2.gz QGSMYJPEVDVVRH-IAGOWNOFSA-N 2 1 362.543 2.450 10 0 FEAEMP O=C(NC[C@H]1CCC[NH+](Cc2cccs2)C1)N1CC[N@@H+]2CCC[C@@H]2C1 ZINC000171905501 327169378 /nfs/dbraw/zinc/16/93/78/327169378.db2.gz QGSMYJPEVDVVRH-IAGOWNOFSA-N 2 1 362.543 2.450 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)Cn2c(C)nc3ccccc32)C[C@@H]1CC ZINC000172297858 327193604 /nfs/dbraw/zinc/19/36/04/327193604.db2.gz UEMVDLJFYNNLJQ-KRWDZBQOSA-N 2 1 358.486 2.304 10 0 FEAEMP CCOCCN1CCN(C(=O)Cn2c(C)nc3ccccc32)C[C@@H]1CC ZINC000172297858 327193605 /nfs/dbraw/zinc/19/36/05/327193605.db2.gz UEMVDLJFYNNLJQ-KRWDZBQOSA-N 2 1 358.486 2.304 10 0 FEAEMP O=C(c1ccccc1)N1CCC(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)CC1 ZINC000261958187 328831843 /nfs/dbraw/zinc/83/18/43/328831843.db2.gz PDFRZTTWRABACW-PWRODBHTSA-N 2 1 371.525 2.286 10 0 FEAEMP CCOCCOCc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c1 ZINC000261962927 328832336 /nfs/dbraw/zinc/83/23/36/328832336.db2.gz PTSLBICPGSYWEB-PWRODBHTSA-N 2 1 362.514 2.486 10 0 FEAEMP O=c1ccccn1Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)cc1 ZINC000261971612 328832602 /nfs/dbraw/zinc/83/26/02/328832602.db2.gz QRWJFTYZBUYFEX-NJDAHSKKSA-N 2 1 367.493 2.143 10 0 FEAEMP CC(C)[N@H+]1C[C@H](NC(=O)NCc2cccc(C[NH+]3CCOCC3)c2)[C@@H](C)C1 ZINC000157860759 545792702 /nfs/dbraw/zinc/79/27/02/545792702.db2.gz LODDMNGTEJEYCD-PXNSSMCTSA-N 2 1 374.529 2.047 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCc2cccc(C[NH+]3CCOCC3)c2)[C@@H](C)C1 ZINC000157860759 545792706 /nfs/dbraw/zinc/79/27/06/545792706.db2.gz LODDMNGTEJEYCD-PXNSSMCTSA-N 2 1 374.529 2.047 10 0 FEAEMP CN(c1ccccc1C[N@H+]1CC[C@@H](N2CCOCC2)C1)C1CC[NH+](C)CC1 ZINC000245539910 548941550 /nfs/dbraw/zinc/94/15/50/548941550.db2.gz LVLHOVYIBUWMQY-OAQYLSRUSA-N 2 1 372.557 2.124 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)C1 ZINC000245747844 548987148 /nfs/dbraw/zinc/98/71/48/548987148.db2.gz ANFWQCUQWJMVQV-BRWVUGGUSA-N 2 1 350.894 2.431 10 0 FEAEMP C[C@@H](c1ccc(NC(=O)N2CC[N@@H+]3CCC[C@H]3C2)cc1)[NH+]1CCOCC1 ZINC000246809953 549218489 /nfs/dbraw/zinc/21/84/89/549218489.db2.gz ZPTDTWCTRODVLD-LPHOPBHVSA-N 2 1 358.486 2.392 10 0 FEAEMP C[C@@H](c1ccc(NC(=O)N2CC[N@H+]3CCC[C@H]3C2)cc1)[NH+]1CCOCC1 ZINC000246809953 549218495 /nfs/dbraw/zinc/21/84/95/549218495.db2.gz ZPTDTWCTRODVLD-LPHOPBHVSA-N 2 1 358.486 2.392 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@H](C)C[NH+]2CCCCC2)C[C@@H]1CC ZINC000247116452 549284913 /nfs/dbraw/zinc/28/49/13/549284913.db2.gz NQGHDPAIIUIPKN-OALUTQOASA-N 2 1 368.566 2.251 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N[C@H]3C[N@H+](C(C)C)C[C@H]3C)cc2)CC1 ZINC000247337070 549321801 /nfs/dbraw/zinc/32/18/01/549321801.db2.gz NGZIYUVXZPIGBF-XLIONFOSSA-N 2 1 358.530 2.287 10 0 FEAEMP Cn1cc(C[NH+]2CCC3(CC[C@H](C[N@@H+](C)Cc4ccncc4)O3)CC2)cn1 ZINC000257192167 549715678 /nfs/dbraw/zinc/71/56/78/549715678.db2.gz SSKZIHVLTAQPHV-HXUWFJFHSA-N 2 1 369.513 2.461 10 0 FEAEMP O[C@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1ccc(Br)cc1C(F)(F)F ZINC000263243715 549888464 /nfs/dbraw/zinc/88/84/64/549888464.db2.gz OYSVZIQDKRZKDQ-CABZTGNLSA-N 2 1 353.182 2.138 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CCN(C)Cc2ccc(F)cc2)CC1 ZINC000181689795 672429588 /nfs/dbraw/zinc/42/95/88/672429588.db2.gz RYYCXPNPXSFWOC-KRWDZBQOSA-N 2 1 351.510 2.282 10 0 FEAEMP COCc1nc(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000666456132 679025965 /nfs/dbraw/zinc/02/59/65/679025965.db2.gz VRSIQFBYFPFSJE-UHFFFAOYSA-N 2 1 361.511 2.406 10 0 FEAEMP CC[N@@H+]1CCC[C@@H](NS(=O)(=O)c2ccc(C[NH2+]C3CCCC3)cc2)C1 ZINC000098178631 209205603 /nfs/dbraw/zinc/20/56/03/209205603.db2.gz FBBKDQITFFRACC-GOSISDBHSA-N 2 1 365.543 2.481 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NS(=O)(=O)c2ccc(C[NH2+]C3CCCC3)cc2)C1 ZINC000098178631 209205607 /nfs/dbraw/zinc/20/56/07/209205607.db2.gz FBBKDQITFFRACC-GOSISDBHSA-N 2 1 365.543 2.481 10 0 FEAEMP O=C([C@H](c1cccnc1)[NH+]1CCCC1)N1CCC([NH+]2CCSCC2)CC1 ZINC000095373636 209034822 /nfs/dbraw/zinc/03/48/22/209034822.db2.gz LUCRIMBVBUWWJT-IBGZPJMESA-N 2 1 374.554 2.258 10 0 FEAEMP C[NH+](C)CCOc1ccc(CNC(=O)N2CC[N@H+]3CCCC[C@H]3C2)cc1 ZINC000105113806 543159411 /nfs/dbraw/zinc/15/94/11/543159411.db2.gz LDGAWMDZJGKQMD-SFHVURJKSA-N 2 1 360.502 2.007 10 0 FEAEMP C[NH+](C)CCOc1ccccc1CNC(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000105205421 543164217 /nfs/dbraw/zinc/16/42/17/543164217.db2.gz FWZBRUSAFVNHFM-GOSISDBHSA-N 2 1 360.502 2.007 10 0 FEAEMP CC[C@H]1CN(C(=O)[C@@H]2CCC[NH+]2Cc2ccccc2)CC[N@@H+]1CCOC ZINC000117300301 543629030 /nfs/dbraw/zinc/62/90/30/543629030.db2.gz FLQPJRVXFZNWAO-PMACEKPBSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@H]1CN(C(=O)[C@@H]2CCC[NH+]2Cc2ccccc2)CC[N@H+]1CCOC ZINC000117300301 543629032 /nfs/dbraw/zinc/62/90/32/543629032.db2.gz FLQPJRVXFZNWAO-PMACEKPBSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@H]1CN(C(=O)[C@@H]2CCC[N@@H+]2Cc2ccccc2)CC[NH+]1CCOC ZINC000117300301 543629034 /nfs/dbraw/zinc/62/90/34/543629034.db2.gz FLQPJRVXFZNWAO-PMACEKPBSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@H]1CN(C(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)CC[NH+]1CCOC ZINC000117300301 543629035 /nfs/dbraw/zinc/62/90/35/543629035.db2.gz FLQPJRVXFZNWAO-PMACEKPBSA-N 2 1 359.514 2.220 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1Cc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000131619260 544198105 /nfs/dbraw/zinc/19/81/05/544198105.db2.gz GHNSYZOPJLCNNK-KRWDZBQOSA-N 2 1 362.499 2.106 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1Cc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000131619260 544198108 /nfs/dbraw/zinc/19/81/08/544198108.db2.gz GHNSYZOPJLCNNK-KRWDZBQOSA-N 2 1 362.499 2.106 10 0 FEAEMP CC[N@@H+](CC(=O)N(C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1)C1CC1 ZINC000153420566 544773354 /nfs/dbraw/zinc/77/33/54/544773354.db2.gz KWJQLEPVFQVJMP-OAQYLSRUSA-N 2 1 373.541 2.375 10 0 FEAEMP CC[NH+](CC)[C@@H](C)CNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190692073 328224909 /nfs/dbraw/zinc/22/49/09/328224909.db2.gz KDYMPJOJMWAWOY-HKUYNNGSSA-N 2 1 361.534 2.275 10 0 FEAEMP CC1CC[NH+](CCNC(=O)N2CC[C@@H](C[N@@H+](C)Cc3cccnc3)C2)CC1 ZINC000190692533 328224955 /nfs/dbraw/zinc/22/49/55/328224955.db2.gz OYTWVHURQSVVTJ-FQEVSTJZSA-N 2 1 373.545 2.277 10 0 FEAEMP C[NH+](C)[C@H]1CC[C@@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000091982376 325399547 /nfs/dbraw/zinc/39/95/47/325399547.db2.gz VYKKGAQJFYBOMA-MOPGFXCFSA-N 2 1 360.502 2.166 10 0 FEAEMP CCCC[NH+]1CCC(NC(=O)N2CC[N@@H+](CCOC)[C@@H](CC)C2)CC1 ZINC000117488668 326062717 /nfs/dbraw/zinc/06/27/17/326062717.db2.gz AGXBNHBNRHZXQK-SFHVURJKSA-N 2 1 354.539 2.003 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)NCc2ccc(OCCC[NH+](C)C)cc2)C1 ZINC000171351186 327134147 /nfs/dbraw/zinc/13/41/47/327134147.db2.gz ICRDFNAHWVMXGT-GOSISDBHSA-N 2 1 362.518 2.301 10 0 FEAEMP Cc1cc(=O)n2nc(C[N@H+]3CC[C@H](CNc4cccc(C)[nH+]4)C3)sc2n1 ZINC000171651169 327151757 /nfs/dbraw/zinc/15/17/57/327151757.db2.gz BWCYQDFJAXXCDT-CQSZACIVSA-N 2 1 370.482 2.097 10 0 FEAEMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)Nc2ccn(CC[NH+](C)C)n2)C1 ZINC000173954674 327297438 /nfs/dbraw/zinc/29/74/38/327297438.db2.gz FFKFORMMQKJWTH-OAHLLOKOSA-N 2 1 359.478 2.073 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)CC[C@@H]2CC[NH2+]C2)C[C@@H](C)O1 ZINC000261904244 328828210 /nfs/dbraw/zinc/82/82/10/328828210.db2.gz VKILIOMEGSHMMQ-KZNAEPCWSA-N 2 1 359.514 2.302 10 0 FEAEMP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)CC1 ZINC000261999782 328834517 /nfs/dbraw/zinc/83/45/17/328834517.db2.gz UJHAVTKWLJBMMD-UMSONDCASA-N 2 1 358.530 2.354 10 0 FEAEMP COc1ccc(C2(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3COCC[NH2+]3)CCOCC2)cc1 ZINC000262016157 328835695 /nfs/dbraw/zinc/83/56/95/328835695.db2.gz VZWZSTOEXYBUPV-HBMCJLEFSA-N 2 1 374.525 2.490 10 0 FEAEMP CC(C)(C)c1nn(-c2ccccc2Cl)cc1C[NH2+]C[C@H]1C[NH2+]C[C@@H]1O ZINC000262197997 328850138 /nfs/dbraw/zinc/85/01/38/328850138.db2.gz ZQEBEMMJUKLJDD-GUYCJALGSA-N 2 1 362.905 2.493 10 0 FEAEMP Cc1cnn([C@@H]2CCC[N@@H+](CC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)C2)c1 ZINC000158423622 545860015 /nfs/dbraw/zinc/86/00/15/545860015.db2.gz ZPVKDPDJZATEPC-UXHICEINSA-N 2 1 369.513 2.248 10 0 FEAEMP Cc1cnn([C@@H]2CCC[N@H+](CC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)C2)c1 ZINC000158423622 545860020 /nfs/dbraw/zinc/86/00/20/545860020.db2.gz ZPVKDPDJZATEPC-UXHICEINSA-N 2 1 369.513 2.248 10 0 FEAEMP COc1ccccc1CCNC(=O)C[N@@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000178320351 546774987 /nfs/dbraw/zinc/77/49/87/546774987.db2.gz JAAXXOWBAIAODG-SFHVURJKSA-N 2 1 356.470 2.023 10 0 FEAEMP COc1ccccc1CCNC(=O)C[N@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000178320351 546774990 /nfs/dbraw/zinc/77/49/90/546774990.db2.gz JAAXXOWBAIAODG-SFHVURJKSA-N 2 1 356.470 2.023 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2C)C1 ZINC000194324134 548465185 /nfs/dbraw/zinc/46/51/85/548465185.db2.gz FULIDPYDNXTIEO-QGZVFWFLSA-N 2 1 359.518 2.353 10 0 FEAEMP CC(C)CO[C@H](C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000245498605 548933767 /nfs/dbraw/zinc/93/37/67/548933767.db2.gz WNSVEXANBZJZET-JKSUJKDBSA-N 2 1 368.522 2.328 10 0 FEAEMP CC(C)CO[C@H](C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000245498605 548933770 /nfs/dbraw/zinc/93/37/70/548933770.db2.gz WNSVEXANBZJZET-JKSUJKDBSA-N 2 1 368.522 2.328 10 0 FEAEMP CC(C)[C@H](C)[N@H+]1Cc2cccc(NC(=O)C(=O)N3CC[C@@H]([NH+](C)C)C3)c2C1 ZINC000246020125 549038102 /nfs/dbraw/zinc/03/81/02/549038102.db2.gz OJUQGTNCFWYAIE-DOTOQJQBSA-N 2 1 372.513 2.148 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000246322803 549106383 /nfs/dbraw/zinc/10/63/83/549106383.db2.gz OCDMGYQOFUZJIV-MSOLQXFVSA-N 2 1 368.485 2.344 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000246322803 549106387 /nfs/dbraw/zinc/10/63/87/549106387.db2.gz OCDMGYQOFUZJIV-MSOLQXFVSA-N 2 1 368.485 2.344 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C)C(=O)N(C)C2CCCCC2)CC1 ZINC000246332161 549107806 /nfs/dbraw/zinc/10/78/06/549107806.db2.gz LDXIUOWRJIYHNX-IAGOWNOFSA-N 2 1 353.551 2.191 10 0 FEAEMP CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@@H](O)C[NH+]2CCCCC2)C1 ZINC000246628770 549177708 /nfs/dbraw/zinc/17/77/08/549177708.db2.gz NXESBYXTYDLUAO-QZTJIDSGSA-N 2 1 368.566 2.033 10 0 FEAEMP CCOCCN1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000247201095 549298124 /nfs/dbraw/zinc/29/81/24/549298124.db2.gz TUKZBGCJFATQOM-FPOVZHCZSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[N@@H+]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000247201095 549298128 /nfs/dbraw/zinc/29/81/28/549298128.db2.gz TUKZBGCJFATQOM-FPOVZHCZSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000247201095 549298130 /nfs/dbraw/zinc/29/81/30/549298130.db2.gz TUKZBGCJFATQOM-FPOVZHCZSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000247201095 549298134 /nfs/dbraw/zinc/29/81/34/549298134.db2.gz TUKZBGCJFATQOM-FPOVZHCZSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000247201095 549298138 /nfs/dbraw/zinc/29/81/38/549298138.db2.gz TUKZBGCJFATQOM-FPOVZHCZSA-N 2 1 373.541 2.468 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1C[C@H]2CCC[N@@H+]2C[C@@H]1C ZINC000248783774 549501292 /nfs/dbraw/zinc/50/12/92/549501292.db2.gz IDKYZTZSRQAXAP-BWPNAZKDSA-N 2 1 356.514 2.385 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1C[C@H]2CCC[N@H+]2C[C@@H]1C ZINC000248783774 549501296 /nfs/dbraw/zinc/50/12/96/549501296.db2.gz IDKYZTZSRQAXAP-BWPNAZKDSA-N 2 1 356.514 2.385 10 0 FEAEMP COc1ccccc1C[N@H+]1C[C@@H](C(=O)NC2CC2)C2(C1)CC[NH+](C)CC2 ZINC000257174906 549711549 /nfs/dbraw/zinc/71/15/49/549711549.db2.gz LVEBGJXZEREBPQ-SFHVURJKSA-N 2 1 357.498 2.118 10 0 FEAEMP [NH3+]C[C@@H]1C[N@H+](CC(=O)N2CCc3sccc3C2)C[C@H]1c1ccccc1 ZINC000261661101 549740602 /nfs/dbraw/zinc/74/06/02/549740602.db2.gz GXDLEVPMLMVVRK-MSOLQXFVSA-N 2 1 355.507 2.307 10 0 FEAEMP [NH3+]C[C@@H]1C[N@@H+](CC(=O)N2CCc3sccc3C2)C[C@H]1c1ccccc1 ZINC000261661101 549740606 /nfs/dbraw/zinc/74/06/06/549740606.db2.gz GXDLEVPMLMVVRK-MSOLQXFVSA-N 2 1 355.507 2.307 10 0 FEAEMP C[C@@H](C(=O)NCCc1cccs1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261691599 549742971 /nfs/dbraw/zinc/74/29/71/549742971.db2.gz IZDKLWDIAZLSMQ-WDYCEAGBSA-N 2 1 357.523 2.470 10 0 FEAEMP C[C@@H](C(=O)NCCc1cccs1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261691599 549742974 /nfs/dbraw/zinc/74/29/74/549742974.db2.gz IZDKLWDIAZLSMQ-WDYCEAGBSA-N 2 1 357.523 2.470 10 0 FEAEMP [NH3+]C1(C(=O)N2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCOCC1 ZINC000261845711 549761393 /nfs/dbraw/zinc/76/13/93/549761393.db2.gz LXJVNIAMMPMDMT-HXUWFJFHSA-N 2 1 357.498 2.009 10 0 FEAEMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)[C@H]2[NH2+]CCO[C@@H]2C)C1 ZINC000262266148 549803822 /nfs/dbraw/zinc/80/38/22/549803822.db2.gz MOTQTKHFVOZKHY-VIPLHTEESA-N 2 1 359.514 2.158 10 0 FEAEMP CN(Cc1ccccc1Br)C(=O)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000262562536 549828413 /nfs/dbraw/zinc/82/84/13/549828413.db2.gz VVRMYJFMRAPVKO-JGGQBBKZSA-N 2 1 366.303 2.077 10 0 FEAEMP CN(Cc1ccccc1Br)C(=O)C[N@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000262562536 549828415 /nfs/dbraw/zinc/82/84/15/549828415.db2.gz VVRMYJFMRAPVKO-JGGQBBKZSA-N 2 1 366.303 2.077 10 0 FEAEMP FC(F)(F)CN1CCC(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)CC1 ZINC000261919612 672905649 /nfs/dbraw/zinc/90/56/49/672905649.db2.gz KCYGYJIADLZQKF-ZACQAIPSSA-N 2 1 363.468 2.398 10 0 FEAEMP COCC[NH+]1CCC(C[N@H+](Cc2ccc(CO)o2)C[C@@H]2CCCO2)CC1 ZINC000012385172 207368896 /nfs/dbraw/zinc/36/88/96/207368896.db2.gz SVIZARXCZVKTBI-SFHVURJKSA-N 2 1 366.502 2.111 10 0 FEAEMP O=C(Nc1ccc(CCN2CCOCC2)cc1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000105013082 543154914 /nfs/dbraw/zinc/15/49/14/543154914.db2.gz YMTVJCTUIZKCIU-HXUWFJFHSA-N 2 1 372.513 2.263 10 0 FEAEMP Cc1nc(C[NH+]2CCC(C(=O)N3C[C@@H]4CCC[N@H+]4C[C@@H]3C)CC2)cs1 ZINC000113231313 543478407 /nfs/dbraw/zinc/47/84/07/543478407.db2.gz SSCSOXJOVYNTLJ-KSSFIOAISA-N 2 1 362.543 2.359 10 0 FEAEMP Cc1nc(C[NH+]2CCC(C(=O)N3C[C@@H]4CCC[N@@H+]4C[C@@H]3C)CC2)cs1 ZINC000113231313 543478409 /nfs/dbraw/zinc/47/84/09/543478409.db2.gz SSCSOXJOVYNTLJ-KSSFIOAISA-N 2 1 362.543 2.359 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(OCCC[NH+](C)C)cc1 ZINC000113614707 543492765 /nfs/dbraw/zinc/49/27/65/543492765.db2.gz NSCWBESUHGRISF-IEBWSBKVSA-N 2 1 374.529 2.395 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N[C@@H]2C[NH+](C(C)C)C[C@H]2C)[C@H](C)C1 ZINC000247458075 549336381 /nfs/dbraw/zinc/33/63/81/549336381.db2.gz UDTOBGBMGIFMKG-AKHDSKFASA-N 2 1 368.566 2.151 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@H]2C)[C@H](C)C1 ZINC000247458075 549336382 /nfs/dbraw/zinc/33/63/82/549336382.db2.gz UDTOBGBMGIFMKG-AKHDSKFASA-N 2 1 368.566 2.151 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)[C@H](C)C1 ZINC000247458075 549336383 /nfs/dbraw/zinc/33/63/83/549336383.db2.gz UDTOBGBMGIFMKG-AKHDSKFASA-N 2 1 368.566 2.151 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCC2([NH+]3CCSCC3)CCCC2)C1 ZINC000132252181 544224289 /nfs/dbraw/zinc/22/42/89/544224289.db2.gz WVSKYKLZAFHYED-SJORKVTESA-N 2 1 368.591 2.376 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)c1 ZINC000150778475 544469604 /nfs/dbraw/zinc/46/96/04/544469604.db2.gz KZRVHIUUIMCLNZ-LPHOPBHVSA-N 2 1 374.529 2.312 10 0 FEAEMP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000152437956 544653749 /nfs/dbraw/zinc/65/37/49/544653749.db2.gz BRAQAWUOTYTIOX-GOSISDBHSA-N 2 1 368.566 2.107 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000152437956 544653757 /nfs/dbraw/zinc/65/37/57/544653757.db2.gz BRAQAWUOTYTIOX-GOSISDBHSA-N 2 1 368.566 2.107 10 0 FEAEMP CCC[C@@H](C(=O)N1CCC[C@@H]([N@H+](C)CC(=O)OC(C)(C)C)CC1)[NH+](C)C ZINC000191588491 328273084 /nfs/dbraw/zinc/27/30/84/328273084.db2.gz GIBMIBKFWIYZOK-SJORKVTESA-N 2 1 369.550 2.371 10 0 FEAEMP CCC[C@@H](C(=O)N1CCC[C@@H]([N@@H+](C)CC(=O)OC(C)(C)C)CC1)[NH+](C)C ZINC000191588491 328273085 /nfs/dbraw/zinc/27/30/85/328273085.db2.gz GIBMIBKFWIYZOK-SJORKVTESA-N 2 1 369.550 2.371 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@@H]1COc2ccccc21 ZINC000174440252 327327109 /nfs/dbraw/zinc/32/71/09/327327109.db2.gz PTYNIXXLSAVLDY-FUHWJXTLSA-N 2 1 360.502 2.178 10 0 FEAEMP CCC(CC)[C@@H](CNC(=O)N(C)C[C@H]1CCC[N@@H+]1CC)[NH+]1CCOCC1 ZINC000177344713 546598084 /nfs/dbraw/zinc/59/80/84/546598084.db2.gz SDFAQGQOQOGGAO-RTBURBONSA-N 2 1 368.566 2.249 10 0 FEAEMP CCC(CC)[C@@H](CNC(=O)N(C)C[C@H]1CCC[N@H+]1CC)[NH+]1CCOCC1 ZINC000177344713 546598088 /nfs/dbraw/zinc/59/80/88/546598088.db2.gz SDFAQGQOQOGGAO-RTBURBONSA-N 2 1 368.566 2.249 10 0 FEAEMP COCc1ccc(CNC(=O)C[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)cc1 ZINC000178750828 546843176 /nfs/dbraw/zinc/84/31/76/546843176.db2.gz XBQDKMFIUOULGF-IBGZPJMESA-N 2 1 356.470 2.119 10 0 FEAEMP COCc1ccc(CNC(=O)C[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)cc1 ZINC000178750828 546843178 /nfs/dbraw/zinc/84/31/78/546843178.db2.gz XBQDKMFIUOULGF-IBGZPJMESA-N 2 1 356.470 2.119 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)NCCO[C@@H]1CCCC[C@@H]1C ZINC000178752428 546844608 /nfs/dbraw/zinc/84/46/08/546844608.db2.gz JRBWZNKMAUWKSU-YTQUADARSA-N 2 1 362.518 2.367 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NCCO[C@@H]1CCCC[C@@H]1C ZINC000178752428 546844612 /nfs/dbraw/zinc/84/46/12/546844612.db2.gz JRBWZNKMAUWKSU-YTQUADARSA-N 2 1 362.518 2.367 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCCCC[NH+]2CCCCC2)CC[N@H+]1C[C@@H](C)O ZINC000181802715 547384221 /nfs/dbraw/zinc/38/42/21/547384221.db2.gz JXNPIKGQOOJLHN-MOPGFXCFSA-N 2 1 368.566 2.129 10 0 FEAEMP CC[N@@H+]1CCC[C@@H](NC(=O)NC[C@@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000194153278 548441844 /nfs/dbraw/zinc/44/18/44/548441844.db2.gz UHLOZQVDYFIBNY-GDBMZVCRSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)NC[C@@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000194153278 548441845 /nfs/dbraw/zinc/44/18/45/548441845.db2.gz UHLOZQVDYFIBNY-GDBMZVCRSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)C1 ZINC000194153278 548441846 /nfs/dbraw/zinc/44/18/46/548441846.db2.gz UHLOZQVDYFIBNY-GDBMZVCRSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)C1 ZINC000194153278 548441847 /nfs/dbraw/zinc/44/18/47/548441847.db2.gz UHLOZQVDYFIBNY-GDBMZVCRSA-N 2 1 350.532 2.278 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000245540884 548942393 /nfs/dbraw/zinc/94/23/93/548942393.db2.gz PSJVUGFAZXPKGO-QFBILLFUSA-N 2 1 359.518 2.326 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)C1 ZINC000245652707 548966175 /nfs/dbraw/zinc/96/61/75/548966175.db2.gz FAHHSTIDWCTRFF-WBAXXEDZSA-N 2 1 366.456 2.494 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246475482 549141280 /nfs/dbraw/zinc/14/12/80/549141280.db2.gz HBHXTXWRDMQCJW-WSTZPKSXSA-N 2 1 374.529 2.012 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246475482 549141284 /nfs/dbraw/zinc/14/12/84/549141284.db2.gz HBHXTXWRDMQCJW-WSTZPKSXSA-N 2 1 374.529 2.012 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246475482 549141288 /nfs/dbraw/zinc/14/12/88/549141288.db2.gz HBHXTXWRDMQCJW-WSTZPKSXSA-N 2 1 374.529 2.012 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246475482 549141290 /nfs/dbraw/zinc/14/12/90/549141290.db2.gz HBHXTXWRDMQCJW-WSTZPKSXSA-N 2 1 374.529 2.012 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000246504663 549148794 /nfs/dbraw/zinc/14/87/94/549148794.db2.gz UJQCWWQNRBVDQP-SFTDATJTSA-N 2 1 370.541 2.431 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(OCC[NH+](C)C)cc1 ZINC000246582920 549167702 /nfs/dbraw/zinc/16/77/02/549167702.db2.gz ZUYSQSGPCIYIAN-OALUTQOASA-N 2 1 374.529 2.395 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)CCC[NH+]2CCN(c3ccccc3)CC2)C1 ZINC000246747752 549203344 /nfs/dbraw/zinc/20/33/44/549203344.db2.gz BFOVYWITFCFSCN-TZIWHRDSSA-N 2 1 372.557 2.434 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)C[C@@H]1C ZINC000247185454 549296558 /nfs/dbraw/zinc/29/65/58/549296558.db2.gz RZKAKYWYWNORFU-AZUAARDMSA-N 2 1 374.529 2.186 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)C[C@@H]1C ZINC000247185454 549296560 /nfs/dbraw/zinc/29/65/60/549296560.db2.gz RZKAKYWYWNORFU-AZUAARDMSA-N 2 1 374.529 2.186 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)[C@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000249271681 549574568 /nfs/dbraw/zinc/57/45/68/549574568.db2.gz JHLJMGMVNKKBJL-HZPDHXFCSA-N 2 1 364.538 2.264 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000249271681 549574572 /nfs/dbraw/zinc/57/45/72/549574572.db2.gz JHLJMGMVNKKBJL-HZPDHXFCSA-N 2 1 364.538 2.264 10 0 FEAEMP C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)N1CC[NH+]2CCC[C@H]2C1)C1CC1 ZINC000251667616 549651279 /nfs/dbraw/zinc/65/12/79/549651279.db2.gz LNZOMRULBHLBTA-VQTJNVASSA-N 2 1 356.514 2.387 10 0 FEAEMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000251667616 549651281 /nfs/dbraw/zinc/65/12/81/549651281.db2.gz LNZOMRULBHLBTA-VQTJNVASSA-N 2 1 356.514 2.387 10 0 FEAEMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)C1CC1 ZINC000251667616 549651286 /nfs/dbraw/zinc/65/12/86/549651286.db2.gz LNZOMRULBHLBTA-VQTJNVASSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@H](C(=O)NCCc1cccs1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261691595 549743290 /nfs/dbraw/zinc/74/32/90/549743290.db2.gz IZDKLWDIAZLSMQ-SUMDDJOVSA-N 2 1 357.523 2.470 10 0 FEAEMP C[C@H](C(=O)NCCc1cccs1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261691595 549743292 /nfs/dbraw/zinc/74/32/92/549743292.db2.gz IZDKLWDIAZLSMQ-SUMDDJOVSA-N 2 1 357.523 2.470 10 0 FEAEMP C[C@@H](C(=O)NC(=O)NC1CCCCC1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262300778 549807772 /nfs/dbraw/zinc/80/77/72/549807772.db2.gz XKQYWKYAIQJIHK-WDYCEAGBSA-N 2 1 372.513 2.208 10 0 FEAEMP C[C@@H](C(=O)NC(=O)NC1CCCCC1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262300778 549807776 /nfs/dbraw/zinc/80/77/76/549807776.db2.gz XKQYWKYAIQJIHK-WDYCEAGBSA-N 2 1 372.513 2.208 10 0 FEAEMP CCOC(=O)CC[C@H](O)C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000385663299 558606492 /nfs/dbraw/zinc/60/64/92/558606492.db2.gz LBVISKMCDNULIU-VNTMZGSJSA-N 2 1 360.498 2.191 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)N(CC[NH+](C)C)Cc2ccccc2F)C1 ZINC000194169992 672750428 /nfs/dbraw/zinc/75/04/28/672750428.db2.gz KOLONAQNJFCTJG-QGZVFWFLSA-N 2 1 350.482 2.383 10 0 FEAEMP C[C@@H]1C[N@H+](CCCC[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@H](C)O1 ZINC000247530683 672851522 /nfs/dbraw/zinc/85/15/22/672851522.db2.gz OZGVRMHRYVPROW-BBWFWOEESA-N 2 1 355.523 2.475 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N(C)Cc2ccccc2)CC1 ZINC000106126228 543204824 /nfs/dbraw/zinc/20/48/24/543204824.db2.gz LPUURABJVNXLIM-MSOLQXFVSA-N 2 1 361.530 2.058 10 0 FEAEMP C[NH+](C)C[C@H]1CC[N@H+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000113513768 543489763 /nfs/dbraw/zinc/48/97/63/543489763.db2.gz OEVDJURXVAXJII-HIFRSBDPSA-N 2 1 357.292 2.072 10 0 FEAEMP C[NH+](C)C[C@H]1CC[N@@H+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000113513768 543489766 /nfs/dbraw/zinc/48/97/66/543489766.db2.gz OEVDJURXVAXJII-HIFRSBDPSA-N 2 1 357.292 2.072 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCCC[NH+]1CCc2ccccc2C1 ZINC000113591855 543491734 /nfs/dbraw/zinc/49/17/34/543491734.db2.gz LCXRCEDBRDFZHD-YLJYHZDGSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCCC[N@@H+]1CCc2ccccc2C1 ZINC000113591855 543491736 /nfs/dbraw/zinc/49/17/36/543491736.db2.gz LCXRCEDBRDFZHD-YLJYHZDGSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000113591855 543491738 /nfs/dbraw/zinc/49/17/38/543491738.db2.gz LCXRCEDBRDFZHD-YLJYHZDGSA-N 2 1 356.514 2.313 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[NH+]3C[C@@H]2C)[C@H](C)C1 ZINC000115852481 543590508 /nfs/dbraw/zinc/59/05/08/543590508.db2.gz JNTGDXQFATVCIL-XWSJACJDSA-N 2 1 366.550 2.002 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[N@@H+]3C[C@@H]2C)[C@H](C)C1 ZINC000115852481 543590510 /nfs/dbraw/zinc/59/05/10/543590510.db2.gz JNTGDXQFATVCIL-XWSJACJDSA-N 2 1 366.550 2.002 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)[C@H](C)C1 ZINC000115852481 543590512 /nfs/dbraw/zinc/59/05/12/543590512.db2.gz JNTGDXQFATVCIL-XWSJACJDSA-N 2 1 366.550 2.002 10 0 FEAEMP COc1cc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc(OC)c1OC ZINC000121140085 326316170 /nfs/dbraw/zinc/31/61/70/326316170.db2.gz XWQGHTRTPJIMDA-OAHLLOKOSA-N 2 1 366.502 2.237 10 0 FEAEMP COCOc1ccc(OC)cc1C[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000121139452 326316272 /nfs/dbraw/zinc/31/62/72/326316272.db2.gz WYRLTIRBLXCVKN-MRXNPFEDSA-N 2 1 366.502 2.203 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2nc(-c3cccnc3)no2)CC1 ZINC000171994141 327174923 /nfs/dbraw/zinc/17/49/23/327174923.db2.gz XQEZHVRXPZTXHT-GJZGRUSLSA-N 2 1 359.474 2.217 10 0 FEAEMP CCOc1c(OC)cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)cc1OC ZINC000261853690 328824677 /nfs/dbraw/zinc/82/46/77/328824677.db2.gz BKJNNQWWXGRYIU-ZACQAIPSSA-N 2 1 364.486 2.349 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@H+]1C[C@@H](C)O ZINC000174623762 546299706 /nfs/dbraw/zinc/29/97/06/546299706.db2.gz QNWKMQZWVQKJRB-HMXCVIKNSA-N 2 1 373.541 2.202 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC[NH+]1C[C@@H](C)O ZINC000174623762 546299713 /nfs/dbraw/zinc/29/97/13/546299713.db2.gz QNWKMQZWVQKJRB-HMXCVIKNSA-N 2 1 373.541 2.202 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC[NH+]1C[C@@H](C)O ZINC000174623762 546299717 /nfs/dbraw/zinc/29/97/17/546299717.db2.gz QNWKMQZWVQKJRB-HMXCVIKNSA-N 2 1 373.541 2.202 10 0 FEAEMP C(C[NH+]1CCO[C@H]2CCCC[C@H]21)OCC[N@H+]1CCO[C@H]2CCCC[C@@H]21 ZINC000178613043 546819357 /nfs/dbraw/zinc/81/93/57/546819357.db2.gz UIPWEEZTJSCMBX-YRPNKDGESA-N 2 1 352.519 2.290 10 0 FEAEMP C(C[NH+]1CCO[C@H]2CCCC[C@@H]21)OCC[N@H+]1CCO[C@H]2CCCC[C@H]21 ZINC000178613043 546819369 /nfs/dbraw/zinc/81/93/69/546819369.db2.gz UIPWEEZTJSCMBX-YRPNKDGESA-N 2 1 352.519 2.290 10 0 FEAEMP CC[NH+]1CCN(c2cccc(NC(=O)N3CC[N@H+]4CCC[C@@H]4C3)c2)CC1 ZINC000184900104 547896161 /nfs/dbraw/zinc/89/61/61/547896161.db2.gz WGGJMMJKKWUQKU-LJQANCHMSA-N 2 1 357.502 2.140 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000246137851 549060402 /nfs/dbraw/zinc/06/04/02/549060402.db2.gz JHWAQVOXAYJIBN-SJORKVTESA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000246137851 549060407 /nfs/dbraw/zinc/06/04/07/549060407.db2.gz JHWAQVOXAYJIBN-SJORKVTESA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000246137851 549060411 /nfs/dbraw/zinc/06/04/11/549060411.db2.gz JHWAQVOXAYJIBN-SJORKVTESA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000246137851 549060416 /nfs/dbraw/zinc/06/04/16/549060416.db2.gz JHWAQVOXAYJIBN-SJORKVTESA-N 2 1 362.543 2.374 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@H]1COc2ccccc21 ZINC000246360373 549114031 /nfs/dbraw/zinc/11/40/31/549114031.db2.gz PTYNIXXLSAVLDY-AEFFLSMTSA-N 2 1 360.502 2.178 10 0 FEAEMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)NC[C@H]1CN(C)CCO1 ZINC000246509173 549149706 /nfs/dbraw/zinc/14/97/06/549149706.db2.gz UPTIYLNEASQJSA-PXNSSMCTSA-N 2 1 374.529 2.191 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N2CC[N@H+]3CCCC[C@H]3C2)[NH+](C)C)c1 ZINC000246568413 549164097 /nfs/dbraw/zinc/16/40/97/549164097.db2.gz ZXROHYIWHWSEAP-HKUYNNGSSA-N 2 1 360.502 2.178 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)[C@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000246642948 549181337 /nfs/dbraw/zinc/18/13/37/549181337.db2.gz CLIRBZMBJIWYTK-IAGOWNOFSA-N 2 1 357.502 2.353 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000246642948 549181342 /nfs/dbraw/zinc/18/13/42/549181342.db2.gz CLIRBZMBJIWYTK-IAGOWNOFSA-N 2 1 357.502 2.353 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)[NH+](C)C)c1 ZINC000246756009 549205525 /nfs/dbraw/zinc/20/55/25/549205525.db2.gz BORDKEVOKFXVQV-LZQZEXGQSA-N 2 1 362.518 2.326 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)[NH+](C)C)c1 ZINC000246755999 549205858 /nfs/dbraw/zinc/20/58/58/549205858.db2.gz BORDKEVOKFXVQV-IPELMVKDSA-N 2 1 362.518 2.326 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@H]2CCC[NH+](C(C)C)C2)C[C@@H]1CC ZINC000246924516 549243475 /nfs/dbraw/zinc/24/34/75/549243475.db2.gz BKEQHJYJTMECMR-MOPGFXCFSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@H]2CCC[N@@H+](C(C)C)C2)C[C@@H]1CC ZINC000246924516 549243481 /nfs/dbraw/zinc/24/34/81/549243481.db2.gz BKEQHJYJTMECMR-MOPGFXCFSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)C[C@@H]1CC ZINC000246924516 549243483 /nfs/dbraw/zinc/24/34/83/549243483.db2.gz BKEQHJYJTMECMR-MOPGFXCFSA-N 2 1 368.566 2.249 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N[C@H]1C[N@H+](C(C)C)C[C@H]1C)[NH+]1CCOCC1 ZINC000247325997 549318974 /nfs/dbraw/zinc/31/89/74/549318974.db2.gz MSZVQPVGPJEUGE-NEWSRXKRSA-N 2 1 368.566 2.151 10 0 FEAEMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH2+][C@@H](C)[C@H]2CCCO2)CC1 ZINC000248629618 549471486 /nfs/dbraw/zinc/47/14/86/549471486.db2.gz WAVGIFGLJCSKGV-AZUAARDMSA-N 2 1 359.514 2.186 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)C(=O)Nc1cc(C[NH+](C)C)ccc1C ZINC000249234018 549572314 /nfs/dbraw/zinc/57/23/14/549572314.db2.gz VVGVKCJORJAGJN-MSOLQXFVSA-N 2 1 372.513 2.080 10 0 FEAEMP CC[N@@H+]1CCC[C@H](NC(=O)NC[C@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000249773038 549628112 /nfs/dbraw/zinc/62/81/12/549628112.db2.gz UHLOZQVDYFIBNY-HOCLYGCPSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)NC[C@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000249773038 549628116 /nfs/dbraw/zinc/62/81/16/549628116.db2.gz UHLOZQVDYFIBNY-HOCLYGCPSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)C1 ZINC000249773038 549628120 /nfs/dbraw/zinc/62/81/20/549628120.db2.gz UHLOZQVDYFIBNY-HOCLYGCPSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)C1 ZINC000249773038 549628123 /nfs/dbraw/zinc/62/81/23/549628123.db2.gz UHLOZQVDYFIBNY-HOCLYGCPSA-N 2 1 350.532 2.278 10 0 FEAEMP CC(C)[C@H](C(=O)N1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000261643127 549738124 /nfs/dbraw/zinc/73/81/24/549738124.db2.gz FUMIYMWLIJQHCC-LXDWIVHCSA-N 2 1 373.541 2.321 10 0 FEAEMP CC(C)[C@H](C(=O)N1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000261643127 549738128 /nfs/dbraw/zinc/73/81/28/549738128.db2.gz FUMIYMWLIJQHCC-LXDWIVHCSA-N 2 1 373.541 2.321 10 0 FEAEMP COCc1ccc(CNC(=O)C[N@@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cc1 ZINC000261691704 549743329 /nfs/dbraw/zinc/74/33/29/549743329.db2.gz JBBHPRUHYCGUBO-RTWAWAEBSA-N 2 1 367.493 2.124 10 0 FEAEMP COCc1ccc(CNC(=O)C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cc1 ZINC000261691704 549743331 /nfs/dbraw/zinc/74/33/31/549743331.db2.gz JBBHPRUHYCGUBO-RTWAWAEBSA-N 2 1 367.493 2.124 10 0 FEAEMP Cc1ccc([C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)N2CCOCC2)cc1 ZINC000261956928 549773583 /nfs/dbraw/zinc/77/35/83/549773583.db2.gz OZFJZEWUIBFHKC-CBPXPLCBSA-N 2 1 373.541 2.115 10 0 FEAEMP CC(C)[NH+]1CCC([NH2+][C@@H]2CC[C@@H]2NS(=O)(=O)Cc2ccccc2)CC1 ZINC000072435094 670495750 /nfs/dbraw/zinc/49/57/50/670495750.db2.gz AMWPAISPEIZOMY-MOPGFXCFSA-N 2 1 365.543 2.099 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N2CCCc3ccccc32)CC1 ZINC000106126538 543204539 /nfs/dbraw/zinc/20/45/39/543204539.db2.gz ZPPAUBHFBXEYHP-ROUUACIJSA-N 2 1 373.541 2.379 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC[C@@H]2CCC[NH+]2Cc2ccccc2)C[C@@H]1C ZINC000117497597 543634699 /nfs/dbraw/zinc/63/46/99/543634699.db2.gz CBGZSXMMHDCDOA-ICSRJNTNSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC[C@@H]2CCC[NH+]2Cc2ccccc2)C[C@@H]1C ZINC000117497597 543634703 /nfs/dbraw/zinc/63/47/03/543634703.db2.gz CBGZSXMMHDCDOA-ICSRJNTNSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@@H]2CCC[N@@H+]2Cc2ccccc2)C[C@@H]1C ZINC000117497597 543634706 /nfs/dbraw/zinc/63/47/06/543634706.db2.gz CBGZSXMMHDCDOA-ICSRJNTNSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)C[C@@H]1C ZINC000117497597 543634710 /nfs/dbraw/zinc/63/47/10/543634710.db2.gz CBGZSXMMHDCDOA-ICSRJNTNSA-N 2 1 374.529 2.013 10 0 FEAEMP Cc1cccc(OC[C@@H](O)C[N@H+](C)C2CCN(CCn3cccn3)CC2)c1 ZINC000155117114 544991730 /nfs/dbraw/zinc/99/17/30/544991730.db2.gz NPJCJAVAMTUOMJ-FQEVSTJZSA-N 2 1 372.513 2.028 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@H+](C)Cc2nc(-c3ccccc3F)no2)CC1 ZINC000189010301 328123296 /nfs/dbraw/zinc/12/32/96/328123296.db2.gz VPUAJSZIEWIEDG-AWEZNQCLSA-N 2 1 362.449 2.400 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2nc(-c3ccccc3F)no2)CC1 ZINC000189010301 328123297 /nfs/dbraw/zinc/12/32/97/328123297.db2.gz VPUAJSZIEWIEDG-AWEZNQCLSA-N 2 1 362.449 2.400 10 0 FEAEMP CC[NH+](CC)[C@H](C)CNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190692057 328224884 /nfs/dbraw/zinc/22/48/84/328224884.db2.gz KDYMPJOJMWAWOY-IEBWSBKVSA-N 2 1 361.534 2.275 10 0 FEAEMP CC[N@H+]1CCCC[C@@H]1C(=O)N1CCC(N(C)CC(=O)OC(C)(C)C)CC1 ZINC000191904392 328287969 /nfs/dbraw/zinc/28/79/69/328287969.db2.gz SSCRNWXJEDKWMQ-QGZVFWFLSA-N 2 1 367.534 2.125 10 0 FEAEMP 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0 FEAEMP CC[C@@H]1CN(C(=O)NCCC[N@@H+](C)C2CCCCC2)CC[NH+]1C[C@@H](C)O ZINC000184834710 547884990 /nfs/dbraw/zinc/88/49/90/547884990.db2.gz UCQOCQNLHIMJHL-QZTJIDSGSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@@H](O)C[NH+]2CCCCC2)C1 ZINC000246628789 549177906 /nfs/dbraw/zinc/17/79/06/549177906.db2.gz NXESBYXTYDLUAO-ZWKOTPCHSA-N 2 1 368.566 2.033 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CCC[NH+]1CCN(c2ccccc2)CC1 ZINC000246779112 549210246 /nfs/dbraw/zinc/21/02/46/549210246.db2.gz BDUCJJOBULNFSR-CTNGQTDRSA-N 2 1 370.541 2.284 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[N@H+]2C[C@H]1C)[NH+]1CCc2ccccc2C1 ZINC000246831733 549223992 /nfs/dbraw/zinc/22/39/92/549223992.db2.gz CTOQFUQCGAAYQB-HLIPFELVSA-N 2 1 356.514 2.311 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[NH+]2C[C@H]1C)[N@@H+]1CCc2ccccc2C1 ZINC000246831733 549223995 /nfs/dbraw/zinc/22/39/95/549223995.db2.gz CTOQFUQCGAAYQB-HLIPFELVSA-N 2 1 356.514 2.311 10 0 FEAEMP 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546614939 /nfs/dbraw/zinc/61/49/39/546614939.db2.gz KUPKNBGZPYFBNR-MRXNPFEDSA-N 2 1 350.532 2.232 10 0 FEAEMP CC[NH+]1CCC[C@@H]1CN(C)C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000177424457 546614941 /nfs/dbraw/zinc/61/49/41/546614941.db2.gz KUPKNBGZPYFBNR-MRXNPFEDSA-N 2 1 350.532 2.232 10 0 FEAEMP CC[NH+]1CCC[C@@H]1CN(C)C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000177424457 546614946 /nfs/dbraw/zinc/61/49/46/546614946.db2.gz KUPKNBGZPYFBNR-MRXNPFEDSA-N 2 1 350.532 2.232 10 0 FEAEMP Cc1nccn1C[C@@H]1CCC[N@@H+]1CC(=O)NCCCN(C)c1ccccc1 ZINC000178303425 546771810 /nfs/dbraw/zinc/77/18/10/546771810.db2.gz WJOASTVIQUUBMP-FQEVSTJZSA-N 2 1 369.513 2.299 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NCCCN(C)c1ccccc1 ZINC000178303425 546771817 /nfs/dbraw/zinc/77/18/17/546771817.db2.gz WJOASTVIQUUBMP-FQEVSTJZSA-N 2 1 369.513 2.299 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CC(=O)NCCOc1c(C)cccc1C ZINC000178755443 546844349 /nfs/dbraw/zinc/84/43/49/546844349.db2.gz ZIEYUQFQLAGJAV-LJQANCHMSA-N 2 1 370.497 2.468 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CC(=O)NCCOc1c(C)cccc1C ZINC000178755443 546844354 /nfs/dbraw/zinc/84/43/54/546844354.db2.gz ZIEYUQFQLAGJAV-LJQANCHMSA-N 2 1 370.497 2.468 10 0 FEAEMP CCOc1cccc(CNC(=O)C[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000178753632 546844926 /nfs/dbraw/zinc/84/49/26/546844926.db2.gz YKUVOJNQJAOGMM-GOSISDBHSA-N 2 1 356.470 2.371 10 0 FEAEMP CCOc1cccc(CNC(=O)C[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000178753632 546844931 /nfs/dbraw/zinc/84/49/31/546844931.db2.gz YKUVOJNQJAOGMM-GOSISDBHSA-N 2 1 356.470 2.371 10 0 FEAEMP COc1ccccc1[C@H](CNC(=O)NC[C@@H]1CCC[N@H+]1C)[NH+]1CCCC1 ZINC000195122111 548580684 /nfs/dbraw/zinc/58/06/84/548580684.db2.gz IPEIKQCZTGKMLU-WMZOPIPTSA-N 2 1 360.502 2.226 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@@H]2C[C@H](C)[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246475471 549141643 /nfs/dbraw/zinc/14/16/43/549141643.db2.gz HBHXTXWRDMQCJW-CMKODMSKSA-N 2 1 374.529 2.012 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@@H]2C[C@H](C)[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246475471 549141648 /nfs/dbraw/zinc/14/16/48/549141648.db2.gz HBHXTXWRDMQCJW-CMKODMSKSA-N 2 1 374.529 2.012 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246475471 549141653 /nfs/dbraw/zinc/14/16/53/549141653.db2.gz HBHXTXWRDMQCJW-CMKODMSKSA-N 2 1 374.529 2.012 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246475471 549141657 /nfs/dbraw/zinc/14/16/57/549141657.db2.gz HBHXTXWRDMQCJW-CMKODMSKSA-N 2 1 374.529 2.012 10 0 FEAEMP CC[N@H+]1CCCC[C@H]1C(=O)NCC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000247063415 549274668 /nfs/dbraw/zinc/27/46/68/549274668.db2.gz XOEQKVRDTDRSLG-LEWJYISDSA-N 2 1 373.541 2.423 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[NH+]3C[C@H]2C)[C@@H](C)C1 ZINC000247169927 549294087 /nfs/dbraw/zinc/29/40/87/549294087.db2.gz JNTGDXQFATVCIL-RDGPPVDQSA-N 2 1 366.550 2.002 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[N@@H+]3C[C@H]2C)[C@@H](C)C1 ZINC000247169927 549294092 /nfs/dbraw/zinc/29/40/92/549294092.db2.gz JNTGDXQFATVCIL-RDGPPVDQSA-N 2 1 366.550 2.002 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)[C@@H](C)C1 ZINC000247169927 549294094 /nfs/dbraw/zinc/29/40/94/549294094.db2.gz JNTGDXQFATVCIL-RDGPPVDQSA-N 2 1 366.550 2.002 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)[C@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000261635184 549737326 /nfs/dbraw/zinc/73/73/26/549737326.db2.gz CBRUIKPMLHPFOB-GDBMZVCRSA-N 2 1 354.292 2.224 10 0 FEAEMP [NH3+][C@@H](C(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2)C1CCOCC1 ZINC000261780686 549755145 /nfs/dbraw/zinc/75/51/45/549755145.db2.gz MZFLDTVIXRDPKX-IFMALSPDSA-N 2 1 371.525 2.255 10 0 FEAEMP COc1ccccc1N1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)C1 ZINC000262004353 549778648 /nfs/dbraw/zinc/77/86/48/549778648.db2.gz UXKZFMJGUUTQTA-HCXYKTFWSA-N 2 1 359.514 2.268 10 0 FEAEMP C([NH2+][C@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1)C1(N2CCSCC2)CCCC1 ZINC000262010231 549779833 /nfs/dbraw/zinc/77/98/33/549779833.db2.gz VLRZLSNNFOGTIZ-SQNIBIBYSA-N 2 1 353.576 2.095 10 0 FEAEMP COc1cc(C[NH2+]C[C@H]2C[NH2+]C[C@@H]2O)ccc1OCc1ccc(F)cc1 ZINC000263224690 549887005 /nfs/dbraw/zinc/88/70/05/549887005.db2.gz MPPKELOYJLIRGM-WMZOPIPTSA-N 2 1 360.429 2.083 10 0 FEAEMP Cc1ccc(NC(=O)[C@H]2CC[C@@H]([NH3+])C2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000263270221 549890895 /nfs/dbraw/zinc/89/08/95/549890895.db2.gz OUTCBVRTIPOINU-JKSUJKDBSA-N 2 1 358.486 2.485 10 0 FEAEMP Cc1cc(NC[C@H](O)C[NH+]2CCOCC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000301703745 553673047 /nfs/dbraw/zinc/67/30/47/553673047.db2.gz APEYGCXRKAYMEJ-ZDUSSCGKSA-N 2 1 367.396 2.250 10 0 FEAEMP CCOC(=O)CC[C@H](O)C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000385663278 558606560 /nfs/dbraw/zinc/60/65/60/558606560.db2.gz LBVISKMCDNULIU-FUMNGEBKSA-N 2 1 360.498 2.191 10 0 FEAEMP C[NH+](C)CCOc1cccc(CNC(=O)N2CC[N@H+]3CCCC[C@H]3C2)c1 ZINC000105114129 543158935 /nfs/dbraw/zinc/15/89/35/543158935.db2.gz ISLLRWIPZRHEDC-SFHVURJKSA-N 2 1 360.502 2.007 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)Nc2ccc(F)cc2Cl)CC1 ZINC000106126292 543204509 /nfs/dbraw/zinc/20/45/09/543204509.db2.gz VWLBERABCBDAST-CYBMUJFWSA-N 2 1 371.884 2.442 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@@H]2CCC[NH+](CC(C)C)C2)CC[N@H+]1CCOC ZINC000130694853 544161559 /nfs/dbraw/zinc/16/15/59/544161559.db2.gz RPWGRSYWBLFGNW-RBUKOAKNSA-N 2 1 368.566 2.107 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)CC[NH+]1CCOC ZINC000130694853 544161562 /nfs/dbraw/zinc/16/15/62/544161562.db2.gz RPWGRSYWBLFGNW-RBUKOAKNSA-N 2 1 368.566 2.107 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)CC[NH+]1CCOC ZINC000130694853 544161564 /nfs/dbraw/zinc/16/15/64/544161564.db2.gz RPWGRSYWBLFGNW-RBUKOAKNSA-N 2 1 368.566 2.107 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N[C@@H]3C[NH+](C(C)C)C[C@@H]3C)c2C1 ZINC000150793921 544473010 /nfs/dbraw/zinc/47/30/10/544473010.db2.gz WAFQFQBIAMQLQN-HNAYVOBHSA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N[C@@H]3C[NH+](C(C)C)C[C@@H]3C)c2C1 ZINC000150793921 544473013 /nfs/dbraw/zinc/47/30/13/544473013.db2.gz WAFQFQBIAMQLQN-HNAYVOBHSA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N[C@@H]3C[N@@H+](C(C)C)C[C@@H]3C)c2C1 ZINC000150793921 544473015 /nfs/dbraw/zinc/47/30/15/544473015.db2.gz WAFQFQBIAMQLQN-HNAYVOBHSA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N[C@@H]3C[N@H+](C(C)C)C[C@@H]3C)c2C1 ZINC000150793921 544473020 /nfs/dbraw/zinc/47/30/20/544473020.db2.gz WAFQFQBIAMQLQN-HNAYVOBHSA-N 2 1 372.513 2.196 10 0 FEAEMP Cc1cccc(OC[C@H](O)C[N@H+](C)C2CCN(CCn3cccn3)CC2)c1 ZINC000155117000 544991811 /nfs/dbraw/zinc/99/18/11/544991811.db2.gz NPJCJAVAMTUOMJ-HXUWFJFHSA-N 2 1 372.513 2.028 10 0 FEAEMP CN(C)c1cc[nH+]cc1C(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190647053 328221731 /nfs/dbraw/zinc/22/17/31/328221731.db2.gz AZKCSGRHJDGSJG-QGZVFWFLSA-N 2 1 353.470 2.137 10 0 FEAEMP CC[N@H+]1CCCC[C@H]1CNC(=O)N1CC[C@H](C[NH+](C)Cc2cccnc2)C1 ZINC000190709947 328226862 /nfs/dbraw/zinc/22/68/62/328226862.db2.gz OSPNCIFVDNNUBR-UXHICEINSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[NH+]1CCCC[C@H]1CNC(=O)N1CC[C@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000190709947 328226863 /nfs/dbraw/zinc/22/68/63/328226863.db2.gz OSPNCIFVDNNUBR-UXHICEINSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[NH+]1CCCC[C@H]1CNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190709947 328226864 /nfs/dbraw/zinc/22/68/64/328226864.db2.gz OSPNCIFVDNNUBR-UXHICEINSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC2CC[NH+](C(C)(C)C)CC2)CC[N@H+]1CCOC ZINC000117482909 326062560 /nfs/dbraw/zinc/06/25/60/326062560.db2.gz NORPHYSAXIAYLO-QGZVFWFLSA-N 2 1 354.539 2.002 10 0 FEAEMP CC(C)[N@H+]1C[C@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)[C@@H](C)C1 ZINC000120930164 326299652 /nfs/dbraw/zinc/29/96/52/326299652.db2.gz XDGGFQKDLDMXOG-PXNSSMCTSA-N 2 1 374.529 2.412 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)[C@@H](C)C1 ZINC000120930164 326299654 /nfs/dbraw/zinc/29/96/54/326299654.db2.gz XDGGFQKDLDMXOG-PXNSSMCTSA-N 2 1 374.529 2.412 10 0 FEAEMP COc1cc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc(OC)c1OC ZINC000121139956 326316212 /nfs/dbraw/zinc/31/62/12/326316212.db2.gz XWQGHTRTPJIMDA-HNNXBMFYSA-N 2 1 366.502 2.237 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)C[C@H](O)COc2ccc(Cl)cc2)CC1 ZINC000170941844 327108988 /nfs/dbraw/zinc/10/89/88/327108988.db2.gz HOSJUITULOFYQS-QAPCUYQASA-N 2 1 370.921 2.104 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2nc(-c3cccnc3)no2)CC1 ZINC000171994142 327174860 /nfs/dbraw/zinc/17/48/60/327174860.db2.gz XQEZHVRXPZTXHT-CABCVRRESA-N 2 1 359.474 2.217 10 0 FEAEMP O=C1CCCN1Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)cc1 ZINC000261929391 328829968 /nfs/dbraw/zinc/82/99/68/328829968.db2.gz LLUVPYNLWDTLNM-ZCNNSNEGSA-N 2 1 357.498 2.056 10 0 FEAEMP O=C1CCCN1Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)cc1 ZINC000261929384 328830140 /nfs/dbraw/zinc/83/01/40/328830140.db2.gz LLUVPYNLWDTLNM-VAMGGRTRSA-N 2 1 357.498 2.056 10 0 FEAEMP CCOc1cc(C[NH2+]C[C@H]2C[NH2+]C[C@@H]2O)ccc1OCc1ccccc1 ZINC000263293431 328931007 /nfs/dbraw/zinc/93/10/07/328931007.db2.gz VYPNMYSHDAJZST-OALUTQOASA-N 2 1 356.466 2.334 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N[C@H]1C[N@H+](C(C)C)C[C@@H]1C)[NH+]1CCOCC1 ZINC000156988888 545684752 /nfs/dbraw/zinc/68/47/52/545684752.db2.gz MSZVQPVGPJEUGE-WDSOQIARSA-N 2 1 368.566 2.151 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N2CCC(CCC[NH+]3CCOCC3)CC2)C1 ZINC000181429859 547314368 /nfs/dbraw/zinc/31/43/68/547314368.db2.gz BBXTUEUYBSYKIG-IBGZPJMESA-N 2 1 366.550 2.005 10 0 FEAEMP CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000246137845 549060230 /nfs/dbraw/zinc/06/02/30/549060230.db2.gz JHWAQVOXAYJIBN-IRXDYDNUSA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000246137845 549060236 /nfs/dbraw/zinc/06/02/36/549060236.db2.gz JHWAQVOXAYJIBN-IRXDYDNUSA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000246137845 549060241 /nfs/dbraw/zinc/06/02/41/549060241.db2.gz JHWAQVOXAYJIBN-IRXDYDNUSA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000246137845 549060244 /nfs/dbraw/zinc/06/02/44/549060244.db2.gz JHWAQVOXAYJIBN-IRXDYDNUSA-N 2 1 362.543 2.374 10 0 FEAEMP O=C(NC[C@@H](O)C[NH+]1CCCCC1)[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000246172411 549068804 /nfs/dbraw/zinc/06/88/04/549068804.db2.gz FGDVKZMMLPCBJY-WOJBJXKFSA-N 2 1 359.514 2.004 10 0 FEAEMP C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000246260712 549091824 /nfs/dbraw/zinc/09/18/24/549091824.db2.gz GHCQZLKJPBQZHP-XLAORIBOSA-N 2 1 353.551 2.189 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc(F)c2)CC1 ZINC000246965018 549253200 /nfs/dbraw/zinc/25/32/00/549253200.db2.gz BTGYIKPNDHSCOU-HUUCEWRRSA-N 2 1 351.466 2.177 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)C[C@@H](O)COc2ccc(Cl)cc2)CC1 ZINC000247573975 549361186 /nfs/dbraw/zinc/36/11/86/549361186.db2.gz HOSJUITULOFYQS-CRAIPNDOSA-N 2 1 370.921 2.104 10 0 FEAEMP COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc1 ZINC000247777314 549380045 /nfs/dbraw/zinc/38/00/45/549380045.db2.gz QXOAMAGMMFZALZ-JKSUJKDBSA-N 2 1 363.502 2.047 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000248717861 549489568 /nfs/dbraw/zinc/48/95/68/549489568.db2.gz FMPSZBQBCHONJA-RLLQIKCJSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000248717861 549489570 /nfs/dbraw/zinc/48/95/70/549489570.db2.gz FMPSZBQBCHONJA-RLLQIKCJSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248717861 549489572 /nfs/dbraw/zinc/48/95/72/549489572.db2.gz FMPSZBQBCHONJA-RLLQIKCJSA-N 2 1 356.514 2.387 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N1C[C@H]2CCC[N@@H+]2C[C@H]1C)[NH+]1CCOCC1 ZINC000252443792 549665697 /nfs/dbraw/zinc/66/56/97/549665697.db2.gz OZEMXPCFWZJIFF-QRQLOZEOSA-N 2 1 366.550 2.002 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N1C[C@H]2CCC[N@H+]2C[C@H]1C)[NH+]1CCOCC1 ZINC000252443792 549665701 /nfs/dbraw/zinc/66/57/01/549665701.db2.gz OZEMXPCFWZJIFF-QRQLOZEOSA-N 2 1 366.550 2.002 10 0 FEAEMP c1sc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)nc1-c1ccncc1 ZINC000261985666 549777355 /nfs/dbraw/zinc/77/73/55/549777355.db2.gz SAWCEOHVZQWFAP-BRWVUGGUSA-N 2 1 358.511 2.494 10 0 FEAEMP Cc1cccc(-c2c[nH]c([C@H]3CCC[N@H+]3CCC(=O)N3CC[NH2+]CC3)n2)c1 ZINC000262228167 549800693 /nfs/dbraw/zinc/80/06/93/549800693.db2.gz VCLJAVXHICDCHE-LJQANCHMSA-N 2 1 367.497 2.344 10 0 FEAEMP COc1ccccc1CCNC(=O)C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262259811 549803274 /nfs/dbraw/zinc/80/32/74/549803274.db2.gz RBKMGQWQRPVQIC-UXHICEINSA-N 2 1 367.493 2.028 10 0 FEAEMP COc1ccccc1CCNC(=O)C[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262259811 549803277 /nfs/dbraw/zinc/80/32/77/549803277.db2.gz RBKMGQWQRPVQIC-UXHICEINSA-N 2 1 367.493 2.028 10 0 FEAEMP O[C@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000263164829 549882794 /nfs/dbraw/zinc/88/27/94/549882794.db2.gz FCSUOHGFLAHMBK-RISCZKNCSA-N 2 1 368.300 2.243 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)S(=O)(=O)/C=C\c1ccccc1 ZINC000750857248 680136303 /nfs/dbraw/zinc/13/63/03/680136303.db2.gz ZLQXNILTQVLGEV-UIRWJGRMSA-N 2 1 365.543 2.335 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)S(=O)(=O)/C=C\c1ccccc1 ZINC000750857248 680136304 /nfs/dbraw/zinc/13/63/04/680136304.db2.gz ZLQXNILTQVLGEV-UIRWJGRMSA-N 2 1 365.543 2.335 10 0 FEAEMP C[N@H+](CC(=O)NC(C)(C)C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000106128128 543205943 /nfs/dbraw/zinc/20/59/43/543205943.db2.gz DPIGSIZUKHDRPY-LJQANCHMSA-N 2 1 361.530 2.279 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C(=O)NC2CC2)c2ccccc2)CC1 ZINC000106125950 543204328 /nfs/dbraw/zinc/20/43/28/543204328.db2.gz HYJLBVRAJWGLER-JXFKEZNVSA-N 2 1 359.514 2.031 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N[C@@H](c2ccccc2)C2CC2)CC1 ZINC000106125066 543204522 /nfs/dbraw/zinc/20/45/22/543204522.db2.gz DLIMOKOBGJWPRS-VGSWGCGISA-N 2 1 373.541 2.279 10 0 FEAEMP CCOc1ccc(OCC[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc1 ZINC000106125435 543204692 /nfs/dbraw/zinc/20/46/92/543204692.db2.gz FRAQOQAUKMTNEZ-KRWDZBQOSA-N 2 1 350.503 2.489 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCC2([NH+]3CCSCC3)CCCC2)C1 ZINC000247490711 549342839 /nfs/dbraw/zinc/34/28/39/549342839.db2.gz WVSKYKLZAFHYED-DLBZAZTESA-N 2 1 368.591 2.376 10 0 FEAEMP CCC[C@H]([NH3+])C(=O)NCCC[NH+]1CCN(c2ccccc2Cl)CC1 ZINC000236852422 328496379 /nfs/dbraw/zinc/49/63/79/328496379.db2.gz GYRMCXVOURRMTE-INIZCTEOSA-N 2 1 352.910 2.096 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC1CC[NH+](Cc2ccncc2)CC1 ZINC000174130420 327307898 /nfs/dbraw/zinc/30/78/98/327307898.db2.gz CWJMPYYDMBBGGK-WOJBJXKFSA-N 2 1 371.529 2.314 10 0 FEAEMP Fc1cccc(F)c1N1CC[C@H]([NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)C1 ZINC000261871764 328825894 /nfs/dbraw/zinc/82/58/94/328825894.db2.gz DFHOCZAOHZECFE-MJSCVDMRSA-N 2 1 351.441 2.290 10 0 FEAEMP Clc1cccnc1N1CC[C@H]([NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)C1 ZINC000261903301 328828251 /nfs/dbraw/zinc/82/82/51/328828251.db2.gz HXTYGLVSBSOOSU-ABFRBSLYSA-N 2 1 350.894 2.060 10 0 FEAEMP COc1cccc(N2CCC[C@H]([NH2+][C@@H]3CCC[C@H]3[C@H]3COCC[NH2+]3)C2)c1 ZINC000261925985 328829763 /nfs/dbraw/zinc/82/97/63/328829763.db2.gz LCOKRFINVVJPLF-LLUDDFSJSA-N 2 1 359.514 2.411 10 0 FEAEMP Cc1ccc([C@H](C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)N2CCOCC2)cc1 ZINC000261956931 328831813 /nfs/dbraw/zinc/83/18/13/328831813.db2.gz OZFJZEWUIBFHKC-YSFYHYPLSA-N 2 1 373.541 2.115 10 0 FEAEMP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H]2C[NH2+]C[C@H]2O)o1 ZINC000262163478 328847254 /nfs/dbraw/zinc/84/72/54/328847254.db2.gz TXIZZRQVNPLUOP-CRAIPNDOSA-N 2 1 352.438 2.111 10 0 FEAEMP CC(C)[N@H+]1C[C@H](NC(=O)NCC[NH+]2CCc3sccc3C2)[C@@H](C)C1 ZINC000158425982 545859519 /nfs/dbraw/zinc/85/95/19/545859519.db2.gz FPYGXGSJTRWHOM-HOCLYGCPSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCC[NH+]2CCc3sccc3C2)[C@@H](C)C1 ZINC000158425982 545859525 /nfs/dbraw/zinc/85/95/25/545859525.db2.gz FPYGXGSJTRWHOM-HOCLYGCPSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[NH+]1C[C@H](NC(=O)NCC[N@@H+]2CCc3sccc3C2)[C@@H](C)C1 ZINC000158425982 545859528 /nfs/dbraw/zinc/85/95/28/545859528.db2.gz FPYGXGSJTRWHOM-HOCLYGCPSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[NH+]1C[C@H](NC(=O)NCC[N@H+]2CCc3sccc3C2)[C@@H](C)C1 ZINC000158425982 545859532 /nfs/dbraw/zinc/85/95/32/545859532.db2.gz FPYGXGSJTRWHOM-HOCLYGCPSA-N 2 1 350.532 2.134 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC[NH+](C(C)C)CC2)C[C@H]1CC ZINC000172115149 546237236 /nfs/dbraw/zinc/23/72/36/546237236.db2.gz GEIMWAGKLORNLD-GOSISDBHSA-N 2 1 354.539 2.002 10 0 FEAEMP C[C@H]1CN(C(=O)NCCC[N@H+](C)C2CCCCC2)C[C@@H]1[NH+]1CCOCC1 ZINC000175668630 546330175 /nfs/dbraw/zinc/33/01/75/546330175.db2.gz ILAOPDLFSBYDKX-HKUYNNGSSA-N 2 1 366.550 2.003 10 0 FEAEMP C[C@H]1CN(C(=O)NCCC[N@@H+](C)C2CCCCC2)C[C@@H]1[NH+]1CCOCC1 ZINC000175668630 546330178 /nfs/dbraw/zinc/33/01/78/546330178.db2.gz ILAOPDLFSBYDKX-HKUYNNGSSA-N 2 1 366.550 2.003 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(CN(C)C(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000176867168 546498416 /nfs/dbraw/zinc/49/84/16/546498416.db2.gz OSNTYGIVRIVLAD-GHTZIAJQSA-N 2 1 373.541 2.202 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCc1cccc(OCC[NH+](C)C)c1 ZINC000177390667 546607571 /nfs/dbraw/zinc/60/75/71/546607571.db2.gz KVYNDRUPWMUZAO-GOSISDBHSA-N 2 1 362.518 2.253 10 0 FEAEMP COCc1ccccc1CNC(=O)C[N@H+]1CCC[C@H]1Cn1ccnc1C ZINC000178751069 546843066 /nfs/dbraw/zinc/84/30/66/546843066.db2.gz DTSLIZIVPOMDMY-IBGZPJMESA-N 2 1 356.470 2.119 10 0 FEAEMP COCc1ccccc1CNC(=O)C[N@@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000178751069 546843072 /nfs/dbraw/zinc/84/30/72/546843072.db2.gz DTSLIZIVPOMDMY-IBGZPJMESA-N 2 1 356.470 2.119 10 0 FEAEMP COCc1ccccc1CNC(=O)C[N@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000178751069 546843078 /nfs/dbraw/zinc/84/30/78/546843078.db2.gz DTSLIZIVPOMDMY-IBGZPJMESA-N 2 1 356.470 2.119 10 0 FEAEMP COc1cc(OC)c(OC)cc1C[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000179516699 546970033 /nfs/dbraw/zinc/97/00/33/546970033.db2.gz XGLIDOUVNSCUQN-HNNXBMFYSA-N 2 1 366.502 2.237 10 0 FEAEMP C[N@@H+](C[C@H](O)C(F)(F)F)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000181689850 547360678 /nfs/dbraw/zinc/36/06/78/547360678.db2.gz FRLDRBNUHQULAJ-IRXDYDNUSA-N 2 1 360.420 2.287 10 0 FEAEMP C[N@@H+](C[C@H](O)C(F)(F)F)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000181689869 547360717 /nfs/dbraw/zinc/36/07/17/547360717.db2.gz FRLDRBNUHQULAJ-SJORKVTESA-N 2 1 360.420 2.287 10 0 FEAEMP COCc1noc(C[N@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)n1 ZINC000182236769 547457755 /nfs/dbraw/zinc/45/77/55/547457755.db2.gz HHIDPXMHUULWEM-GOSISDBHSA-N 2 1 374.485 2.093 10 0 FEAEMP COCc1noc(C[N@@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)n1 ZINC000182236769 547457759 /nfs/dbraw/zinc/45/77/59/547457759.db2.gz HHIDPXMHUULWEM-GOSISDBHSA-N 2 1 374.485 2.093 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC1CC[NH+](CCOC(C)C)CC1 ZINC000245469276 548929718 /nfs/dbraw/zinc/92/97/18/548929718.db2.gz LREXUHZKGINITQ-MOPGFXCFSA-N 2 1 366.550 2.144 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000245540887 548941749 /nfs/dbraw/zinc/94/17/49/548941749.db2.gz PSJVUGFAZXPKGO-VQIMIIECSA-N 2 1 359.518 2.326 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000245662354 548969753 /nfs/dbraw/zinc/96/97/53/548969753.db2.gz DIKPMJMGJDIJSD-MOPGFXCFSA-N 2 1 374.529 2.395 10 0 FEAEMP Cc1nc(N2CCOCC2)ccc1NC(=O)N[C@H]1C[N@@H+](C(C)C)C[C@H]1C ZINC000245687894 548975228 /nfs/dbraw/zinc/97/52/28/548975228.db2.gz OAGMLEANVHEZQF-PBHICJAKSA-N 2 1 361.490 2.077 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@H](C)C(=O)NC(=O)NC1CCCCC1 ZINC000245905867 549016409 /nfs/dbraw/zinc/01/64/09/549016409.db2.gz CDUSFBCHLUNBRB-PBHICJAKSA-N 2 1 361.490 2.203 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@H](C)C(=O)NC(=O)NC1CCCCC1 ZINC000245905867 549016410 /nfs/dbraw/zinc/01/64/10/549016410.db2.gz CDUSFBCHLUNBRB-PBHICJAKSA-N 2 1 361.490 2.203 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NC[C@H](C)[NH+]2CCc3ccccc3C2)C1 ZINC000247324079 549319059 /nfs/dbraw/zinc/31/90/59/549319059.db2.gz MPVWXSSMRUWYJK-FUHIMQAGSA-N 2 1 358.530 2.461 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)NC[C@H](C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000247324079 549319063 /nfs/dbraw/zinc/31/90/63/549319063.db2.gz MPVWXSSMRUWYJK-FUHIMQAGSA-N 2 1 358.530 2.461 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)C1 ZINC000247324079 549319067 /nfs/dbraw/zinc/31/90/67/549319067.db2.gz MPVWXSSMRUWYJK-FUHIMQAGSA-N 2 1 358.530 2.461 10 0 FEAEMP C[C@H](C(=O)N[C@@H]1CCCC[C@@H]1C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247809011 549382890 /nfs/dbraw/zinc/38/28/90/549382890.db2.gz UGRHBIDBWQSTCK-IMBTUZDBSA-N 2 1 353.551 2.094 10 0 FEAEMP Cc1ccc(OC[C@@H](O)C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c(C)c1 ZINC000247809433 549383335 /nfs/dbraw/zinc/38/33/35/549383335.db2.gz UJDDKOORALPCPU-ICSRJNTNSA-N 2 1 364.530 2.068 10 0 FEAEMP C[N@H+](Cc1ccccc1)CC1CCN(C(=O)C2(C[NH3+])CCOCC2)CC1 ZINC000262287734 549807330 /nfs/dbraw/zinc/80/73/30/549807330.db2.gz OKZVYOIDSXIXAS-UHFFFAOYSA-N 2 1 359.514 2.113 10 0 FEAEMP CCOc1cc2[nH+]ccc(NC[C@H]3C[NH+]4CCN3CC4)c2cc1OCC ZINC000301801490 553681197 /nfs/dbraw/zinc/68/11/97/553681197.db2.gz WQCDAWKJENLYQH-HNNXBMFYSA-N 2 1 356.470 2.444 10 0 FEAEMP OC[C@H]1C[N@@H+](Cc2cc(Br)ccc2F)CC12CC[NH2+]CC2 ZINC000169783921 672322580 /nfs/dbraw/zinc/32/25/80/672322580.db2.gz SKUJXEZTQLMHME-CYBMUJFWSA-N 2 1 357.267 2.382 10 0 FEAEMP CC1(C)C[N@H+](C2(CNC(=O)[C@@H]3CCC[C@@H]3C[NH3+])CCCCC2)CCO1 ZINC000261797489 672903659 /nfs/dbraw/zinc/90/36/59/672903659.db2.gz QPOFFVLAPQVVJA-IAGOWNOFSA-N 2 1 351.535 2.291 10 0 FEAEMP FC(F)(F)CN1CCC(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)CC1 ZINC000261919592 672904831 /nfs/dbraw/zinc/90/48/31/672904831.db2.gz KCYGYJIADLZQKF-BBWFWOEESA-N 2 1 363.468 2.398 10 0 FEAEMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653151921 677517748 /nfs/dbraw/zinc/51/77/48/677517748.db2.gz XXBOCLJLNJIKSK-LCGIIJARSA-N 2 1 355.404 2.021 10 0 FEAEMP C[N@@H+](CCOc1ccccc1)Cc1ccc(-c2nc(C[NH3+])cc(=O)[nH]2)cc1 ZINC000023581299 211392082 /nfs/dbraw/zinc/39/20/82/211392082.db2.gz NBWBWTAEOSMYOW-UHFFFAOYSA-N 2 1 364.449 2.406 10 0 FEAEMP COc1ccc(CC[N@H+](C)[C@H]2CCCN(c3cc(N)[nH+]cn3)C2)cc1OC ZINC000072476734 136149301 /nfs/dbraw/zinc/14/93/01/136149301.db2.gz PZQCLNASLTZDNR-INIZCTEOSA-N 2 1 371.485 2.219 10 0 FEAEMP COc1ccc(CC[N@@H+](C)[C@H]2CCCN(c3cc(N)[nH+]cn3)C2)cc1OC ZINC000072476734 136149302 /nfs/dbraw/zinc/14/93/02/136149302.db2.gz PZQCLNASLTZDNR-INIZCTEOSA-N 2 1 371.485 2.219 10 0 FEAEMP O=C(NCC1([NH+]2CCSCC2)CCCC1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000105150134 543162454 /nfs/dbraw/zinc/16/24/54/543162454.db2.gz VNFTUTRYXSVKCL-KRWDZBQOSA-N 2 1 366.575 2.228 10 0 FEAEMP CCCCNC(=O)C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000106128134 543205956 /nfs/dbraw/zinc/20/59/56/543205956.db2.gz UDXSQNSACKORAC-HXUWFJFHSA-N 2 1 361.530 2.280 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)NC2(c3ccccc3)CCC2)CC1 ZINC000106124719 543204430 /nfs/dbraw/zinc/20/44/30/543204430.db2.gz CDGAGSJBVVBIQT-SFHVURJKSA-N 2 1 373.541 2.207 10 0 FEAEMP CCc1nnc(C[N@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)n1C ZINC000106127171 543204567 /nfs/dbraw/zinc/20/45/67/543204567.db2.gz YSUSCHQAUGOHMF-IBGZPJMESA-N 2 1 371.529 2.255 10 0 FEAEMP CCc1nnc(C[N@@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)n1C ZINC000106127171 543204568 /nfs/dbraw/zinc/20/45/68/543204568.db2.gz YSUSCHQAUGOHMF-IBGZPJMESA-N 2 1 371.529 2.255 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CCCOc2ccc3c(c2)OCO3)CC1 ZINC000106124608 543205067 /nfs/dbraw/zinc/20/50/67/543205067.db2.gz OBSOVLMXKFZPLS-INIZCTEOSA-N 2 1 364.486 2.209 10 0 FEAEMP O=C(NC[C@H]1CCC[NH+](Cc2cccs2)C1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000247513730 549348716 /nfs/dbraw/zinc/34/87/16/549348716.db2.gz QGSMYJPEVDVVRH-SJORKVTESA-N 2 1 362.543 2.450 10 0 FEAEMP O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[NH+]2CCC[C@H]2C1 ZINC000247513730 549348709 /nfs/dbraw/zinc/34/87/09/549348709.db2.gz QGSMYJPEVDVVRH-SJORKVTESA-N 2 1 362.543 2.450 10 0 FEAEMP O=C(NC[C@H]1CCC[NH+](Cc2cccs2)C1)N1CC[N@@H+]2CCC[C@H]2C1 ZINC000247513730 549348713 /nfs/dbraw/zinc/34/87/13/549348713.db2.gz QGSMYJPEVDVVRH-SJORKVTESA-N 2 1 362.543 2.450 10 0 FEAEMP C[C@@H]1CCC[N@@H+](CCNC(=O)N2CC[C@H](C[NH+](C)Cc3cccnc3)C2)C1 ZINC000190692614 328225185 /nfs/dbraw/zinc/22/51/85/328225185.db2.gz KSTMSSHEUVYRII-UYAOXDASSA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@@H]1CCC[NH+](CCNC(=O)N2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000190692614 328225186 /nfs/dbraw/zinc/22/51/86/328225186.db2.gz KSTMSSHEUVYRII-UYAOXDASSA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@@H]1CCC[NH+](CCNC(=O)N2CC[C@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000190692614 328225187 /nfs/dbraw/zinc/22/51/87/328225187.db2.gz KSTMSSHEUVYRII-UYAOXDASSA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1)C[NH+]1CCCC1 ZINC000190697432 328225502 /nfs/dbraw/zinc/22/55/02/328225502.db2.gz BDMXDHGISWEFKP-ICSRJNTNSA-N 2 1 373.545 2.277 10 0 FEAEMP CC[C@@H]1CN(C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1CCOC ZINC000117309437 326056858 /nfs/dbraw/zinc/05/68/58/326056858.db2.gz RHKGDVIPCQSFIM-HXUWFJFHSA-N 2 1 359.514 2.465 10 0 FEAEMP CC[C@@H]1CN(C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@H+]1CCOC ZINC000117309437 326056859 /nfs/dbraw/zinc/05/68/59/326056859.db2.gz RHKGDVIPCQSFIM-HXUWFJFHSA-N 2 1 359.514 2.465 10 0 FEAEMP COc1ccccc1[C@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)[NH+]1CCCC1 ZINC000171897983 327168029 /nfs/dbraw/zinc/16/80/29/327168029.db2.gz MSFFBQLKUAYRGU-MJGOQNOKSA-N 2 1 372.513 2.322 10 0 FEAEMP CN(C)[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1)c1c(F)cccc1F ZINC000261865577 328825444 /nfs/dbraw/zinc/82/54/44/328825444.db2.gz COKYCTIXOVERKZ-NKGKWGDASA-N 2 1 353.457 2.314 10 0 FEAEMP O=C(c1ccccc1)N1CCC(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)CC1 ZINC000261958180 328831851 /nfs/dbraw/zinc/83/18/51/328831851.db2.gz PDFRZTTWRABACW-HBMCJLEFSA-N 2 1 371.525 2.286 10 0 FEAEMP COc1ccccc1N1CCC([NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)CC1 ZINC000261972811 328832832 /nfs/dbraw/zinc/83/28/32/328832832.db2.gz QSBYVAGNJOEPKF-GUDVDZBRSA-N 2 1 359.514 2.411 10 0 FEAEMP COc1ccccc1N1CCC([NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)CC1 ZINC000261972812 328832857 /nfs/dbraw/zinc/83/28/57/328832857.db2.gz QSBYVAGNJOEPKF-IPMKNSEASA-N 2 1 359.514 2.411 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(C)C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000177396360 546610007 /nfs/dbraw/zinc/61/00/07/546610007.db2.gz NZXIAKHFULIBRL-KRWDZBQOSA-N 2 1 356.474 2.201 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000177396360 546610008 /nfs/dbraw/zinc/61/00/08/546610008.db2.gz NZXIAKHFULIBRL-KRWDZBQOSA-N 2 1 356.474 2.201 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N2c3ccccc3CC[C@H]2C)CC1 ZINC000247871812 549387194 /nfs/dbraw/zinc/38/71/94/549387194.db2.gz XSLFWHSLVXQHPU-MSOLQXFVSA-N 2 1 373.541 2.379 10 0 FEAEMP c1nc2n(n1)C[C@@H]([NH2+][C@H]1CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]31)CC2 ZINC000248411165 549432002 /nfs/dbraw/zinc/43/20/02/549432002.db2.gz YYIZJBVCOGJZGD-HAGHYFMRSA-N 2 1 351.498 2.483 10 0 FEAEMP [NH3+][C@@H](C(=O)N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2)C1CCOCC1 ZINC000261780690 549755065 /nfs/dbraw/zinc/75/50/65/549755065.db2.gz MZFLDTVIXRDPKX-IRLDBZIGSA-N 2 1 371.525 2.255 10 0 FEAEMP COc1cccc(N2CCC[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@@H]3COCC[NH2+]3)C2)c1 ZINC000261925980 549770666 /nfs/dbraw/zinc/77/06/66/549770666.db2.gz LCOKRFINVVJPLF-DVWBAYGPSA-N 2 1 359.514 2.411 10 0 FEAEMP CCOCCOCc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)c1 ZINC000261962923 549774349 /nfs/dbraw/zinc/77/43/49/549774349.db2.gz PTSLBICPGSYWEB-NJDAHSKKSA-N 2 1 362.514 2.486 10 0 FEAEMP c1ccc(-c2ccc(NCC[NH2+][C@@H]3CCC[C@@H]3[C@@H]3COCC[NH2+]3)nn2)cc1 ZINC000262011568 549779400 /nfs/dbraw/zinc/77/94/00/549779400.db2.gz VOTFUXBZNDTAFQ-SXLOBPIMSA-N 2 1 367.497 2.302 10 0 FEAEMP CC[NH+](CC)[C@@H](C)CNC(=O)c1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000066916669 541393285 /nfs/dbraw/zinc/39/32/85/541393285.db2.gz YZLDIUIDJMXSCK-INIZCTEOSA-N 2 1 364.509 2.428 10 0 FEAEMP Cc1[nH+]ccn1-c1cncc(N2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)n1 ZINC000091478876 542810003 /nfs/dbraw/zinc/81/00/03/542810003.db2.gz AMWBGBLBHVFHIC-HZPDHXFCSA-N 2 1 370.501 2.296 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CCC[NH+]1CCN(c2ccccc2)CC1 ZINC000113445023 543488798 /nfs/dbraw/zinc/48/87/98/543488798.db2.gz BDUCJJOBULNFSR-TZIWHRDSSA-N 2 1 370.541 2.284 10 0 FEAEMP C[C@@H](C(=O)N1CCN(c2ccc(C[NH+](C)C)cn2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000114539303 543522832 /nfs/dbraw/zinc/52/28/32/543522832.db2.gz NGUJFTSNDNYERR-KSZLIROESA-N 2 1 373.545 2.053 10 0 FEAEMP COc1cccc([C@@H](CNC(=O)N2CC[N@H+]3CCC[C@H]3C2)[NH+]2CCCC2)c1 ZINC000247487459 549342535 /nfs/dbraw/zinc/34/25/35/549342535.db2.gz KYFHTPQNVBEEEH-AZUAARDMSA-N 2 1 372.513 2.322 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@@H]2CC[NH+](CC(C)C)C2)C[C@H]1CC ZINC000150757964 544467957 /nfs/dbraw/zinc/46/79/57/544467957.db2.gz ZPNXTTFFAXVQRB-RBUKOAKNSA-N 2 1 368.566 2.107 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)C[C@H]1CC ZINC000150757964 544467958 /nfs/dbraw/zinc/46/79/58/544467958.db2.gz ZPNXTTFFAXVQRB-RBUKOAKNSA-N 2 1 368.566 2.107 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)C[C@H]1CC ZINC000150757964 544467961 /nfs/dbraw/zinc/46/79/61/544467961.db2.gz ZPNXTTFFAXVQRB-RBUKOAKNSA-N 2 1 368.566 2.107 10 0 FEAEMP C[C@H](CNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1)C[NH+]1CCCC1 ZINC000190697448 328225442 /nfs/dbraw/zinc/22/54/42/328225442.db2.gz BDMXDHGISWEFKP-QUCCMNQESA-N 2 1 373.545 2.277 10 0 FEAEMP C[NH+](CCNC(=O)N1CC[C@H](C[N@H+](C)Cc2cccnc2)C1)C1CCCC1 ZINC000190708140 328226410 /nfs/dbraw/zinc/22/64/10/328226410.db2.gz JXFJKLVEOZQQGE-LJQANCHMSA-N 2 1 373.545 2.419 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@H]1CCN(C(=O)NCC[N@H+](C)C2CCCC2)C1 ZINC000190708140 328226412 /nfs/dbraw/zinc/22/64/12/328226412.db2.gz JXFJKLVEOZQQGE-LJQANCHMSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[N@H+]1CCCC[C@@H]1CNC(=O)N1CC[C@H](C[NH+](C)Cc2cccnc2)C1 ZINC000190709926 328226754 /nfs/dbraw/zinc/22/67/54/328226754.db2.gz OSPNCIFVDNNUBR-WOJBJXKFSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[NH+]1CCCC[C@@H]1CNC(=O)N1CC[C@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000190709926 328226757 /nfs/dbraw/zinc/22/67/57/328226757.db2.gz OSPNCIFVDNNUBR-WOJBJXKFSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[NH+]1CCCC[C@@H]1CNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190709926 328226759 /nfs/dbraw/zinc/22/67/59/328226759.db2.gz OSPNCIFVDNNUBR-WOJBJXKFSA-N 2 1 373.545 2.419 10 0 FEAEMP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)CC1 ZINC000261999780 328834363 /nfs/dbraw/zinc/83/43/63/328834363.db2.gz UJHAVTKWLJBMMD-RCOXNQKVSA-N 2 1 358.530 2.354 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000175965074 546380437 /nfs/dbraw/zinc/38/04/37/546380437.db2.gz VIWWEQKAHFYCGS-LJQANCHMSA-N 2 1 355.486 2.498 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCC[N@H+](C)Cc1ccccc1 ZINC000175965074 546380440 /nfs/dbraw/zinc/38/04/40/546380440.db2.gz VIWWEQKAHFYCGS-LJQANCHMSA-N 2 1 355.486 2.498 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCC1([NH+]2CCSCC2)CCCC1 ZINC000176228902 546422235 /nfs/dbraw/zinc/42/22/35/546422235.db2.gz AXFZIXKRMABBQS-KRWDZBQOSA-N 2 1 368.591 2.474 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NCCOc1cccc(C)c1 ZINC000178321162 546774209 /nfs/dbraw/zinc/77/42/09/546774209.db2.gz PELAKYYVPJLMLZ-SFHVURJKSA-N 2 1 356.470 2.160 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)NCCOc1cccc(C)c1 ZINC000178321162 546774214 /nfs/dbraw/zinc/77/42/14/546774214.db2.gz PELAKYYVPJLMLZ-SFHVURJKSA-N 2 1 356.470 2.160 10 0 FEAEMP CC[N@H+](Cc1ccc(C(=O)N2CC[NH+](C[C@H](C)O)[C@@H](C)C2)cc1)C(C)C ZINC000246786973 549212318 /nfs/dbraw/zinc/21/23/18/549212318.db2.gz QKYHMMBAWJLLIF-ROUUACIJSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH+](C[C@H](C)O)[C@@H](C)C2)cc1)C(C)C ZINC000246786973 549212322 /nfs/dbraw/zinc/21/23/22/549212322.db2.gz QKYHMMBAWJLLIF-ROUUACIJSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[NH+](Cc1ccc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)cc1)C(C)C ZINC000246786973 549212325 /nfs/dbraw/zinc/21/23/25/549212325.db2.gz QKYHMMBAWJLLIF-ROUUACIJSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[NH+](Cc1ccc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)cc1)C(C)C ZINC000246786973 549212328 /nfs/dbraw/zinc/21/23/28/549212328.db2.gz QKYHMMBAWJLLIF-ROUUACIJSA-N 2 1 361.530 2.444 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N[C@@H]1C[N@H+](C(C)C)C[C@H]1C)[NH+]1CCOCC1 ZINC000247326007 549319295 /nfs/dbraw/zinc/31/92/95/549319295.db2.gz MSZVQPVGPJEUGE-QRQLOZEOSA-N 2 1 368.566 2.151 10 0 FEAEMP Cc1ccc(C)c(OC[C@H](O)C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c1 ZINC000247817284 549384209 /nfs/dbraw/zinc/38/42/09/549384209.db2.gz WLROISGPCIXBOZ-AZUAARDMSA-N 2 1 364.530 2.068 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000252443588 549665446 /nfs/dbraw/zinc/66/54/46/549665446.db2.gz DALKTWVRUWDLNO-WMZOPIPTSA-N 2 1 360.502 2.005 10 0 FEAEMP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1)c1ccc2c(c1)OCCO2 ZINC000261951229 549773642 /nfs/dbraw/zinc/77/36/42/549773642.db2.gz OJNGTAKRXLKSCR-KSZLIROESA-N 2 1 360.498 2.482 10 0 FEAEMP CC(C)(C)OC(=O)N1CCC[C@H](C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)C1 ZINC000301381796 553647442 /nfs/dbraw/zinc/64/74/42/553647442.db2.gz BXACZMCVAZHUID-BRWVUGGUSA-N 2 1 353.507 2.086 10 0 FEAEMP CC(C)(C)OC(=O)N1CCC[C@H](C[NH2+]C[C@@H]2C[N@H+]3CCC[C@@H]3CO2)C1 ZINC000301381796 553647444 /nfs/dbraw/zinc/64/74/44/553647444.db2.gz BXACZMCVAZHUID-BRWVUGGUSA-N 2 1 353.507 2.086 10 0 FEAEMP C[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@H]2CO1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000365115984 555489303 /nfs/dbraw/zinc/48/93/03/555489303.db2.gz HSGSCLNHLPXRFS-LUKYLMHMSA-N 2 1 353.507 2.085 10 0 FEAEMP C[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@H]2CO1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000365115984 555489307 /nfs/dbraw/zinc/48/93/07/555489307.db2.gz HSGSCLNHLPXRFS-LUKYLMHMSA-N 2 1 353.507 2.085 10 0 FEAEMP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)S(=O)(=O)/C=C\c1ccccc1 ZINC000206884288 672788862 /nfs/dbraw/zinc/78/88/62/672788862.db2.gz ZLQXNILTQVLGEV-KVVHSQDJSA-N 2 1 365.543 2.335 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)S(=O)(=O)/C=C\c1ccccc1 ZINC000206884288 672788865 /nfs/dbraw/zinc/78/88/65/672788865.db2.gz ZLQXNILTQVLGEV-KVVHSQDJSA-N 2 1 365.543 2.335 10 0 FEAEMP O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)[C@H]1C[NH2+]CCC1(F)F ZINC000649305145 677329032 /nfs/dbraw/zinc/32/90/32/677329032.db2.gz GPSUODOOHCYZRM-IAGOWNOFSA-N 2 1 351.441 2.402 10 0 FEAEMP c1ccc(C[N@@H+]2CC[C@@H](CCNc3ncnc4c3CC[NH2+]CC4)C2)cc1 ZINC000072427854 210064651 /nfs/dbraw/zinc/06/46/51/210064651.db2.gz RXXYUSYZEVUECO-GOSISDBHSA-N 2 1 351.498 2.489 10 0 FEAEMP CC[N@@H+](CC(=O)N(C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1)C1CC1 ZINC000153420450 544773486 /nfs/dbraw/zinc/77/34/86/544773486.db2.gz KWJQLEPVFQVJMP-NRFANRHFSA-N 2 1 373.541 2.375 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1ccc(Br)cc1C(F)(F)F ZINC000263243716 328927904 /nfs/dbraw/zinc/92/79/04/328927904.db2.gz OYSVZIQDKRZKDQ-JOYOIKCWSA-N 2 1 353.182 2.138 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000187682570 328039282 /nfs/dbraw/zinc/03/92/82/328039282.db2.gz DXOIAWGJRQKARN-HOTGVXAUSA-N 2 1 368.543 2.176 10 0 FEAEMP CC[N@H+](CC(=O)N1CCC[C@H]([NH+](C)CC(=O)OC(C)(C)C)CC1)C1CC1 ZINC000191589676 328272899 /nfs/dbraw/zinc/27/28/99/328272899.db2.gz ICNNJNKHRPJBPW-INIZCTEOSA-N 2 1 367.534 2.125 10 0 FEAEMP CC[N@@H+](CC(=O)N1CCC[C@H]([NH+](C)CC(=O)OC(C)(C)C)CC1)C1CC1 ZINC000191589676 328272900 /nfs/dbraw/zinc/27/29/00/328272900.db2.gz ICNNJNKHRPJBPW-INIZCTEOSA-N 2 1 367.534 2.125 10 0 FEAEMP CC[NH+](CC(=O)N1CCC[C@H]([N@H+](C)CC(=O)OC(C)(C)C)CC1)C1CC1 ZINC000191589676 328272901 /nfs/dbraw/zinc/27/29/01/328272901.db2.gz ICNNJNKHRPJBPW-INIZCTEOSA-N 2 1 367.534 2.125 10 0 FEAEMP CC[NH+](CC(=O)N1CCC[C@H]([N@@H+](C)CC(=O)OC(C)(C)C)CC1)C1CC1 ZINC000191589676 328272902 /nfs/dbraw/zinc/27/29/02/328272902.db2.gz ICNNJNKHRPJBPW-INIZCTEOSA-N 2 1 367.534 2.125 10 0 FEAEMP C[N@@H+](CC[C@H]1CCOC1=O)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000120475260 326261832 /nfs/dbraw/zinc/26/18/32/326261832.db2.gz MXHDWQYTQGOOOW-PMACEKPBSA-N 2 1 360.498 2.317 10 0 FEAEMP COc1ccc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c(OC)c1OC ZINC000121097056 326312899 /nfs/dbraw/zinc/31/28/99/326312899.db2.gz CNBGQBKORLOINS-HNNXBMFYSA-N 2 1 366.502 2.237 10 0 FEAEMP COc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)c(OC)c1OC ZINC000261960097 328831973 /nfs/dbraw/zinc/83/19/73/328831973.db2.gz PLFQGGWLUCZZPX-ZACQAIPSSA-N 2 1 364.486 2.002 10 0 FEAEMP COc1ccccc1N1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)C1 ZINC000262004354 328834793 /nfs/dbraw/zinc/83/47/93/328834793.db2.gz UXKZFMJGUUTQTA-MKXGPGLRSA-N 2 1 359.514 2.268 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000262065450 328839415 /nfs/dbraw/zinc/83/94/15/328839415.db2.gz BBCCDVGOZHQTOS-RAIGVLPGSA-N 2 1 372.309 2.229 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC1CCN(c2cc(C)nc(C)n2)CC1 ZINC000176886051 546500656 /nfs/dbraw/zinc/50/06/56/546500656.db2.gz FAHFKDVIUMDGSD-SFHVURJKSA-N 2 1 374.533 2.188 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000176886051 546500664 /nfs/dbraw/zinc/50/06/64/546500664.db2.gz FAHFKDVIUMDGSD-SFHVURJKSA-N 2 1 374.533 2.188 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)N[C@@H]1CCOc2ccccc21 ZINC000178289631 546770324 /nfs/dbraw/zinc/77/03/24/546770324.db2.gz GROIALURYIZNKQ-FUHWJXTLSA-N 2 1 354.454 2.296 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)N[C@@H]1CCOc2ccccc21 ZINC000178289631 546770328 /nfs/dbraw/zinc/77/03/28/546770328.db2.gz GROIALURYIZNKQ-FUHWJXTLSA-N 2 1 354.454 2.296 10 0 FEAEMP COc1ccccc1CNC(=O)[C@H](C)[N@@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000178328890 546776126 /nfs/dbraw/zinc/77/61/26/546776126.db2.gz YIMDJPHQCIDTDY-MAUKXSAKSA-N 2 1 356.470 2.369 10 0 FEAEMP COc1ccccc1CNC(=O)[C@H](C)[N@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000178328890 546776129 /nfs/dbraw/zinc/77/61/29/546776129.db2.gz YIMDJPHQCIDTDY-MAUKXSAKSA-N 2 1 356.470 2.369 10 0 FEAEMP COCc1noc([C@@H](C)[NH2+]CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)n1 ZINC000183072265 547595840 /nfs/dbraw/zinc/59/58/40/547595840.db2.gz OHIXJRUMPCSWPI-QAPCUYQASA-N 2 1 374.485 2.312 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CC[NH+](C)CC2)c1 ZINC000245413648 548912198 /nfs/dbraw/zinc/91/21/98/548912198.db2.gz BQADEWOKPAUVSK-SFTDATJTSA-N 2 1 370.541 2.133 10 0 FEAEMP C[C@H](O)C[N@H+]1CCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@H]1C ZINC000245704727 548979932 /nfs/dbraw/zinc/97/99/32/548979932.db2.gz DTVGBRVNSGRNID-MOPGFXCFSA-N 2 1 374.573 2.104 10 0 FEAEMP O=C(NCCC[N@H+]1CCc2ccccc2C1)N1CC[NH+]2CCCC[C@H]2C1 ZINC000246457552 549137477 /nfs/dbraw/zinc/13/74/77/549137477.db2.gz PHRHEYXUMXZPJE-FQEVSTJZSA-N 2 1 356.514 2.315 10 0 FEAEMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000246457552 549137480 /nfs/dbraw/zinc/13/74/80/549137480.db2.gz PHRHEYXUMXZPJE-FQEVSTJZSA-N 2 1 356.514 2.315 10 0 FEAEMP CC[C@H]1CN(C(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)CC[N@H+]1CCOC ZINC000247266071 549308553 /nfs/dbraw/zinc/30/85/53/549308553.db2.gz ZAFGMIRQHHEBRW-DLBZAZTESA-N 2 1 356.555 2.105 10 0 FEAEMP C[C@@H](NC(=O)[C@@H](C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1)c1ccccc1 ZINC000247807964 549383491 /nfs/dbraw/zinc/38/34/91/549383491.db2.gz TYFBZETYNLMBLR-RCCFBDPRSA-N 2 1 361.530 2.277 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)C[C@@H]1C ZINC000248407606 549430405 /nfs/dbraw/zinc/43/04/05/549430405.db2.gz ULKLLZTWYWHZPI-RCCFBDPRSA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)C[C@@H]1C ZINC000248407606 549430409 /nfs/dbraw/zinc/43/04/09/549430409.db2.gz ULKLLZTWYWHZPI-RCCFBDPRSA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)C[C@@H]1C ZINC000248407606 549430412 /nfs/dbraw/zinc/43/04/12/549430412.db2.gz ULKLLZTWYWHZPI-RCCFBDPRSA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C[C@@H]1C ZINC000248407606 549430418 /nfs/dbraw/zinc/43/04/18/549430418.db2.gz ULKLLZTWYWHZPI-RCCFBDPRSA-N 2 1 366.550 2.002 10 0 FEAEMP c1cc(CN2CC[NH+]3CCC[C@H]3C2)cc(CN2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000252692196 549676708 /nfs/dbraw/zinc/67/67/08/549676708.db2.gz RHCGKEHUIMLOBR-VXKWHMMOSA-N 2 1 354.542 2.247 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000255038527 549702958 /nfs/dbraw/zinc/70/29/58/549702958.db2.gz FQJCUQAMJKIRFG-BRWVUGGUSA-N 2 1 356.555 2.150 10 0 FEAEMP CC(C)c1cc(N2CC[NH+]3CCC[C@@H]3C2)nc(N2CC[N@H+]3CCC[C@@H]3C2)n1 ZINC000302766500 553731797 /nfs/dbraw/zinc/73/17/97/553731797.db2.gz LSXARSCEXQZMQC-QZTJIDSGSA-N 2 1 370.545 2.169 10 0 FEAEMP CC(C)c1cc(N2CC[N@@H+]3CCC[C@@H]3C2)nc(N2CC[NH+]3CCC[C@@H]3C2)n1 ZINC000302766500 553731798 /nfs/dbraw/zinc/73/17/98/553731798.db2.gz LSXARSCEXQZMQC-QZTJIDSGSA-N 2 1 370.545 2.169 10 0 FEAEMP CC(C)c1cc(N2CC[N@H+]3CCC[C@@H]3C2)nc(N2CC[NH+]3CCC[C@@H]3C2)n1 ZINC000302766500 553731799 /nfs/dbraw/zinc/73/17/99/553731799.db2.gz LSXARSCEXQZMQC-QZTJIDSGSA-N 2 1 370.545 2.169 10 0 FEAEMP CCc1nc(C[NH+]2CCC(CNC(=O)[C@@H]3CCC[C@@H]3C[NH3+])CC2)cs1 ZINC000261635284 672900346 /nfs/dbraw/zinc/90/03/46/672900346.db2.gz CDAOFZMATDRDJF-NVXWUHKLSA-N 2 1 364.559 2.409 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[N@H+]2CCCC[C@@H]2C1)[NH+]1CCc2ccccc2C1 ZINC000105149623 543161716 /nfs/dbraw/zinc/16/17/16/543161716.db2.gz FCZCDNIKXZFHAK-FXAWDEMLSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[NH+]2CCCC[C@@H]2C1)[N@@H+]1CCc2ccccc2C1 ZINC000105149623 543161719 /nfs/dbraw/zinc/16/17/19/543161719.db2.gz FCZCDNIKXZFHAK-FXAWDEMLSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[NH+]2CCCC[C@@H]2C1)[N@H+]1CCc2ccccc2C1 ZINC000105149623 543161721 /nfs/dbraw/zinc/16/17/21/543161721.db2.gz FCZCDNIKXZFHAK-FXAWDEMLSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N(C)Cc2ccccc2)CC1 ZINC000106126225 543204641 /nfs/dbraw/zinc/20/46/41/543204641.db2.gz LPUURABJVNXLIM-ROUUACIJSA-N 2 1 361.530 2.058 10 0 FEAEMP COc1ccc(NC(=O)[C@H](C)[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc1 ZINC000106125611 543204680 /nfs/dbraw/zinc/20/46/80/543204680.db2.gz QXOAMAGMMFZALZ-HOTGVXAUSA-N 2 1 363.502 2.047 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CCC[NH+]1CCN(c2ccccc2)CC1 ZINC000113445026 543488804 /nfs/dbraw/zinc/48/88/04/543488804.db2.gz BDUCJJOBULNFSR-PZJWPPBQSA-N 2 1 370.541 2.284 10 0 FEAEMP CCN(C)C(=O)CC[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000130352067 544148093 /nfs/dbraw/zinc/14/80/93/544148093.db2.gz BRUHSVJNESVLOA-HXUWFJFHSA-N 2 1 361.530 2.232 10 0 FEAEMP CCC[C@H](C(=O)N[C@H]1CC[N@H+](Cc2cc(OC)cc(OC)c2)C1)[NH+](C)C ZINC000153561938 544790602 /nfs/dbraw/zinc/79/06/02/544790602.db2.gz ZBAFSCKPMNLMEU-QFBILLFUSA-N 2 1 363.502 2.125 10 0 FEAEMP CCC[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2cc(OC)cc(OC)c2)C1)[NH+](C)C ZINC000153561938 544790607 /nfs/dbraw/zinc/79/06/07/544790607.db2.gz ZBAFSCKPMNLMEU-QFBILLFUSA-N 2 1 363.502 2.125 10 0 FEAEMP CC[N@@H+](CC(=O)N1CC[C@@H](C[NH+](C)Cc2scnc2C)C1)C1CC1 ZINC000190557417 328216162 /nfs/dbraw/zinc/21/61/62/328216162.db2.gz PZGWTIMTTHMMMU-HNNXBMFYSA-N 2 1 350.532 2.216 10 0 FEAEMP CC[NH+](CC(=O)N1CC[C@@H](C[N@H+](C)Cc2scnc2C)C1)C1CC1 ZINC000190557417 328216163 /nfs/dbraw/zinc/21/61/63/328216163.db2.gz PZGWTIMTTHMMMU-HNNXBMFYSA-N 2 1 350.532 2.216 10 0 FEAEMP CC[NH+](CC(=O)N1CC[C@@H](C[N@@H+](C)Cc2scnc2C)C1)C1CC1 ZINC000190557417 328216164 /nfs/dbraw/zinc/21/61/64/328216164.db2.gz PZGWTIMTTHMMMU-HNNXBMFYSA-N 2 1 350.532 2.216 10 0 FEAEMP CC[NH+](CC)[C@@H](C)CNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190692038 328224989 /nfs/dbraw/zinc/22/49/89/328224989.db2.gz KDYMPJOJMWAWOY-PKOBYXMFSA-N 2 1 361.534 2.275 10 0 FEAEMP CCC[NH+]1CCC(CNC(=O)N2CC[N@@H+](CCOCC)[C@@H](CC)C2)CC1 ZINC000117041831 326049202 /nfs/dbraw/zinc/04/92/02/326049202.db2.gz ASUBSSSBGIFOEW-IBGZPJMESA-N 2 1 368.566 2.251 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)N2CCO[C@H](C[NH+](C)C)C2)cc1 ZINC000123307839 326427197 /nfs/dbraw/zinc/42/71/97/326427197.db2.gz FVGKEHHTONUZIG-HNAYVOBHSA-N 2 1 371.485 2.214 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)N3CC[C@H]([NH+](C)C)C3)cc2)C[C@H](C)O1 ZINC000170828759 327100953 /nfs/dbraw/zinc/10/09/53/327100953.db2.gz CEXMRVQVWBLRMD-QKLQHJQFSA-N 2 1 374.529 2.141 10 0 FEAEMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N1CC[NH+]2CCC[C@@H]2C1 ZINC000171907204 327169564 /nfs/dbraw/zinc/16/95/64/327169564.db2.gz AROAXUWFEJQGOE-VQTJNVASSA-N 2 1 356.514 2.041 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@@H+]2CCC[C@@H]2C1 ZINC000171907204 327169566 /nfs/dbraw/zinc/16/95/66/327169566.db2.gz AROAXUWFEJQGOE-VQTJNVASSA-N 2 1 356.514 2.041 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000171907204 327169567 /nfs/dbraw/zinc/16/95/67/327169567.db2.gz AROAXUWFEJQGOE-VQTJNVASSA-N 2 1 356.514 2.041 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@@H]1COc2ccccc21 ZINC000174440237 327327206 /nfs/dbraw/zinc/32/72/06/327327206.db2.gz PTYNIXXLSAVLDY-SJLPKXTDSA-N 2 1 360.502 2.178 10 0 FEAEMP O[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1)c1ccc(OC(F)(F)F)cc1 ZINC000262023901 328836205 /nfs/dbraw/zinc/83/62/05/328836205.db2.gz WUBRJJBIBJJNEJ-WCXIOVBPSA-N 2 1 374.403 2.365 10 0 FEAEMP O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)c1ccn([C@H]2CCC[NH2+]C2)n1 ZINC000262761747 328887439 /nfs/dbraw/zinc/88/74/39/328887439.db2.gz LNHUXNPRQNHTNO-FUHWJXTLSA-N 2 1 371.485 2.358 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1 ZINC000156865992 545669973 /nfs/dbraw/zinc/66/99/73/545669973.db2.gz CKDBSUMNTOBNQN-HOJAQTOUSA-N 2 1 374.529 2.088 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC1CCN(c2cc(C)nc(C)n2)CC1 ZINC000176886032 546500959 /nfs/dbraw/zinc/50/09/59/546500959.db2.gz FAHFKDVIUMDGSD-GOSISDBHSA-N 2 1 374.533 2.188 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000176886032 546500968 /nfs/dbraw/zinc/50/09/68/546500968.db2.gz FAHFKDVIUMDGSD-GOSISDBHSA-N 2 1 374.533 2.188 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CCC(=O)NC(=O)Nc1ccccc1 ZINC000178285672 546769581 /nfs/dbraw/zinc/76/95/81/546769581.db2.gz OIHNZONKTBIZJZ-KRWDZBQOSA-N 2 1 355.442 2.394 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CCC(=O)NC(=O)Nc1ccccc1 ZINC000178285672 546769584 /nfs/dbraw/zinc/76/95/84/546769584.db2.gz OIHNZONKTBIZJZ-KRWDZBQOSA-N 2 1 355.442 2.394 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cnn(Cc3ccccc3)c2)CC1 ZINC000179423152 546950728 /nfs/dbraw/zinc/95/07/28/546950728.db2.gz SCDVMKKHIJNCED-GOSISDBHSA-N 2 1 356.514 2.456 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000180361806 547091474 /nfs/dbraw/zinc/09/14/74/547091474.db2.gz PSJVUGFAZXPKGO-APWZRJJASA-N 2 1 359.518 2.326 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NCC[C@@H](C)[NH+]2CCCCC2)C[C@H]1CC ZINC000182691655 547534857 /nfs/dbraw/zinc/53/48/57/547534857.db2.gz KFQFMZFVHIGABP-RTBURBONSA-N 2 1 368.566 2.393 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2)C1 ZINC000194169875 548444512 /nfs/dbraw/zinc/44/45/12/548444512.db2.gz UPOMCEUSIHIDMK-GOSISDBHSA-N 2 1 350.482 2.383 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@H]([NH+](C)C)C1 ZINC000246294233 549098212 /nfs/dbraw/zinc/09/82/12/549098212.db2.gz BHNHJPPEDBNUIG-KVPLUYHFSA-N 2 1 358.530 2.489 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@H]1COc2ccccc21 ZINC000246360384 549114254 /nfs/dbraw/zinc/11/42/54/549114254.db2.gz PTYNIXXLSAVLDY-WMZOPIPTSA-N 2 1 360.502 2.178 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@H](C)C[NH+]2CCCCC2)C[C@H]1CC ZINC000247116481 549286836 /nfs/dbraw/zinc/28/68/36/549286836.db2.gz NQGHDPAIIUIPKN-RBUKOAKNSA-N 2 1 368.566 2.251 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)C[C@H]1C ZINC000247235108 549303396 /nfs/dbraw/zinc/30/33/96/549303396.db2.gz WRDREYKDDUFAHW-UYAOXDASSA-N 2 1 374.529 2.186 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)C[C@H]1C ZINC000247235108 549303400 /nfs/dbraw/zinc/30/34/00/549303400.db2.gz WRDREYKDDUFAHW-UYAOXDASSA-N 2 1 374.529 2.186 10 0 FEAEMP CN(Cc1cccnc1)C[C@H]1CC[N@@H+](C[C@@H](O)COCc2ccccc2)C1 ZINC000248661234 549479785 /nfs/dbraw/zinc/47/97/85/549479785.db2.gz WXPGGJOSKYVMQU-FGZHOGPDSA-N 2 1 369.509 2.413 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000252443587 549665427 /nfs/dbraw/zinc/66/54/27/549665427.db2.gz DALKTWVRUWDLNO-AEFFLSMTSA-N 2 1 360.502 2.005 10 0 FEAEMP CC(C)C[NH+]1CCc2nnc([C@H]3CC[N@@H+](Cc4cccnc4)C3)n2CC1 ZINC000257184343 549713465 /nfs/dbraw/zinc/71/34/65/549713465.db2.gz ILJMTSGMVFMXCZ-SFHVURJKSA-N 2 1 354.502 2.177 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)[C@@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000261635192 549737388 /nfs/dbraw/zinc/73/73/88/549737388.db2.gz CBRUIKPMLHPFOB-HOCLYGCPSA-N 2 1 354.292 2.224 10 0 FEAEMP Cc1cccc(-c2c[nH]c([C@@H]3CCC[N@H+]3CCC(=O)N3CC[NH2+]CC3)n2)c1 ZINC000262228166 549801052 /nfs/dbraw/zinc/80/10/52/549801052.db2.gz VCLJAVXHICDCHE-IBGZPJMESA-N 2 1 367.497 2.344 10 0 FEAEMP [NH3+]C[C@@H]1C[N@H+](CC(=O)N2CCC[C@H](C(F)(F)F)C2)C[C@H]1c1ccccc1 ZINC000262286371 549806323 /nfs/dbraw/zinc/80/63/23/549806323.db2.gz VIVFNGOLPDDQSX-IKGGRYGDSA-N 2 1 369.431 2.462 10 0 FEAEMP [NH3+]C[C@@H]1C[N@@H+](CC(=O)N2CCC[C@H](C(F)(F)F)C2)C[C@H]1c1ccccc1 ZINC000262286371 549806326 /nfs/dbraw/zinc/80/63/26/549806326.db2.gz VIVFNGOLPDDQSX-IKGGRYGDSA-N 2 1 369.431 2.462 10 0 FEAEMP C[NH+](C)C1(C[NH2+]C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CCOCC1 ZINC000130152585 672071649 /nfs/dbraw/zinc/07/16/49/672071649.db2.gz KVTVUUVUVOGOEH-MRXNPFEDSA-N 2 1 355.523 2.334 10 0 FEAEMP CC[NH+](CC)[C@@H](C)CNC(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000056762028 540743375 /nfs/dbraw/zinc/74/33/75/540743375.db2.gz FNDOLGDGBBGOMY-KRWDZBQOSA-N 2 1 362.518 2.413 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N(CC[NH+](C)C)Cc2cccc(F)c2)C1 ZINC000068587629 541612317 /nfs/dbraw/zinc/61/23/17/541612317.db2.gz RPQFIKDCIXKZFU-SFHVURJKSA-N 2 1 350.482 2.383 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(C[NH+]2CCC(CO)CC2)cc1 ZINC000247400626 549329248 /nfs/dbraw/zinc/32/92/48/549329248.db2.gz LMDQMWPNYMACFQ-UWJYYQICSA-N 2 1 371.525 2.200 10 0 FEAEMP O=C(NCCC[N@H+]1CCc2ccccc2C1)N1CC[NH+]2CCCC[C@@H]2C1 ZINC000105128663 543161002 /nfs/dbraw/zinc/16/10/02/543161002.db2.gz PHRHEYXUMXZPJE-HXUWFJFHSA-N 2 1 356.514 2.315 10 0 FEAEMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000105128663 543161005 /nfs/dbraw/zinc/16/10/05/543161005.db2.gz PHRHEYXUMXZPJE-HXUWFJFHSA-N 2 1 356.514 2.315 10 0 FEAEMP O=C(NCCC[NH+]1CCc2ccccc2C1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000105128663 543161008 /nfs/dbraw/zinc/16/10/08/543161008.db2.gz PHRHEYXUMXZPJE-HXUWFJFHSA-N 2 1 356.514 2.315 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N2CCCc3ccccc32)CC1 ZINC000106126542 543204585 /nfs/dbraw/zinc/20/45/85/543204585.db2.gz ZPPAUBHFBXEYHP-MSOLQXFVSA-N 2 1 373.541 2.379 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[NH+]2CCC[C@H](C)C2)CC[N@H+]1CCOC ZINC000117478728 543633366 /nfs/dbraw/zinc/63/33/66/543633366.db2.gz GQGWUIRSACDYID-RBUKOAKNSA-N 2 1 368.566 2.251 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)CC[NH+]1CCOC ZINC000117478728 543633368 /nfs/dbraw/zinc/63/33/68/543633368.db2.gz GQGWUIRSACDYID-RBUKOAKNSA-N 2 1 368.566 2.251 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)CC[NH+]1CCOC ZINC000117478728 543633371 /nfs/dbraw/zinc/63/33/71/543633371.db2.gz GQGWUIRSACDYID-RBUKOAKNSA-N 2 1 368.566 2.251 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)N2CCC(OCC[NH+]3CCCC3)CC2)[C@@H](C)C1 ZINC000132361195 544228639 /nfs/dbraw/zinc/22/86/39/544228639.db2.gz IJQYLXBBWOEJFW-HKUYNNGSSA-N 2 1 366.550 2.002 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)CC[NH+]2CCN(c3ccccc3)CC2)C1 ZINC000247501523 549346537 /nfs/dbraw/zinc/34/65/37/549346537.db2.gz XPUFVUPZWNASEJ-AZUAARDMSA-N 2 1 358.530 2.044 10 0 FEAEMP CCO[C@H]1C[C@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C12CCOCC2 ZINC000186372294 327958892 /nfs/dbraw/zinc/95/88/92/327958892.db2.gz YSLYOQDUMVNOMX-OALUTQOASA-N 2 1 354.535 2.440 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)C[C@@H]1CC ZINC000117023545 326047790 /nfs/dbraw/zinc/04/77/90/326047790.db2.gz UQYKRVTVCLJYTJ-KRWDZBQOSA-N 2 1 368.566 2.438 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC000117398167 326059364 /nfs/dbraw/zinc/05/93/64/326059364.db2.gz XPJRGNGCRLSWHX-GOSISDBHSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC000117398167 326059368 /nfs/dbraw/zinc/05/93/68/326059368.db2.gz XPJRGNGCRLSWHX-GOSISDBHSA-N 2 1 374.529 2.013 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@@H](C)C(C)(C)C[NH+](C)C)C[C@@H]1CC ZINC000121034110 326307920 /nfs/dbraw/zinc/30/79/20/326307920.db2.gz RAIFTEDKNDIGFC-IRXDYDNUSA-N 2 1 356.555 2.105 10 0 FEAEMP COc1cccc(N2CC[C@H](C[NH2+][C@@H]3CCC[C@@H]3[C@H]3COCC[NH2+]3)C2)c1 ZINC000261901913 328827972 /nfs/dbraw/zinc/82/79/72/328827972.db2.gz HTVLAPYYIPJZBX-UMSONDCASA-N 2 1 359.514 2.268 10 0 FEAEMP O=C1CCCN1Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000261913247 328828997 /nfs/dbraw/zinc/82/89/97/328828997.db2.gz JGPMRBMUUDDHOT-ZCNNSNEGSA-N 2 1 357.498 2.056 10 0 FEAEMP O=C1CCCN1Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c1 ZINC000261913246 328829079 /nfs/dbraw/zinc/82/90/79/328829079.db2.gz JGPMRBMUUDDHOT-XUVXKRRUSA-N 2 1 357.498 2.056 10 0 FEAEMP COc1cc(OC)cc(Oc2ccc(C[NH2+]C[C@H]3C[NH2+]C[C@H]3O)cc2)c1 ZINC000263298489 328931318 /nfs/dbraw/zinc/93/13/18/328931318.db2.gz WROLZOJVDALVQS-MGPUTAFESA-N 2 1 358.438 2.166 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCC[NH+](C)Cc1ccc(F)cc1 ZINC000175946744 546377926 /nfs/dbraw/zinc/37/79/26/546377926.db2.gz SQEXDJWEWKLPQG-SFHVURJKSA-N 2 1 350.482 2.383 10 0 FEAEMP CC[NH+]1CCC[C@H]1CN(C)C(=O)NCC[N@H+](C)Cc1ccc(F)cc1 ZINC000175946744 546377928 /nfs/dbraw/zinc/37/79/28/546377928.db2.gz SQEXDJWEWKLPQG-SFHVURJKSA-N 2 1 350.482 2.383 10 0 FEAEMP CC[NH+]1CCC[C@H]1CN(C)C(=O)NCC[N@@H+](C)Cc1ccc(F)cc1 ZINC000175946744 546377931 /nfs/dbraw/zinc/37/79/31/546377931.db2.gz SQEXDJWEWKLPQG-SFHVURJKSA-N 2 1 350.482 2.383 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1ccc(N2CC[NH+](CC)CC2)cc1 ZINC000177014952 546523563 /nfs/dbraw/zinc/52/35/63/546523563.db2.gz XZWGSUXJDZMTLD-HXUWFJFHSA-N 2 1 358.530 2.385 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)c1 ZINC000177394669 546608402 /nfs/dbraw/zinc/60/84/02/546608402.db2.gz HOMWUEQTUKSZHX-LJQANCHMSA-N 2 1 372.513 2.164 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)c1 ZINC000177394669 546608406 /nfs/dbraw/zinc/60/84/06/546608406.db2.gz HOMWUEQTUKSZHX-LJQANCHMSA-N 2 1 372.513 2.164 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000181689560 547361578 /nfs/dbraw/zinc/36/15/78/547361578.db2.gz YOWPLUKWQSBTIG-QGZVFWFLSA-N 2 1 367.578 2.296 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)NCC2([NH+]3CCSCC3)CCCC2)C1 ZINC000194153232 548441868 /nfs/dbraw/zinc/44/18/68/548441868.db2.gz YPTPFPCMISQWGI-MRXNPFEDSA-N 2 1 354.564 2.132 10 0 FEAEMP CC(C)CO[C@@H](C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000245498604 548934257 /nfs/dbraw/zinc/93/42/57/548934257.db2.gz WNSVEXANBZJZET-HOTGVXAUSA-N 2 1 368.522 2.328 10 0 FEAEMP CC(C)CO[C@@H](C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000245498604 548934260 /nfs/dbraw/zinc/93/42/60/548934260.db2.gz WNSVEXANBZJZET-HOTGVXAUSA-N 2 1 368.522 2.328 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@H](C)C(=O)Nc1ccc2c(c1)OCO2 ZINC000245980041 549031059 /nfs/dbraw/zinc/03/10/59/549031059.db2.gz YCBANVIDIVANHF-CJNGLKHVSA-N 2 1 356.426 2.412 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@H](C)C(=O)Nc1ccc2c(c1)OCO2 ZINC000245980041 549031062 /nfs/dbraw/zinc/03/10/62/549031062.db2.gz YCBANVIDIVANHF-CJNGLKHVSA-N 2 1 356.426 2.412 10 0 FEAEMP O=C(NCCN1CCc2c(Cl)cccc2C1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000249093380 549549754 /nfs/dbraw/zinc/54/97/54/549549754.db2.gz NVRYLRIXXOOSDR-INIZCTEOSA-N 2 1 362.905 2.188 10 0 FEAEMP COc1ccccc1C[N@H+]1C[C@H](C(=O)NC2CC2)C2(C1)CC[NH+](C)CC2 ZINC000257174905 549711625 /nfs/dbraw/zinc/71/16/25/549711625.db2.gz LVEBGJXZEREBPQ-GOSISDBHSA-N 2 1 357.498 2.118 10 0 FEAEMP C([NH2+][C@@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1)C1(CN2CCOCC2)CCCCC1 ZINC000261841238 549761638 /nfs/dbraw/zinc/76/16/38/549761638.db2.gz AIQSDUOPEXKVDN-AQNXPRMDSA-N 2 1 365.562 2.016 10 0 FEAEMP C[C@H]1OCC[NH2+][C@@H]1C(=O)NCc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000262266147 549803980 /nfs/dbraw/zinc/80/39/80/549803980.db2.gz MOTQTKHFVOZKHY-LJCCNALRSA-N 2 1 359.514 2.158 10 0 FEAEMP CC(C)(C)OC(=O)N1CCC[C@H](C[NH2+]C[C@H]2C[N@@H+]3CCC[C@H]3CO2)C1 ZINC000301381797 553647195 /nfs/dbraw/zinc/64/71/95/553647195.db2.gz BXACZMCVAZHUID-IKGGRYGDSA-N 2 1 353.507 2.086 10 0 FEAEMP CC(C)(C)OC(=O)N1CCC[C@H](C[NH2+]C[C@H]2C[N@H+]3CCC[C@H]3CO2)C1 ZINC000301381797 553647201 /nfs/dbraw/zinc/64/72/01/553647201.db2.gz BXACZMCVAZHUID-IKGGRYGDSA-N 2 1 353.507 2.086 10 0 FEAEMP NC(=[NH2+])c1ccc2[nH]c(CCCc3nc4ccc(C(N)=[NH2+])cc4[nH]3)nc2c1 ZINC000005117256 539402662 /nfs/dbraw/zinc/40/26/62/539402662.db2.gz JSWDSBAWSDFTEK-UHFFFAOYSA-N 2 1 360.425 2.183 10 0 FEAEMP CC(C)C[C@@H](C[NH+](C)C)NC(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000079053624 542496035 /nfs/dbraw/zinc/49/60/35/542496035.db2.gz FQJCUQAMJKIRFG-BBWFWOEESA-N 2 1 356.555 2.150 10 0 FEAEMP CC(C)C[C@@H](C[NH+](C)C)NC(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000079053624 542496039 /nfs/dbraw/zinc/49/60/39/542496039.db2.gz FQJCUQAMJKIRFG-BBWFWOEESA-N 2 1 356.555 2.150 10 0 FEAEMP Cc1cc(C[NH2+]C2CCN(c3nc(N(C)C)[nH+]c4c3CCCC4)CC2)on1 ZINC000095526215 132214511 /nfs/dbraw/zinc/21/45/11/132214511.db2.gz QZWRLLVKBSLJLH-UHFFFAOYSA-N 2 1 370.501 2.476 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N[C@@H]2C[NH+](C(C)C)C[C@@H]2C)[C@@H](C)C1 ZINC000247458079 549335999 /nfs/dbraw/zinc/33/59/99/549335999.db2.gz UDTOBGBMGIFMKG-CADBVGFASA-N 2 1 368.566 2.151 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)[C@@H](C)C1 ZINC000247458079 549336006 /nfs/dbraw/zinc/33/60/06/549336006.db2.gz UDTOBGBMGIFMKG-CADBVGFASA-N 2 1 368.566 2.151 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)[C@@H](C)C1 ZINC000247458079 549336011 /nfs/dbraw/zinc/33/60/11/549336011.db2.gz UDTOBGBMGIFMKG-CADBVGFASA-N 2 1 368.566 2.151 10 0 FEAEMP CCOCC[N@@H+]1CCN(C(=O)c2cccc(C[NH+]3CCCC3)c2)C[C@H]1C ZINC000117283511 543627785 /nfs/dbraw/zinc/62/77/85/543627785.db2.gz VTONGSTXYLNDPR-GOSISDBHSA-N 2 1 359.514 2.465 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)c2cccc(C[NH+]3CCCC3)c2)C[C@H]1C ZINC000117283511 543627787 /nfs/dbraw/zinc/62/77/87/543627787.db2.gz VTONGSTXYLNDPR-GOSISDBHSA-N 2 1 359.514 2.465 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000097216167 222168921 /nfs/dbraw/zinc/16/89/21/222168921.db2.gz MKOLMERCGBIPMM-MRXNPFEDSA-N 2 1 352.548 2.382 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000097216167 222168923 /nfs/dbraw/zinc/16/89/23/222168923.db2.gz MKOLMERCGBIPMM-MRXNPFEDSA-N 2 1 352.548 2.382 10 0 FEAEMP CC(C)CSCCC[NH+]1CCN(C[C@@H]2C[N@H+](C(C)C)CCO2)CC1 ZINC000152624228 544675387 /nfs/dbraw/zinc/67/53/87/544675387.db2.gz ASVRNXXEXAXPAF-LJQANCHMSA-N 2 1 357.608 2.493 10 0 FEAEMP CC[N@@H+](CC(=O)N1CC[C@H](C[NH+](C)Cc2scnc2C)C1)C1CC1 ZINC000190557398 328216152 /nfs/dbraw/zinc/21/61/52/328216152.db2.gz PZGWTIMTTHMMMU-OAHLLOKOSA-N 2 1 350.532 2.216 10 0 FEAEMP CC[NH+](CC(=O)N1CC[C@H](C[N@H+](C)Cc2scnc2C)C1)C1CC1 ZINC000190557398 328216153 /nfs/dbraw/zinc/21/61/53/328216153.db2.gz PZGWTIMTTHMMMU-OAHLLOKOSA-N 2 1 350.532 2.216 10 0 FEAEMP CC[NH+](CC(=O)N1CC[C@H](C[N@@H+](C)Cc2scnc2C)C1)C1CC1 ZINC000190557398 328216154 /nfs/dbraw/zinc/21/61/54/328216154.db2.gz PZGWTIMTTHMMMU-OAHLLOKOSA-N 2 1 350.532 2.216 10 0 FEAEMP CN(C)c1cc[nH+]cc1C(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190647075 328221561 /nfs/dbraw/zinc/22/15/61/328221561.db2.gz AZKCSGRHJDGSJG-KRWDZBQOSA-N 2 1 353.470 2.137 10 0 FEAEMP CC(C)[NH+]1CCN(CCC[N@H+]2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)CC1 ZINC000191592521 328272979 /nfs/dbraw/zinc/27/29/79/328272979.db2.gz DCARWOVWYPFSHK-YLJYHZDGSA-N 2 1 367.484 2.489 10 0 FEAEMP C[N@@H+](CC[C@@H]1CCOC1=O)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000120475100 326261913 /nfs/dbraw/zinc/26/19/13/326261913.db2.gz MXHDWQYTQGOOOW-UXHICEINSA-N 2 1 360.498 2.317 10 0 FEAEMP COc1ccc(CNC(=O)C[N@H+]2CC[C@H](CNc3cccc(C)[nH+]3)C2)cc1 ZINC000171652995 327152235 /nfs/dbraw/zinc/15/22/35/327152235.db2.gz BMQRMJGTVBEDOZ-GOSISDBHSA-N 2 1 368.481 2.449 10 0 FEAEMP CC[NH+](CC)CCOc1ccc(CNC(=O)N2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000171900714 327168639 /nfs/dbraw/zinc/16/86/39/327168639.db2.gz KTYJRWAIBAOKAJ-IBGZPJMESA-N 2 1 374.529 2.397 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)C[C@H](O)COc2ccccc2Cl)CC1 ZINC000172111271 327181507 /nfs/dbraw/zinc/18/15/07/327181507.db2.gz RRDHBEPNCBCPAA-WBVHZDCISA-N 2 1 370.921 2.104 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NCCC[NH+]2CCCCC2)C[C@H]1CC ZINC000172117481 327181803 /nfs/dbraw/zinc/18/18/03/327181803.db2.gz BOKPLEQBBPANNK-GOSISDBHSA-N 2 1 354.539 2.005 10 0 FEAEMP CC[N@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000173885808 327291660 /nfs/dbraw/zinc/29/16/60/327291660.db2.gz MZYCOYIVJPYZCG-ZBFHGGJFSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000173885808 327291662 /nfs/dbraw/zinc/29/16/62/327291662.db2.gz MZYCOYIVJPYZCG-ZBFHGGJFSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[NH+](C)C[C@H]1CC[N@H+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000173885808 327291663 /nfs/dbraw/zinc/29/16/63/327291663.db2.gz MZYCOYIVJPYZCG-ZBFHGGJFSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[NH+](C)C[C@H]1CC[N@@H+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000173885808 327291665 /nfs/dbraw/zinc/29/16/65/327291665.db2.gz MZYCOYIVJPYZCG-ZBFHGGJFSA-N 2 1 371.319 2.462 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)cn1 ZINC000157897242 545796978 /nfs/dbraw/zinc/79/69/78/545796978.db2.gz IQHUYRBPFAZUFT-YOEHRIQHSA-N 2 1 356.474 2.104 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)cn1 ZINC000157897242 545796985 /nfs/dbraw/zinc/79/69/85/545796985.db2.gz IQHUYRBPFAZUFT-YOEHRIQHSA-N 2 1 356.474 2.104 10 0 FEAEMP CC[NH+](CC)[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)Cc1ccccc1 ZINC000171900861 546229428 /nfs/dbraw/zinc/22/94/28/546229428.db2.gz WFNALJAOUIGCMH-WOJBJXKFSA-N 2 1 358.530 2.429 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N(C)C[C@H]2CCC[N@H+]2CC)c1 ZINC000176903793 546505437 /nfs/dbraw/zinc/50/54/37/546505437.db2.gz XCMWSEOUNVQZKM-LJQANCHMSA-N 2 1 374.529 2.410 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(C)C(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000177034125 546528233 /nfs/dbraw/zinc/52/82/33/546528233.db2.gz BYTRHDTZSLWGBX-VQTJNVASSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000177034125 546528235 /nfs/dbraw/zinc/52/82/35/546528235.db2.gz BYTRHDTZSLWGBX-VQTJNVASSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[NH+]1CCC[C@H]1CN(C)C(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000177034125 546528239 /nfs/dbraw/zinc/52/82/39/546528239.db2.gz BYTRHDTZSLWGBX-VQTJNVASSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[NH+]1CCC[C@H]1CN(C)C(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000177034125 546528241 /nfs/dbraw/zinc/52/82/41/546528241.db2.gz BYTRHDTZSLWGBX-VQTJNVASSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000177448860 546620546 /nfs/dbraw/zinc/62/05/46/546620546.db2.gz CZDRCGVTLKNINN-GOSISDBHSA-N 2 1 362.518 2.253 10 0 FEAEMP COc1cccc(CNC(=O)[C@H](C)[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000178290951 546770297 /nfs/dbraw/zinc/77/02/97/546770297.db2.gz RVLBWWZFSRSCKO-MAUKXSAKSA-N 2 1 356.470 2.369 10 0 FEAEMP COc1cccc(CNC(=O)[C@H](C)[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000178290951 546770301 /nfs/dbraw/zinc/77/03/01/546770301.db2.gz RVLBWWZFSRSCKO-MAUKXSAKSA-N 2 1 356.470 2.369 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000178300248 546771968 /nfs/dbraw/zinc/77/19/68/546771968.db2.gz RKAFRKQFAJUTNZ-WMLDXEAASA-N 2 1 355.442 2.393 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000178300248 546771972 /nfs/dbraw/zinc/77/19/72/546771972.db2.gz RKAFRKQFAJUTNZ-WMLDXEAASA-N 2 1 355.442 2.393 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CCCN1C(=O)c2ccccc2C1=O ZINC000178333920 546777380 /nfs/dbraw/zinc/77/73/80/546777380.db2.gz IZVNXTFUEUPKET-MRXNPFEDSA-N 2 1 352.438 2.342 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CCCN1C(=O)c2ccccc2C1=O ZINC000178333920 546777385 /nfs/dbraw/zinc/77/73/85/546777385.db2.gz IZVNXTFUEUPKET-MRXNPFEDSA-N 2 1 352.438 2.342 10 0 FEAEMP COCc1ccc(CNC(=O)C[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)cc1 ZINC000178750837 546843283 /nfs/dbraw/zinc/84/32/83/546843283.db2.gz XBQDKMFIUOULGF-LJQANCHMSA-N 2 1 356.470 2.119 10 0 FEAEMP COCc1ccc(CNC(=O)C[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)cc1 ZINC000178750837 546843285 /nfs/dbraw/zinc/84/32/85/546843285.db2.gz XBQDKMFIUOULGF-LJQANCHMSA-N 2 1 356.470 2.119 10 0 FEAEMP COCCOc1ccc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc1 ZINC000179517513 546969306 /nfs/dbraw/zinc/96/93/06/546969306.db2.gz ABVFYTZENLYSSQ-KRWDZBQOSA-N 2 1 350.503 2.236 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCC[C@@H](C)[NH+]2CCCCC2)CC[N@H+]1CCOC ZINC000182688700 547534138 /nfs/dbraw/zinc/53/41/38/547534138.db2.gz PLWXHUQNXDPSSN-QZTJIDSGSA-N 2 1 354.539 2.003 10 0 FEAEMP COc1cccc([C@@H]2[C@@H](NC(=O)N3CC[C@@H]([NH+](C)C)C3)CC[N@H+]2C2CC2)c1 ZINC000183765062 547716459 /nfs/dbraw/zinc/71/64/59/547716459.db2.gz FSKLSHYFNHZOSO-YZGWKJHDSA-N 2 1 372.513 2.319 10 0 FEAEMP CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000245423939 548914647 /nfs/dbraw/zinc/91/46/47/548914647.db2.gz BYTRHDTZSLWGBX-UXHICEINSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000245423939 548914650 /nfs/dbraw/zinc/91/46/50/548914650.db2.gz BYTRHDTZSLWGBX-UXHICEINSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[NH+]1CCC[C@@H]1CN(C)C(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000245423939 548914654 /nfs/dbraw/zinc/91/46/54/548914654.db2.gz BYTRHDTZSLWGBX-UXHICEINSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[NH+]1CCC[C@@H]1CN(C)C(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000245423939 548914656 /nfs/dbraw/zinc/91/46/56/548914656.db2.gz BYTRHDTZSLWGBX-UXHICEINSA-N 2 1 359.514 2.220 10 0 FEAEMP O=C(NC[C@@H](O)C[NH+]1CCCCC1)[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000246171255 549069125 /nfs/dbraw/zinc/06/91/25/549069125.db2.gz FGDVKZMMLPCBJY-UXHICEINSA-N 2 1 359.514 2.004 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCC[NH+]1CCc2ccccc2C1 ZINC000246540732 549157596 /nfs/dbraw/zinc/15/75/96/549157596.db2.gz YDVREAURUOYPPE-PMACEKPBSA-N 2 1 356.514 2.313 10 0 FEAEMP CC[C@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC[N@@H+]1CCc2ccccc2C1 ZINC000246540732 549157597 /nfs/dbraw/zinc/15/75/97/549157597.db2.gz YDVREAURUOYPPE-PMACEKPBSA-N 2 1 356.514 2.313 10 0 FEAEMP CC[C@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000246540732 549157599 /nfs/dbraw/zinc/15/75/99/549157599.db2.gz YDVREAURUOYPPE-PMACEKPBSA-N 2 1 356.514 2.313 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)NCCC[N@H+]2CCc3ccccc3C2)C1 ZINC000246741812 549201680 /nfs/dbraw/zinc/20/16/80/549201680.db2.gz AZVIJUKOWOYGBG-YLJYHZDGSA-N 2 1 358.530 2.463 10 0 FEAEMP Cc1ccc(N2CC[C@@H]([N@H+](C)CC3CC[NH+](C[C@H](C)O)CC3)C2=O)cc1 ZINC000246776330 549209242 /nfs/dbraw/zinc/20/92/42/549209242.db2.gz OJKKRFNSBNXRRS-FXAWDEMLSA-N 2 1 359.514 2.125 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC[C@H]2CCC[NH+]2Cc2ccccc2)C[C@@H]1C ZINC000246938416 549247224 /nfs/dbraw/zinc/24/72/24/549247224.db2.gz CBGZSXMMHDCDOA-AZUAARDMSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC[C@H]2CCC[NH+]2Cc2ccccc2)C[C@@H]1C ZINC000246938416 549247228 /nfs/dbraw/zinc/24/72/28/549247228.db2.gz CBGZSXMMHDCDOA-AZUAARDMSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@H]2CCC[N@@H+]2Cc2ccccc2)C[C@@H]1C ZINC000246938416 549247230 /nfs/dbraw/zinc/24/72/30/549247230.db2.gz CBGZSXMMHDCDOA-AZUAARDMSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)C[C@@H]1C ZINC000246938416 549247234 /nfs/dbraw/zinc/24/72/34/549247234.db2.gz CBGZSXMMHDCDOA-AZUAARDMSA-N 2 1 374.529 2.013 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000247070424 549276494 /nfs/dbraw/zinc/27/64/94/549276494.db2.gz OMPIYHLRHGOSGQ-HUUCEWRRSA-N 2 1 358.408 2.457 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000247070424 549276498 /nfs/dbraw/zinc/27/64/98/549276498.db2.gz OMPIYHLRHGOSGQ-HUUCEWRRSA-N 2 1 358.408 2.457 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)Cc1ccccc1 ZINC000247649672 549368900 /nfs/dbraw/zinc/36/89/00/549368900.db2.gz WFNALJAOUIGCMH-PMACEKPBSA-N 2 1 358.530 2.429 10 0 FEAEMP CCOc1cccc(CNC(=O)C[N@@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261766427 549753326 /nfs/dbraw/zinc/75/33/26/549753326.db2.gz ONDQPYMOZGIIIF-CTNGQTDRSA-N 2 1 367.493 2.376 10 0 FEAEMP CCOc1cccc(CNC(=O)C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261766427 549753327 /nfs/dbraw/zinc/75/33/27/549753327.db2.gz ONDQPYMOZGIIIF-CTNGQTDRSA-N 2 1 367.493 2.376 10 0 FEAEMP COc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)c(OC)c1OC ZINC000261960095 549774835 /nfs/dbraw/zinc/77/48/35/549774835.db2.gz PLFQGGWLUCZZPX-BRWVUGGUSA-N 2 1 364.486 2.002 10 0 FEAEMP CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000261997085 549778545 /nfs/dbraw/zinc/77/85/45/549778545.db2.gz UEAJISYREFFNIK-OBZTUIKSSA-N 2 1 359.514 2.462 10 0 FEAEMP O[C@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000263199821 549884929 /nfs/dbraw/zinc/88/49/29/549884929.db2.gz IXXJFMUGAMWQGN-FPOVZHCZSA-N 2 1 362.477 2.268 10 0 FEAEMP CCOC(=O)c1cnc2ccc(C)cc2c1N1C[C@@H]2OCCN(C)[C@H]2C1 ZINC000301686772 553671583 /nfs/dbraw/zinc/67/15/83/553671583.db2.gz XFKJYGYUYSMKSK-ROUUACIJSA-N 2 1 355.438 2.239 10 0 FEAEMP Cc1[nH+]ccn1-c1cncc(N2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)n1 ZINC000091478879 542810264 /nfs/dbraw/zinc/81/02/64/542810264.db2.gz AMWBGBLBHVFHIC-HOTGVXAUSA-N 2 1 370.501 2.296 10 0 FEAEMP CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cnc(N3CC[NH+](C)CC3)nc2)C12CCCC2 ZINC000093611074 542934543 /nfs/dbraw/zinc/93/45/43/542934543.db2.gz JHISWRISRCVXNL-RTBURBONSA-N 2 1 373.545 2.398 10 0 FEAEMP CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cnc(N3CC[NH+](C)CC3)nc2)C12CCCC2 ZINC000093611074 542934550 /nfs/dbraw/zinc/93/45/50/542934550.db2.gz JHISWRISRCVXNL-RTBURBONSA-N 2 1 373.545 2.398 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000106124540 543204527 /nfs/dbraw/zinc/20/45/27/543204527.db2.gz VCPMQRVSTNDWLM-SFHVURJKSA-N 2 1 373.541 2.202 10 0 FEAEMP CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@H](O)C[NH+]2CCCCC2)C1 ZINC000111881060 543422684 /nfs/dbraw/zinc/42/26/84/543422684.db2.gz NXESBYXTYDLUAO-MSOLQXFVSA-N 2 1 368.566 2.033 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@H]4CCC[N@@H+]4C[C@H]3C)cc2F)CC1 ZINC000247493246 549344253 /nfs/dbraw/zinc/34/42/53/549344253.db2.gz UKLZJEMYSPZMAL-SJLPKXTDSA-N 2 1 374.504 2.276 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@H]4CCC[N@H+]4C[C@H]3C)cc2F)CC1 ZINC000247493246 549344255 /nfs/dbraw/zinc/34/42/55/549344255.db2.gz UKLZJEMYSPZMAL-SJLPKXTDSA-N 2 1 374.504 2.276 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N[C@H]3C[NH+](C(C)C)C[C@@H]3C)c2C1 ZINC000150793957 544472877 /nfs/dbraw/zinc/47/28/77/544472877.db2.gz WAFQFQBIAMQLQN-KXBFYZLASA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N[C@H]3C[NH+](C(C)C)C[C@@H]3C)c2C1 ZINC000150793957 544472879 /nfs/dbraw/zinc/47/28/79/544472879.db2.gz WAFQFQBIAMQLQN-KXBFYZLASA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N[C@H]3C[N@@H+](C(C)C)C[C@@H]3C)c2C1 ZINC000150793957 544472882 /nfs/dbraw/zinc/47/28/82/544472882.db2.gz WAFQFQBIAMQLQN-KXBFYZLASA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N[C@H]3C[N@H+](C(C)C)C[C@@H]3C)c2C1 ZINC000150793957 544472883 /nfs/dbraw/zinc/47/28/83/544472883.db2.gz WAFQFQBIAMQLQN-KXBFYZLASA-N 2 1 372.513 2.196 10 0 FEAEMP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)N1CCCC[C@@H]1C[NH+]1CCOCC1 ZINC000152389713 544646931 /nfs/dbraw/zinc/64/69/31/544646931.db2.gz HUMUGZIAATUZBD-RTBURBONSA-N 2 1 366.550 2.003 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N1CCCC[C@@H]1C[NH+]1CCOCC1 ZINC000152389713 544646938 /nfs/dbraw/zinc/64/69/38/544646938.db2.gz HUMUGZIAATUZBD-RTBURBONSA-N 2 1 366.550 2.003 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)NC(=O)NCc1ccccc1 ZINC000154547079 544919294 /nfs/dbraw/zinc/91/92/94/544919294.db2.gz KBCNFCYBJWAECQ-YJBOKZPZSA-N 2 1 369.469 2.070 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@@H](C)C(=O)NC(=O)NCc1ccccc1 ZINC000154547079 544919296 /nfs/dbraw/zinc/91/92/96/544919296.db2.gz KBCNFCYBJWAECQ-YJBOKZPZSA-N 2 1 369.469 2.070 10 0 FEAEMP Cc1cccc(C)c1OC[C@H](O)C[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247537619 549352591 /nfs/dbraw/zinc/35/25/91/549352591.db2.gz CQQWAURZKJSKCS-AZUAARDMSA-N 2 1 364.530 2.068 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CCOCC(F)(F)C(F)(F)F)CC1 ZINC000189180539 328133646 /nfs/dbraw/zinc/13/36/46/328133646.db2.gz VCJHDZYPJKNCAW-LBPRGKRZSA-N 2 1 362.383 2.225 10 0 FEAEMP CC[NH+](CC)[C@H](C)CNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190692091 328225075 /nfs/dbraw/zinc/22/50/75/328225075.db2.gz KDYMPJOJMWAWOY-MJGOQNOKSA-N 2 1 361.534 2.275 10 0 FEAEMP CC[NH+]1CCN(c2ccc(NC(=O)N3CC[N@H+]4CCC[C@@H]4C3)c(C)c2)CC1 ZINC000171806948 327162597 /nfs/dbraw/zinc/16/25/97/327162597.db2.gz PSFQMQDMRRVGSN-LJQANCHMSA-N 2 1 371.529 2.449 10 0 FEAEMP C[NH+](C)[C@@H](CNC(=O)N1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1Cl ZINC000171898178 327168414 /nfs/dbraw/zinc/16/84/14/327168414.db2.gz SPHJJWGAFZGQEA-PBHICJAKSA-N 2 1 350.894 2.432 10 0 FEAEMP C[NH+](C)[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1Cl ZINC000171898178 327168415 /nfs/dbraw/zinc/16/84/15/327168415.db2.gz SPHJJWGAFZGQEA-PBHICJAKSA-N 2 1 350.894 2.432 10 0 FEAEMP CC[N@H+]1CCCC[C@H]1C(=O)NCC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000174855456 327355268 /nfs/dbraw/zinc/35/52/68/327355268.db2.gz XOEQKVRDTDRSLG-SFTDATJTSA-N 2 1 373.541 2.423 10 0 FEAEMP Clc1cc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)cc2c1OCCO2 ZINC000261936033 328830365 /nfs/dbraw/zinc/83/03/65/328830365.db2.gz MEYVLFUJUWDXLA-USXIJHARSA-N 2 1 366.889 2.400 10 0 FEAEMP O=c1ccccn1Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)cc1 ZINC000261971610 328832559 /nfs/dbraw/zinc/83/25/59/328832559.db2.gz QRWJFTYZBUYFEX-HBMCJLEFSA-N 2 1 367.493 2.143 10 0 FEAEMP COc1cc[nH+]c(N2CCN(CC[N@H+](C)Cc3ccc(F)cc3)CC2)c1 ZINC000159279697 545938857 /nfs/dbraw/zinc/93/88/57/545938857.db2.gz RYPFYBAKXPBKGX-UHFFFAOYSA-N 2 1 358.461 2.483 10 0 FEAEMP COc1cc[nH+]c(N2CCN(CC[N@@H+](C)Cc3ccc(F)cc3)CC2)c1 ZINC000159279697 545938861 /nfs/dbraw/zinc/93/88/61/545938861.db2.gz RYPFYBAKXPBKGX-UHFFFAOYSA-N 2 1 358.461 2.483 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC1CC[NH+](CCOC(C)C)CC1 ZINC000176627771 546469021 /nfs/dbraw/zinc/46/90/21/546469021.db2.gz LREXUHZKGINITQ-RBUKOAKNSA-N 2 1 366.550 2.144 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC1CC[NH+](Cc2ccccn2)CC1 ZINC000177373758 546602820 /nfs/dbraw/zinc/60/28/20/546602820.db2.gz BSOIDWAYCGVVQQ-IBGZPJMESA-N 2 1 359.518 2.172 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N2CC[N@@H+]3CCCC[C@H]3C2)c1 ZINC000177394689 546608309 /nfs/dbraw/zinc/60/83/09/546608309.db2.gz HOMWUEQTUKSZHX-IBGZPJMESA-N 2 1 372.513 2.164 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N2CC[N@H+]3CCCC[C@H]3C2)c1 ZINC000177394689 546608315 /nfs/dbraw/zinc/60/83/15/546608315.db2.gz HOMWUEQTUKSZHX-IBGZPJMESA-N 2 1 372.513 2.164 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000178300230 546771712 /nfs/dbraw/zinc/77/17/12/546771712.db2.gz RKAFRKQFAJUTNZ-YOEHRIQHSA-N 2 1 355.442 2.393 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000178300230 546771716 /nfs/dbraw/zinc/77/17/16/546771716.db2.gz RKAFRKQFAJUTNZ-YOEHRIQHSA-N 2 1 355.442 2.393 10 0 FEAEMP COc1cc(OC)c(OC)cc1C[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000179516708 546970109 /nfs/dbraw/zinc/97/01/09/546970109.db2.gz XGLIDOUVNSCUQN-OAHLLOKOSA-N 2 1 366.502 2.237 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ccc3c(c2)CCC(=O)N3C)CC1 ZINC000186942669 548224815 /nfs/dbraw/zinc/22/48/15/548224815.db2.gz NPCQYCXIABGOHM-INIZCTEOSA-N 2 1 359.514 2.120 10 0 FEAEMP COc1cccc([C@H](CNC(=O)NC[C@@H]2CCC[N@H+]2C)[NH+]2CCCC2)c1 ZINC000195122593 548580704 /nfs/dbraw/zinc/58/07/04/548580704.db2.gz DHEYMEQWKYMDTJ-HKUYNNGSSA-N 2 1 360.502 2.226 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)C1 ZINC000245652699 548966026 /nfs/dbraw/zinc/96/60/26/548966026.db2.gz FAHHSTIDWCTRFF-JCGIZDLHSA-N 2 1 366.456 2.494 10 0 FEAEMP C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CCC[C@H]1CN1CCOCC1 ZINC000245893921 549012781 /nfs/dbraw/zinc/01/27/81/549012781.db2.gz MQJUXPQTRIGNAR-ICSRJNTNSA-N 2 1 374.529 2.013 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[N@H+]2CCCC[C@H]2C1)[NH+]1CCc2ccccc2C1 ZINC000246360668 549113623 /nfs/dbraw/zinc/11/36/23/549113623.db2.gz FCZCDNIKXZFHAK-PXNSSMCTSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[NH+]2CCCC[C@H]2C1)[N@@H+]1CCc2ccccc2C1 ZINC000246360668 549113627 /nfs/dbraw/zinc/11/36/27/549113627.db2.gz FCZCDNIKXZFHAK-PXNSSMCTSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[NH+]2CCCC[C@H]2C1)[N@H+]1CCc2ccccc2C1 ZINC000246360668 549113631 /nfs/dbraw/zinc/11/36/31/549113631.db2.gz FCZCDNIKXZFHAK-PXNSSMCTSA-N 2 1 356.514 2.313 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@H]2CC[NH+](CC(C)C)C2)C[C@@H]1CC ZINC000246601830 549171661 /nfs/dbraw/zinc/17/16/61/549171661.db2.gz ZPNXTTFFAXVQRB-MOPGFXCFSA-N 2 1 368.566 2.107 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)C[C@@H]1CC ZINC000246601830 549171664 /nfs/dbraw/zinc/17/16/64/549171664.db2.gz ZPNXTTFFAXVQRB-MOPGFXCFSA-N 2 1 368.566 2.107 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)C[C@@H]1CC ZINC000246601830 549171668 /nfs/dbraw/zinc/17/16/68/549171668.db2.gz ZPNXTTFFAXVQRB-MOPGFXCFSA-N 2 1 368.566 2.107 10 0 FEAEMP C[NH+](C)[C@H](CNC(=O)N1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1Cl ZINC000247596881 549365331 /nfs/dbraw/zinc/36/53/31/549365331.db2.gz SPHJJWGAFZGQEA-WMLDXEAASA-N 2 1 350.894 2.432 10 0 FEAEMP C[NH+](C)[C@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)c1ccccc1Cl ZINC000247596881 549365335 /nfs/dbraw/zinc/36/53/35/549365335.db2.gz SPHJJWGAFZGQEA-WMLDXEAASA-N 2 1 350.894 2.432 10 0 FEAEMP COC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000249208578 549569493 /nfs/dbraw/zinc/56/94/93/549569493.db2.gz CFNRDAZZCJNZHE-QRVBRYPASA-N 2 1 351.535 2.209 10 0 FEAEMP Cc1nccn1C[C@@H]1CCC[N@@H+]1CC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000249296652 549577825 /nfs/dbraw/zinc/57/78/25/549577825.db2.gz MOAMDYOCQVFJBR-VQTJNVASSA-N 2 1 369.513 2.075 10 0 FEAEMP Clc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)cc2c1OCCO2 ZINC000261960063 549774459 /nfs/dbraw/zinc/77/44/59/549774459.db2.gz PKBJWRONDXJJCE-FVQBIDKESA-N 2 1 352.862 2.358 10 0 FEAEMP COc1ccccc1N1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)C1 ZINC000262004355 549778980 /nfs/dbraw/zinc/77/89/80/549778980.db2.gz UXKZFMJGUUTQTA-NCXUSEDFSA-N 2 1 359.514 2.268 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000263187992 549884416 /nfs/dbraw/zinc/88/44/16/549884416.db2.gz HOYYOTMLMNWJIE-GXSJLCMTSA-N 2 1 369.181 2.018 10 0 FEAEMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653151922 677517655 /nfs/dbraw/zinc/51/76/55/677517655.db2.gz XXBOCLJLNJIKSK-MIGQKNRLSA-N 2 1 355.404 2.021 10 0 FEAEMP CN(C(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000653448418 677531444 /nfs/dbraw/zinc/53/14/44/677531444.db2.gz RVJJLRLLDRNWAR-BZUAXINKSA-N 2 1 355.404 2.117 10 0 FEAEMP COc1ccc(CC[N@H+](C)[C@@H]2CCCN(c3cc(N)[nH+]cn3)C2)cc1OC ZINC000072476733 136149313 /nfs/dbraw/zinc/14/93/13/136149313.db2.gz PZQCLNASLTZDNR-MRXNPFEDSA-N 2 1 371.485 2.219 10 0 FEAEMP COc1ccc(CC[N@@H+](C)[C@@H]2CCCN(c3cc(N)[nH+]cn3)C2)cc1OC ZINC000072476733 136149314 /nfs/dbraw/zinc/14/93/14/136149314.db2.gz PZQCLNASLTZDNR-MRXNPFEDSA-N 2 1 371.485 2.219 10 0 FEAEMP COc1cccc([C@@H](CNC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)[NH+](C)C)c1 ZINC000105083151 543157849 /nfs/dbraw/zinc/15/78/49/543157849.db2.gz ZXROHYIWHWSEAP-IEBWSBKVSA-N 2 1 360.502 2.178 10 0 FEAEMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N1CC[NH+]2CCCC[C@@H]2C1 ZINC000105244843 543166872 /nfs/dbraw/zinc/16/68/72/543166872.db2.gz UJQCWWQNRBVDQP-NHCUHLMSSA-N 2 1 370.541 2.431 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000105244843 543166875 /nfs/dbraw/zinc/16/68/75/543166875.db2.gz UJQCWWQNRBVDQP-NHCUHLMSSA-N 2 1 370.541 2.431 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000105244843 543166878 /nfs/dbraw/zinc/16/68/78/543166878.db2.gz UJQCWWQNRBVDQP-NHCUHLMSSA-N 2 1 370.541 2.431 10 0 FEAEMP C[N@H+](CC(=O)N1CCCCC1)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000106128340 543206005 /nfs/dbraw/zinc/20/60/05/543206005.db2.gz OFPFATFAYIZLNQ-OAQYLSRUSA-N 2 1 373.541 2.376 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)Nc2cc(Cl)ccc2F)CC1 ZINC000106126415 543205022 /nfs/dbraw/zinc/20/50/22/543205022.db2.gz RKACOCKZKTVBPB-CYBMUJFWSA-N 2 1 371.884 2.442 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CCOCC(F)(F)C(F)(F)F)CC1 ZINC000189180560 328133458 /nfs/dbraw/zinc/13/34/58/328133458.db2.gz VCJHDZYPJKNCAW-GFCCVEGCSA-N 2 1 362.383 2.225 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000170835481 327101408 /nfs/dbraw/zinc/10/14/08/327101408.db2.gz JWALMVLFCJXSJJ-HZPDHXFCSA-N 2 1 350.532 2.306 10 0 FEAEMP COc1cccc(NC(=O)CC[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c1 ZINC000174783017 327350864 /nfs/dbraw/zinc/35/08/64/327350864.db2.gz FZTYZZVZKQQNIW-MRXNPFEDSA-N 2 1 363.502 2.048 10 0 FEAEMP CCC(CC)[C@H](C(=O)N1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1)[NH+]1CCOCC1 ZINC000261804496 328821032 /nfs/dbraw/zinc/82/10/32/328821032.db2.gz RBYUXLCYKYPRLJ-QHAWAJNXSA-N 2 1 373.541 2.324 10 0 FEAEMP Cc1ccc(NC(=O)[C@H]2CC[C@H]([NH3+])C2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000263270218 328929556 /nfs/dbraw/zinc/92/95/56/328929556.db2.gz OUTCBVRTIPOINU-HOTGVXAUSA-N 2 1 358.486 2.485 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NC1CC[NH+](Cc2ccncc2)CC1 ZINC000179072260 546895387 /nfs/dbraw/zinc/89/53/87/546895387.db2.gz RWHHEVGDHXLASE-HXUWFJFHSA-N 2 1 373.545 2.466 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)N2CCC(CCC[NH+]3CCOCC3)CC2)C1 ZINC000181429879 547313738 /nfs/dbraw/zinc/31/37/38/547313738.db2.gz BBXTUEUYBSYKIG-LJQANCHMSA-N 2 1 366.550 2.005 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ccc3c(c2)sc(=O)n3C)CC1 ZINC000195011480 548564293 /nfs/dbraw/zinc/56/42/93/548564293.db2.gz ANMUHNUMCNVOJO-CQSZACIVSA-N 2 1 363.527 2.125 10 0 FEAEMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000195222929 548598407 /nfs/dbraw/zinc/59/84/07/548598407.db2.gz FKRODCWZQBDSIE-IBGZPJMESA-N 2 1 371.529 2.449 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)N1CCC[C@@H]1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000246392456 549122849 /nfs/dbraw/zinc/12/28/49/549122849.db2.gz ISJKLFHUAINQSH-FCGDIQPGSA-N 2 1 368.566 2.246 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)N1CCC[C@@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000246392456 549122852 /nfs/dbraw/zinc/12/28/52/549122852.db2.gz ISJKLFHUAINQSH-FCGDIQPGSA-N 2 1 368.566 2.246 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](C)[C@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000246567208 549163687 /nfs/dbraw/zinc/16/36/87/549163687.db2.gz XDGGFQKDLDMXOG-FXAWDEMLSA-N 2 1 374.529 2.412 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000246567208 549163689 /nfs/dbraw/zinc/16/36/89/549163689.db2.gz XDGGFQKDLDMXOG-FXAWDEMLSA-N 2 1 374.529 2.412 10 0 FEAEMP CC[C@H]1CN(C(=O)[C@H]2CCC[NH+]2Cc2ccccc2)CC[N@@H+]1CCOC ZINC000246980757 549256230 /nfs/dbraw/zinc/25/62/30/549256230.db2.gz FLQPJRVXFZNWAO-VQTJNVASSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@H]1CN(C(=O)[C@H]2CCC[NH+]2Cc2ccccc2)CC[N@H+]1CCOC ZINC000246980757 549256233 /nfs/dbraw/zinc/25/62/33/549256233.db2.gz FLQPJRVXFZNWAO-VQTJNVASSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@H]1CN(C(=O)[C@H]2CCC[N@@H+]2Cc2ccccc2)CC[NH+]1CCOC ZINC000246980757 549256237 /nfs/dbraw/zinc/25/62/37/549256237.db2.gz FLQPJRVXFZNWAO-VQTJNVASSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@H]1CN(C(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)CC[NH+]1CCOC ZINC000246980757 549256240 /nfs/dbraw/zinc/25/62/40/549256240.db2.gz FLQPJRVXFZNWAO-VQTJNVASSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)NC[C@H]2C[NH+](Cc3ccccc3)CCCO2)C1 ZINC000248656295 549478958 /nfs/dbraw/zinc/47/89/58/549478958.db2.gz DMBRDHLZQQQMJE-UXHICEINSA-N 2 1 374.529 2.061 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@H]2C[N@H+](Cc3ccccc3)CCCO2)C1 ZINC000248656295 549478960 /nfs/dbraw/zinc/47/89/60/549478960.db2.gz DMBRDHLZQQQMJE-UXHICEINSA-N 2 1 374.529 2.061 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)C1 ZINC000248656295 549478961 /nfs/dbraw/zinc/47/89/61/549478961.db2.gz DMBRDHLZQQQMJE-UXHICEINSA-N 2 1 374.529 2.061 10 0 FEAEMP C[C@@H]1CCC[N@@H+](CCNC(=O)N2CC[C@@H](C[NH+](C)Cc3cccnc3)C2)C1 ZINC000251714078 549651751 /nfs/dbraw/zinc/65/17/51/549651751.db2.gz KSTMSSHEUVYRII-QUCCMNQESA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@@H]1CCC[NH+](CCNC(=O)N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000251714078 549651755 /nfs/dbraw/zinc/65/17/55/549651755.db2.gz KSTMSSHEUVYRII-QUCCMNQESA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@@H]1CCC[NH+](CCNC(=O)N2CC[C@@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000251714078 549651758 /nfs/dbraw/zinc/65/17/58/549651758.db2.gz KSTMSSHEUVYRII-QUCCMNQESA-N 2 1 373.545 2.277 10 0 FEAEMP COC[C@@H]1[C@H](C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CCC[N@H+]1C ZINC000257183587 549713678 /nfs/dbraw/zinc/71/36/78/549713678.db2.gz HSTYWGYUGVUGFR-WOJBJXKFSA-N 2 1 359.514 2.124 10 0 FEAEMP [NH3+]C[C@@H]1C[N@H+](CC(=O)NCCc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000261868342 549763953 /nfs/dbraw/zinc/76/39/53/549763953.db2.gz XCOBXHISWFQQJI-QUCCMNQESA-N 2 1 355.457 2.159 10 0 FEAEMP [NH3+]C[C@@H]1C[N@@H+](CC(=O)NCCc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000261868342 549763956 /nfs/dbraw/zinc/76/39/56/549763956.db2.gz XCOBXHISWFQQJI-QUCCMNQESA-N 2 1 355.457 2.159 10 0 FEAEMP COc1cccc(N2CC[C@H](C[NH2+][C@@H]3CCC[C@H]3[C@H]3COCC[NH2+]3)C2)c1 ZINC000261901911 549767599 /nfs/dbraw/zinc/76/75/99/549767599.db2.gz HTVLAPYYIPJZBX-QYRPDUKASA-N 2 1 359.514 2.268 10 0 FEAEMP FC(F)(F)CN1CCC(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)CC1 ZINC000261919604 672905017 /nfs/dbraw/zinc/90/50/17/672905017.db2.gz KCYGYJIADLZQKF-GVDBMIGSSA-N 2 1 363.468 2.398 10 0 FEAEMP C[NH+](C)CCCOc1ccc(CNC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cc1 ZINC000105244065 543166996 /nfs/dbraw/zinc/16/69/96/543166996.db2.gz IADJDGPALVGOJP-LJQANCHMSA-N 2 1 374.529 2.397 10 0 FEAEMP CC(C)NC(=O)CC[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000106127462 543205075 /nfs/dbraw/zinc/20/50/75/543205075.db2.gz SWXZXZKLMLJELN-HXUWFJFHSA-N 2 1 361.530 2.279 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)NCC[N@H+](C)Cc2ccc(F)cc2)C1 ZINC000247458089 549336259 /nfs/dbraw/zinc/33/62/59/549336259.db2.gz UDTOHUABIKXZKZ-CRAIPNDOSA-N 2 1 350.482 2.285 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)C1 ZINC000247458089 549336263 /nfs/dbraw/zinc/33/62/63/549336263.db2.gz UDTOHUABIKXZKZ-CRAIPNDOSA-N 2 1 350.482 2.285 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)cc1 ZINC000189495471 328151714 /nfs/dbraw/zinc/15/17/14/328151714.db2.gz KLURGIBCIBVVNS-LPHOPBHVSA-N 2 1 372.513 2.162 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N(CC[NH+](C)C)Cc2cccc(OC)c2)C1 ZINC000191131228 328251240 /nfs/dbraw/zinc/25/12/40/328251240.db2.gz PFJHYHZIQYUUPS-SFHVURJKSA-N 2 1 362.518 2.253 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000118881482 326109858 /nfs/dbraw/zinc/10/98/58/326109858.db2.gz FUKKSBWIEFCKLA-HXUWFJFHSA-N 2 1 360.546 2.140 10 0 FEAEMP CN(c1ccccc1C[N@H+]1CC[C@H](N2CCOCC2)C1)C1CC[NH+](C)CC1 ZINC000121033191 326307717 /nfs/dbraw/zinc/30/77/17/326307717.db2.gz LVLHOVYIBUWMQY-NRFANRHFSA-N 2 1 372.557 2.124 10 0 FEAEMP Cc1ccc(C)c(OC[C@H](O)C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c1 ZINC000170941614 327108408 /nfs/dbraw/zinc/10/84/08/327108408.db2.gz WLROISGPCIXBOZ-UYAOXDASSA-N 2 1 364.530 2.068 10 0 FEAEMP Cc1ccc(C)c(OC[C@@H](O)C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c1 ZINC000170941616 327108473 /nfs/dbraw/zinc/10/84/73/327108473.db2.gz WLROISGPCIXBOZ-QUCCMNQESA-N 2 1 364.530 2.068 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)c2ccc(-n3ccnc3)cc2)C[C@H]1CC ZINC000172297025 327193595 /nfs/dbraw/zinc/19/35/95/327193595.db2.gz AZRRILNBAPIQJM-GOSISDBHSA-N 2 1 356.470 2.445 10 0 FEAEMP CCOCCN1CCN(C(=O)c2ccc(-n3ccnc3)cc2)C[C@H]1CC ZINC000172297025 327193596 /nfs/dbraw/zinc/19/35/96/327193596.db2.gz AZRRILNBAPIQJM-GOSISDBHSA-N 2 1 356.470 2.445 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000174181914 327311299 /nfs/dbraw/zinc/31/12/99/327311299.db2.gz OCDMGYQOFUZJIV-QZTJIDSGSA-N 2 1 368.485 2.344 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000174181914 327311300 /nfs/dbraw/zinc/31/13/00/327311300.db2.gz OCDMGYQOFUZJIV-QZTJIDSGSA-N 2 1 368.485 2.344 10 0 FEAEMP O[C@H]1C[NH2+]C[C@H]1C[NH2+]Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000263187994 328923425 /nfs/dbraw/zinc/92/34/25/328923425.db2.gz HOYYOTMLMNWJIE-KOLCDFICSA-N 2 1 369.181 2.018 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)C[C@H]1C ZINC000176495928 546454296 /nfs/dbraw/zinc/45/42/96/546454296.db2.gz ZBGRBQYJIXORMS-QGZVFWFLSA-N 2 1 366.550 2.146 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)C[C@H]1C ZINC000176495928 546454301 /nfs/dbraw/zinc/45/43/01/546454301.db2.gz ZBGRBQYJIXORMS-QGZVFWFLSA-N 2 1 366.550 2.146 10 0 FEAEMP COc1cccc([C@@H]2[C@H](NC(=O)N3CC[C@H]([NH+](C)C)C3)CC[N@H+]2C2CC2)c1 ZINC000183765043 547716291 /nfs/dbraw/zinc/71/62/91/547716291.db2.gz FSKLSHYFNHZOSO-DFQSSKMNSA-N 2 1 372.513 2.319 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(C)C(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000245423937 548914778 /nfs/dbraw/zinc/91/47/78/548914778.db2.gz BYTRHDTZSLWGBX-PMACEKPBSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000245423937 548914782 /nfs/dbraw/zinc/91/47/82/548914782.db2.gz BYTRHDTZSLWGBX-PMACEKPBSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[NH+]1CCC[C@H]1CN(C)C(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000245423937 548914784 /nfs/dbraw/zinc/91/47/84/548914784.db2.gz BYTRHDTZSLWGBX-PMACEKPBSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[NH+]1CCC[C@H]1CN(C)C(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000245423937 548914788 /nfs/dbraw/zinc/91/47/88/548914788.db2.gz BYTRHDTZSLWGBX-PMACEKPBSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[N@@H+](C)[C@H](C(=O)N(C)CC1CC[NH+](C[C@H](C)O)CC1)c1ccccc1 ZINC000246121072 549056338 /nfs/dbraw/zinc/05/63/38/549056338.db2.gz DAZAREUENWBZKR-PXNSSMCTSA-N 2 1 361.530 2.231 10 0 FEAEMP C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000246260738 549091388 /nfs/dbraw/zinc/09/13/88/549091388.db2.gz GHCQZLKJPBQZHP-ZJPYXAASSA-N 2 1 353.551 2.189 10 0 FEAEMP CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000246322817 549105873 /nfs/dbraw/zinc/10/58/73/549105873.db2.gz OCDMGYQOFUZJIV-ROUUACIJSA-N 2 1 368.485 2.344 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000246322817 549105875 /nfs/dbraw/zinc/10/58/75/549105875.db2.gz OCDMGYQOFUZJIV-ROUUACIJSA-N 2 1 368.485 2.344 10 0 FEAEMP CC[C@H](NC(=O)N1CC[C@@H]([NH+](C)C)C1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000246648566 549182800 /nfs/dbraw/zinc/18/28/00/549182800.db2.gz ZATQOJWJTXFTHI-HSALFYBXSA-N 2 1 374.529 2.012 10 0 FEAEMP CC[C@H](NC(=O)N1CC[C@@H]([NH+](C)C)C1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000246648566 549182804 /nfs/dbraw/zinc/18/28/04/549182804.db2.gz ZATQOJWJTXFTHI-HSALFYBXSA-N 2 1 374.529 2.012 10 0 FEAEMP C[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000247313596 549316394 /nfs/dbraw/zinc/31/63/94/549316394.db2.gz OEVDJURXVAXJII-DZGCQCFKSA-N 2 1 357.292 2.072 10 0 FEAEMP C[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000247313596 549316397 /nfs/dbraw/zinc/31/63/97/549316397.db2.gz OEVDJURXVAXJII-DZGCQCFKSA-N 2 1 357.292 2.072 10 0 FEAEMP C[C@H](C(=O)N(C)Cc1ccccc1)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247605816 549365814 /nfs/dbraw/zinc/36/58/14/549365814.db2.gz LPUURABJVNXLIM-ZWKOTPCHSA-N 2 1 361.530 2.058 10 0 FEAEMP CCN(C(=O)[C@@H](C)[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1)c1ccccc1 ZINC000247870682 549387275 /nfs/dbraw/zinc/38/72/75/549387275.db2.gz XKVHQNFQJIMASX-ZWKOTPCHSA-N 2 1 361.530 2.453 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@H]2CC[NH+](C)[C@@H]2c2ccccc2)CC[N@H+]1CCOC ZINC000247980033 549398031 /nfs/dbraw/zinc/39/80/31/549398031.db2.gz HHTUBKYNQPBJJJ-HSALFYBXSA-N 2 1 374.529 2.184 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)CC[NH+]1CCOC ZINC000247980033 549398035 /nfs/dbraw/zinc/39/80/35/549398035.db2.gz HHTUBKYNQPBJJJ-HSALFYBXSA-N 2 1 374.529 2.184 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)CC[NH+]1CCOC ZINC000247980033 549398038 /nfs/dbraw/zinc/39/80/38/549398038.db2.gz HHTUBKYNQPBJJJ-HSALFYBXSA-N 2 1 374.529 2.184 10 0 FEAEMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[NH+]2CCCC[C@H]2C1 ZINC000248798118 549503438 /nfs/dbraw/zinc/50/34/38/549503438.db2.gz ZLWKNSFKLZBAIM-UXHICEINSA-N 2 1 356.514 2.388 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000248798118 549503443 /nfs/dbraw/zinc/50/34/43/549503443.db2.gz ZLWKNSFKLZBAIM-UXHICEINSA-N 2 1 356.514 2.388 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000248798118 549503447 /nfs/dbraw/zinc/50/34/47/549503447.db2.gz ZLWKNSFKLZBAIM-UXHICEINSA-N 2 1 356.514 2.388 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000248845552 549512491 /nfs/dbraw/zinc/51/24/91/549512491.db2.gz RPWBIPGISBFWMV-JTEYQQGYSA-N 2 1 364.530 2.420 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000248845552 549512494 /nfs/dbraw/zinc/51/24/94/549512494.db2.gz RPWBIPGISBFWMV-JTEYQQGYSA-N 2 1 364.530 2.420 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000248845552 549512498 /nfs/dbraw/zinc/51/24/98/549512498.db2.gz RPWBIPGISBFWMV-JTEYQQGYSA-N 2 1 364.530 2.420 10 0 FEAEMP O=C([C@H](c1ccccc1)N1CCSCC1)N1CCN2CCCC[C@H]2C1 ZINC000250198562 549639431 /nfs/dbraw/zinc/63/94/31/549639431.db2.gz ACVMDQQBUNCQGV-OALUTQOASA-N 2 1 359.539 2.473 10 0 FEAEMP C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[NH+]2CCC[C@H]2C1)C1CC1 ZINC000251667614 549650648 /nfs/dbraw/zinc/65/06/48/549650648.db2.gz LNZOMRULBHLBTA-PMACEKPBSA-N 2 1 356.514 2.387 10 0 FEAEMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000251667614 549650653 /nfs/dbraw/zinc/65/06/53/549650653.db2.gz LNZOMRULBHLBTA-PMACEKPBSA-N 2 1 356.514 2.387 10 0 FEAEMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)C1CC1 ZINC000251667614 549650658 /nfs/dbraw/zinc/65/06/58/549650658.db2.gz LNZOMRULBHLBTA-PMACEKPBSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@H](c1cccc(N2CCCS2(=O)=O)c1)[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000261982489 549777325 /nfs/dbraw/zinc/77/73/25/549777325.db2.gz ROGOCDBXIWHROK-CVEARBPZSA-N 2 1 351.516 2.219 10 0 FEAEMP C[C@@H]1C[C@@H](CCNC(=O)[C@H]2CC(F)(F)CN2)C[N@H+]1Cc1ccccc1 ZINC000262695558 549840373 /nfs/dbraw/zinc/84/03/73/549840373.db2.gz BDTWYVVEWCRNFU-DJIMGWMZSA-N 2 1 351.441 2.401 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCCC[NH+](C)C2CCCCC2)C[C@@H]1C ZINC000117477936 543633265 /nfs/dbraw/zinc/63/32/65/543633265.db2.gz ARGDOUKWJXDVHG-KRWDZBQOSA-N 2 1 354.539 2.003 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCCC[NH+](C)C2CCCCC2)C[C@@H]1C ZINC000117477936 543633269 /nfs/dbraw/zinc/63/32/69/543633269.db2.gz ARGDOUKWJXDVHG-KRWDZBQOSA-N 2 1 354.539 2.003 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NCCC[N@H+](C)C2CCCCC2)C[C@@H]1C ZINC000117477936 543633273 /nfs/dbraw/zinc/63/32/73/543633273.db2.gz ARGDOUKWJXDVHG-KRWDZBQOSA-N 2 1 354.539 2.003 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NCCC[N@@H+](C)C2CCCCC2)C[C@@H]1C ZINC000117477936 543633276 /nfs/dbraw/zinc/63/32/76/543633276.db2.gz ARGDOUKWJXDVHG-KRWDZBQOSA-N 2 1 354.539 2.003 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)N2CCC(OCC[NH+]3CCCC3)CC2)C1 ZINC000132361032 544228503 /nfs/dbraw/zinc/22/85/03/544228503.db2.gz IJQYLXBBWOEJFW-MJGOQNOKSA-N 2 1 366.550 2.002 10 0 FEAEMP COC(=O)c1cc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c(C)s1 ZINC000151063113 544500900 /nfs/dbraw/zinc/50/09/00/544500900.db2.gz KFRSHKSRQINTKJ-ZDUSSCGKSA-N 2 1 354.516 2.368 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NCC[NH+](C)C2CCCC2)C[C@@H]1CC ZINC000117046372 326048883 /nfs/dbraw/zinc/04/88/83/326048883.db2.gz LWKLJTMTVLPYBI-KRWDZBQOSA-N 2 1 354.539 2.003 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NCC[N@H+](C)C2CCCC2)C[C@@H]1CC ZINC000117046372 326048884 /nfs/dbraw/zinc/04/88/84/326048884.db2.gz LWKLJTMTVLPYBI-KRWDZBQOSA-N 2 1 354.539 2.003 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NCC[N@@H+](C)C2CCCC2)C[C@@H]1CC ZINC000117046372 326048888 /nfs/dbraw/zinc/04/88/88/326048888.db2.gz LWKLJTMTVLPYBI-KRWDZBQOSA-N 2 1 354.539 2.003 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC000117398170 326059645 /nfs/dbraw/zinc/05/96/45/326059645.db2.gz XPJRGNGCRLSWHX-SFHVURJKSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC000117398170 326059647 /nfs/dbraw/zinc/05/96/47/326059647.db2.gz XPJRGNGCRLSWHX-SFHVURJKSA-N 2 1 374.529 2.013 10 0 FEAEMP COCCOc1ccccc1C[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000121138459 326316330 /nfs/dbraw/zinc/31/63/30/326316330.db2.gz RAAAUFBXZUVZRG-QGZVFWFLSA-N 2 1 350.503 2.236 10 0 FEAEMP Cc1cc(=O)n2nc(C[N@H+]3CC[C@@H](CNc4cccc(C)[nH+]4)C3)sc2n1 ZINC000171651165 327151795 /nfs/dbraw/zinc/15/17/95/327151795.db2.gz BWCYQDFJAXXCDT-AWEZNQCLSA-N 2 1 370.482 2.097 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C[C@@H]1C ZINC000172323144 327195695 /nfs/dbraw/zinc/19/56/95/327195695.db2.gz JIFBPBQNXZTVPS-SFHVURJKSA-N 2 1 374.529 2.145 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C[C@@H]1C ZINC000172323144 327195696 /nfs/dbraw/zinc/19/56/96/327195696.db2.gz JIFBPBQNXZTVPS-SFHVURJKSA-N 2 1 374.529 2.145 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC1CC[NH+](Cc2ccccn2)CC1 ZINC000173745931 327280910 /nfs/dbraw/zinc/28/09/10/327280910.db2.gz HVBWHOCHEMFVRK-VQTJNVASSA-N 2 1 371.529 2.314 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC[NH+]1CCc2ccccc2C1 ZINC000173833160 327287669 /nfs/dbraw/zinc/28/76/69/327287669.db2.gz YDVREAURUOYPPE-WOJBJXKFSA-N 2 1 356.514 2.313 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC[N@@H+]1CCc2ccccc2C1 ZINC000173833160 327287670 /nfs/dbraw/zinc/28/76/70/327287670.db2.gz YDVREAURUOYPPE-WOJBJXKFSA-N 2 1 356.514 2.313 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000173833160 327287671 /nfs/dbraw/zinc/28/76/71/327287671.db2.gz YDVREAURUOYPPE-WOJBJXKFSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H]1CN(C(=O)NCCCCC[NH+]2CCCCC2)C[C@H]1[NH+]1CCOCC1 ZINC000175800781 546353427 /nfs/dbraw/zinc/35/34/27/546353427.db2.gz MCBILILKTWWTRU-RTBURBONSA-N 2 1 366.550 2.005 10 0 FEAEMP CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000176144141 546413673 /nfs/dbraw/zinc/41/36/73/546413673.db2.gz IIZWJURNABRAIC-GOSISDBHSA-N 2 1 366.550 2.147 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000176144141 546413675 /nfs/dbraw/zinc/41/36/75/546413675.db2.gz IIZWJURNABRAIC-GOSISDBHSA-N 2 1 366.550 2.147 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC[C@@H](c1cccc(OC)c1)[NH+](C)C ZINC000176151908 546414798 /nfs/dbraw/zinc/41/47/98/546414798.db2.gz LILVOSCABSITBG-HKUYNNGSSA-N 2 1 362.518 2.424 10 0 FEAEMP C[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000177144075 546555052 /nfs/dbraw/zinc/55/50/52/546555052.db2.gz AWJMRFPPJOIIAY-FXAWDEMLSA-N 2 1 372.513 2.262 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000177144075 546555053 /nfs/dbraw/zinc/55/50/53/546555053.db2.gz AWJMRFPPJOIIAY-FXAWDEMLSA-N 2 1 372.513 2.262 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCc1cccc(OCC[NH+](C)C)c1 ZINC000177390687 546607117 /nfs/dbraw/zinc/60/71/17/546607117.db2.gz KVYNDRUPWMUZAO-SFHVURJKSA-N 2 1 362.518 2.253 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)C(=O)Nc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC000194156917 548443047 /nfs/dbraw/zinc/44/30/47/548443047.db2.gz OUYKGAKTIJNSFY-LJQANCHMSA-N 2 1 372.513 2.212 10 0 FEAEMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[NH+]2CCCC[C@@H]2C1 ZINC000194432141 548481682 /nfs/dbraw/zinc/48/16/82/548481682.db2.gz ZLWKNSFKLZBAIM-VQTJNVASSA-N 2 1 356.514 2.388 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000194432141 548481686 /nfs/dbraw/zinc/48/16/86/548481686.db2.gz ZLWKNSFKLZBAIM-VQTJNVASSA-N 2 1 356.514 2.388 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000194432141 548481690 /nfs/dbraw/zinc/48/16/90/548481690.db2.gz ZLWKNSFKLZBAIM-VQTJNVASSA-N 2 1 356.514 2.388 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@H](c1cccc(OC)c1)[NH+](C)C ZINC000245469031 548929425 /nfs/dbraw/zinc/92/94/25/548929425.db2.gz LILVOSCABSITBG-IEBWSBKVSA-N 2 1 362.518 2.424 10 0 FEAEMP CC[N@@H+](C)[C@@H](C(=O)N(C)CC1CC[NH+](C[C@H](C)O)CC1)c1ccccc1 ZINC000246121061 549056663 /nfs/dbraw/zinc/05/66/63/549056663.db2.gz DAZAREUENWBZKR-FXAWDEMLSA-N 2 1 361.530 2.231 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000246593693 549169979 /nfs/dbraw/zinc/16/99/79/549169979.db2.gz PNOFIXBURUNFFI-NJYVYQBISA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000246593693 549169980 /nfs/dbraw/zinc/16/99/80/549169980.db2.gz PNOFIXBURUNFFI-NJYVYQBISA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000246593693 549169981 /nfs/dbraw/zinc/16/99/81/549169981.db2.gz PNOFIXBURUNFFI-NJYVYQBISA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000246593693 549169982 /nfs/dbraw/zinc/16/99/82/549169982.db2.gz PNOFIXBURUNFFI-NJYVYQBISA-N 2 1 371.525 2.363 10 0 FEAEMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N1CC[NH+]2CCC[C@H]2C1 ZINC000246696784 549191303 /nfs/dbraw/zinc/19/13/03/549191303.db2.gz AROAXUWFEJQGOE-PMACEKPBSA-N 2 1 356.514 2.041 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@@H+]2CCC[C@H]2C1 ZINC000246696784 549191305 /nfs/dbraw/zinc/19/13/05/549191305.db2.gz AROAXUWFEJQGOE-PMACEKPBSA-N 2 1 356.514 2.041 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000246696784 549191310 /nfs/dbraw/zinc/19/13/10/549191310.db2.gz AROAXUWFEJQGOE-PMACEKPBSA-N 2 1 356.514 2.041 10 0 FEAEMP CC[N@H+](Cc1ccc(C(=O)N2CC[NH+](C[C@@H](C)O)[C@@H](C)C2)cc1)C(C)C ZINC000246787003 549213056 /nfs/dbraw/zinc/21/30/56/549213056.db2.gz QKYHMMBAWJLLIF-ZWKOTPCHSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH+](C[C@@H](C)O)[C@@H](C)C2)cc1)C(C)C ZINC000246787003 549213059 /nfs/dbraw/zinc/21/30/59/549213059.db2.gz QKYHMMBAWJLLIF-ZWKOTPCHSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[NH+](Cc1ccc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)cc1)C(C)C ZINC000246787003 549213061 /nfs/dbraw/zinc/21/30/61/549213061.db2.gz QKYHMMBAWJLLIF-ZWKOTPCHSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[NH+](Cc1ccc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)cc1)C(C)C ZINC000246787003 549213065 /nfs/dbraw/zinc/21/30/65/549213065.db2.gz QKYHMMBAWJLLIF-ZWKOTPCHSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[C@@H]1CN(C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@H+]1C[C@H](C)O ZINC000246793257 549214616 /nfs/dbraw/zinc/21/46/16/549214616.db2.gz JLPYUKYLCROOED-FXAWDEMLSA-N 2 1 359.514 2.200 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)[C@@](C)([NH3+])c2ccc(Br)cc2)C1 ZINC000261635196 549737244 /nfs/dbraw/zinc/73/72/44/549737244.db2.gz CBRUIKPMLHPFOB-ZBFHGGJFSA-N 2 1 354.292 2.224 10 0 FEAEMP CC(C)[C@@H](C(=O)N1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000261643129 549738391 /nfs/dbraw/zinc/73/83/91/549738391.db2.gz FUMIYMWLIJQHCC-RKNHFHLDSA-N 2 1 373.541 2.321 10 0 FEAEMP CC(C)[C@@H](C(=O)N1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000261643129 549738395 /nfs/dbraw/zinc/73/83/95/549738395.db2.gz FUMIYMWLIJQHCC-RKNHFHLDSA-N 2 1 373.541 2.321 10 0 FEAEMP C[C@@H](C(=O)NCCc1ccccc1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261861213 549763517 /nfs/dbraw/zinc/76/35/17/549763517.db2.gz WJLICKVESLRPJJ-WMQCIHAUSA-N 2 1 351.494 2.408 10 0 FEAEMP C[C@@H](C(=O)NCCc1ccccc1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261861213 549763520 /nfs/dbraw/zinc/76/35/20/549763520.db2.gz WJLICKVESLRPJJ-WMQCIHAUSA-N 2 1 351.494 2.408 10 0 FEAEMP COc1cc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2O)ccc1OCc1ccc(F)cc1 ZINC000263224687 549886549 /nfs/dbraw/zinc/88/65/49/549886549.db2.gz MPPKELOYJLIRGM-SJLPKXTDSA-N 2 1 360.429 2.083 10 0 FEAEMP CC(C)(C)NNc1[nH+]cnc(N2CC[NH+](Cc3ccccc3)CC2)c1N ZINC000040728900 136120443 /nfs/dbraw/zinc/12/04/43/136120443.db2.gz PXSAWKYLQLLZFO-UHFFFAOYSA-N 2 1 355.490 2.096 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC[C@@H]1CC[NH+](CCc2ccccc2)C1 ZINC000247470017 549338913 /nfs/dbraw/zinc/33/89/13/549338913.db2.gz RPJKSKFEBDWEGA-GIVPXCGWSA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000247470017 549338915 /nfs/dbraw/zinc/33/89/15/549338915.db2.gz RPJKSKFEBDWEGA-GIVPXCGWSA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000247470017 549338918 /nfs/dbraw/zinc/33/89/18/549338918.db2.gz RPJKSKFEBDWEGA-GIVPXCGWSA-N 2 1 370.541 2.429 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000117288791 543627904 /nfs/dbraw/zinc/62/79/04/543627904.db2.gz QMGVUTOLGXPJGD-UYAOXDASSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000117288791 543627909 /nfs/dbraw/zinc/62/79/09/543627909.db2.gz QMGVUTOLGXPJGD-UYAOXDASSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[NH+]1CCN(C(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000117288791 543627913 /nfs/dbraw/zinc/62/79/13/543627913.db2.gz QMGVUTOLGXPJGD-UYAOXDASSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[NH+]1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000117288791 543627914 /nfs/dbraw/zinc/62/79/14/543627914.db2.gz QMGVUTOLGXPJGD-UYAOXDASSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C[C@H]1C ZINC000117476805 543633656 /nfs/dbraw/zinc/63/36/56/543633656.db2.gz HRTYBQVCSMTSIG-GOSISDBHSA-N 2 1 374.529 2.145 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C[C@H]1C ZINC000117476805 543633659 /nfs/dbraw/zinc/63/36/59/543633659.db2.gz HRTYBQVCSMTSIG-GOSISDBHSA-N 2 1 374.529 2.145 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCCC[NH+]2CCC[C@H](C)C2)CC[N@H+]1CCOC ZINC000117478730 543633703 /nfs/dbraw/zinc/63/37/03/543633703.db2.gz GQGWUIRSACDYID-OALUTQOASA-N 2 1 368.566 2.251 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)CC[NH+]1CCOC ZINC000117478730 543633706 /nfs/dbraw/zinc/63/37/06/543633706.db2.gz GQGWUIRSACDYID-OALUTQOASA-N 2 1 368.566 2.251 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)CC[NH+]1CCOC ZINC000117478730 543633710 /nfs/dbraw/zinc/63/37/10/543633710.db2.gz GQGWUIRSACDYID-OALUTQOASA-N 2 1 368.566 2.251 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCC2([NH+]3CCSCC3)CCCC2)[C@@H](C)C1 ZINC000132252362 544224250 /nfs/dbraw/zinc/22/42/50/544224250.db2.gz WVSKYKLZAFHYED-IRXDYDNUSA-N 2 1 368.591 2.376 10 0 FEAEMP CCC[N@H+]1CC[C@@H](CNC(=O)N2CC[C@H](C[NH+](C)Cc3cccnc3)C2)C1 ZINC000190499311 328211816 /nfs/dbraw/zinc/21/18/16/328211816.db2.gz FFISEDSZYNWODZ-VQTJNVASSA-N 2 1 373.545 2.277 10 0 FEAEMP CCC[NH+]1CC[C@@H](CNC(=O)N2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000190499311 328211817 /nfs/dbraw/zinc/21/18/17/328211817.db2.gz FFISEDSZYNWODZ-VQTJNVASSA-N 2 1 373.545 2.277 10 0 FEAEMP CCC[NH+]1CC[C@@H](CNC(=O)N2CC[C@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000190499311 328211819 /nfs/dbraw/zinc/21/18/19/328211819.db2.gz FFISEDSZYNWODZ-VQTJNVASSA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000172080461 327179651 /nfs/dbraw/zinc/17/96/51/327179651.db2.gz GMPLKBNRFVIVDD-WIYYLYMNSA-N 2 1 370.541 2.067 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000174261385 327315748 /nfs/dbraw/zinc/31/57/48/327315748.db2.gz JHWAQVOXAYJIBN-IAGOWNOFSA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000174261385 327315749 /nfs/dbraw/zinc/31/57/49/327315749.db2.gz JHWAQVOXAYJIBN-IAGOWNOFSA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000174261385 327315750 /nfs/dbraw/zinc/31/57/50/327315750.db2.gz JHWAQVOXAYJIBN-IAGOWNOFSA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000174261385 327315751 /nfs/dbraw/zinc/31/57/51/327315751.db2.gz JHWAQVOXAYJIBN-IAGOWNOFSA-N 2 1 362.543 2.374 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC1CC[NH+](Cc2ccccn2)CC1 ZINC000177373739 546602211 /nfs/dbraw/zinc/60/22/11/546602211.db2.gz BSOIDWAYCGVVQQ-LJQANCHMSA-N 2 1 359.518 2.172 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000178333991 546776702 /nfs/dbraw/zinc/77/67/02/546776702.db2.gz FOVPUJAZOROWIZ-WMLDXEAASA-N 2 1 370.453 2.454 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000178333991 546776705 /nfs/dbraw/zinc/77/67/05/546776705.db2.gz FOVPUJAZOROWIZ-WMLDXEAASA-N 2 1 370.453 2.454 10 0 FEAEMP CCS[C@H](C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000178422897 546792118 /nfs/dbraw/zinc/79/21/18/546792118.db2.gz OPKPFQNBIVUQBZ-ZIAGYGMSSA-N 2 1 356.536 2.408 10 0 FEAEMP CCS[C@H](C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000178422897 546792128 /nfs/dbraw/zinc/79/21/28/546792128.db2.gz OPKPFQNBIVUQBZ-ZIAGYGMSSA-N 2 1 356.536 2.408 10 0 FEAEMP COCc1cccc(CNC(=O)C[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000178746259 546843220 /nfs/dbraw/zinc/84/32/20/546843220.db2.gz KJTTYHYICCTXCS-LJQANCHMSA-N 2 1 356.470 2.119 10 0 FEAEMP COCc1cccc(CNC(=O)C[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000178746259 546843222 /nfs/dbraw/zinc/84/32/22/546843222.db2.gz KJTTYHYICCTXCS-LJQANCHMSA-N 2 1 356.470 2.119 10 0 FEAEMP COc1cccc([C@@H]2[C@H](NC(=O)N3CC[C@@H]([NH+](C)C)C3)CC[N@H+]2C2CC2)c1 ZINC000183765030 547716371 /nfs/dbraw/zinc/71/63/71/547716371.db2.gz FSKLSHYFNHZOSO-MISYRCLQSA-N 2 1 372.513 2.319 10 0 FEAEMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000186268441 548110189 /nfs/dbraw/zinc/11/01/89/548110189.db2.gz LNZOMRULBHLBTA-UXHICEINSA-N 2 1 356.514 2.387 10 0 FEAEMP C[NH+](Cc1ccccc1)[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)C1CC1 ZINC000186268441 548110193 /nfs/dbraw/zinc/11/01/93/548110193.db2.gz LNZOMRULBHLBTA-UXHICEINSA-N 2 1 356.514 2.387 10 0 FEAEMP CC(C)N1CC[C@@H]([N@@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)C1=O ZINC000245468332 548930067 /nfs/dbraw/zinc/93/00/67/548930067.db2.gz KPGUYGSNACKWOT-NHCUHLMSSA-N 2 1 373.541 2.373 10 0 FEAEMP C[N@@H+](CC[C@H]1CCOC1=O)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000246936158 549246168 /nfs/dbraw/zinc/24/61/68/549246168.db2.gz MXHDWQYTQGOOOW-VQTJNVASSA-N 2 1 360.498 2.317 10 0 FEAEMP CCOc1ccc(OC[C@H](O)C[N@H+]2CCC[C@H]2Cn2ccnc2C)cc1 ZINC000247019177 549266600 /nfs/dbraw/zinc/26/66/00/549266600.db2.gz LSEXLIGOHVMKOW-ZWKOTPCHSA-N 2 1 359.470 2.495 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)cn1 ZINC000247062843 549274621 /nfs/dbraw/zinc/27/46/21/549274621.db2.gz IQHUYRBPFAZUFT-RHSMWYFYSA-N 2 1 356.474 2.104 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@H]2C)cn1 ZINC000247062843 549274627 /nfs/dbraw/zinc/27/46/27/549274627.db2.gz IQHUYRBPFAZUFT-RHSMWYFYSA-N 2 1 356.474 2.104 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)CC[N@H+]1CCOC ZINC000247266082 549308961 /nfs/dbraw/zinc/30/89/61/549308961.db2.gz ZAFGMIRQHHEBRW-IAGOWNOFSA-N 2 1 356.555 2.105 10 0 FEAEMP COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1 ZINC000247777311 549379822 /nfs/dbraw/zinc/37/98/22/549379822.db2.gz QXOAMAGMMFZALZ-HZPDHXFCSA-N 2 1 363.502 2.047 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@H]2CC[NH+](C)[C@H]2c2ccccc2)CC[N@H+]1CCOC ZINC000247980029 549397928 /nfs/dbraw/zinc/39/79/28/549397928.db2.gz HHTUBKYNQPBJJJ-AABGKKOBSA-N 2 1 374.529 2.184 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)CC[NH+]1CCOC ZINC000247980029 549397932 /nfs/dbraw/zinc/39/79/32/549397932.db2.gz HHTUBKYNQPBJJJ-AABGKKOBSA-N 2 1 374.529 2.184 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)CC[NH+]1CCOC ZINC000247980029 549397935 /nfs/dbraw/zinc/39/79/35/549397935.db2.gz HHTUBKYNQPBJJJ-AABGKKOBSA-N 2 1 374.529 2.184 10 0 FEAEMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[NH+]2CCCC[C@H]2C1 ZINC000248798115 549503352 /nfs/dbraw/zinc/50/33/52/549503352.db2.gz ZLWKNSFKLZBAIM-PMACEKPBSA-N 2 1 356.514 2.388 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000248798115 549503357 /nfs/dbraw/zinc/50/33/57/549503357.db2.gz ZLWKNSFKLZBAIM-PMACEKPBSA-N 2 1 356.514 2.388 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](Cc2ccccc2)C1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000248798115 549503362 /nfs/dbraw/zinc/50/33/62/549503362.db2.gz ZLWKNSFKLZBAIM-PMACEKPBSA-N 2 1 356.514 2.388 10 0 FEAEMP COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000249208575 549569451 /nfs/dbraw/zinc/56/94/51/549569451.db2.gz CFNRDAZZCJNZHE-OTWHNJEPSA-N 2 1 351.535 2.209 10 0 FEAEMP CCOc1c(OC)cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)cc1OC ZINC000261853680 549762510 /nfs/dbraw/zinc/76/25/10/549762510.db2.gz BKJNNQWWXGRYIU-BBWFWOEESA-N 2 1 364.486 2.349 10 0 FEAEMP O=C1CCCN1Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1 ZINC000261938510 549771742 /nfs/dbraw/zinc/77/17/42/549771742.db2.gz MPBMSLMPKKPKSZ-AQNXPRMDSA-N 2 1 357.498 2.056 10 0 FEAEMP CCN1CC[NH+](Cc2ccc(N[C@@H]3CCC[C@@H]3[C@@H]3COCC[NH2+]3)cc2)CC1 ZINC000261956991 549773723 /nfs/dbraw/zinc/77/37/23/549773723.db2.gz PCQGQNZBAGNVKI-BDTNDASRSA-N 2 1 372.557 2.393 10 0 FEAEMP CC[NH+](CC(=O)[O-])C1CC(N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000263528516 549906817 /nfs/dbraw/zinc/90/68/17/549906817.db2.gz VHNVWUJWZHWNLG-HSFDUWRESA-N 2 1 359.514 2.424 10 0 FEAEMP CC[NH+](CC(=O)[O-])C1CC(N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000263528516 549906820 /nfs/dbraw/zinc/90/68/20/549906820.db2.gz VHNVWUJWZHWNLG-HSFDUWRESA-N 2 1 359.514 2.424 10 0 FEAEMP C[C@H]1CN(C(=O)[C@@H]2C[NH2+]C[C@H]2C(F)(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000638447292 677145217 /nfs/dbraw/zinc/14/52/17/677145217.db2.gz BLOLTJBWAKJQMR-NUEKZKHPSA-N 2 1 355.404 2.117 10 0 FEAEMP C[C@H]1CN(C(=O)[C@@H]2C[NH2+]C[C@H]2C(F)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000638447292 677145218 /nfs/dbraw/zinc/14/52/18/677145218.db2.gz BLOLTJBWAKJQMR-NUEKZKHPSA-N 2 1 355.404 2.117 10 0 FEAEMP CC(C)CC[N@H+]1CCOc2ccc(CN3CC[NH+](CCO)CC3)cc2C1 ZINC000022911980 539702118 /nfs/dbraw/zinc/70/21/18/539702118.db2.gz CNAPYGFTJJUOSK-UHFFFAOYSA-N 2 1 361.530 2.037 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)N2CCC[NH+](Cc3ccc(OC)cc3)CC2)C1 ZINC000052594507 540476137 /nfs/dbraw/zinc/47/61/37/540476137.db2.gz JJHMCMKUMDQVLM-LJQANCHMSA-N 2 1 374.529 2.397 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)N2CCC[N@H+](Cc3ccc(OC)cc3)CC2)C1 ZINC000052594507 540476139 /nfs/dbraw/zinc/47/61/39/540476139.db2.gz JJHMCMKUMDQVLM-LJQANCHMSA-N 2 1 374.529 2.397 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)N2CCC[N@@H+](Cc3ccc(OC)cc3)CC2)C1 ZINC000052594507 540476141 /nfs/dbraw/zinc/47/61/41/540476141.db2.gz JJHMCMKUMDQVLM-LJQANCHMSA-N 2 1 374.529 2.397 10 0 FEAEMP Cc1csc([C@H]2CCC[N@@H+](Cc3cnc(N4CC[NH+](C)CC4)nc3)C2)n1 ZINC000092788248 542887119 /nfs/dbraw/zinc/88/71/19/542887119.db2.gz DPMYLRFHCCKRHC-KRWDZBQOSA-N 2 1 372.542 2.373 10 0 FEAEMP Cc1csc([C@H]2CCC[N@H+](Cc3cnc(N4CC[NH+](C)CC4)nc3)C2)n1 ZINC000092788248 542887122 /nfs/dbraw/zinc/88/71/22/542887122.db2.gz DPMYLRFHCCKRHC-KRWDZBQOSA-N 2 1 372.542 2.373 10 0 FEAEMP CC[N@H+]1CCN(c2nc(-c3ccncc3)nc3c2CC[NH2+]C3)CC1(C)C ZINC000071745413 136139907 /nfs/dbraw/zinc/13/99/07/136139907.db2.gz MLHOYANKWVKDKH-UHFFFAOYSA-N 2 1 352.486 2.105 10 0 FEAEMP O=C(NCC1([NH+]2CCSCC2)CCCC1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000105150141 543162348 /nfs/dbraw/zinc/16/23/48/543162348.db2.gz VNFTUTRYXSVKCL-QGZVFWFLSA-N 2 1 366.575 2.228 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@@H](C)C[NH+]2CCCCC2)C[C@H]1CC ZINC000117032121 543621723 /nfs/dbraw/zinc/62/17/23/543621723.db2.gz YKBGDKPNBYZTIZ-ZWKOTPCHSA-N 2 1 354.539 2.003 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@@H]2CCC[NH+](CC(C)C)C2)CC[N@H+]1CCOC ZINC000130695065 544161251 /nfs/dbraw/zinc/16/12/51/544161251.db2.gz RPWGRSYWBLFGNW-OALUTQOASA-N 2 1 368.566 2.107 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)CC[NH+]1CCOC ZINC000130695065 544161252 /nfs/dbraw/zinc/16/12/52/544161252.db2.gz RPWGRSYWBLFGNW-OALUTQOASA-N 2 1 368.566 2.107 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)CC[NH+]1CCOC ZINC000130695065 544161253 /nfs/dbraw/zinc/16/12/53/544161253.db2.gz RPWGRSYWBLFGNW-OALUTQOASA-N 2 1 368.566 2.107 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)[C@H]1COCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000236885642 328497170 /nfs/dbraw/zinc/49/71/70/328497170.db2.gz XMIOIEYPLRELBV-HZPDHXFCSA-N 2 1 373.419 2.193 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000091232627 325381924 /nfs/dbraw/zinc/38/19/24/325381924.db2.gz PPAHLGKPFOITAH-QFBILLFUSA-N 2 1 357.502 2.176 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N(C)C2CC[NH+](CCc3ccccn3)CC2)C1 ZINC000171048342 327114415 /nfs/dbraw/zinc/11/44/15/327114415.db2.gz VCRKARVYACEQPH-IBGZPJMESA-N 2 1 373.545 2.214 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)NC[C@@H]2CC[NH+](CCc3ccccc3)C2)C1 ZINC000171351238 327134073 /nfs/dbraw/zinc/13/40/73/327134073.db2.gz PMBAWMYZCWNIPP-PMACEKPBSA-N 2 1 358.530 2.335 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)C1 ZINC000171351238 327134074 /nfs/dbraw/zinc/13/40/74/327134074.db2.gz PMBAWMYZCWNIPP-PMACEKPBSA-N 2 1 358.530 2.335 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC000171351238 327134075 /nfs/dbraw/zinc/13/40/75/327134075.db2.gz PMBAWMYZCWNIPP-PMACEKPBSA-N 2 1 358.530 2.335 10 0 FEAEMP COc1ccccc1[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)[NH+]1CCCC1 ZINC000171897982 327167916 /nfs/dbraw/zinc/16/79/16/327167916.db2.gz MSFFBQLKUAYRGU-IEBWSBKVSA-N 2 1 372.513 2.322 10 0 FEAEMP CC[NH+](CC)CCOc1ccccc1CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000171900715 327168565 /nfs/dbraw/zinc/16/85/65/327168565.db2.gz MMUHAIVPIVZTPK-LJQANCHMSA-N 2 1 374.529 2.397 10 0 FEAEMP O=C(NCC1CC[NH+](Cc2cccs2)CC1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000171905460 327169247 /nfs/dbraw/zinc/16/92/47/327169247.db2.gz WWGTVMPXYFBIFZ-QGZVFWFLSA-N 2 1 362.543 2.450 10 0 FEAEMP O=C(NCC1([NH+]2CCSCC2)CCCCC1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000171978552 327174038 /nfs/dbraw/zinc/17/40/38/327174038.db2.gz ILQVQYVIFFVZQR-QGZVFWFLSA-N 2 1 366.575 2.228 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000173471964 327259594 /nfs/dbraw/zinc/25/95/94/327259594.db2.gz PTPNUTGYCGEXQC-LEWJYISDSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000173471964 327259597 /nfs/dbraw/zinc/25/95/97/327259597.db2.gz PTPNUTGYCGEXQC-LEWJYISDSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000173471964 327259598 /nfs/dbraw/zinc/25/95/98/327259598.db2.gz PTPNUTGYCGEXQC-LEWJYISDSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000173471951 327259797 /nfs/dbraw/zinc/25/97/97/327259797.db2.gz PTPNUTGYCGEXQC-NHCUHLMSSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000173471951 327259802 /nfs/dbraw/zinc/25/98/02/327259802.db2.gz PTPNUTGYCGEXQC-NHCUHLMSSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000173471951 327259804 /nfs/dbraw/zinc/25/98/04/327259804.db2.gz PTPNUTGYCGEXQC-NHCUHLMSSA-N 2 1 370.541 2.133 10 0 FEAEMP CC(C)N1CC[C@@H]([N@@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)C1=O ZINC000175191704 327378841 /nfs/dbraw/zinc/37/88/41/327378841.db2.gz KPGUYGSNACKWOT-RTWAWAEBSA-N 2 1 373.541 2.373 10 0 FEAEMP C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)[C@@H](C[NH3+])C1 ZINC000261702267 328812996 /nfs/dbraw/zinc/81/29/96/328812996.db2.gz FQVYEZHZHZAIEA-NHAYFPRASA-N 2 1 359.514 2.495 10 0 FEAEMP CCN(CC)C(=O)c1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)cc1 ZINC000261909042 328828717 /nfs/dbraw/zinc/82/87/17/328828717.db2.gz ITRXDAFXXHJMGI-VAMGGRTRSA-N 2 1 359.514 2.415 10 0 FEAEMP Clc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)cc2c1OCCO2 ZINC000261960065 328831970 /nfs/dbraw/zinc/83/19/70/328831970.db2.gz PKBJWRONDXJJCE-NUEKZKHPSA-N 2 1 352.862 2.358 10 0 FEAEMP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1 ZINC000262048438 328838230 /nfs/dbraw/zinc/83/82/30/328838230.db2.gz ZIWDIYDVGRHTFR-BHDDXSALSA-N 3 1 373.541 2.408 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCCCCC[NH+]2CCCCC2)C[C@H]1C ZINC000161625464 546133144 /nfs/dbraw/zinc/13/31/44/546133144.db2.gz LLCBCZJDLBFLQS-GOSISDBHSA-N 2 1 354.539 2.005 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCCCCC[NH+]2CCCCC2)C[C@H]1C ZINC000161625464 546133147 /nfs/dbraw/zinc/13/31/47/546133147.db2.gz LLCBCZJDLBFLQS-GOSISDBHSA-N 2 1 354.539 2.005 10 0 FEAEMP COc1ccccc1CCNC(=O)C[N@@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000178320368 546774966 /nfs/dbraw/zinc/77/49/66/546774966.db2.gz JAAXXOWBAIAODG-GOSISDBHSA-N 2 1 356.470 2.023 10 0 FEAEMP COc1ccccc1CCNC(=O)C[N@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000178320368 546774970 /nfs/dbraw/zinc/77/49/70/546774970.db2.gz JAAXXOWBAIAODG-GOSISDBHSA-N 2 1 356.470 2.023 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCCC[NH+]2CCCCC2)CC[N@H+]1C[C@@H](C)O ZINC000181802696 547384154 /nfs/dbraw/zinc/38/41/54/547384154.db2.gz JXNPIKGQOOJLHN-RTBURBONSA-N 2 1 368.566 2.129 10 0 FEAEMP CC[NH+]1CCN(c2ccccc2NC(=O)N[C@@H]2CCC[N@@H+](CC)C2)CC1 ZINC000194325655 548466160 /nfs/dbraw/zinc/46/61/60/548466160.db2.gz OOTIXOYSNMXBDX-QGZVFWFLSA-N 2 1 359.518 2.434 10 0 FEAEMP COc1ccccc1[C@H](CNC(=O)NC[C@H]1CCC[N@H+]1C)[NH+]1CCCC1 ZINC000195122100 548581282 /nfs/dbraw/zinc/58/12/82/548581282.db2.gz IPEIKQCZTGKMLU-AEFFLSMTSA-N 2 1 360.502 2.226 10 0 FEAEMP CCC[C@H](C(=O)Nc1ccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)cc1)[NH+](C)C ZINC000245513098 548936791 /nfs/dbraw/zinc/93/67/91/548936791.db2.gz OKKARFSMYOHIOG-SJLPKXTDSA-N 2 1 360.502 2.053 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@H](C)C(=O)NC(=O)NCc1ccccc1 ZINC000245933458 549024169 /nfs/dbraw/zinc/02/41/69/549024169.db2.gz KBCNFCYBJWAECQ-QAPCUYQASA-N 2 1 369.469 2.070 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@H](C)C(=O)NC(=O)NCc1ccccc1 ZINC000245933458 549024173 /nfs/dbraw/zinc/02/41/73/549024173.db2.gz KBCNFCYBJWAECQ-QAPCUYQASA-N 2 1 369.469 2.070 10 0 FEAEMP COc1ccccc1N1CC[C@H]([N@H+]2CCC[C@H]2Cn2ccnc2C)C1=O ZINC000246573457 549164734 /nfs/dbraw/zinc/16/47/34/549164734.db2.gz XRDYZOQEURDAHH-WMZOPIPTSA-N 2 1 354.454 2.470 10 0 FEAEMP COc1ccccc1N1CC[C@H]([N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)C1=O ZINC000246573457 549164736 /nfs/dbraw/zinc/16/47/36/549164736.db2.gz XRDYZOQEURDAHH-WMZOPIPTSA-N 2 1 354.454 2.470 10 0 FEAEMP CC[C@H](NC(=O)N1CC[C@@H]([NH+](C)C)C1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000246648553 549182749 /nfs/dbraw/zinc/18/27/49/549182749.db2.gz ZATQOJWJTXFTHI-AABGKKOBSA-N 2 1 374.529 2.012 10 0 FEAEMP CC[C@H](NC(=O)N1CC[C@@H]([NH+](C)C)C1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000246648553 549182754 /nfs/dbraw/zinc/18/27/54/549182754.db2.gz ZATQOJWJTXFTHI-AABGKKOBSA-N 2 1 374.529 2.012 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)CCC[NH+]2CCN(c3ccccc3)CC2)C1 ZINC000246747737 549202364 /nfs/dbraw/zinc/20/23/64/549202364.db2.gz BFOVYWITFCFSCN-PZJWPPBQSA-N 2 1 372.557 2.434 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCCCC[NH+]2C[C@H](C)C[C@H](C)C2)C[C@@H]1C ZINC000247194240 549297508 /nfs/dbraw/zinc/29/75/08/549297508.db2.gz SQEGLHHFMMXIKY-OTWHNJEPSA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCCCC[NH+]2C[C@H](C)C[C@H](C)C2)C[C@@H]1C ZINC000247194240 549297509 /nfs/dbraw/zinc/29/75/09/549297509.db2.gz SQEGLHHFMMXIKY-OTWHNJEPSA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)C[C@@H]1C ZINC000247194240 549297513 /nfs/dbraw/zinc/29/75/13/549297513.db2.gz SQEGLHHFMMXIKY-OTWHNJEPSA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C[C@@H]1C ZINC000247194240 549297514 /nfs/dbraw/zinc/29/75/14/549297514.db2.gz SQEGLHHFMMXIKY-OTWHNJEPSA-N 2 1 368.566 2.107 10 0 FEAEMP CCO[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)C12CCOCC2 ZINC000249054380 549543315 /nfs/dbraw/zinc/54/33/15/549543315.db2.gz XHSQQFZMKKDHAV-NJDAHSKKSA-N 2 1 374.525 2.317 10 0 FEAEMP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)CC1 ZINC000261999779 549779082 /nfs/dbraw/zinc/77/90/82/549779082.db2.gz UJHAVTKWLJBMMD-QYRPDUKASA-N 2 1 358.530 2.354 10 0 FEAEMP [NH3+]C[C@@H]1C[N@H+](CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C[C@H]1c1ccccc1 ZINC000262286373 549806366 /nfs/dbraw/zinc/80/63/66/549806366.db2.gz VIVFNGOLPDDQSX-ZACQAIPSSA-N 2 1 369.431 2.462 10 0 FEAEMP [NH3+]C[C@@H]1C[N@@H+](CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C[C@H]1c1ccccc1 ZINC000262286373 549806368 /nfs/dbraw/zinc/80/63/68/549806368.db2.gz VIVFNGOLPDDQSX-ZACQAIPSSA-N 2 1 369.431 2.462 10 0 FEAEMP C[C@@H]1C[C@H](CCNC(=O)[C@H]2CC(F)(F)CN2)C[N@H+]1Cc1ccccc1 ZINC000262695559 549840355 /nfs/dbraw/zinc/84/03/55/549840355.db2.gz BDTWYVVEWCRNFU-HYVNUMGLSA-N 2 1 351.441 2.401 10 0 FEAEMP O=C(Nc1cccc(C[NH2+]C[C@@H]2C[NH2+]C[C@@H]2O)c1)c1ccccc1Cl ZINC000263159759 549882333 /nfs/dbraw/zinc/88/23/33/549882333.db2.gz DRUIINFMRUTQEM-KDOFPFPSSA-N 2 1 359.857 2.262 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000221944998 568036047 /nfs/dbraw/zinc/03/60/47/568036047.db2.gz FQJCUQAMJKIRFG-IXDOHACOSA-N 2 1 356.555 2.150 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000221944998 568036049 /nfs/dbraw/zinc/03/60/49/568036049.db2.gz FQJCUQAMJKIRFG-IXDOHACOSA-N 2 1 356.555 2.150 10 0 FEAEMP COc1ccc(Br)cc1C[N@H+]1C[C@H](CO)C2(C1)CC[NH2+]CC2 ZINC000169782186 672322189 /nfs/dbraw/zinc/32/21/89/672322189.db2.gz BVKAXNJWKKVBTJ-CQSZACIVSA-N 2 1 369.303 2.252 10 0 FEAEMP O[C@](C[NH2+][C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1)(c1ccccc1)C(F)(F)F ZINC000261852274 672904209 /nfs/dbraw/zinc/90/42/09/672904209.db2.gz BINVCJUNBLNBQW-QBPKDAKJSA-N 2 1 358.404 2.183 10 0 FEAEMP C[C@@H]1CN(C(=O)[C@@H]2C[NH2+]C[C@H]2C(F)(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000638447291 677145233 /nfs/dbraw/zinc/14/52/33/677145233.db2.gz BLOLTJBWAKJQMR-FVQBIDKESA-N 2 1 355.404 2.117 10 0 FEAEMP C[C@@H]1CN(C(=O)[C@@H]2C[NH2+]C[C@H]2C(F)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000638447291 677145234 /nfs/dbraw/zinc/14/52/34/677145234.db2.gz BLOLTJBWAKJQMR-FVQBIDKESA-N 2 1 355.404 2.117 10 0 FEAEMP COc1ccc(C[NH2+]Cc2ccncc2)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000012436242 539559981 /nfs/dbraw/zinc/55/99/81/539559981.db2.gz HJOUCSNSTJIWKI-LJQANCHMSA-N 2 1 373.497 2.460 10 0 FEAEMP Cc1cc(C[NH2+]Cc2ccc(OC[C@@H](O)C[NH+]3CCCCC3)cc2)nn1C ZINC000012454071 539561088 /nfs/dbraw/zinc/56/10/88/539561088.db2.gz BFXIDJLNIQNINO-FQEVSTJZSA-N 2 1 372.513 2.244 10 0 FEAEMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NC[C@@H]3CN(C)CCO3)cc2)C1 ZINC000104787342 543143978 /nfs/dbraw/zinc/14/39/78/543143978.db2.gz SLDMGCILWWBPQY-YLJYHZDGSA-N 2 1 374.529 2.048 10 0 FEAEMP C[NH+](C)C[C@H]1CN(C(=O)NC[C@H]2CCCC[N@H+]2Cc2ccccc2)CCO1 ZINC000117040266 543621595 /nfs/dbraw/zinc/62/15/95/543621595.db2.gz KOGCAFGKXDQRDK-UXHICEINSA-N 2 1 374.529 2.013 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1cccc(OCC[NH+](C)C)c1 ZINC000247497136 549345213 /nfs/dbraw/zinc/34/52/13/549345213.db2.gz USKDJCYMVAWSFZ-AEFFLSMTSA-N 2 1 360.502 2.005 10 0 FEAEMP COC(=O)c1cc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c(C)s1 ZINC000151063059 544500799 /nfs/dbraw/zinc/50/07/99/544500799.db2.gz KFRSHKSRQINTKJ-CYBMUJFWSA-N 2 1 354.516 2.368 10 0 FEAEMP CC[N@@H+](CC(=O)NCC1CC[NH+](C[C@H](O)c2ccccc2)CC1)C1CC1 ZINC000153174396 544742310 /nfs/dbraw/zinc/74/23/10/544742310.db2.gz NGYVCNFGDUAEHJ-FQEVSTJZSA-N 2 1 359.514 2.033 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc2c(c1)OCO2 ZINC000154589297 544925603 /nfs/dbraw/zinc/92/56/03/544925603.db2.gz YCBANVIDIVANHF-XJKSGUPXSA-N 2 1 356.426 2.412 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1ccc2c(c1)OCO2 ZINC000154589297 544925610 /nfs/dbraw/zinc/92/56/10/544925610.db2.gz YCBANVIDIVANHF-XJKSGUPXSA-N 2 1 356.426 2.412 10 0 FEAEMP C[C@H](CNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1)C[NH+]1CCCC1 ZINC000190697414 328225514 /nfs/dbraw/zinc/22/55/14/328225514.db2.gz BDMXDHGISWEFKP-UYAOXDASSA-N 2 1 373.545 2.277 10 0 FEAEMP CC[N@H+](CC(=O)N1CCC[C@@H]([NH+](C)CC(=O)OC(C)(C)C)CC1)C1CC1 ZINC000191589696 328272938 /nfs/dbraw/zinc/27/29/38/328272938.db2.gz ICNNJNKHRPJBPW-MRXNPFEDSA-N 2 1 367.534 2.125 10 0 FEAEMP CC[N@@H+](CC(=O)N1CCC[C@@H]([NH+](C)CC(=O)OC(C)(C)C)CC1)C1CC1 ZINC000191589696 328272939 /nfs/dbraw/zinc/27/29/39/328272939.db2.gz ICNNJNKHRPJBPW-MRXNPFEDSA-N 2 1 367.534 2.125 10 0 FEAEMP CC[NH+](CC(=O)N1CCC[C@@H]([N@H+](C)CC(=O)OC(C)(C)C)CC1)C1CC1 ZINC000191589696 328272940 /nfs/dbraw/zinc/27/29/40/328272940.db2.gz ICNNJNKHRPJBPW-MRXNPFEDSA-N 2 1 367.534 2.125 10 0 FEAEMP CC[NH+](CC(=O)N1CCC[C@@H]([N@@H+](C)CC(=O)OC(C)(C)C)CC1)C1CC1 ZINC000191589696 328272941 /nfs/dbraw/zinc/27/29/41/328272941.db2.gz ICNNJNKHRPJBPW-MRXNPFEDSA-N 2 1 367.534 2.125 10 0 FEAEMP Cc1ccc(N2CC[C@H]([N@H+](C)CC3CC[NH+](C[C@@H](C)O)CC3)C2=O)cc1 ZINC000119184409 326135479 /nfs/dbraw/zinc/13/54/79/326135479.db2.gz OJKKRFNSBNXRRS-XLIONFOSSA-N 2 1 359.514 2.125 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cn(C)nc2-c2cccnc2)CC1 ZINC000121100156 326313386 /nfs/dbraw/zinc/31/33/86/326313386.db2.gz POVYPNIRUSZFLF-INIZCTEOSA-N 2 1 357.502 2.007 10 0 FEAEMP CCC[C@H](C(=O)NCCC[NH+]1CCN(Cc2ccccc2)CC1)[NH+](C)C ZINC000161530418 327002052 /nfs/dbraw/zinc/00/20/52/327002052.db2.gz ARFLLSWNBIPLSK-HXUWFJFHSA-N 2 1 360.546 2.041 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC000163758988 327058041 /nfs/dbraw/zinc/05/80/41/327058041.db2.gz CKAVPNIGSQLSAR-LJQANCHMSA-N 2 1 373.541 2.468 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC000163758988 327058043 /nfs/dbraw/zinc/05/80/43/327058043.db2.gz CKAVPNIGSQLSAR-LJQANCHMSA-N 2 1 373.541 2.468 10 0 FEAEMP COC(=O)c1cc(F)ccc1C[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000170941664 327108424 /nfs/dbraw/zinc/10/84/24/327108424.db2.gz ZGPMWQGIUJRNIC-CQSZACIVSA-N 2 1 352.450 2.137 10 0 FEAEMP Cc1cccc(C)c1OC[C@@H](O)C[N@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000170941846 327108937 /nfs/dbraw/zinc/10/89/37/327108937.db2.gz CQQWAURZKJSKCS-QUCCMNQESA-N 2 1 364.530 2.068 10 0 FEAEMP COc1cccc([C@@H](CNC(=O)N2CC[N@H+]3CCC[C@@H]3C2)[NH+]2CCCC2)c1 ZINC000171898170 327168243 /nfs/dbraw/zinc/16/82/43/327168243.db2.gz KYFHTPQNVBEEEH-UYAOXDASSA-N 2 1 372.513 2.322 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)Cc2nc(CCc3ccccc3)no2)CC1 ZINC000173682527 327276613 /nfs/dbraw/zinc/27/66/13/327276613.db2.gz JJUZQOOXHPDGQM-QGZVFWFLSA-N 2 1 372.513 2.379 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2nc(CCc3ccccc3)no2)CC1 ZINC000173682527 327276614 /nfs/dbraw/zinc/27/66/14/327276614.db2.gz JJUZQOOXHPDGQM-QGZVFWFLSA-N 2 1 372.513 2.379 10 0 FEAEMP Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3COCC[NH2+]3)cn2)n1 ZINC000261870148 328825758 /nfs/dbraw/zinc/82/57/58/328825758.db2.gz DAJIJRYSRJOGQT-QRVBRYPASA-N 2 1 355.486 2.131 10 0 FEAEMP Fc1cccc(F)c1N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)C1 ZINC000261871759 328825952 /nfs/dbraw/zinc/82/59/52/328825952.db2.gz DFHOCZAOHZECFE-LBTBCDHLSA-N 2 1 351.441 2.290 10 0 FEAEMP Cc1cccc([C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)N2CCOCC2)c1 ZINC000261909086 328828840 /nfs/dbraw/zinc/82/88/40/328828840.db2.gz IUIXAUZUBBCWOX-LRSLUSHPSA-N 2 1 373.541 2.115 10 0 FEAEMP COc1ccccc1N1CCC([NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)CC1 ZINC000261972814 328832862 /nfs/dbraw/zinc/83/28/62/328832862.db2.gz QSBYVAGNJOEPKF-OTWHNJEPSA-N 2 1 359.514 2.411 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000262078540 328840462 /nfs/dbraw/zinc/84/04/62/328840462.db2.gz DONZEHSGLIXGBI-OXQOHEQNSA-N 2 1 366.440 2.348 10 0 FEAEMP O[C@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000263245649 328927901 /nfs/dbraw/zinc/92/79/01/328927901.db2.gz PERICHAMIBBZOJ-PBHICJAKSA-N 2 1 354.479 2.271 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NC2CC[NH+](Cc3ccccn3)CC2)[C@@H](C)C1 ZINC000157495686 545748256 /nfs/dbraw/zinc/74/82/56/545748256.db2.gz RXWGZDYPBJEAIN-LPHOPBHVSA-N 2 1 359.518 2.074 10 0 FEAEMP C[C@@H]1CN(C(=O)NCCC[N@H+](C)C2CCCCC2)C[C@H]1[NH+]1CCOCC1 ZINC000175668647 546330325 /nfs/dbraw/zinc/33/03/25/546330325.db2.gz ILAOPDLFSBYDKX-IEBWSBKVSA-N 2 1 366.550 2.003 10 0 FEAEMP C[C@@H]1CN(C(=O)NCCC[N@@H+](C)C2CCCCC2)C[C@H]1[NH+]1CCOCC1 ZINC000175668647 546330327 /nfs/dbraw/zinc/33/03/27/546330327.db2.gz ILAOPDLFSBYDKX-IEBWSBKVSA-N 2 1 366.550 2.003 10 0 FEAEMP CC[N@H+](C)Cc1cccc(CNC(=O)N2C[C@@H](C)[C@H]([NH+]3CCOCC3)C2)c1 ZINC000175731192 546340870 /nfs/dbraw/zinc/34/08/70/546340870.db2.gz IZNCWAXYMFITFN-YLJYHZDGSA-N 2 1 374.529 2.000 10 0 FEAEMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2C[C@@H](C)[C@H]([NH+]3CCOCC3)C2)c1 ZINC000175731192 546340874 /nfs/dbraw/zinc/34/08/74/546340874.db2.gz IZNCWAXYMFITFN-YLJYHZDGSA-N 2 1 374.529 2.000 10 0 FEAEMP CC[NH+](CC)[C@@H](C)CNC(=O)NC1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000175774628 546347580 /nfs/dbraw/zinc/34/75/80/546347580.db2.gz MBFQQOXJPJRILR-HNNXBMFYSA-N 2 1 362.522 2.092 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCC1([NH+]2CCSCC2)CCCC1 ZINC000176228878 546421719 /nfs/dbraw/zinc/42/17/19/546421719.db2.gz AXFZIXKRMABBQS-QGZVFWFLSA-N 2 1 368.591 2.474 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC1CC[NH+](Cc2ccncc2)CC1 ZINC000177377026 546603722 /nfs/dbraw/zinc/60/37/22/546603722.db2.gz HNLRKTSDNYFKAN-LJQANCHMSA-N 2 1 359.518 2.172 10 0 FEAEMP COc1ccccc1CNC(=O)[C@H](C)[N@@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000178328874 546775813 /nfs/dbraw/zinc/77/58/13/546775813.db2.gz YIMDJPHQCIDTDY-YJBOKZPZSA-N 2 1 356.470 2.369 10 0 FEAEMP COc1ccccc1CNC(=O)[C@H](C)[N@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000178328874 546775817 /nfs/dbraw/zinc/77/58/17/546775817.db2.gz YIMDJPHQCIDTDY-YJBOKZPZSA-N 2 1 356.470 2.369 10 0 FEAEMP C[C@H]([NH2+][C@@H](CO)c1ccccc1)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000183626949 547691368 /nfs/dbraw/zinc/69/13/68/547691368.db2.gz XHSWIYAXYUGLHW-WMQCIHAUSA-N 2 1 367.493 2.089 10 0 FEAEMP C[C@H]([NH2+][C@@H](CO)c1ccccc1)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000183626949 547691370 /nfs/dbraw/zinc/69/13/70/547691370.db2.gz XHSWIYAXYUGLHW-WMQCIHAUSA-N 2 1 367.493 2.089 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000245434390 548918114 /nfs/dbraw/zinc/91/81/14/548918114.db2.gz PTPNUTGYCGEXQC-RTWAWAEBSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1ccc(CN2CCN(C)CC2)cc1 ZINC000245434390 548918116 /nfs/dbraw/zinc/91/81/16/548918116.db2.gz PTPNUTGYCGEXQC-RTWAWAEBSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000245434390 548918120 /nfs/dbraw/zinc/91/81/20/548918120.db2.gz PTPNUTGYCGEXQC-RTWAWAEBSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000245434390 548918122 /nfs/dbraw/zinc/91/81/22/548918122.db2.gz PTPNUTGYCGEXQC-RTWAWAEBSA-N 2 1 370.541 2.133 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)c1 ZINC000246395498 549124572 /nfs/dbraw/zinc/12/45/72/549124572.db2.gz KZRVHIUUIMCLNZ-APWZRJJASA-N 2 1 374.529 2.312 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@H](c2cccs2)[NH+](C)C)CC[N@H+]1CCOC ZINC000246972142 549253903 /nfs/dbraw/zinc/25/39/03/549253903.db2.gz DXAJSNXCPNLEST-JKSUJKDBSA-N 2 1 368.547 2.103 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N2CC[NH+]3CCCC[C@H]3C2)[C@@H](C)C1 ZINC000247272215 549310156 /nfs/dbraw/zinc/31/01/56/549310156.db2.gz RKGKOTJMQKZZDM-FHWLQOOXSA-N 2 1 366.550 2.003 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2CC[N@@H+]3CCCC[C@H]3C2)[C@@H](C)C1 ZINC000247272215 549310157 /nfs/dbraw/zinc/31/01/57/549310157.db2.gz RKGKOTJMQKZZDM-FHWLQOOXSA-N 2 1 366.550 2.003 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2CC[N@H+]3CCCC[C@H]3C2)[C@@H](C)C1 ZINC000247272215 549310160 /nfs/dbraw/zinc/31/01/60/549310160.db2.gz RKGKOTJMQKZZDM-FHWLQOOXSA-N 2 1 366.550 2.003 10 0 FEAEMP C[C@@H]1C[C@H](C)CN(C(=O)CN2CC[C@@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000248651346 549477653 /nfs/dbraw/zinc/47/76/53/549477653.db2.gz MVBRSTBTHVCCAN-NSHGMRRFSA-N 2 1 358.530 2.340 10 0 FEAEMP C[C@@H]1C[C@H](C)CN(C(=O)C[N@@H+]2CC[C@@H](CN(C)Cc3cccnc3)C2)C1 ZINC000248651346 549477657 /nfs/dbraw/zinc/47/76/57/549477657.db2.gz MVBRSTBTHVCCAN-NSHGMRRFSA-N 2 1 358.530 2.340 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)cc1 ZINC000248751579 549495862 /nfs/dbraw/zinc/49/58/62/549495862.db2.gz KLURGIBCIBVVNS-VQIMIIECSA-N 2 1 372.513 2.162 10 0 FEAEMP COc1cccc([C@@H](CNC(=O)NC[C@H]2CCC[N@H+]2C)[NH+]2CCCC2)c1 ZINC000249735160 549621274 /nfs/dbraw/zinc/62/12/74/549621274.db2.gz DHEYMEQWKYMDTJ-IEBWSBKVSA-N 2 1 360.502 2.226 10 0 FEAEMP C[NH+](C)[C@@H]1CCC[C@@H](NC(=O)N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000252032644 549661758 /nfs/dbraw/zinc/66/17/58/549661758.db2.gz ZVGAEGZFXSYVKV-XUVXKRRUSA-N 2 1 373.545 2.418 10 0 FEAEMP COCc1ccccc1CNC(=O)C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261819502 549758730 /nfs/dbraw/zinc/75/87/30/549758730.db2.gz SEEVROQSIHSKLS-RTWAWAEBSA-N 2 1 367.493 2.124 10 0 FEAEMP COCc1ccccc1CNC(=O)C[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261819502 549758733 /nfs/dbraw/zinc/75/87/33/549758733.db2.gz SEEVROQSIHSKLS-RTWAWAEBSA-N 2 1 367.493 2.124 10 0 FEAEMP CN(C)S(=O)(=O)c1cccc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261861014 549763169 /nfs/dbraw/zinc/76/31/69/549763169.db2.gz WHHBLMMMSSCEAK-QUCCMNQESA-N 2 1 373.522 2.111 10 0 FEAEMP CN(C)S(=O)(=O)c1cccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261861014 549763172 /nfs/dbraw/zinc/76/31/72/549763172.db2.gz WHHBLMMMSSCEAK-QUCCMNQESA-N 2 1 373.522 2.111 10 0 FEAEMP Cc1ccccc1CCNC(=O)C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262280221 549805468 /nfs/dbraw/zinc/80/54/68/549805468.db2.gz UMWMUJVHIIVRJW-RTWAWAEBSA-N 2 1 351.494 2.328 10 0 FEAEMP Cc1ccccc1CCNC(=O)C[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262280221 549805471 /nfs/dbraw/zinc/80/54/71/549805471.db2.gz UMWMUJVHIIVRJW-RTWAWAEBSA-N 2 1 351.494 2.328 10 0 FEAEMP CC(C)(C)OC(=O)N1CCC[C@H](C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@H]3CO2)C1 ZINC000301381798 553647286 /nfs/dbraw/zinc/64/72/86/553647286.db2.gz BXACZMCVAZHUID-IXDOHACOSA-N 2 1 353.507 2.086 10 0 FEAEMP CC(C)(C)OC(=O)N1CCC[C@H](C[NH2+]C[C@@H]2C[N@H+]3CCC[C@H]3CO2)C1 ZINC000301381798 553647288 /nfs/dbraw/zinc/64/72/88/553647288.db2.gz BXACZMCVAZHUID-IXDOHACOSA-N 2 1 353.507 2.086 10 0 FEAEMP CC(C)c1cc(N2CC[NH+]3CCC[C@@H]3C2)nc(N2CC[N@H+]3CCC[C@H]3C2)n1 ZINC000302766498 553731748 /nfs/dbraw/zinc/73/17/48/553731748.db2.gz LSXARSCEXQZMQC-MSOLQXFVSA-N 2 1 370.545 2.169 10 0 FEAEMP CC(C)c1cc(N2CC[N@@H+]3CCC[C@@H]3C2)nc(N2CC[NH+]3CCC[C@H]3C2)n1 ZINC000302766498 553731750 /nfs/dbraw/zinc/73/17/50/553731750.db2.gz LSXARSCEXQZMQC-MSOLQXFVSA-N 2 1 370.545 2.169 10 0 FEAEMP CC(C)c1cc(N2CC[N@H+]3CCC[C@@H]3C2)nc(N2CC[NH+]3CCC[C@H]3C2)n1 ZINC000302766498 553731752 /nfs/dbraw/zinc/73/17/52/553731752.db2.gz LSXARSCEXQZMQC-MSOLQXFVSA-N 2 1 370.545 2.169 10 0 FEAEMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@H](C)O1 ZINC000178853914 672395854 /nfs/dbraw/zinc/39/58/54/672395854.db2.gz OZGVRMHRYVPROW-IXDOHACOSA-N 2 1 355.523 2.475 10 0 FEAEMP O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@H]1C[NH2+]CCC1(F)F ZINC000649305140 677329035 /nfs/dbraw/zinc/32/90/35/677329035.db2.gz GPSUODOOHCYZRM-DLBZAZTESA-N 2 1 351.441 2.402 10 0 FEAEMP O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653120731 677516731 /nfs/dbraw/zinc/51/67/31/677516731.db2.gz YQJWEPFWAMFKGE-BZUAXINKSA-N 2 1 355.404 2.165 10 0 FEAEMP C[C@H]1C[C@H](NC(=O)[C@@H]2C[NH2+]C[C@H]2C(F)(F)F)C[N@H+]1Cc1ccccc1 ZINC000653122370 677516759 /nfs/dbraw/zinc/51/67/59/677516759.db2.gz VDCQNENXEWYNNZ-ARLBYUKCSA-N 2 1 355.404 2.164 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CCC(=O)Nc2ccc(F)cc2)CC1 ZINC000106124774 543204811 /nfs/dbraw/zinc/20/48/11/543204811.db2.gz RMXQKGDUOMKCDV-HNNXBMFYSA-N 2 1 351.466 2.179 10 0 FEAEMP C[NH+](C)C[C@@H]1CC[N@H+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000113513766 543489738 /nfs/dbraw/zinc/48/97/38/543489738.db2.gz OEVDJURXVAXJII-ZFWWWQNUSA-N 2 1 357.292 2.072 10 0 FEAEMP C[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc(Br)c2)C1 ZINC000113513766 543489741 /nfs/dbraw/zinc/48/97/41/543489741.db2.gz OEVDJURXVAXJII-ZFWWWQNUSA-N 2 1 357.292 2.072 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@@H]1C)[NH+]1CCOCC1 ZINC000113586979 543491728 /nfs/dbraw/zinc/49/17/28/543491728.db2.gz OZEMXPCFWZJIFF-WDSOQIARSA-N 2 1 366.550 2.002 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N1C[C@@H]2CCC[N@H+]2C[C@@H]1C)[NH+]1CCOCC1 ZINC000113586979 543491730 /nfs/dbraw/zinc/49/17/30/543491730.db2.gz OZEMXPCFWZJIFF-WDSOQIARSA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCCCC[NH+]2C[C@H](C)C[C@H](C)C2)C[C@H]1C ZINC000117478765 543633773 /nfs/dbraw/zinc/63/37/73/543633773.db2.gz SQEGLHHFMMXIKY-CEXWTWQISA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCCCC[NH+]2C[C@H](C)C[C@H](C)C2)C[C@H]1C ZINC000117478765 543633776 /nfs/dbraw/zinc/63/37/76/543633776.db2.gz SQEGLHHFMMXIKY-CEXWTWQISA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)C[C@H]1C ZINC000117478765 543633778 /nfs/dbraw/zinc/63/37/78/543633778.db2.gz SQEGLHHFMMXIKY-CEXWTWQISA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C[C@H]1C ZINC000117478765 543633781 /nfs/dbraw/zinc/63/37/81/543633781.db2.gz SQEGLHHFMMXIKY-CEXWTWQISA-N 2 1 368.566 2.107 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N1CCC(OCCC[NH+](C)C)CC1 ZINC000152431529 544652601 /nfs/dbraw/zinc/65/26/01/544652601.db2.gz WGEVLTXOHUAEJY-GOSISDBHSA-N 2 1 368.566 2.249 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117480727 326062339 /nfs/dbraw/zinc/06/23/39/326062339.db2.gz GBVVMTJIWUUBGS-AZUAARDMSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117480727 326062341 /nfs/dbraw/zinc/06/23/41/326062341.db2.gz GBVVMTJIWUUBGS-AZUAARDMSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117480727 326062344 /nfs/dbraw/zinc/06/23/44/326062344.db2.gz GBVVMTJIWUUBGS-AZUAARDMSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117480727 326062347 /nfs/dbraw/zinc/06/23/47/326062347.db2.gz GBVVMTJIWUUBGS-AZUAARDMSA-N 2 1 374.529 2.013 10 0 FEAEMP CCOc1cc(C)nc(N2CC[NH+](CCCCn3cc[nH+]c3C)CC2)n1 ZINC000120886252 326296064 /nfs/dbraw/zinc/29/60/64/326296064.db2.gz ZWTGFNZZPBDDGN-UHFFFAOYSA-N 2 1 358.490 2.291 10 0 FEAEMP COc1ccc([C@@H](CNC(=O)N2CC[N@H+]3CCC[C@@H]3C2)[NH+]2CCCC2)cc1 ZINC000171896330 327167979 /nfs/dbraw/zinc/16/79/79/327167979.db2.gz VAPFZODQEBEKDY-UYAOXDASSA-N 2 1 372.513 2.322 10 0 FEAEMP CC[C@@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1C[C@@H](C)O ZINC000173361807 327252085 /nfs/dbraw/zinc/25/20/85/327252085.db2.gz XFZYQWIQNMAXKQ-HZPDHXFCSA-N 2 1 373.497 2.412 10 0 FEAEMP CC[C@@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@H+]1C[C@@H](C)O ZINC000173361807 327252086 /nfs/dbraw/zinc/25/20/86/327252086.db2.gz XFZYQWIQNMAXKQ-HZPDHXFCSA-N 2 1 373.497 2.412 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000263187996 328923526 /nfs/dbraw/zinc/92/35/26/328923526.db2.gz HOYYOTMLMNWJIE-MWLCHTKSSA-N 2 1 369.181 2.018 10 0 FEAEMP C[C@@H]1C[C@@H](NC(=O)N2CCO[C@H](C[NH+](C)C)C2)CC[N@H+]1Cc1ccccc1 ZINC000175645942 546327376 /nfs/dbraw/zinc/32/73/76/546327376.db2.gz OFKYVPOCTDVADY-YZGWKJHDSA-N 2 1 374.529 2.012 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC1CC[NH+](Cc2ccncc2)CC1 ZINC000177377042 546604160 /nfs/dbraw/zinc/60/41/60/546604160.db2.gz HNLRKTSDNYFKAN-IBGZPJMESA-N 2 1 359.518 2.172 10 0 FEAEMP COc1ccccc1CN(C)C(=O)C[N@@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000178320996 546774163 /nfs/dbraw/zinc/77/41/63/546774163.db2.gz XBYLCARKJHUIHS-GOSISDBHSA-N 2 1 356.470 2.323 10 0 FEAEMP COc1ccccc1CN(C)C(=O)C[N@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000178320996 546774165 /nfs/dbraw/zinc/77/41/65/546774165.db2.gz XBYLCARKJHUIHS-GOSISDBHSA-N 2 1 356.470 2.323 10 0 FEAEMP COc1cccc(CN(C)C(=O)C[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000178314186 546775029 /nfs/dbraw/zinc/77/50/29/546775029.db2.gz JFUQPNBYZVDMAR-GOSISDBHSA-N 2 1 356.470 2.323 10 0 FEAEMP COc1cccc(CN(C)C(=O)C[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000178314186 546775033 /nfs/dbraw/zinc/77/50/33/546775033.db2.gz JFUQPNBYZVDMAR-GOSISDBHSA-N 2 1 356.470 2.323 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CCCN1C(=O)c2ccccc2C1=O ZINC000178333905 546777412 /nfs/dbraw/zinc/77/74/12/546777412.db2.gz IZVNXTFUEUPKET-INIZCTEOSA-N 2 1 352.438 2.342 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CCCN1C(=O)c2ccccc2C1=O ZINC000178333905 546777416 /nfs/dbraw/zinc/77/74/16/546777416.db2.gz IZVNXTFUEUPKET-INIZCTEOSA-N 2 1 352.438 2.342 10 0 FEAEMP C[C@H]([NH2+][C@@H](CO)c1ccccc1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000183626983 547691674 /nfs/dbraw/zinc/69/16/74/547691674.db2.gz XHSWIYAXYUGLHW-YYWHXJBOSA-N 2 1 367.493 2.089 10 0 FEAEMP C[C@H]([NH2+][C@@H](CO)c1ccccc1)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000183626983 547691675 /nfs/dbraw/zinc/69/16/75/547691675.db2.gz XHSWIYAXYUGLHW-YYWHXJBOSA-N 2 1 367.493 2.089 10 0 FEAEMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000186268464 548109628 /nfs/dbraw/zinc/10/96/28/548109628.db2.gz LNZOMRULBHLBTA-WOJBJXKFSA-N 2 1 356.514 2.387 10 0 FEAEMP C[NH+](Cc1ccccc1)[C@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)C1CC1 ZINC000186268464 548109631 /nfs/dbraw/zinc/10/96/31/548109631.db2.gz LNZOMRULBHLBTA-WOJBJXKFSA-N 2 1 356.514 2.387 10 0 FEAEMP O=C(NCC[N@H+]1CCCOCC1)NC[C@H]1CCCC[NH+]1Cc1ccccc1 ZINC000187053926 548248321 /nfs/dbraw/zinc/24/83/21/548248321.db2.gz ZNOBBPZIVGYBBX-HXUWFJFHSA-N 2 1 374.529 2.063 10 0 FEAEMP O=C(NCC[NH+]1CCCOCC1)NC[C@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000187053926 548248323 /nfs/dbraw/zinc/24/83/23/548248323.db2.gz ZNOBBPZIVGYBBX-HXUWFJFHSA-N 2 1 374.529 2.063 10 0 FEAEMP O=C(NCC[NH+]1CCCOCC1)NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000187053926 548248328 /nfs/dbraw/zinc/24/83/28/548248328.db2.gz ZNOBBPZIVGYBBX-HXUWFJFHSA-N 2 1 374.529 2.063 10 0 FEAEMP Cc1cccc(CNC(=O)CN2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)c1 ZINC000195271187 548607440 /nfs/dbraw/zinc/60/74/40/548607440.db2.gz RCCLTCMTJCUSTK-OAQYLSRUSA-N 2 1 366.509 2.460 10 0 FEAEMP CC[N@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000245448608 548924312 /nfs/dbraw/zinc/92/43/12/548924312.db2.gz MZYCOYIVJPYZCG-GDBMZVCRSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000245448608 548924313 /nfs/dbraw/zinc/92/43/13/548924313.db2.gz MZYCOYIVJPYZCG-GDBMZVCRSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[NH+](C)C[C@H]1CC[N@H+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000245448608 548924316 /nfs/dbraw/zinc/92/43/16/548924316.db2.gz MZYCOYIVJPYZCG-GDBMZVCRSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000245448608 548924317 /nfs/dbraw/zinc/92/43/17/548924317.db2.gz MZYCOYIVJPYZCG-GDBMZVCRSA-N 2 1 371.319 2.462 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000246593699 549170705 /nfs/dbraw/zinc/17/07/05/549170705.db2.gz PNOFIXBURUNFFI-QHAWAJNXSA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000246593699 549170711 /nfs/dbraw/zinc/17/07/11/549170711.db2.gz PNOFIXBURUNFFI-QHAWAJNXSA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000246593699 549170713 /nfs/dbraw/zinc/17/07/13/549170713.db2.gz PNOFIXBURUNFFI-QHAWAJNXSA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000246593699 549170717 /nfs/dbraw/zinc/17/07/17/549170717.db2.gz PNOFIXBURUNFFI-QHAWAJNXSA-N 2 1 371.525 2.363 10 0 FEAEMP CC(C)[N@@H+](C)CCNC(=O)NC[C@H](c1cccs1)N1CCO[C@H](C)C1 ZINC000246721745 549196861 /nfs/dbraw/zinc/19/68/61/549196861.db2.gz GELOIEIDKLAZPF-HZPDHXFCSA-N 2 1 368.547 2.149 10 0 FEAEMP C[N@@H+](CC[C@@H]1CCOC1=O)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000246936180 549245270 /nfs/dbraw/zinc/24/52/70/549245270.db2.gz MXHDWQYTQGOOOW-WOJBJXKFSA-N 2 1 360.498 2.317 10 0 FEAEMP CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)NCc2cccc(C[NH+]3CCOCC3)c2)C1 ZINC000247304369 549314014 /nfs/dbraw/zinc/31/40/14/549314014.db2.gz LODDMNGTEJEYCD-YLJYHZDGSA-N 2 1 374.529 2.047 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCc2cccc(C[NH+]3CCOCC3)c2)C1 ZINC000247304369 549314018 /nfs/dbraw/zinc/31/40/18/549314018.db2.gz LODDMNGTEJEYCD-YLJYHZDGSA-N 2 1 374.529 2.047 10 0 FEAEMP [NH3+][C@H](C(=O)N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2)C1CCOCC1 ZINC000261780696 549755082 /nfs/dbraw/zinc/75/50/82/549755082.db2.gz MZFLDTVIXRDPKX-UNMCSNQZSA-N 2 1 371.525 2.255 10 0 FEAEMP FC(F)(F)COc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)ccn1 ZINC000261861071 549763461 /nfs/dbraw/zinc/76/34/61/549763461.db2.gz CDODYYLORLUFQA-KFWWJZLASA-N 2 1 359.392 2.269 10 0 FEAEMP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(CNC(=O)[C@H]3[NH2+]CCO[C@@H]3C)cc2)C1 ZINC000262330305 549811916 /nfs/dbraw/zinc/81/19/16/549811916.db2.gz SEYJIXWCGORCDK-YZLZLFLDSA-N 2 1 359.514 2.158 10 0 FEAEMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)[C@H]3[NH2+]CCO[C@@H]3C)cc2)C1 ZINC000262330305 549811917 /nfs/dbraw/zinc/81/19/17/549811917.db2.gz SEYJIXWCGORCDK-YZLZLFLDSA-N 2 1 359.514 2.158 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000262065452 672908547 /nfs/dbraw/zinc/90/85/47/672908547.db2.gz BBCCDVGOZHQTOS-RTXFEEFZSA-N 2 1 372.309 2.229 10 0 FEAEMP CC[N@@H+]1CCC[C@@H](NC(=O)C2CC[NH+](Cc3csc(C)n3)CC2)C1 ZINC000068429930 541590872 /nfs/dbraw/zinc/59/08/72/541590872.db2.gz BPAOUKBACDOWJS-MRXNPFEDSA-N 2 1 350.532 2.264 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)C2CC[NH+](Cc3csc(C)n3)CC2)C1 ZINC000068429930 541590875 /nfs/dbraw/zinc/59/08/75/541590875.db2.gz BPAOUKBACDOWJS-MRXNPFEDSA-N 2 1 350.532 2.264 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000106124543 543204899 /nfs/dbraw/zinc/20/48/99/543204899.db2.gz VCPMQRVSTNDWLM-GOSISDBHSA-N 2 1 373.541 2.202 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117288795 543627143 /nfs/dbraw/zinc/62/71/43/543627143.db2.gz QMGVUTOLGXPJGD-AZUAARDMSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117288795 543627148 /nfs/dbraw/zinc/62/71/48/543627148.db2.gz QMGVUTOLGXPJGD-AZUAARDMSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[NH+]1CCN(C(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117288795 543627151 /nfs/dbraw/zinc/62/71/51/543627151.db2.gz QMGVUTOLGXPJGD-AZUAARDMSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[NH+]1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117288795 543627155 /nfs/dbraw/zinc/62/71/55/543627155.db2.gz QMGVUTOLGXPJGD-AZUAARDMSA-N 2 1 359.514 2.078 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@@H](c2ccccc2)[NH+](C)C)CC[N@H+]1CCOC ZINC000117469317 543632760 /nfs/dbraw/zinc/63/27/60/543632760.db2.gz LBIUSZVWPJTPPL-OALUTQOASA-N 2 1 362.518 2.042 10 0 FEAEMP CC[N@@H+](CC(=O)N(C)C[C@H](c1cccs1)N1CCOCC1)C1CC1 ZINC000153322955 544761600 /nfs/dbraw/zinc/76/16/00/544761600.db2.gz SJRHSJRABULMTQ-MRXNPFEDSA-N 2 1 351.516 2.064 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N(C)C[C@H]2CCC[N@H+]2CC)cc1 ZINC000189462921 328149782 /nfs/dbraw/zinc/14/97/82/328149782.db2.gz BHFCTTYKOMLJNP-LJQANCHMSA-N 2 1 374.529 2.410 10 0 FEAEMP CCC[C@H](C(=O)N1CCC[C@H]([N@H+](C)CC(=O)OC(C)(C)C)CC1)[NH+](C)C ZINC000191588475 328272928 /nfs/dbraw/zinc/27/29/28/328272928.db2.gz GIBMIBKFWIYZOK-DLBZAZTESA-N 2 1 369.550 2.371 10 0 FEAEMP CCC[C@H](C(=O)N1CCC[C@H]([N@@H+](C)CC(=O)OC(C)(C)C)CC1)[NH+](C)C ZINC000191588475 328272929 /nfs/dbraw/zinc/27/29/29/328272929.db2.gz GIBMIBKFWIYZOK-DLBZAZTESA-N 2 1 369.550 2.371 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cc(F)cc3c2OCOC3)CC1 ZINC000170941899 327108918 /nfs/dbraw/zinc/10/89/18/327108918.db2.gz CUBWNRGBWJQPPA-AWEZNQCLSA-N 2 1 352.450 2.217 10 0 FEAEMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@@H]1C ZINC000172134667 327182768 /nfs/dbraw/zinc/18/27/68/327182768.db2.gz FIPAMPYCVLNQDC-HKUYNNGSSA-N 2 1 371.529 2.447 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000263220925 328926137 /nfs/dbraw/zinc/92/61/37/328926137.db2.gz LUOWEXUWBPUVMF-BXKDBHETSA-N 2 1 353.182 2.138 10 0 FEAEMP CC(C)[N@@H+](C)CC(=O)N(C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000177455606 546623298 /nfs/dbraw/zinc/62/32/98/546623298.db2.gz WAKJQDMFMHYZRX-FQEVSTJZSA-N 2 1 361.530 2.231 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccc2c(c1)OCO2 ZINC000178316094 546774591 /nfs/dbraw/zinc/77/45/91/546774591.db2.gz NEVLIMFCJOORNQ-MRXNPFEDSA-N 2 1 356.426 2.413 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CCC(=O)Nc1ccc2c(c1)OCO2 ZINC000178316094 546774595 /nfs/dbraw/zinc/77/45/95/546774595.db2.gz NEVLIMFCJOORNQ-MRXNPFEDSA-N 2 1 356.426 2.413 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ccc3c(c2)sc(=O)n3C)CC1 ZINC000195011466 548563958 /nfs/dbraw/zinc/56/39/58/548563958.db2.gz ANMUHNUMCNVOJO-AWEZNQCLSA-N 2 1 363.527 2.125 10 0 FEAEMP CN(Cc1cccnc1)C[C@H]1CC[N@@H+](C[C@H](O)COCc2ccccc2)C1 ZINC000195272576 548607275 /nfs/dbraw/zinc/60/72/75/548607275.db2.gz WXPGGJOSKYVMQU-YADHBBJMSA-N 2 1 369.509 2.413 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1C[C@@H](C)[C@@H]([NH+]2CCOCC2)C1)CC(C)C ZINC000246147441 549062663 /nfs/dbraw/zinc/06/26/63/549062663.db2.gz ONXQREIBYDCEMB-QYZOEREBSA-N 2 1 368.566 2.105 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@H]2CCC[NH+](CC(C)C)C2)CC[N@H+]1CCOC ZINC000246489794 549144699 /nfs/dbraw/zinc/14/46/99/549144699.db2.gz RPWGRSYWBLFGNW-RTBURBONSA-N 2 1 368.566 2.107 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)CC[NH+]1CCOC ZINC000246489794 549144703 /nfs/dbraw/zinc/14/47/03/549144703.db2.gz RPWGRSYWBLFGNW-RTBURBONSA-N 2 1 368.566 2.107 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@H]2CCC[N@@H+](CC(C)C)C2)CC[NH+]1CCOC ZINC000246489794 549144704 /nfs/dbraw/zinc/14/47/04/549144704.db2.gz RPWGRSYWBLFGNW-RTBURBONSA-N 2 1 368.566 2.107 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000246747688 549203364 /nfs/dbraw/zinc/20/33/64/549203364.db2.gz BFLMGVANRJQHOT-VQIMIIECSA-N 2 1 362.518 2.155 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCCN2CCc3sccc3C2)C1 ZINC000246862413 549230155 /nfs/dbraw/zinc/23/01/55/549230155.db2.gz FPYGXGSJTRWHOM-GDBMZVCRSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)NCC[NH+]2CCc3sccc3C2)C1 ZINC000246862413 549230158 /nfs/dbraw/zinc/23/01/58/549230158.db2.gz FPYGXGSJTRWHOM-GDBMZVCRSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCC[NH+]2CCc3sccc3C2)C1 ZINC000246862413 549230162 /nfs/dbraw/zinc/23/01/62/549230162.db2.gz FPYGXGSJTRWHOM-GDBMZVCRSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)NCC[N@@H+]2CCc3sccc3C2)C1 ZINC000246862413 549230165 /nfs/dbraw/zinc/23/01/65/549230165.db2.gz FPYGXGSJTRWHOM-GDBMZVCRSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)NCC[N@H+]2CCc3sccc3C2)C1 ZINC000246862413 549230168 /nfs/dbraw/zinc/23/01/68/549230168.db2.gz FPYGXGSJTRWHOM-GDBMZVCRSA-N 2 1 350.532 2.134 10 0 FEAEMP Cc1cc(C)cc(OC[C@@H](O)C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c1 ZINC000247004379 549262979 /nfs/dbraw/zinc/26/29/79/549262979.db2.gz FPFNPNXZYDXCQV-ICSRJNTNSA-N 2 1 364.530 2.068 10 0 FEAEMP C[NH+](C)[C@@H](CNC(=O)N1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1Cl ZINC000247596886 549364886 /nfs/dbraw/zinc/36/48/86/549364886.db2.gz SPHJJWGAFZGQEA-YOEHRIQHSA-N 2 1 350.894 2.432 10 0 FEAEMP C[NH+](C)[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)c1ccccc1Cl ZINC000247596886 549364888 /nfs/dbraw/zinc/36/48/88/549364888.db2.gz SPHJJWGAFZGQEA-YOEHRIQHSA-N 2 1 350.894 2.432 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)NC2CCC(C)CC2)CC1 ZINC000247805800 549382128 /nfs/dbraw/zinc/38/21/28/549382128.db2.gz SPTVJESGLKNMGR-VIHIWDAPSA-N 2 1 353.551 2.094 10 0 FEAEMP c1nc2n(n1)C[C@H]([NH2+][C@H]1CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]31)CC2 ZINC000248411167 549431340 /nfs/dbraw/zinc/43/13/40/549431340.db2.gz YYIZJBVCOGJZGD-YRPNKDGESA-N 2 1 351.498 2.483 10 0 FEAEMP COc1cccc(CNC(=O)[C@H](C)[N@@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261732038 549748457 /nfs/dbraw/zinc/74/84/57/549748457.db2.gz LYLKZFLTBJTBNI-SCWSEQNSSA-N 2 1 367.493 2.374 10 0 FEAEMP COc1cccc(CNC(=O)[C@H](C)[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261732038 549748460 /nfs/dbraw/zinc/74/84/60/549748460.db2.gz LYLKZFLTBJTBNI-SCWSEQNSSA-N 2 1 367.493 2.374 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)[C@@](C)([NH3+])c1ccc(Br)cc1 ZINC000261749007 549751550 /nfs/dbraw/zinc/75/15/50/549751550.db2.gz MOHZPGMWENTQQZ-VMGRFDJRSA-N 2 1 366.303 2.318 10 0 FEAEMP O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)c1ccn([C@@H]2CCC[NH2+]C2)n1 ZINC000262761748 549847226 /nfs/dbraw/zinc/84/72/26/549847226.db2.gz LNHUXNPRQNHTNO-SJLPKXTDSA-N 2 1 371.485 2.358 10 0 FEAEMP O=C(Nc1cccc(C[NH2+]C[C@@H]2C[NH2+]C[C@@H]2O)c1)c1ccc(Cl)cc1 ZINC000263178874 549884204 /nfs/dbraw/zinc/88/42/04/549884204.db2.gz GLIIOLVCUGZCHS-QAPCUYQASA-N 2 1 359.857 2.262 10 0 FEAEMP COc1cc(OC)cc(Oc2ccc(C[NH2+]C[C@@H]3C[NH2+]C[C@H]3O)cc2)c1 ZINC000263298488 549893170 /nfs/dbraw/zinc/89/31/70/549893170.db2.gz WROLZOJVDALVQS-FOIQADDNSA-N 2 1 358.438 2.166 10 0 FEAEMP CC(C)(C)OC(=O)N1CCC[C@H](C[NH2+]C[C@H]2C[N@@H+]3CCC[C@@H]3CO2)C1 ZINC000301381799 553647533 /nfs/dbraw/zinc/64/75/33/553647533.db2.gz BXACZMCVAZHUID-ZACQAIPSSA-N 2 1 353.507 2.086 10 0 FEAEMP CC(C)(C)OC(=O)N1CCC[C@H](C[NH2+]C[C@H]2C[N@H+]3CCC[C@@H]3CO2)C1 ZINC000301381799 553647535 /nfs/dbraw/zinc/64/75/35/553647535.db2.gz BXACZMCVAZHUID-ZACQAIPSSA-N 2 1 353.507 2.086 10 0 FEAEMP CC(C)c1cc(N2CC[NH+]3CCC[C@H]3C2)nc(N2CC[N@H+]3CCC[C@@H]3C2)n1 ZINC000302766504 553731468 /nfs/dbraw/zinc/73/14/68/553731468.db2.gz LSXARSCEXQZMQC-ZWKOTPCHSA-N 2 1 370.545 2.169 10 0 FEAEMP CC(C)c1cc(N2CC[N@@H+]3CCC[C@H]3C2)nc(N2CC[NH+]3CCC[C@@H]3C2)n1 ZINC000302766504 553731469 /nfs/dbraw/zinc/73/14/69/553731469.db2.gz LSXARSCEXQZMQC-ZWKOTPCHSA-N 2 1 370.545 2.169 10 0 FEAEMP CC(C)c1cc(N2CC[N@H+]3CCC[C@H]3C2)nc(N2CC[NH+]3CCC[C@@H]3C2)n1 ZINC000302766504 553731471 /nfs/dbraw/zinc/73/14/71/553731471.db2.gz LSXARSCEXQZMQC-ZWKOTPCHSA-N 2 1 370.545 2.169 10 0 FEAEMP C[C@@H]1CCCC[N@H+]1CCN(C)c1nc(-c2cccnc2)nc2c1CC[NH2+]C2 ZINC000071750810 541770231 /nfs/dbraw/zinc/77/02/31/541770231.db2.gz AIPWTHVPTCEWKW-MRXNPFEDSA-N 2 1 366.513 2.495 10 0 FEAEMP O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)N1CC[NH+]2CCCC[C@@H]2C1 ZINC000105244849 543166593 /nfs/dbraw/zinc/16/65/93/543166593.db2.gz UJQCWWQNRBVDQP-LEWJYISDSA-N 2 1 370.541 2.431 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000105244849 543166595 /nfs/dbraw/zinc/16/65/95/543166595.db2.gz UJQCWWQNRBVDQP-LEWJYISDSA-N 2 1 370.541 2.431 10 0 FEAEMP O=C(NC[C@@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000105244849 543166596 /nfs/dbraw/zinc/16/65/96/543166596.db2.gz UJQCWWQNRBVDQP-LEWJYISDSA-N 2 1 370.541 2.431 10 0 FEAEMP CC[NH+](CC)[C@@H](CNC(=O)N1CC[N@H+](CCOC)[C@H](C)C1)c1ccco1 ZINC000117486177 543633315 /nfs/dbraw/zinc/63/33/15/543633315.db2.gz HFUXBWICSRKFCA-SJORKVTESA-N 2 1 366.506 2.025 10 0 FEAEMP CC[NH+](CC)[C@@H](CNC(=O)N1CC[N@@H+](CCOC)[C@H](C)C1)c1ccco1 ZINC000117486177 543633319 /nfs/dbraw/zinc/63/33/19/543633319.db2.gz HFUXBWICSRKFCA-SJORKVTESA-N 2 1 366.506 2.025 10 0 FEAEMP Cc1cc(N2CCC(NC(=O)N[C@H]3C[N@H+](C(C)C)C[C@@H]3C)CC2)nc(C)[nH+]1 ZINC000132199323 544222953 /nfs/dbraw/zinc/22/29/53/544222953.db2.gz QKQFELVKGPRFFC-KSSFIOAISA-N 2 1 374.533 2.090 10 0 FEAEMP Cc1cc(N2CCC(NC(=O)N[C@H]3C[N@@H+](C(C)C)C[C@@H]3C)CC2)nc(C)[nH+]1 ZINC000132199323 544222954 /nfs/dbraw/zinc/22/29/54/544222954.db2.gz QKQFELVKGPRFFC-KSSFIOAISA-N 2 1 374.533 2.090 10 0 FEAEMP Cc1nc(C)n(C[C@H]2CCC[N@H+](CCCN3CC[NH+](C(C)C)CC3)C2)n1 ZINC000191486058 328267969 /nfs/dbraw/zinc/26/79/69/328267969.db2.gz ATITZFCATDYUTG-FQEVSTJZSA-N 2 1 362.566 2.023 10 0 FEAEMP CC(C)[C@@H](C(=O)NC[C@H](O)C[N@H+]1CCc2ccccc2C1)[NH+]1CCCCC1 ZINC000119875656 326207927 /nfs/dbraw/zinc/20/79/27/326207927.db2.gz FFDVRMSVKGVZIE-SFTDATJTSA-N 2 1 373.541 2.032 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cc(F)cc3c2OCOC3)CC1 ZINC000170941900 327109085 /nfs/dbraw/zinc/10/90/85/327109085.db2.gz CUBWNRGBWJQPPA-CQSZACIVSA-N 2 1 352.450 2.217 10 0 FEAEMP Clc1cc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)cc2c1OCCO2 ZINC000261936031 328830482 /nfs/dbraw/zinc/83/04/82/328830482.db2.gz MEYVLFUJUWDXLA-UAGQMJEPSA-N 2 1 366.889 2.400 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)Cc1ccccc1 ZINC000171900860 546229652 /nfs/dbraw/zinc/22/96/52/546229652.db2.gz WFNALJAOUIGCMH-UXHICEINSA-N 2 1 358.530 2.429 10 0 FEAEMP O=C(C[N@@H+]1CCCC[C@@H]1c1cn[nH]c1)N1CCN(Cc2cccs2)CC1 ZINC000178871835 546864470 /nfs/dbraw/zinc/86/44/70/546864470.db2.gz UDWGJHOMINGYFB-GOSISDBHSA-N 2 1 373.526 2.343 10 0 FEAEMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)CN2CCS[C@@H](C)C2)CC1 ZINC000246213806 549080604 /nfs/dbraw/zinc/08/06/04/549080604.db2.gz ZMWFXHNOUSTQIB-SFHVURJKSA-N 2 1 361.555 2.467 10 0 FEAEMP C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000246260725 549091301 /nfs/dbraw/zinc/09/13/01/549091301.db2.gz GHCQZLKJPBQZHP-XWTMOSNGSA-N 2 1 353.551 2.189 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[N@H+]2C[C@@H]1C)[NH+]1CCc2ccccc2C1 ZINC000246831763 549223501 /nfs/dbraw/zinc/22/35/01/549223501.db2.gz CTOQFUQCGAAYQB-UWVAXJGDSA-N 2 1 356.514 2.311 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[NH+]2C[C@@H]1C)[N@@H+]1CCc2ccccc2C1 ZINC000246831763 549223505 /nfs/dbraw/zinc/22/35/05/549223505.db2.gz CTOQFUQCGAAYQB-UWVAXJGDSA-N 2 1 356.514 2.311 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[NH+]2C[C@@H]1C)[N@H+]1CCc2ccccc2C1 ZINC000246831763 549223507 /nfs/dbraw/zinc/22/35/07/549223507.db2.gz CTOQFUQCGAAYQB-UWVAXJGDSA-N 2 1 356.514 2.311 10 0 FEAEMP Cc1ccc(C[N@@H+]2CCCN(C(=O)C[NH2+][C@@H](C)[C@H]3CCCO3)CC2)cc1 ZINC000248595291 549464723 /nfs/dbraw/zinc/46/47/23/549464723.db2.gz MFWGPXXBBUWAQP-AZUAARDMSA-N 2 1 359.514 2.186 10 0 FEAEMP COc1ccccc1[C@@H](CNC(=O)NC[C@@H]1CCC[N@H+]1C)[NH+]1CCCC1 ZINC000249741162 549622107 /nfs/dbraw/zinc/62/21/07/549622107.db2.gz IPEIKQCZTGKMLU-FUHWJXTLSA-N 2 1 360.502 2.226 10 0 FEAEMP CCc1nc(C)sc1C[N@H+]1CC[C@](O)(C[NH+]2CCOCC2)C(C)(C)C1 ZINC000091603439 670729717 /nfs/dbraw/zinc/72/97/17/670729717.db2.gz YVXFDQRQOOVWHX-IBGZPJMESA-N 2 1 367.559 2.309 10 0 FEAEMP CC1(C)C[N@H+](C2(CNC(=O)[C@H]3CCC[C@H]([NH3+])C3)CCCCC2)CCO1 ZINC000262285797 672912680 /nfs/dbraw/zinc/91/26/80/672912680.db2.gz MFIANRIAGCPJAH-IRXDYDNUSA-N 2 1 351.535 2.434 10 0 FEAEMP Cc1cc(C[NH2+]Cc2ccc(OC[C@H](O)C[NH+]3CCCCC3)cc2)nn1C ZINC000012454075 539561230 /nfs/dbraw/zinc/56/12/30/539561230.db2.gz BFXIDJLNIQNINO-HXUWFJFHSA-N 2 1 372.513 2.244 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N[C@@H]3CCC[N@H+](CC)C3)cc2F)CC1 ZINC000066921990 541393923 /nfs/dbraw/zinc/39/39/23/541393923.db2.gz OULPDGNSRVHNII-QGZVFWFLSA-N 2 1 362.493 2.182 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N[C@@H]3CCC[N@@H+](CC)C3)cc2F)CC1 ZINC000066921990 541393926 /nfs/dbraw/zinc/39/39/26/541393926.db2.gz OULPDGNSRVHNII-QGZVFWFLSA-N 2 1 362.493 2.182 10 0 FEAEMP CCN(C(=O)[C@@H](C)[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1)c1ccccc1 ZINC000106125710 543204989 /nfs/dbraw/zinc/20/49/89/543204989.db2.gz XKVHQNFQJIMASX-QZTJIDSGSA-N 2 1 361.530 2.453 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)CC[N@H+]1CCOC ZINC000117498709 543634605 /nfs/dbraw/zinc/63/46/05/543634605.db2.gz ZAFGMIRQHHEBRW-SJORKVTESA-N 2 1 356.555 2.105 10 0 FEAEMP CCOCC[N@@H+]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117278265 326054457 /nfs/dbraw/zinc/05/44/57/326054457.db2.gz TUKZBGCJFATQOM-PZJWPPBQSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117278265 326054459 /nfs/dbraw/zinc/05/44/59/326054459.db2.gz TUKZBGCJFATQOM-PZJWPPBQSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117278265 326054460 /nfs/dbraw/zinc/05/44/60/326054460.db2.gz TUKZBGCJFATQOM-PZJWPPBQSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000117278265 326054462 /nfs/dbraw/zinc/05/44/62/326054462.db2.gz TUKZBGCJFATQOM-PZJWPPBQSA-N 2 1 373.541 2.468 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCc2ccc(F)c(C[NH+](C)C)c2)[C@@H](C)C1 ZINC000120835186 326292004 /nfs/dbraw/zinc/29/20/04/326292004.db2.gz RESBDEHEFPRANH-KSSFIOAISA-N 2 1 350.482 2.415 10 0 FEAEMP O=C(NCC1CC[NH+](Cc2ccccc2)CC1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000171904694 327169220 /nfs/dbraw/zinc/16/92/20/327169220.db2.gz YHHVWDOEIMFWAJ-HXUWFJFHSA-N 2 1 356.514 2.388 10 0 FEAEMP C[NH+](C)CCCOc1ccc(CNC(=O)N2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000171907193 327169681 /nfs/dbraw/zinc/16/96/81/327169681.db2.gz CSTQROODYRNQEN-SFHVURJKSA-N 2 1 360.502 2.007 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)CC[C@H]2CC[NH2+]C2)C[C@@H](C)O1 ZINC000261904241 328828273 /nfs/dbraw/zinc/82/82/73/328828273.db2.gz VKILIOMEGSHMMQ-KURKYZTESA-N 2 1 359.514 2.302 10 0 FEAEMP O[C@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000262078535 328840383 /nfs/dbraw/zinc/84/03/83/328840383.db2.gz DONZEHSGLIXGBI-JXFKEZNVSA-N 2 1 366.440 2.348 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCc2ccc(OCC[NH+](C)C)cc2)[C@@H](C)C1 ZINC000157826512 545789215 /nfs/dbraw/zinc/78/92/15/545789215.db2.gz BFLMGVANRJQHOT-LPHOPBHVSA-N 2 1 362.518 2.155 10 0 FEAEMP c1ncn([C@@H]2CCC[NH+](CCCCC[N@H+]3CCC[C@H](n4cncn4)C3)C2)n1 ZINC000157908622 545798642 /nfs/dbraw/zinc/79/86/42/545798642.db2.gz BZCAOEXHIJMGJT-KDURUIRLSA-N 2 1 372.521 2.014 10 0 FEAEMP c1ncn([C@@H]2CCC[N@@H+](CCCCC[NH+]3CCC[C@H](n4cncn4)C3)C2)n1 ZINC000157908622 545798648 /nfs/dbraw/zinc/79/86/48/545798648.db2.gz BZCAOEXHIJMGJT-KDURUIRLSA-N 2 1 372.521 2.014 10 0 FEAEMP c1ncn([C@@H]2CCC[N@H+](CCCCC[NH+]3CCC[C@H](n4cncn4)C3)C2)n1 ZINC000157908622 545798655 /nfs/dbraw/zinc/79/86/55/545798655.db2.gz BZCAOEXHIJMGJT-KDURUIRLSA-N 2 1 372.521 2.014 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CCC(=O)NC(=O)NCc1ccccc1 ZINC000178298740 546772482 /nfs/dbraw/zinc/77/24/82/546772482.db2.gz CTDCBUQTMDGJLC-GOSISDBHSA-N 2 1 369.469 2.072 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CCC(=O)NC(=O)NCc1ccccc1 ZINC000178298740 546772488 /nfs/dbraw/zinc/77/24/88/546772488.db2.gz CTDCBUQTMDGJLC-GOSISDBHSA-N 2 1 369.469 2.072 10 0 FEAEMP c1cc(CN2CC[NH+]3CCC[C@@H]3C2)cc(CN2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000178630953 546823592 /nfs/dbraw/zinc/82/35/92/546823592.db2.gz RHCGKEHUIMLOBR-FGZHOGPDSA-N 2 1 354.542 2.247 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@H](C)C(C)(C)C[NH+](C)C)C[C@H]1CC ZINC000246373969 549118076 /nfs/dbraw/zinc/11/80/76/549118076.db2.gz RAIFTEDKNDIGFC-IAGOWNOFSA-N 2 1 356.555 2.105 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@H](c2ccco2)N(C)C)C[C@@H]1CC ZINC000246900978 549238806 /nfs/dbraw/zinc/23/88/06/549238806.db2.gz AIIKLLFZBCSNKX-DLBZAZTESA-N 2 1 366.506 2.025 10 0 FEAEMP C(C[NH+]1CCO[C@@H]2CCCC[C@@H]21)OCC[N@@H+]1CCO[C@H]2CCCC[C@H]21 ZINC000247152749 549291761 /nfs/dbraw/zinc/29/17/61/549291761.db2.gz UIPWEEZTJSCMBX-JVSBHGNQSA-N 2 1 352.519 2.290 10 0 FEAEMP C(C[NH+]1CCO[C@@H]2CCCC[C@@H]21)OCC[N@H+]1CCO[C@H]2CCCC[C@H]21 ZINC000247152749 549291762 /nfs/dbraw/zinc/29/17/62/549291762.db2.gz UIPWEEZTJSCMBX-JVSBHGNQSA-N 2 1 352.519 2.290 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NC[C@H](C)[NH+]2CCc3ccccc3C2)C1 ZINC000247324092 549319277 /nfs/dbraw/zinc/31/92/77/549319277.db2.gz MPVWXSSMRUWYJK-UWVAXJGDSA-N 2 1 358.530 2.461 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@@H](NC(=O)NC[C@H](C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000247324092 549319280 /nfs/dbraw/zinc/31/92/80/549319280.db2.gz MPVWXSSMRUWYJK-UWVAXJGDSA-N 2 1 358.530 2.461 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@@H](NC(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)C1 ZINC000247324092 549319282 /nfs/dbraw/zinc/31/92/82/549319282.db2.gz MPVWXSSMRUWYJK-UWVAXJGDSA-N 2 1 358.530 2.461 10 0 FEAEMP Cc1ncsc1CN(C)C[C@H]1CC[N@@H+](CC(=O)N2CCC[C@@H](C)C2)C1 ZINC000248642402 549475460 /nfs/dbraw/zinc/47/54/60/549475460.db2.gz DGEHBFXLJCMNST-NVXWUHKLSA-N 2 1 364.559 2.464 10 0 FEAEMP Cc1ncsc1CN(C)C[C@H]1CC[N@H+](CC(=O)N2CCC[C@@H](C)C2)C1 ZINC000248642402 549475463 /nfs/dbraw/zinc/47/54/63/549475463.db2.gz DGEHBFXLJCMNST-NVXWUHKLSA-N 2 1 364.559 2.464 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)C(=O)Nc1cc(C[NH+](C)C)ccc1C ZINC000249234020 549572151 /nfs/dbraw/zinc/57/21/51/549572151.db2.gz VVGVKCJORJAGJN-ROUUACIJSA-N 2 1 372.513 2.080 10 0 FEAEMP [NH3+]C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc3c(c2)OCO3)C[C@H]1c1ccccc1 ZINC000261661008 549740846 /nfs/dbraw/zinc/74/08/46/549740846.db2.gz GVHYLXKXSBMVAH-AEFFLSMTSA-N 2 1 367.449 2.418 10 0 FEAEMP COC[C@@H]([NH3+])C(=O)N(CC[N@@H+](C)Cc1ccccc1)Cc1ccccc1 ZINC000262314360 549809473 /nfs/dbraw/zinc/80/94/73/549809473.db2.gz DFFHINFVLXSYHI-HXUWFJFHSA-N 2 1 355.482 2.121 10 0 FEAEMP CN(Cc1ccccc1Br)C(=O)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000262562537 549828359 /nfs/dbraw/zinc/82/83/59/549828359.db2.gz VVRMYJFMRAPVKO-NOLJZWGESA-N 2 1 366.303 2.077 10 0 FEAEMP CN(Cc1ccccc1Br)C(=O)C[N@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000262562537 549828362 /nfs/dbraw/zinc/82/83/62/549828362.db2.gz VVRMYJFMRAPVKO-NOLJZWGESA-N 2 1 366.303 2.077 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000221945066 568035993 /nfs/dbraw/zinc/03/59/93/568035993.db2.gz FQJCUQAMJKIRFG-YESZJQIVSA-N 2 1 356.555 2.150 10 0 FEAEMP O[C@](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1)(c1ccccc1)C(F)(F)F ZINC000261852282 672903982 /nfs/dbraw/zinc/90/39/82/672903982.db2.gz BINVCJUNBLNBQW-WCXIOVBPSA-N 2 1 358.404 2.183 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000262065448 672908524 /nfs/dbraw/zinc/90/85/24/672908524.db2.gz BBCCDVGOZHQTOS-CYZMBNFOSA-N 2 1 372.309 2.229 10 0 FEAEMP O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@@H]1C[NH2+]CCC1(F)F ZINC000649305146 677329048 /nfs/dbraw/zinc/32/90/48/677329048.db2.gz GPSUODOOHCYZRM-IRXDYDNUSA-N 2 1 351.441 2.402 10 0 FEAEMP COCC[NH+]1CCC(C[N@@H+](Cc2cnn(C)c2)Cc2ccncc2)CC1 ZINC000011821858 539536540 /nfs/dbraw/zinc/53/65/40/539536540.db2.gz HEVWYZLQBGUSLL-UHFFFAOYSA-N 2 1 357.502 2.176 10 0 FEAEMP Cc1[nH+]ccn1-c1cncc(N2CC[C@H](OCC[NH+]3CCCCC3)C2)n1 ZINC000092923544 542896442 /nfs/dbraw/zinc/89/64/42/542896442.db2.gz FVOMJDGNBADYAZ-KRWDZBQOSA-N 2 1 356.474 2.052 10 0 FEAEMP CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@H](O)C[NH+]2CCCCC2)C1 ZINC000111881062 543422713 /nfs/dbraw/zinc/42/27/13/543422713.db2.gz NXESBYXTYDLUAO-ROUUACIJSA-N 2 1 368.566 2.033 10 0 FEAEMP COc1ccc(NC(=O)CC[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1 ZINC000170941666 327108525 /nfs/dbraw/zinc/10/85/25/327108525.db2.gz PYKGXVLSAVAMOR-MRXNPFEDSA-N 2 1 363.502 2.048 10 0 FEAEMP Cc1ccc(OC[C@@H](O)C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c(C)c1 ZINC000170941618 327108604 /nfs/dbraw/zinc/10/86/04/327108604.db2.gz UJDDKOORALPCPU-QUCCMNQESA-N 2 1 364.530 2.068 10 0 FEAEMP O=C(CCC[NH+]1CCN(c2ccccc2)CC1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000171857370 327165961 /nfs/dbraw/zinc/16/59/61/327165961.db2.gz CHSXJTMPNDBYGR-NRFANRHFSA-N 2 1 370.541 2.286 10 0 FEAEMP C[NH+](C)[C@H](CNC(=O)N1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1Cl ZINC000171898179 327168262 /nfs/dbraw/zinc/16/82/62/327168262.db2.gz SPHJJWGAFZGQEA-RHSMWYFYSA-N 2 1 350.894 2.432 10 0 FEAEMP C[NH+](C)[C@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1Cl ZINC000171898179 327168263 /nfs/dbraw/zinc/16/82/63/327168263.db2.gz SPHJJWGAFZGQEA-RHSMWYFYSA-N 2 1 350.894 2.432 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1cccc(OCC[NH+](C)C)c1 ZINC000173755023 327281565 /nfs/dbraw/zinc/28/15/65/327281565.db2.gz DOHPLVYFJRZRCH-RBUKOAKNSA-N 2 1 374.529 2.395 10 0 FEAEMP O=C1CCCN1Cc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)c1 ZINC000261913245 328829104 /nfs/dbraw/zinc/82/91/04/328829104.db2.gz JGPMRBMUUDDHOT-VAMGGRTRSA-N 2 1 357.498 2.056 10 0 FEAEMP O=c1ccccn1Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)cc1 ZINC000261971613 328832631 /nfs/dbraw/zinc/83/26/31/328832631.db2.gz QRWJFTYZBUYFEX-NJYVYQBISA-N 2 1 367.493 2.143 10 0 FEAEMP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H]2C[NH2+]C[C@@H]2O)o1 ZINC000262163482 328847268 /nfs/dbraw/zinc/84/72/68/328847268.db2.gz TXIZZRQVNPLUOP-QAPCUYQASA-N 2 1 352.438 2.111 10 0 FEAEMP c1ccc(CN2CC[N@H+]3CCC[C@@H]3C2)c(CN2CC[NH+]3CCC[C@@H]3C2)c1 ZINC000179310616 546928598 /nfs/dbraw/zinc/92/85/98/546928598.db2.gz SLDXHXACUKOAOZ-FGZHOGPDSA-N 2 1 354.542 2.247 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCC2CCN(c3cc[nH+]cc3)CC2)[C@@H](C)C1 ZINC000180361820 547091372 /nfs/dbraw/zinc/09/13/72/547091372.db2.gz PSJVUGFAZXPKGO-LPHOPBHVSA-N 2 1 359.518 2.326 10 0 FEAEMP Cc1ccc(C[N@@H+]2CCCN(C(=O)C[NH2+][C@@H](C)[C@@H]3CCCO3)CC2)cc1 ZINC000183146859 547610415 /nfs/dbraw/zinc/61/04/15/547610415.db2.gz MFWGPXXBBUWAQP-ICSRJNTNSA-N 2 1 359.514 2.186 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCC[NH+](C)C2CCCCC2)CC[N@H+]1C[C@@H](C)O ZINC000184834731 547885400 /nfs/dbraw/zinc/88/54/00/547885400.db2.gz UCQOCQNLHIMJHL-MSOLQXFVSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCC[N@H+](C)C2CCCCC2)CC[NH+]1C[C@@H](C)O ZINC000184834731 547885403 /nfs/dbraw/zinc/88/54/03/547885403.db2.gz UCQOCQNLHIMJHL-MSOLQXFVSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCC[N@@H+](C)C2CCCCC2)CC[NH+]1C[C@@H](C)O ZINC000184834731 547885405 /nfs/dbraw/zinc/88/54/05/547885405.db2.gz UCQOCQNLHIMJHL-MSOLQXFVSA-N 2 1 368.566 2.128 10 0 FEAEMP C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)C(=O)N3CC[C@@H]([NH+](C)C)C3)cc2)C1 ZINC000246036820 549040169 /nfs/dbraw/zinc/04/01/69/549040169.db2.gz WJJHPJHLMUAXSN-QFBILLFUSA-N 2 1 372.513 2.020 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCC[NH+]1CCc2ccccc2C1 ZINC000246540739 549156879 /nfs/dbraw/zinc/15/68/79/549156879.db2.gz YDVREAURUOYPPE-UXHICEINSA-N 2 1 356.514 2.313 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC[N@@H+]1CCc2ccccc2C1 ZINC000246540739 549156883 /nfs/dbraw/zinc/15/68/83/549156883.db2.gz YDVREAURUOYPPE-UXHICEINSA-N 2 1 356.514 2.313 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000246540739 549156887 /nfs/dbraw/zinc/15/68/87/549156887.db2.gz YDVREAURUOYPPE-UXHICEINSA-N 2 1 356.514 2.313 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@@H]2CCC[C@@H]([NH+](C)C)C2)C[C@H]1CC ZINC000246964713 549253103 /nfs/dbraw/zinc/25/31/03/549253103.db2.gz IVMSJLFBLNUUBG-KZNAEPCWSA-N 2 1 354.539 2.002 10 0 FEAEMP COCCN1CCN(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246989560 549259237 /nfs/dbraw/zinc/25/92/37/549259237.db2.gz GBVVMTJIWUUBGS-ICSRJNTNSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246989560 549259239 /nfs/dbraw/zinc/25/92/39/549259239.db2.gz GBVVMTJIWUUBGS-ICSRJNTNSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246989560 549259242 /nfs/dbraw/zinc/25/92/42/549259242.db2.gz GBVVMTJIWUUBGS-ICSRJNTNSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000246989560 549259244 /nfs/dbraw/zinc/25/92/44/549259244.db2.gz GBVVMTJIWUUBGS-ICSRJNTNSA-N 2 1 374.529 2.013 10 0 FEAEMP CC[N@H+]1CCCC[C@@H]1CNC(=O)N1CC[C@@H](C[NH+](C)Cc2cccnc2)C1 ZINC000251845076 549654155 /nfs/dbraw/zinc/65/41/55/549654155.db2.gz OSPNCIFVDNNUBR-VQTJNVASSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[NH+]1CCCC[C@@H]1CNC(=O)N1CC[C@@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000251845076 549654158 /nfs/dbraw/zinc/65/41/58/549654158.db2.gz OSPNCIFVDNNUBR-VQTJNVASSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[NH+]1CCCC[C@@H]1CNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000251845076 549654162 /nfs/dbraw/zinc/65/41/62/549654162.db2.gz OSPNCIFVDNNUBR-VQTJNVASSA-N 2 1 373.545 2.419 10 0 FEAEMP CN(Cc1ccccc1F)C(=O)C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261609342 549733843 /nfs/dbraw/zinc/73/38/43/549733843.db2.gz BPNFCRDMMHOQGN-MOPGFXCFSA-N 2 1 355.457 2.458 10 0 FEAEMP CN(Cc1ccccc1F)C(=O)C[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261609342 549733846 /nfs/dbraw/zinc/73/38/46/549733846.db2.gz BPNFCRDMMHOQGN-MOPGFXCFSA-N 2 1 355.457 2.458 10 0 FEAEMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)C3([NH3+])CCOCC3)cc2)C1 ZINC000261777746 549754132 /nfs/dbraw/zinc/75/41/32/549754132.db2.gz HEHRDQOOIIYFAT-CALCHBBNSA-N 2 1 359.514 2.289 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3COCCN3)c2)CCO1 ZINC000261965924 549775300 /nfs/dbraw/zinc/77/53/00/549775300.db2.gz PZMYJYBURGTGKM-XYEHWOGUSA-N 2 1 373.541 2.154 10 0 FEAEMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3COCCN3)c2)CCO1 ZINC000261965924 549775302 /nfs/dbraw/zinc/77/53/02/549775302.db2.gz PZMYJYBURGTGKM-XYEHWOGUSA-N 2 1 373.541 2.154 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1ccc(Br)cc1C(F)(F)F ZINC000263243714 549888632 /nfs/dbraw/zinc/88/86/32/549888632.db2.gz OYSVZIQDKRZKDQ-BXKDBHETSA-N 2 1 353.182 2.138 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000263199823 549885200 /nfs/dbraw/zinc/88/52/00/549885200.db2.gz IXXJFMUGAMWQGN-TZIWHRDSSA-N 2 1 362.477 2.268 10 0 FEAEMP CN(C)c1ncc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)n1C ZINC000311552023 553754848 /nfs/dbraw/zinc/75/48/48/553754848.db2.gz PVGMYGGEURXZGH-MISYRCLQSA-N 2 1 353.514 2.486 10 0 FEAEMP C[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000365115987 555488863 /nfs/dbraw/zinc/48/88/63/555488863.db2.gz HSGSCLNHLPXRFS-YLFCFFPRSA-N 2 1 353.507 2.085 10 0 FEAEMP C[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@@H]2CO1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000365115987 555488864 /nfs/dbraw/zinc/48/88/64/555488864.db2.gz HSGSCLNHLPXRFS-YLFCFFPRSA-N 2 1 353.507 2.085 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CCN(C)Cc2ccc(F)cc2)CC1 ZINC000181689815 672429664 /nfs/dbraw/zinc/42/96/64/672429664.db2.gz RYYCXPNPXSFWOC-QGZVFWFLSA-N 2 1 351.510 2.282 10 0 FEAEMP CC(C)CNC(=O)C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000106128140 543205735 /nfs/dbraw/zinc/20/57/35/543205735.db2.gz AWMZNULSBPEYQM-HXUWFJFHSA-N 2 1 361.530 2.136 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC1([NH+]2CCSCC2)CCCC1 ZINC000113596184 543492099 /nfs/dbraw/zinc/49/20/99/543492099.db2.gz SBEIBEUQCOZSOL-IAGOWNOFSA-N 2 1 366.575 2.226 10 0 FEAEMP COc1ccccc1N1CC[C@@H]([N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)C1=O ZINC000154126290 544867563 /nfs/dbraw/zinc/86/75/63/544867563.db2.gz XRDYZOQEURDAHH-SJLPKXTDSA-N 2 1 354.454 2.470 10 0 FEAEMP COc1ccccc1N1CC[C@@H]([N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)C1=O ZINC000154126290 544867567 /nfs/dbraw/zinc/86/75/67/544867567.db2.gz XRDYZOQEURDAHH-SJLPKXTDSA-N 2 1 354.454 2.470 10 0 FEAEMP CCO[C@H]1C[C@@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C12CCOCC2 ZINC000186372325 327958847 /nfs/dbraw/zinc/95/88/47/327958847.db2.gz YSLYOQDUMVNOMX-MOPGFXCFSA-N 2 1 354.535 2.440 10 0 FEAEMP Cc1csc([C@@H]2CN(CCC[NH+]3CCN(C(C)C)CC3)CCO2)n1 ZINC000191468141 328267032 /nfs/dbraw/zinc/26/70/32/328267032.db2.gz YKFQSYOBBBCAPL-KRWDZBQOSA-N 2 1 352.548 2.241 10 0 FEAEMP C[NH+](C)[C@@H](Cc1ccccc1)C(=O)NCC1([NH+]2CCCCC2)CCOCC1 ZINC000112912110 325811367 /nfs/dbraw/zinc/81/13/67/325811367.db2.gz VMDQYAFZKLCBCQ-FQEVSTJZSA-N 2 1 373.541 2.311 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)[NH+](C)C)c1 ZINC000162503691 327027455 /nfs/dbraw/zinc/02/74/55/327027455.db2.gz BORDKEVOKFXVQV-MNEFBYGVSA-N 2 1 362.518 2.326 10 0 FEAEMP C[NH+](C)[C@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000170835479 327101231 /nfs/dbraw/zinc/10/12/31/327101231.db2.gz JWALMVLFCJXSJJ-HOTGVXAUSA-N 2 1 350.532 2.306 10 0 FEAEMP CC(C)(CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)[NH+]1CCc2ccccc2C1 ZINC000171901780 327168742 /nfs/dbraw/zinc/16/87/42/327168742.db2.gz PBYCSCDNSHBXAG-LJQANCHMSA-N 2 1 356.514 2.313 10 0 FEAEMP CC(C)(CNC(=O)N1CC[NH+]2CCC[C@@H]2C1)[N@@H+]1CCc2ccccc2C1 ZINC000171901780 327168744 /nfs/dbraw/zinc/16/87/44/327168744.db2.gz PBYCSCDNSHBXAG-LJQANCHMSA-N 2 1 356.514 2.313 10 0 FEAEMP CC(C)(CNC(=O)N1CC[NH+]2CCC[C@@H]2C1)[N@H+]1CCc2ccccc2C1 ZINC000171901780 327168745 /nfs/dbraw/zinc/16/87/45/327168745.db2.gz PBYCSCDNSHBXAG-LJQANCHMSA-N 2 1 356.514 2.313 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)N1CCC[C@@H]1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000246392487 328613980 /nfs/dbraw/zinc/61/39/80/328613980.db2.gz ISJKLFHUAINQSH-NCXUSEDFSA-N 2 1 368.566 2.246 10 0 FEAEMP Fc1ccc(-n2ccc(CC[NH2+][C@@H]3CCC[C@@H]3[C@@H]3COCC[NH2+]3)n2)cc1 ZINC000261954398 328831661 /nfs/dbraw/zinc/83/16/61/328831661.db2.gz OTHIJYGRTWOFJP-ZCNNSNEGSA-N 2 1 358.461 2.301 10 0 FEAEMP COc1ccccc1N1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)C1 ZINC000262004352 328834579 /nfs/dbraw/zinc/83/45/79/328834579.db2.gz UXKZFMJGUUTQTA-FCGDIQPGSA-N 2 1 359.514 2.268 10 0 FEAEMP C([NH2+][C@@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1)C1(N2CCSCC2)CCCCC1 ZINC000262011625 328835158 /nfs/dbraw/zinc/83/51/58/328835158.db2.gz VPYRWFZZDBVOHZ-OTWHNJEPSA-N 2 1 367.603 2.485 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@@H](c2cccs2)[NH+](C)C)CC[N@H+]1CCOC ZINC000172320808 546247014 /nfs/dbraw/zinc/24/70/14/546247014.db2.gz DXAJSNXCPNLEST-HOTGVXAUSA-N 2 1 368.547 2.103 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CC(=O)N[C@@H]1CCOc2ccccc21 ZINC000178289652 546770912 /nfs/dbraw/zinc/77/09/12/546770912.db2.gz GROIALURYIZNKQ-SJLPKXTDSA-N 2 1 354.454 2.296 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CC(=O)N[C@@H]1CCOc2ccccc21 ZINC000178289652 546770914 /nfs/dbraw/zinc/77/09/14/546770914.db2.gz GROIALURYIZNKQ-SJLPKXTDSA-N 2 1 354.454 2.296 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@@H]2CC[NH+](C)[C@@H]2c2ccccc2)CC[N@H+]1CCOC ZINC000179481068 546961775 /nfs/dbraw/zinc/96/17/75/546961775.db2.gz HHTUBKYNQPBJJJ-VAMGGRTRSA-N 2 1 374.529 2.184 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@H]2CCCC[N@@H+]2Cc2ccccc2)CC1 ZINC000194526431 548494044 /nfs/dbraw/zinc/49/40/44/548494044.db2.gz PNHLRNPSLLOUPS-HXUWFJFHSA-N 2 1 374.529 2.015 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@H]2CCCC[N@H+]2Cc2ccccc2)CC1 ZINC000194526431 548494047 /nfs/dbraw/zinc/49/40/47/548494047.db2.gz PNHLRNPSLLOUPS-HXUWFJFHSA-N 2 1 374.529 2.015 10 0 FEAEMP Cc1ncsc1CN(C)C[C@H]1CC[N@@H+](C[C@H](O)COC(C)(C)C)C1 ZINC000195266936 548607622 /nfs/dbraw/zinc/60/76/22/548607622.db2.gz WBJWVBLPTHMLSW-CVEARBPZSA-N 2 1 355.548 2.381 10 0 FEAEMP O=C(NCCC[NH+](Cc1ccccc1)Cc1ccccc1)[C@H]1COCC[NH2+]1 ZINC000238023533 548872347 /nfs/dbraw/zinc/87/23/47/548872347.db2.gz CKQSYIHEWLENLK-OAQYLSRUSA-N 2 1 367.493 2.184 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000245662357 548969441 /nfs/dbraw/zinc/96/94/41/548969441.db2.gz DIKPMJMGJDIJSD-OALUTQOASA-N 2 1 374.529 2.395 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@H](C)C(=O)NC(=O)NC1CCCCC1 ZINC000245905875 549015952 /nfs/dbraw/zinc/01/59/52/549015952.db2.gz CDUSFBCHLUNBRB-RHSMWYFYSA-N 2 1 361.490 2.203 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@H](C)C(=O)NC(=O)NC1CCCCC1 ZINC000245905875 549015956 /nfs/dbraw/zinc/01/59/56/549015956.db2.gz CDUSFBCHLUNBRB-RHSMWYFYSA-N 2 1 361.490 2.203 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)NC[C@H]2CC[NH+](CCc3ccccc3)C2)C1 ZINC000246151833 549064205 /nfs/dbraw/zinc/06/42/05/549064205.db2.gz PMBAWMYZCWNIPP-WOJBJXKFSA-N 2 1 358.530 2.335 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@H]2CC[N@H+](CCc3ccccc3)C2)C1 ZINC000246151833 549064209 /nfs/dbraw/zinc/06/42/09/549064209.db2.gz PMBAWMYZCWNIPP-WOJBJXKFSA-N 2 1 358.530 2.335 10 0 FEAEMP CC[NH+]1CCC[C@@H](NC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC000246151833 549064213 /nfs/dbraw/zinc/06/42/13/549064213.db2.gz PMBAWMYZCWNIPP-WOJBJXKFSA-N 2 1 358.530 2.335 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N2[C@H](C)CCC[C@@H]2C)CC1 ZINC000246260698 549091469 /nfs/dbraw/zinc/09/14/69/549091469.db2.gz GHCQZLKJPBQZHP-MHORFTMASA-N 2 1 353.551 2.189 10 0 FEAEMP C[C@H](C(=O)N(C)C1CCCCC1)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000246332151 549107607 /nfs/dbraw/zinc/10/76/07/549107607.db2.gz LDXIUOWRJIYHNX-DLBZAZTESA-N 2 1 353.551 2.191 10 0 FEAEMP COc1cccc([C@@H](CNC(=O)N2CC[N@H+]3CCCC[C@H]3C2)[NH+](C)C)c1 ZINC000246568418 549163582 /nfs/dbraw/zinc/16/35/82/549163582.db2.gz ZXROHYIWHWSEAP-PKOBYXMFSA-N 2 1 360.502 2.178 10 0 FEAEMP Cc1cc(C)cc(OC[C@H](O)C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c1 ZINC000247004358 549262454 /nfs/dbraw/zinc/26/24/54/549262454.db2.gz FPFNPNXZYDXCQV-AZUAARDMSA-N 2 1 364.530 2.068 10 0 FEAEMP CC[C@H]1CN(C(=O)NC[C@H](c2ccccc2)[NH+](C)C)CC[N@H+]1CCOC ZINC000247075128 549278130 /nfs/dbraw/zinc/27/81/30/549278130.db2.gz LBIUSZVWPJTPPL-RBUKOAKNSA-N 2 1 362.518 2.042 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)CC1 ZINC000247772522 549379201 /nfs/dbraw/zinc/37/92/01/549379201.db2.gz PPJWLHPQQYDRCD-BZSNNMDCSA-N 2 1 373.541 2.377 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NCC[C@H](C)[NH+]2CCCCC2)C[C@H]1CC ZINC000248484703 549449443 /nfs/dbraw/zinc/44/94/43/549449443.db2.gz KFQFMZFVHIGABP-RBUKOAKNSA-N 2 1 368.566 2.393 10 0 FEAEMP Cc1cnn([C@@H]2CCC[N@@H+](CC(=O)NC[C@H](c3ccccc3)[NH+](C)C)C2)c1 ZINC000249379942 549585264 /nfs/dbraw/zinc/58/52/64/549585264.db2.gz ZPVKDPDJZATEPC-WOJBJXKFSA-N 2 1 369.513 2.248 10 0 FEAEMP Cc1cnn([C@@H]2CCC[N@H+](CC(=O)NC[C@H](c3ccccc3)[NH+](C)C)C2)c1 ZINC000249379942 549585270 /nfs/dbraw/zinc/58/52/70/549585270.db2.gz ZPVKDPDJZATEPC-WOJBJXKFSA-N 2 1 369.513 2.248 10 0 FEAEMP C[NH+](C)[C@@H]1CCC[C@H](NC(=O)N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000252032642 549662168 /nfs/dbraw/zinc/66/21/68/549662168.db2.gz ZVGAEGZFXSYVKV-SLFFLAALSA-N 2 1 373.545 2.418 10 0 FEAEMP Fc1ccc(-n2ccc(CC[NH2+][C@@H]3CCC[C@@H]3[C@H]3COCC[NH2+]3)n2)cc1 ZINC000261954396 549773655 /nfs/dbraw/zinc/77/36/55/549773655.db2.gz OTHIJYGRTWOFJP-XUVXKRRUSA-N 2 1 358.461 2.301 10 0 FEAEMP CCn1cc(C[N@@H+]2CCCN(C(=O)C3C[C@H]4CCC[C@@H](C3)C4[NH3+])CC2)cn1 ZINC000262285940 549806455 /nfs/dbraw/zinc/80/64/55/549806455.db2.gz MHWYUEGMGQTNGE-VCWRXUFXSA-N 2 1 373.545 2.091 10 0 FEAEMP CCn1cc(C[N@H+]2CCCN(C(=O)C3C[C@H]4CCC[C@@H](C3)C4[NH3+])CC2)cn1 ZINC000262285940 549806457 /nfs/dbraw/zinc/80/64/57/549806457.db2.gz MHWYUEGMGQTNGE-VCWRXUFXSA-N 2 1 373.545 2.091 10 0 FEAEMP CC(C)C[N@H+]1CCO[C@@H](CNC(=O)C[NH2+][C@@H](C)c2cccc(Cl)c2)C1 ZINC000154537694 672218444 /nfs/dbraw/zinc/21/84/44/672218444.db2.gz FGFIWHPGHSHDEJ-YJBOKZPZSA-N 2 1 367.921 2.464 10 0 FEAEMP C[NH+](C)CCCNC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(F)(F)F ZINC000249376603 672870116 /nfs/dbraw/zinc/87/01/16/672870116.db2.gz UEEVHQPQJYVKHW-HZPDHXFCSA-N 2 1 357.420 2.365 10 0 FEAEMP CC1(C)C[N@H+](C2(CNC(=O)[C@@H]3CCC[C@H]([NH3+])C3)CCCCC2)CCO1 ZINC000262285799 672912661 /nfs/dbraw/zinc/91/26/61/672912661.db2.gz MFIANRIAGCPJAH-SJORKVTESA-N 2 1 351.535 2.434 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCc2ccccc2OCC[NH+](C)C)C1 ZINC000247388293 549326518 /nfs/dbraw/zinc/32/65/18/549326518.db2.gz QFDODSOSQMXESP-FUHWJXTLSA-N 2 1 362.518 2.155 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N[C@H](CC(C)C)C[NH+](C)C)c2C1 ZINC000067531365 541475514 /nfs/dbraw/zinc/47/55/14/541475514.db2.gz DNUUTWCSZBDMAO-QGZVFWFLSA-N 2 1 374.529 2.443 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N[C@H](CC(C)C)C[NH+](C)C)c2C1 ZINC000067531365 541475516 /nfs/dbraw/zinc/47/55/16/541475516.db2.gz DNUUTWCSZBDMAO-QGZVFWFLSA-N 2 1 374.529 2.443 10 0 FEAEMP C[N@H+](CC(=O)NC1CCCC1)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000106128078 543204288 /nfs/dbraw/zinc/20/42/88/543204288.db2.gz UMFLNXLIXCAOMS-OAQYLSRUSA-N 2 1 373.541 2.423 10 0 FEAEMP CC[C@@H]1CCCCN1C(=O)[C@@H](C)[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000106126555 543204503 /nfs/dbraw/zinc/20/45/03/543204503.db2.gz GUSGBMIIHABZFG-ZHALLVOQSA-N 2 1 353.551 2.191 10 0 FEAEMP Cc1cc(C)cc(OC[C@H](O)C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c1 ZINC000113310643 543483780 /nfs/dbraw/zinc/48/37/80/543483780.db2.gz FPFNPNXZYDXCQV-UYAOXDASSA-N 2 1 364.530 2.068 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1cccc(OCC[NH+](C)C)c1 ZINC000113589127 543491709 /nfs/dbraw/zinc/49/17/09/543491709.db2.gz USKDJCYMVAWSFZ-FUHWJXTLSA-N 2 1 360.502 2.005 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@@H]2CCC[NH+](C(C)C)C2)C[C@@H]1CC ZINC000117046080 543621737 /nfs/dbraw/zinc/62/17/37/543621737.db2.gz BKEQHJYJTMECMR-OALUTQOASA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](C(C)C)C2)C[C@@H]1CC ZINC000117046080 543621739 /nfs/dbraw/zinc/62/17/39/543621739.db2.gz BKEQHJYJTMECMR-OALUTQOASA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)C[C@@H]1CC ZINC000117046080 543621743 /nfs/dbraw/zinc/62/17/43/543621743.db2.gz BKEQHJYJTMECMR-OALUTQOASA-N 2 1 368.566 2.249 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N2CC[N@H+]3CCC[C@H]3C2)[NH+]2CCCC2)c1 ZINC000247487467 549342279 /nfs/dbraw/zinc/34/22/79/549342279.db2.gz KYFHTPQNVBEEEH-ICSRJNTNSA-N 2 1 372.513 2.322 10 0 FEAEMP CC[N@@H+](CC(=O)N(C)C[C@@H](c1cccs1)N1CCOCC1)C1CC1 ZINC000153322833 544761837 /nfs/dbraw/zinc/76/18/37/544761837.db2.gz SJRHSJRABULMTQ-INIZCTEOSA-N 2 1 351.516 2.064 10 0 FEAEMP CC[N@@H+](CC(=O)NCC1CC[NH+](C[C@@H](O)c2ccccc2)CC1)C1CC1 ZINC000153174456 544742628 /nfs/dbraw/zinc/74/26/28/544742628.db2.gz NGYVCNFGDUAEHJ-HXUWFJFHSA-N 2 1 359.514 2.033 10 0 FEAEMP CC[C@@H](C)[C@@H]([NH3+])C(=O)Nc1ccc2c(ccn2CC[NH+]2CCOCC2)c1 ZINC000237025767 328501818 /nfs/dbraw/zinc/50/18/18/328501818.db2.gz XIUQYNDHZFYXDX-DNVCBOLYSA-N 2 1 358.486 2.285 10 0 FEAEMP CC[C@H]1CN(C(=O)NCc2cccc(C[NH+](C)C)c2)CC[N@H+]1CCOC ZINC000117479536 326062948 /nfs/dbraw/zinc/06/29/48/326062948.db2.gz KVESLMOLWFHWDJ-IBGZPJMESA-N 2 1 362.518 2.000 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)NCCC2CCCCC2)CC1 ZINC000170941696 327108757 /nfs/dbraw/zinc/10/87/57/327108757.db2.gz OHJZOZYMPCWCRU-QGZVFWFLSA-N 2 1 353.551 2.098 10 0 FEAEMP Cc1cccc(NC[C@H]2CC[N@H+](CCN3C(=O)c4ccccc4C3=O)C2)[nH+]1 ZINC000171653512 327152211 /nfs/dbraw/zinc/15/22/11/327152211.db2.gz PKGMVYHMCLBTGS-MRXNPFEDSA-N 2 1 364.449 2.420 10 0 FEAEMP Cc1cccc(NC[C@H]2CC[N@@H+](CCN3C(=O)c4ccccc4C3=O)C2)[nH+]1 ZINC000171653512 327152212 /nfs/dbraw/zinc/15/22/12/327152212.db2.gz PKGMVYHMCLBTGS-MRXNPFEDSA-N 2 1 364.449 2.420 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N2CC[N@H+]3CCC[C@@H]3C2)[NH+]2CCCC2)c1 ZINC000171898171 327168352 /nfs/dbraw/zinc/16/83/52/327168352.db2.gz KYFHTPQNVBEEEH-QUCCMNQESA-N 2 1 372.513 2.322 10 0 FEAEMP O[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1)c1ccc(OC(F)(F)F)cc1 ZINC000262023905 328836241 /nfs/dbraw/zinc/83/62/41/328836241.db2.gz WUBRJJBIBJJNEJ-YLFCFFPRSA-N 2 1 374.403 2.365 10 0 FEAEMP CCOc1cc(C[NH2+]C[C@@H]2C[NH2+]C[C@@H]2O)ccc1OCc1ccccc1 ZINC000263293429 328931146 /nfs/dbraw/zinc/93/11/46/328931146.db2.gz VYPNMYSHDAJZST-MOPGFXCFSA-N 2 1 356.466 2.334 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(CN(C)C(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000176867183 546498388 /nfs/dbraw/zinc/49/83/88/546498388.db2.gz OSNTYGIVRIVLAD-WIYYLYMNSA-N 2 1 373.541 2.202 10 0 FEAEMP Cc1nccn1C[C@@H]1CCC[N@@H+]1CC(=O)NC(=O)N[C@@H]1CCCC[C@@H]1C ZINC000178303163 546771778 /nfs/dbraw/zinc/77/17/78/546771778.db2.gz ICTZUUJTFZZHIO-BHYGNILZSA-N 2 1 361.490 2.060 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NC(=O)N[C@@H]1CCCC[C@@H]1C ZINC000178303163 546771785 /nfs/dbraw/zinc/77/17/85/546771785.db2.gz ICTZUUJTFZZHIO-BHYGNILZSA-N 2 1 361.490 2.060 10 0 FEAEMP COc1ccccc1CN(C)C(=O)C[N@@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000178320980 546774067 /nfs/dbraw/zinc/77/40/67/546774067.db2.gz XBYLCARKJHUIHS-SFHVURJKSA-N 2 1 356.470 2.323 10 0 FEAEMP COc1ccccc1CN(C)C(=O)C[N@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000178320980 546774070 /nfs/dbraw/zinc/77/40/70/546774070.db2.gz XBYLCARKJHUIHS-SFHVURJKSA-N 2 1 356.470 2.323 10 0 FEAEMP CCc1nnc(C[N@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)[nH]1 ZINC000181689991 547360939 /nfs/dbraw/zinc/36/09/39/547360939.db2.gz KXPQDRPMCRMVOQ-SFHVURJKSA-N 2 1 357.502 2.245 10 0 FEAEMP CCc1nnc(C[N@@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)[nH]1 ZINC000181689991 547360945 /nfs/dbraw/zinc/36/09/45/547360945.db2.gz KXPQDRPMCRMVOQ-SFHVURJKSA-N 2 1 357.502 2.245 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N(C)C[C@@H]2CCC[NH+]2CC)[C@@H](C)C1 ZINC000245428873 548916346 /nfs/dbraw/zinc/91/63/46/548916346.db2.gz XTAREDKFGZPTCA-FHWLQOOXSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N(C)C[C@@H]2CCC[N@@H+]2CC)[C@@H](C)C1 ZINC000245428873 548916350 /nfs/dbraw/zinc/91/63/50/548916350.db2.gz XTAREDKFGZPTCA-FHWLQOOXSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N(C)C[C@@H]2CCC[N@H+]2CC)[C@@H](C)C1 ZINC000245428873 548916351 /nfs/dbraw/zinc/91/63/51/548916351.db2.gz XTAREDKFGZPTCA-FHWLQOOXSA-N 2 1 368.566 2.249 10 0 FEAEMP CC[N@H+](Cc1ccc(C(=O)N2CC[NH+](C[C@H](C)O)[C@H](C)C2)cc1)C(C)C ZINC000246786949 549212735 /nfs/dbraw/zinc/21/27/35/549212735.db2.gz QKYHMMBAWJLLIF-MSOLQXFVSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH+](C[C@H](C)O)[C@H](C)C2)cc1)C(C)C ZINC000246786949 549212740 /nfs/dbraw/zinc/21/27/40/549212740.db2.gz QKYHMMBAWJLLIF-MSOLQXFVSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[NH+](Cc1ccc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)cc1)C(C)C ZINC000246786949 549212744 /nfs/dbraw/zinc/21/27/44/549212744.db2.gz QKYHMMBAWJLLIF-MSOLQXFVSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[NH+](Cc1ccc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)cc1)C(C)C ZINC000246786949 549212748 /nfs/dbraw/zinc/21/27/48/549212748.db2.gz QKYHMMBAWJLLIF-MSOLQXFVSA-N 2 1 361.530 2.444 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC[C@H]2CCC[NH+]2Cc2ccccc2)C[C@H]1C ZINC000246938431 549247077 /nfs/dbraw/zinc/24/70/77/549247077.db2.gz CBGZSXMMHDCDOA-UYAOXDASSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC[C@H]2CCC[NH+]2Cc2ccccc2)C[C@H]1C ZINC000246938431 549247079 /nfs/dbraw/zinc/24/70/79/549247079.db2.gz CBGZSXMMHDCDOA-UYAOXDASSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@H]2CCC[N@@H+]2Cc2ccccc2)C[C@H]1C ZINC000246938431 549247080 /nfs/dbraw/zinc/24/70/80/549247080.db2.gz CBGZSXMMHDCDOA-UYAOXDASSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)C[C@H]1C ZINC000246938431 549247081 /nfs/dbraw/zinc/24/70/81/549247081.db2.gz CBGZSXMMHDCDOA-UYAOXDASSA-N 2 1 374.529 2.013 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@H](C)C[NH+]2CCCCC2)C[C@@H]1CC ZINC000247260343 549308624 /nfs/dbraw/zinc/30/86/24/549308624.db2.gz YKBGDKPNBYZTIZ-MSOLQXFVSA-N 2 1 354.539 2.003 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@@H]4CCC[N@H+]4C[C@H]3C)cc2)CC1 ZINC000247259937 549308950 /nfs/dbraw/zinc/30/89/50/549308950.db2.gz ZTUKICSSBPCZIX-XLIONFOSSA-N 2 1 356.514 2.137 10 0 FEAEMP CC[NH+](CC)[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)Cc1ccccc1 ZINC000247649675 549368676 /nfs/dbraw/zinc/36/86/76/549368676.db2.gz WFNALJAOUIGCMH-VQTJNVASSA-N 2 1 358.530 2.429 10 0 FEAEMP C[C@H](C(=O)NCC1CCCCC1)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247767922 549378044 /nfs/dbraw/zinc/37/80/44/549378044.db2.gz OIKZUCHGFHPRKG-DLBZAZTESA-N 2 1 353.551 2.096 10 0 FEAEMP CC(C)C[NH+]1CC[C@H](c2nnc3n2CC[N@H+](Cc2cccnc2)CC3)C1 ZINC000257194425 549716069 /nfs/dbraw/zinc/71/60/69/549716069.db2.gz UAOAYBSPVDVQLL-SFHVURJKSA-N 2 1 354.502 2.177 10 0 FEAEMP C[C@H](c1cccc(N2CCCS2(=O)=O)c1)[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000261982493 549777396 /nfs/dbraw/zinc/77/73/96/549777396.db2.gz ROGOCDBXIWHROK-HZPDHXFCSA-N 2 1 351.516 2.219 10 0 FEAEMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@@H]3[C@H]3COCCN3)C2)cc1 ZINC000261992569 549777812 /nfs/dbraw/zinc/77/78/12/549777812.db2.gz SXIFOMMUWZALCP-CIAFKFPVSA-N 2 1 357.542 2.298 10 0 FEAEMP O=C(Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c1)[C@@H]1CCCO1 ZINC000262016365 549780400 /nfs/dbraw/zinc/78/04/00/549780400.db2.gz WCHBPIDEHZITOK-YRPNKDGESA-N 2 1 373.497 2.051 10 0 FEAEMP CN(Cc1ccccc1Br)C(=O)C[N@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000262562535 549828468 /nfs/dbraw/zinc/82/84/68/549828468.db2.gz VVRMYJFMRAPVKO-DUVNUKRYSA-N 2 1 366.303 2.077 10 0 FEAEMP CN(Cc1ccccc1Br)C(=O)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000262562535 549828466 /nfs/dbraw/zinc/82/84/66/549828466.db2.gz VVRMYJFMRAPVKO-DUVNUKRYSA-N 2 1 366.303 2.077 10 0 FEAEMP CCOC(=O)CC[C@H](O)C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000385663292 558606832 /nfs/dbraw/zinc/60/68/32/558606832.db2.gz LBVISKMCDNULIU-LWYYNNOASA-N 2 1 360.498 2.191 10 0 FEAEMP C[C@H](CNC(=O)N1CC[N@H+]2CCCC[C@@H]2C1)[NH+]1CCc2ccccc2C1 ZINC000105149627 543161618 /nfs/dbraw/zinc/16/16/18/543161618.db2.gz FCZCDNIKXZFHAK-YLJYHZDGSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H](CNC(=O)N1CC[NH+]2CCCC[C@@H]2C1)[N@@H+]1CCc2ccccc2C1 ZINC000105149627 543161620 /nfs/dbraw/zinc/16/16/20/543161620.db2.gz FCZCDNIKXZFHAK-YLJYHZDGSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H](CNC(=O)N1CC[NH+]2CCCC[C@@H]2C1)[N@H+]1CCc2ccccc2C1 ZINC000105149627 543161623 /nfs/dbraw/zinc/16/16/23/543161623.db2.gz FCZCDNIKXZFHAK-YLJYHZDGSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@H+](C)Cc2nnc(-c3ccccc3)n2C)CC1 ZINC000106124451 543204380 /nfs/dbraw/zinc/20/43/80/543204380.db2.gz GNVUCEGUGGBMNH-INIZCTEOSA-N 2 1 357.502 2.007 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2nnc(-c3ccccc3)n2C)CC1 ZINC000106124451 543204382 /nfs/dbraw/zinc/20/43/82/543204382.db2.gz GNVUCEGUGGBMNH-INIZCTEOSA-N 2 1 357.502 2.007 10 0 FEAEMP Cc1c(O)ccc2c(C[N@H+](C)CC3CC[NH+](C[C@@H](C)O)CC3)cc(=O)oc12 ZINC000106126071 543204386 /nfs/dbraw/zinc/20/43/86/543204386.db2.gz ANJVNQCXJMJBCC-CQSZACIVSA-N 2 1 374.481 2.332 10 0 FEAEMP C[NH+](C)[C@H](Cc1ccccc1)C(=O)NCC1([NH+]2CCCCC2)CCOCC1 ZINC000112912112 543467280 /nfs/dbraw/zinc/46/72/80/543467280.db2.gz VMDQYAFZKLCBCQ-HXUWFJFHSA-N 2 1 373.541 2.311 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)C[C@@H]1C ZINC000117468491 543632167 /nfs/dbraw/zinc/63/21/67/543632167.db2.gz RZKAKYWYWNORFU-ICSRJNTNSA-N 2 1 374.529 2.186 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)C[C@@H]1C ZINC000117468491 543632170 /nfs/dbraw/zinc/63/21/70/543632170.db2.gz RZKAKYWYWNORFU-ICSRJNTNSA-N 2 1 374.529 2.186 10 0 FEAEMP C[C@H]1CCC[N@@H+](CCNC(=O)N2CC[C@H](C[NH+](C)Cc3cccnc3)C2)C1 ZINC000190692637 328224937 /nfs/dbraw/zinc/22/49/37/328224937.db2.gz KSTMSSHEUVYRII-AZUAARDMSA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@H]1CCC[NH+](CCNC(=O)N2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000190692637 328224938 /nfs/dbraw/zinc/22/49/38/328224938.db2.gz KSTMSSHEUVYRII-AZUAARDMSA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@H]1CCC[NH+](CCNC(=O)N2CC[C@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000190692637 328224939 /nfs/dbraw/zinc/22/49/39/328224939.db2.gz KSTMSSHEUVYRII-AZUAARDMSA-N 2 1 373.545 2.277 10 0 FEAEMP CC[NH+](CC)[C@@H](C)CNC(=O)NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000122119169 326384647 /nfs/dbraw/zinc/38/46/47/326384647.db2.gz LJVOBABWAALIOG-KRWDZBQOSA-N 2 1 362.518 2.048 10 0 FEAEMP C[NH+](C)CCCOc1ccc(CNC(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000171907192 327169766 /nfs/dbraw/zinc/16/97/66/327169766.db2.gz CSTQROODYRNQEN-GOSISDBHSA-N 2 1 360.502 2.007 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)C[C@H](O)COc2ccccc2Cl)CC1 ZINC000172111267 327181422 /nfs/dbraw/zinc/18/14/22/327181422.db2.gz RRDHBEPNCBCPAA-RDJZCZTQSA-N 2 1 370.921 2.104 10 0 FEAEMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)[C@H]([NH2+]C2CCOCC2)C(C)C)C1 ZINC000173157195 327238156 /nfs/dbraw/zinc/23/81/56/327238156.db2.gz NORNBPNONVDNAL-IEBWSBKVSA-N 2 1 362.518 2.402 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@H+](C)Cc2nc(CCc3ccccc3)no2)CC1 ZINC000173682512 327276624 /nfs/dbraw/zinc/27/66/24/327276624.db2.gz JJUZQOOXHPDGQM-KRWDZBQOSA-N 2 1 372.513 2.379 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2nc(CCc3ccccc3)no2)CC1 ZINC000173682512 327276625 /nfs/dbraw/zinc/27/66/25/327276625.db2.gz JJUZQOOXHPDGQM-KRWDZBQOSA-N 2 1 372.513 2.379 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000174438959 327327052 /nfs/dbraw/zinc/32/70/52/327327052.db2.gz DIKPMJMGJDIJSD-RBUKOAKNSA-N 2 1 374.529 2.395 10 0 FEAEMP CC(C)c1nn(C)c(N2CCOCC2)c1C[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000175012844 327368071 /nfs/dbraw/zinc/36/80/71/327368071.db2.gz GFXFTDWXCNNFMA-IRXDYDNUSA-N 2 1 363.550 2.343 10 0 FEAEMP c1sc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)nc1-c1ccncc1 ZINC000261985665 328833540 /nfs/dbraw/zinc/83/35/40/328833540.db2.gz SAWCEOHVZQWFAP-BBWFWOEESA-N 2 1 358.511 2.494 10 0 FEAEMP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H]2C[NH2+]C[C@@H]2O)o1 ZINC000262163484 328847297 /nfs/dbraw/zinc/84/72/97/328847297.db2.gz TXIZZRQVNPLUOP-YJBOKZPZSA-N 2 1 352.438 2.111 10 0 FEAEMP Clc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)cc2c1OCCO2 ZINC000261960064 518194508 /nfs/dbraw/zinc/19/45/08/518194508.db2.gz PKBJWRONDXJJCE-IMJJTQAJSA-N 2 1 352.862 2.358 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(CN(C)C(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000176867133 546498539 /nfs/dbraw/zinc/49/85/39/546498539.db2.gz OSNTYGIVRIVLAD-RXVVDRJESA-N 2 1 373.541 2.202 10 0 FEAEMP CCc1oc(C(=O)OC)cc1C[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000177133406 546551944 /nfs/dbraw/zinc/55/19/44/546551944.db2.gz NWVACGXZWPPOAP-AWEZNQCLSA-N 2 1 352.475 2.153 10 0 FEAEMP CCC(CC)[C@@H](CNC(=O)N(C)C[C@@H]1CCC[N@@H+]1CC)[NH+]1CCOCC1 ZINC000177344677 546598217 /nfs/dbraw/zinc/59/82/17/546598217.db2.gz SDFAQGQOQOGGAO-RBUKOAKNSA-N 2 1 368.566 2.249 10 0 FEAEMP CCC(CC)[C@@H](CNC(=O)N(C)C[C@@H]1CCC[N@H+]1CC)[NH+]1CCOCC1 ZINC000177344677 546598221 /nfs/dbraw/zinc/59/82/21/546598221.db2.gz SDFAQGQOQOGGAO-RBUKOAKNSA-N 2 1 368.566 2.249 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CCC(=O)NC(=O)Nc1ccccc1 ZINC000178285687 546769038 /nfs/dbraw/zinc/76/90/38/546769038.db2.gz OIHNZONKTBIZJZ-QGZVFWFLSA-N 2 1 355.442 2.394 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CCC(=O)NC(=O)Nc1ccccc1 ZINC000178285687 546769043 /nfs/dbraw/zinc/76/90/43/546769043.db2.gz OIHNZONKTBIZJZ-QGZVFWFLSA-N 2 1 355.442 2.394 10 0 FEAEMP Cn1cc([C@H]2CCC[NH+]2CCOCC[N@@H+]2CCC[C@@H]2c2cnn(C)c2)cn1 ZINC000178636573 546824095 /nfs/dbraw/zinc/82/40/95/546824095.db2.gz OIOAINICHHRUMY-WOJBJXKFSA-N 2 1 372.517 2.144 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cnn(Cc3ccccc3)c2)CC1 ZINC000179423141 546951246 /nfs/dbraw/zinc/95/12/46/546951246.db2.gz SCDVMKKHIJNCED-SFHVURJKSA-N 2 1 356.514 2.456 10 0 FEAEMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH2+][C@H](C)[C@@H]2CCCO2)CC1 ZINC000183090183 547600100 /nfs/dbraw/zinc/60/01/00/547600100.db2.gz WAVGIFGLJCSKGV-QUCCMNQESA-N 2 1 359.514 2.186 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N(C)C[C@@H]2CCC[NH+]2CC)[C@H](C)C1 ZINC000245428876 548916054 /nfs/dbraw/zinc/91/60/54/548916054.db2.gz XTAREDKFGZPTCA-QYZOEREBSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N(C)C[C@@H]2CCC[N@@H+]2CC)[C@H](C)C1 ZINC000245428876 548916057 /nfs/dbraw/zinc/91/60/57/548916057.db2.gz XTAREDKFGZPTCA-QYZOEREBSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N(C)C[C@@H]2CCC[N@H+]2CC)[C@H](C)C1 ZINC000245428876 548916060 /nfs/dbraw/zinc/91/60/60/548916060.db2.gz XTAREDKFGZPTCA-QYZOEREBSA-N 2 1 368.566 2.249 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[NH+]2CCCC[C@H]2C)CC[N@H+]1C[C@H](C)O ZINC000248453972 549441083 /nfs/dbraw/zinc/44/10/83/549441083.db2.gz LRGSICZVGZGPGB-CEXWTWQISA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@@H+]2CCCC[C@H]2C)CC[NH+]1C[C@H](C)O ZINC000248453972 549441091 /nfs/dbraw/zinc/44/10/91/549441091.db2.gz LRGSICZVGZGPGB-CEXWTWQISA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@H+]2CCCC[C@H]2C)CC[NH+]1C[C@H](C)O ZINC000248453972 549441093 /nfs/dbraw/zinc/44/10/93/549441093.db2.gz LRGSICZVGZGPGB-CEXWTWQISA-N 2 1 368.566 2.128 10 0 FEAEMP COC1CC[NH+](C2(CN[C@@H]3CCC[C@H]3[C@@H]3COCC[NH2+]3)CCCC2)CC1 ZINC000261886630 549765884 /nfs/dbraw/zinc/76/58/84/549765884.db2.gz FYXOLDNNEWCIRX-AQNXPRMDSA-N 3 1 365.562 2.157 10 0 FEAEMP Fc1ccc(-n2ccc(CC[NH2+][C@@H]3CCC[C@H]3[C@@H]3COCC[NH2+]3)n2)cc1 ZINC000261954390 549773827 /nfs/dbraw/zinc/77/38/27/549773827.db2.gz OTHIJYGRTWOFJP-AQNXPRMDSA-N 2 1 358.461 2.301 10 0 FEAEMP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c(O[C@@H]2CCOC2)c1 ZINC000261951152 549773834 /nfs/dbraw/zinc/77/38/34/549773834.db2.gz OHIFJCJXQZQUBZ-WCIQWLHISA-N 2 1 360.498 2.409 10 0 FEAEMP CCOC(=O)c1cnc2ccc(C)cc2c1N1C[C@@H]2[C@H](C1)OCCN2C ZINC000301686770 553671945 /nfs/dbraw/zinc/67/19/45/553671945.db2.gz XFKJYGYUYSMKSK-MSOLQXFVSA-N 2 1 355.438 2.239 10 0 FEAEMP CCc1nc(C)sc1C[N@H+]1CC[C@@](O)(C[NH+]2CCOCC2)C(C)(C)C1 ZINC000091603442 670729613 /nfs/dbraw/zinc/72/96/13/670729613.db2.gz YVXFDQRQOOVWHX-LJQANCHMSA-N 2 1 367.559 2.309 10 0 FEAEMP CC(C)(C)c1nn(-c2ccccc2Cl)cc1C[NH2+]C[C@H]1C[NH2+]C[C@H]1O ZINC000262197998 672910413 /nfs/dbraw/zinc/91/04/13/672910413.db2.gz ZQEBEMMJUKLJDD-SUMWQHHRSA-N 2 1 362.905 2.493 10 0 FEAEMP COCC[NH+]1CCC(C[N@H+](Cc2ccc(CO)o2)C[C@H]2CCCO2)CC1 ZINC000012385173 539557190 /nfs/dbraw/zinc/55/71/90/539557190.db2.gz SVIZARXCZVKTBI-GOSISDBHSA-N 2 1 366.502 2.111 10 0 FEAEMP CCN(C(=O)C[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1)C1CCCCC1 ZINC000106125796 543204474 /nfs/dbraw/zinc/20/44/74/543204474.db2.gz MDBUSRDUJGFBDG-QGZVFWFLSA-N 2 1 353.551 2.192 10 0 FEAEMP Cc1cc(C)cc(OC[C@@H](O)C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c1 ZINC000113310646 543483978 /nfs/dbraw/zinc/48/39/78/543483978.db2.gz FPFNPNXZYDXCQV-QUCCMNQESA-N 2 1 364.530 2.068 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCCC[NH+]1CCc2ccccc2C1 ZINC000113591858 543491926 /nfs/dbraw/zinc/49/19/26/543491926.db2.gz LCXRCEDBRDFZHD-FXAWDEMLSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCCC[N@@H+]1CCc2ccccc2C1 ZINC000113591858 543491928 /nfs/dbraw/zinc/49/19/28/543491928.db2.gz LCXRCEDBRDFZHD-FXAWDEMLSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000113591858 543491930 /nfs/dbraw/zinc/49/19/30/543491930.db2.gz LCXRCEDBRDFZHD-FXAWDEMLSA-N 2 1 356.514 2.313 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCCC[NH+](C)C2CCCCC2)C[C@H]1C ZINC000117477934 543633598 /nfs/dbraw/zinc/63/35/98/543633598.db2.gz ARGDOUKWJXDVHG-QGZVFWFLSA-N 2 1 354.539 2.003 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCCC[NH+](C)C2CCCCC2)C[C@H]1C ZINC000117477934 543633601 /nfs/dbraw/zinc/63/36/01/543633601.db2.gz ARGDOUKWJXDVHG-QGZVFWFLSA-N 2 1 354.539 2.003 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NCCC[N@H+](C)C2CCCCC2)C[C@H]1C ZINC000117477934 543633602 /nfs/dbraw/zinc/63/36/02/543633602.db2.gz ARGDOUKWJXDVHG-QGZVFWFLSA-N 2 1 354.539 2.003 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NCCC[N@@H+](C)C2CCCCC2)C[C@H]1C ZINC000117477934 543633605 /nfs/dbraw/zinc/63/36/05/543633605.db2.gz ARGDOUKWJXDVHG-QGZVFWFLSA-N 2 1 354.539 2.003 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NC[C@@H]2CCC[NH+]2Cc2ccccc2)C[C@H]1C ZINC000117497594 543634369 /nfs/dbraw/zinc/63/43/69/543634369.db2.gz CBGZSXMMHDCDOA-QUCCMNQESA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NC[C@@H]2CCC[NH+]2Cc2ccccc2)C[C@H]1C ZINC000117497594 543634373 /nfs/dbraw/zinc/63/43/73/543634373.db2.gz CBGZSXMMHDCDOA-QUCCMNQESA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@@H]2CCC[N@@H+]2Cc2ccccc2)C[C@H]1C ZINC000117497594 543634376 /nfs/dbraw/zinc/63/43/76/543634376.db2.gz CBGZSXMMHDCDOA-QUCCMNQESA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)C[C@H]1C ZINC000117497594 543634381 /nfs/dbraw/zinc/63/43/81/543634381.db2.gz CBGZSXMMHDCDOA-QUCCMNQESA-N 2 1 374.529 2.013 10 0 FEAEMP COc1ccccc1[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)[NH+]1CCCC1 ZINC000247496887 549345009 /nfs/dbraw/zinc/34/50/09/549345009.db2.gz MSFFBQLKUAYRGU-PKOBYXMFSA-N 2 1 372.513 2.322 10 0 FEAEMP CC(C)CSCCC[NH+]1CCN(C[C@H]2C[N@H+](C(C)C)CCO2)CC1 ZINC000152624337 544675702 /nfs/dbraw/zinc/67/57/02/544675702.db2.gz ASVRNXXEXAXPAF-IBGZPJMESA-N 2 1 357.608 2.493 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)CC1 ZINC000190905648 328239568 /nfs/dbraw/zinc/23/95/68/328239568.db2.gz ARMVYQBLDNZSIE-QPIRBTGLSA-N 2 1 352.519 2.421 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NCC[NH+](C)C2CCCC2)C[C@H]1CC ZINC000117046370 326049265 /nfs/dbraw/zinc/04/92/65/326049265.db2.gz LWKLJTMTVLPYBI-QGZVFWFLSA-N 2 1 354.539 2.003 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NCC[N@H+](C)C2CCCC2)C[C@H]1CC ZINC000117046370 326049267 /nfs/dbraw/zinc/04/92/67/326049267.db2.gz LWKLJTMTVLPYBI-QGZVFWFLSA-N 2 1 354.539 2.003 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NCC[N@@H+](C)C2CCCC2)C[C@H]1CC ZINC000117046370 326049268 /nfs/dbraw/zinc/04/92/68/326049268.db2.gz LWKLJTMTVLPYBI-QGZVFWFLSA-N 2 1 354.539 2.003 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCCC[NH+]2CCC(C)CC2)CC[N@H+]1CCOC ZINC000117478589 326062887 /nfs/dbraw/zinc/06/28/87/326062887.db2.gz QIWQJHINHFMCEK-IBGZPJMESA-N 2 1 368.566 2.251 10 0 FEAEMP Cc1[nH+]ccn1CCCC[NH+]1CCN(C[C@H](O)COc2ccccc2)CC1 ZINC000120957458 326302470 /nfs/dbraw/zinc/30/24/70/326302470.db2.gz DDAHDFPVGUDIMZ-FQEVSTJZSA-N 2 1 372.513 2.029 10 0 FEAEMP CCC[C@H](C(=O)NCc1ccc(C[NH+]2CCN(CC)CC2)cc1)[NH+](C)C ZINC000161590568 327003688 /nfs/dbraw/zinc/00/36/88/327003688.db2.gz YPBHJBFLVBVDHA-HXUWFJFHSA-N 2 1 360.546 2.171 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000170835477 327101198 /nfs/dbraw/zinc/10/11/98/327101198.db2.gz JWALMVLFCJXSJJ-JKSUJKDBSA-N 2 1 350.532 2.306 10 0 FEAEMP CC(C)CO[C@H](C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000173885662 327291404 /nfs/dbraw/zinc/29/14/04/327291404.db2.gz WNSVEXANBZJZET-HZPDHXFCSA-N 2 1 368.522 2.328 10 0 FEAEMP CC(C)CO[C@H](C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000173885662 327291405 /nfs/dbraw/zinc/29/14/05/327291405.db2.gz WNSVEXANBZJZET-HZPDHXFCSA-N 2 1 368.522 2.328 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)N[C@@H](Cc1ccccc1)C[NH+](C)C ZINC000174203019 327312710 /nfs/dbraw/zinc/31/27/10/327312710.db2.gz UCXCYGHMAKHRMK-XUVXKRRUSA-N 2 1 358.530 2.428 10 0 FEAEMP C([NH2+][C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1)C1(N2CCSCC2)CCCCC1 ZINC000262011622 328835317 /nfs/dbraw/zinc/83/53/17/328835317.db2.gz VPYRWFZZDBVOHZ-GUDVDZBRSA-N 2 1 367.603 2.485 10 0 FEAEMP O=C(Nc1cccc(C[NH2+]C[C@H]2C[NH2+]C[C@@H]2O)c1)c1ccc(Cl)cc1 ZINC000263178877 328922452 /nfs/dbraw/zinc/92/24/52/328922452.db2.gz GLIIOLVCUGZCHS-YJBOKZPZSA-N 2 1 359.857 2.262 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)CCC[NH+]2CCN(c3ccccc3)CC2)C1 ZINC000171865625 546229022 /nfs/dbraw/zinc/22/90/22/546229022.db2.gz IMTCBSVSOKWOEC-LJQANCHMSA-N 2 1 358.530 2.189 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(C)C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000176144161 546413597 /nfs/dbraw/zinc/41/35/97/546413597.db2.gz IIZWJURNABRAIC-SFHVURJKSA-N 2 1 366.550 2.147 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000176144161 546413601 /nfs/dbraw/zinc/41/36/01/546413601.db2.gz IIZWJURNABRAIC-SFHVURJKSA-N 2 1 366.550 2.147 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC1CC[NH+](CCOC(C)C)CC1 ZINC000176627753 546469740 /nfs/dbraw/zinc/46/97/40/546469740.db2.gz LREXUHZKGINITQ-RTBURBONSA-N 2 1 366.550 2.144 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCc1ccc(OCC[NH+](C)C)cc1 ZINC000177389942 546606716 /nfs/dbraw/zinc/60/67/16/546606716.db2.gz IUBWOXDUEMPHDM-GOSISDBHSA-N 2 1 362.518 2.253 10 0 FEAEMP CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000177396342 546609868 /nfs/dbraw/zinc/60/98/68/546609868.db2.gz NZXIAKHFULIBRL-QGZVFWFLSA-N 2 1 356.474 2.201 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000177396342 546609870 /nfs/dbraw/zinc/60/98/70/546609870.db2.gz NZXIAKHFULIBRL-QGZVFWFLSA-N 2 1 356.474 2.201 10 0 FEAEMP CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)[C@@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000177422827 546615207 /nfs/dbraw/zinc/61/52/07/546615207.db2.gz YWOOGNCSWMBOFN-UYAOXDASSA-N 2 1 359.514 2.127 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)[C@@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000177422827 546615209 /nfs/dbraw/zinc/61/52/09/546615209.db2.gz YWOOGNCSWMBOFN-UYAOXDASSA-N 2 1 359.514 2.127 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CCC(=O)NC(=O)NCc1ccccc1 ZINC000178298723 546771750 /nfs/dbraw/zinc/77/17/50/546771750.db2.gz CTDCBUQTMDGJLC-SFHVURJKSA-N 2 1 369.469 2.072 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CCC(=O)NC(=O)NCc1ccccc1 ZINC000178298723 546771754 /nfs/dbraw/zinc/77/17/54/546771754.db2.gz CTDCBUQTMDGJLC-SFHVURJKSA-N 2 1 369.469 2.072 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)C(=O)Nc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC000194156887 548443310 /nfs/dbraw/zinc/44/33/10/548443310.db2.gz OUYKGAKTIJNSFY-IBGZPJMESA-N 2 1 372.513 2.212 10 0 FEAEMP CN(Cc1cccnc1)C[C@@H]1CC[N@@H+](C[C@H](O)COCc2ccccc2)C1 ZINC000195272557 548607881 /nfs/dbraw/zinc/60/78/81/548607881.db2.gz WXPGGJOSKYVMQU-VXKWHMMOSA-N 2 1 369.509 2.413 10 0 FEAEMP CCC[C@H](C(=O)NCCC[N@H+]1CCN(C)C[C@H]1c1ccccc1)[NH+](C)C ZINC000245639929 548963554 /nfs/dbraw/zinc/96/35/54/548963554.db2.gz AUBSNJJPWDWORO-UXHICEINSA-N 2 1 360.546 2.212 10 0 FEAEMP CCC[C@H](C(=O)NCCCN1CC[N@H+](C)C[C@H]1c1ccccc1)[NH+](C)C ZINC000245639929 548963559 /nfs/dbraw/zinc/96/35/59/548963559.db2.gz AUBSNJJPWDWORO-UXHICEINSA-N 2 1 360.546 2.212 10 0 FEAEMP CCC[C@H](C(=O)NCCCN1CC[N@@H+](C)C[C@H]1c1ccccc1)[NH+](C)C ZINC000245639929 548963564 /nfs/dbraw/zinc/96/35/64/548963564.db2.gz AUBSNJJPWDWORO-UXHICEINSA-N 2 1 360.546 2.212 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)C1 ZINC000245747865 548987794 /nfs/dbraw/zinc/98/77/94/548987794.db2.gz ANFWQCUQWJMVQV-ZACQAIPSSA-N 2 1 350.894 2.431 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)NC[C@H]2CC[NH+](CCc3ccccc3)C2)C1 ZINC000246151824 549063860 /nfs/dbraw/zinc/06/38/60/549063860.db2.gz PMBAWMYZCWNIPP-UXHICEINSA-N 2 1 358.530 2.335 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@H]2CC[N@H+](CCc3ccccc3)C2)C1 ZINC000246151824 549063864 /nfs/dbraw/zinc/06/38/64/549063864.db2.gz PMBAWMYZCWNIPP-UXHICEINSA-N 2 1 358.530 2.335 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC000246151824 549063869 /nfs/dbraw/zinc/06/38/69/549063869.db2.gz PMBAWMYZCWNIPP-UXHICEINSA-N 2 1 358.530 2.335 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000246747675 549203232 /nfs/dbraw/zinc/20/32/32/549203232.db2.gz BFLMGVANRJQHOT-QFBILLFUSA-N 2 1 362.518 2.155 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CC(=O)N[C@H]1CCOc2ccccc21 ZINC000246923843 549243761 /nfs/dbraw/zinc/24/37/61/549243761.db2.gz GROIALURYIZNKQ-AEFFLSMTSA-N 2 1 354.454 2.296 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CC(=O)N[C@H]1CCOc2ccccc21 ZINC000246923843 549243762 /nfs/dbraw/zinc/24/37/62/549243762.db2.gz GROIALURYIZNKQ-AEFFLSMTSA-N 2 1 354.454 2.296 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@H]2CN1CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000247037448 549270578 /nfs/dbraw/zinc/27/05/78/549270578.db2.gz GMPLKBNRFVIVDD-RXVVDRJESA-N 2 1 370.541 2.067 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NC[C@@H](C)[NH+]2CCc3ccccc3C2)C1 ZINC000247324084 549319122 /nfs/dbraw/zinc/31/91/22/549319122.db2.gz MPVWXSSMRUWYJK-MBOZVWFJSA-N 2 1 358.530 2.461 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)NC[C@@H](C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000247324084 549319125 /nfs/dbraw/zinc/31/91/25/549319125.db2.gz MPVWXSSMRUWYJK-MBOZVWFJSA-N 2 1 358.530 2.461 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)C1 ZINC000247324084 549319131 /nfs/dbraw/zinc/31/91/31/549319131.db2.gz MPVWXSSMRUWYJK-MBOZVWFJSA-N 2 1 358.530 2.461 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C(=O)NC2CC2)c2ccccc2)CC1 ZINC000247577364 549360822 /nfs/dbraw/zinc/36/08/22/549360822.db2.gz HYJLBVRAJWGLER-OXJNMPFZSA-N 2 1 359.514 2.031 10 0 FEAEMP COC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000249208581 549569220 /nfs/dbraw/zinc/56/92/20/549569220.db2.gz CFNRDAZZCJNZHE-QYZOEREBSA-N 2 1 351.535 2.209 10 0 FEAEMP CCN1CC[NH+](Cc2ccc(N[C@@H]3CCC[C@H]3[C@H]3COCC[NH2+]3)cc2)CC1 ZINC000261956994 549773467 /nfs/dbraw/zinc/77/34/67/549773467.db2.gz PCQGQNZBAGNVKI-YPAWHYETSA-N 2 1 372.557 2.393 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000263220927 549886972 /nfs/dbraw/zinc/88/69/72/549886972.db2.gz LUOWEXUWBPUVMF-JOYOIKCWSA-N 2 1 353.182 2.138 10 0 FEAEMP COCC[N@H+]1C[C@H](CO)C2(C1)CC[NH+](Cc1cccc(Cl)c1)CC2 ZINC000169789520 672322545 /nfs/dbraw/zinc/32/25/45/672322545.db2.gz YEKMKYXPNXCTJG-QGZVFWFLSA-N 2 1 352.906 2.493 10 0 FEAEMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)NC[C@@H]2CN(C)CCO2)cc1 ZINC000104787285 543143940 /nfs/dbraw/zinc/14/39/40/543143940.db2.gz MTGMADARVPHIBX-YLJYHZDGSA-N 2 1 374.529 2.191 10 0 FEAEMP CCCCNC(=O)C[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106128132 543206064 /nfs/dbraw/zinc/20/60/64/543206064.db2.gz UDXSQNSACKORAC-FQEVSTJZSA-N 2 1 361.530 2.280 10 0 FEAEMP CCN(C(=O)C[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1)C1CCCCC1 ZINC000106125799 543204621 /nfs/dbraw/zinc/20/46/21/543204621.db2.gz MDBUSRDUJGFBDG-KRWDZBQOSA-N 2 1 353.551 2.192 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc(F)c2)CC1 ZINC000106125620 543204730 /nfs/dbraw/zinc/20/47/30/543204730.db2.gz BTGYIKPNDHSCOU-GJZGRUSLSA-N 2 1 351.466 2.177 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CCCOc2ccc3c(c2)OCO3)CC1 ZINC000106124612 543205035 /nfs/dbraw/zinc/20/50/35/543205035.db2.gz OBSOVLMXKFZPLS-MRXNPFEDSA-N 2 1 364.486 2.209 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC1([NH+]2CCSCC2)CCCC1 ZINC000113596187 543491894 /nfs/dbraw/zinc/49/18/94/543491894.db2.gz SBEIBEUQCOZSOL-DLBZAZTESA-N 2 1 366.575 2.226 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[N@H+]2C[C@@H]1C)[NH+]1CCc2ccccc2C1 ZINC000113596124 543491961 /nfs/dbraw/zinc/49/19/61/543491961.db2.gz CTOQFUQCGAAYQB-FUHIMQAGSA-N 2 1 356.514 2.311 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[NH+]2C[C@@H]1C)[N@@H+]1CCc2ccccc2C1 ZINC000113596124 543491963 /nfs/dbraw/zinc/49/19/63/543491963.db2.gz CTOQFUQCGAAYQB-FUHIMQAGSA-N 2 1 356.514 2.311 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[NH+]2C[C@@H]1C)[N@H+]1CCc2ccccc2C1 ZINC000113596124 543491964 /nfs/dbraw/zinc/49/19/64/543491964.db2.gz CTOQFUQCGAAYQB-FUHIMQAGSA-N 2 1 356.514 2.311 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)NC(=O)NCc1ccccc1 ZINC000154547190 544919379 /nfs/dbraw/zinc/91/93/79/544919379.db2.gz KBCNFCYBJWAECQ-MAUKXSAKSA-N 2 1 369.469 2.070 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)NC(=O)NCc1ccccc1 ZINC000154547190 544919382 /nfs/dbraw/zinc/91/93/82/544919382.db2.gz KBCNFCYBJWAECQ-MAUKXSAKSA-N 2 1 369.469 2.070 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)[C@@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000189181088 328133528 /nfs/dbraw/zinc/13/35/28/328133528.db2.gz JHLJMGMVNKKBJL-CVEARBPZSA-N 2 1 364.538 2.264 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000189181088 328133530 /nfs/dbraw/zinc/13/35/30/328133530.db2.gz JHLJMGMVNKKBJL-CVEARBPZSA-N 2 1 364.538 2.264 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N3C[C@H]4CCC[NH+]4C[C@@H]3C)c2C1 ZINC000190075505 328186079 /nfs/dbraw/zinc/18/60/79/328186079.db2.gz LAPXUYRBTYBWPR-DOTOQJQBSA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N3C[C@H]4CCC[NH+]4C[C@@H]3C)c2C1 ZINC000190075505 328186080 /nfs/dbraw/zinc/18/60/80/328186080.db2.gz LAPXUYRBTYBWPR-DOTOQJQBSA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N3C[C@H]4CCC[N@@H+]4C[C@@H]3C)c2C1 ZINC000190075505 328186082 /nfs/dbraw/zinc/18/60/82/328186082.db2.gz LAPXUYRBTYBWPR-DOTOQJQBSA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N3C[C@H]4CCC[N@H+]4C[C@@H]3C)c2C1 ZINC000190075505 328186084 /nfs/dbraw/zinc/18/60/84/328186084.db2.gz LAPXUYRBTYBWPR-DOTOQJQBSA-N 2 1 370.497 2.046 10 0 FEAEMP CN(C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)n1 ZINC000192713095 328334561 /nfs/dbraw/zinc/33/45/61/328334561.db2.gz KMAZQBAJZCIILG-SFHVURJKSA-N 2 1 373.501 2.013 10 0 FEAEMP CN(C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)n1 ZINC000192713095 328334563 /nfs/dbraw/zinc/33/45/63/328334563.db2.gz KMAZQBAJZCIILG-SFHVURJKSA-N 2 1 373.501 2.013 10 0 FEAEMP COc1cccc(NC(=O)CC[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c1 ZINC000174783009 327350754 /nfs/dbraw/zinc/35/07/54/327350754.db2.gz FZTYZZVZKQQNIW-INIZCTEOSA-N 2 1 363.502 2.048 10 0 FEAEMP FC(F)(F)COc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)ccn1 ZINC000261861077 328825259 /nfs/dbraw/zinc/82/52/59/328825259.db2.gz CDODYYLORLUFQA-ZNMIVQPWSA-N 2 1 359.392 2.269 10 0 FEAEMP c1ncn([C@H]2CCC[NH+](CCCCC[N@H+]3CCC[C@H](n4cncn4)C3)C2)n1 ZINC000157908773 545798997 /nfs/dbraw/zinc/79/89/97/545798997.db2.gz BZCAOEXHIJMGJT-OALUTQOASA-N 2 1 372.521 2.014 10 0 FEAEMP CC(C)[N@@H+](C)CCNC(=O)NC[C@@H](c1cccs1)N1CCO[C@@H](C)C1 ZINC000178635363 546824398 /nfs/dbraw/zinc/82/43/98/546824398.db2.gz GELOIEIDKLAZPF-HOTGVXAUSA-N 2 1 368.547 2.149 10 0 FEAEMP O=C(c1ccc(C[NH+]2CCC(CO)CC2)cc1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000179761711 547009826 /nfs/dbraw/zinc/00/98/26/547009826.db2.gz NLTWYCCPCFHBPM-OAQYLSRUSA-N 2 1 371.525 2.201 10 0 FEAEMP O=C(c1ccc(C[NH+]2CCC(CO)CC2)cc1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000179761711 547009830 /nfs/dbraw/zinc/00/98/30/547009830.db2.gz NLTWYCCPCFHBPM-OAQYLSRUSA-N 2 1 371.525 2.201 10 0 FEAEMP COC(=O)c1ccc(F)c(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c1 ZINC000181925616 547406645 /nfs/dbraw/zinc/40/66/45/547406645.db2.gz KCUDIXZVVDYVSL-AWEZNQCLSA-N 2 1 352.450 2.137 10 0 FEAEMP CC[NH+]1CCN(c2cccc(NC(=O)N[C@@H]3CCC[N@@H+](CC)C3)c2)CC1 ZINC000184910003 547897969 /nfs/dbraw/zinc/89/79/69/547897969.db2.gz HLGOAQVYEFGLFF-GOSISDBHSA-N 2 1 359.518 2.434 10 0 FEAEMP CCO[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)C12CCOCC2 ZINC000186499263 548144412 /nfs/dbraw/zinc/14/44/12/548144412.db2.gz XHSQQFZMKKDHAV-PWRODBHTSA-N 2 1 374.525 2.317 10 0 FEAEMP Cc1ncsc1CN(C)C[C@H]1CC[N@H+]([C@@H](C)C(=O)NCC(C)C)C1 ZINC000195266652 548607740 /nfs/dbraw/zinc/60/77/40/548607740.db2.gz HVHQIOMOZXFCDR-JKSUJKDBSA-N 2 1 352.548 2.366 10 0 FEAEMP C[C@H](O)C[N@H+]1CCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@@H]1C ZINC000245704734 548980017 /nfs/dbraw/zinc/98/00/17/548980017.db2.gz DTVGBRVNSGRNID-OALUTQOASA-N 2 1 374.573 2.104 10 0 FEAEMP CC[C@H]1CN(C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@H+]1C[C@H](C)O ZINC000246793269 549214162 /nfs/dbraw/zinc/21/41/62/549214162.db2.gz JLPYUKYLCROOED-PXNSSMCTSA-N 2 1 359.514 2.200 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCCC[NH+]2CCC[C@@H](C)C2)CC[N@H+]1CCOC ZINC000247001333 549261701 /nfs/dbraw/zinc/26/17/01/549261701.db2.gz GQGWUIRSACDYID-MOPGFXCFSA-N 2 1 368.566 2.251 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)CC[NH+]1CCOC ZINC000247001333 549261704 /nfs/dbraw/zinc/26/17/04/549261704.db2.gz GQGWUIRSACDYID-MOPGFXCFSA-N 2 1 368.566 2.251 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)CC[NH+]1CCOC ZINC000247001333 549261707 /nfs/dbraw/zinc/26/17/07/549261707.db2.gz GQGWUIRSACDYID-MOPGFXCFSA-N 2 1 368.566 2.251 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1CC[N@H+](CCOC)[C@@H](C)C1)c1ccco1 ZINC000247013443 549265366 /nfs/dbraw/zinc/26/53/66/549265366.db2.gz HFUXBWICSRKFCA-DLBZAZTESA-N 2 1 366.506 2.025 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1CC[N@@H+](CCOC)[C@@H](C)C1)c1ccco1 ZINC000247013443 549265370 /nfs/dbraw/zinc/26/53/70/549265370.db2.gz HFUXBWICSRKFCA-DLBZAZTESA-N 2 1 366.506 2.025 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)C[C@@H](O)COc2ccc(Cl)cc2)CC1 ZINC000247573980 549361106 /nfs/dbraw/zinc/36/11/06/549361106.db2.gz HOSJUITULOFYQS-MAUKXSAKSA-N 2 1 370.921 2.104 10 0 FEAEMP C[C@H](C(=O)N[C@H]1CCCC[C@@H]1C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247809007 549383171 /nfs/dbraw/zinc/38/31/71/549383171.db2.gz UGRHBIDBWQSTCK-BMFAXAFESA-N 2 1 353.551 2.094 10 0 FEAEMP CC[C@H]1CN(C(=O)NCC[C@H](C)[NH+]2CCCCC2)CC[N@H+]1CCOC ZINC000248493692 549450547 /nfs/dbraw/zinc/45/05/47/549450547.db2.gz PLWXHUQNXDPSSN-ROUUACIJSA-N 2 1 354.539 2.003 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)cc1 ZINC000248751572 549496279 /nfs/dbraw/zinc/49/62/79/549496279.db2.gz KLURGIBCIBVVNS-APWZRJJASA-N 2 1 372.513 2.162 10 0 FEAEMP COc1cccc([C@@H](CNC(=O)NC[C@@H]2CCC[N@H+]2C)[NH+]2CCCC2)c1 ZINC000249735163 549620885 /nfs/dbraw/zinc/62/08/85/549620885.db2.gz DHEYMEQWKYMDTJ-PKOBYXMFSA-N 2 1 360.502 2.226 10 0 FEAEMP CC(C)C[NH+]1CCc2nnc([C@@H]3CC[N@@H+](Cc4cccnc4)C3)n2CC1 ZINC000257184342 549713540 /nfs/dbraw/zinc/71/35/40/549713540.db2.gz ILJMTSGMVFMXCZ-GOSISDBHSA-N 2 1 354.502 2.177 10 0 FEAEMP [NH3+]Cc1nc(CN2CC[NH+](CCC34CC5CC(CC(C5)C3)C4)CC2)no1 ZINC000261868368 549763894 /nfs/dbraw/zinc/76/38/94/549763894.db2.gz XEIVRXBJNCCOBR-UHFFFAOYSA-N 2 1 359.518 2.252 10 0 FEAEMP C[C@@H]1C[C@H](CCNC(=O)[C@@H]2CC(F)(F)CN2)C[N@H+]1Cc1ccccc1 ZINC000262695561 549840239 /nfs/dbraw/zinc/84/02/39/549840239.db2.gz BDTWYVVEWCRNFU-PVAVHDDUSA-N 2 1 351.441 2.401 10 0 FEAEMP CCOC(=O)CC[C@H](O)C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000385663287 558606804 /nfs/dbraw/zinc/60/68/04/558606804.db2.gz LBVISKMCDNULIU-IYWMVGAKSA-N 2 1 360.498 2.191 10 0 FEAEMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653151920 677517744 /nfs/dbraw/zinc/51/77/44/677517744.db2.gz XXBOCLJLNJIKSK-DTZQCDIJSA-N 2 1 355.404 2.021 10 0 FEAEMP CC(C)[N@H+]1CC[C@@H](NS(=O)(=O)c2ccc(C[NH2+]C3CCCC3)cc2)C1 ZINC000098178628 209206549 /nfs/dbraw/zinc/20/65/49/209206549.db2.gz FKSNSQGCSOBQTJ-GOSISDBHSA-N 2 1 365.543 2.480 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)NCC2CCCCC2)CC1 ZINC000106126511 543204552 /nfs/dbraw/zinc/20/45/52/543204552.db2.gz OIKZUCHGFHPRKG-IRXDYDNUSA-N 2 1 353.551 2.096 10 0 FEAEMP CCC[NH+]1CCC(CNC(=O)N2CC[N@@H+](CCOCC)[C@H](CC)C2)CC1 ZINC000117041828 326049235 /nfs/dbraw/zinc/04/92/35/326049235.db2.gz ASUBSSSBGIFOEW-LJQANCHMSA-N 2 1 368.566 2.251 10 0 FEAEMP CCOCC[N@@H+]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000117278268 326054425 /nfs/dbraw/zinc/05/44/25/326054425.db2.gz TUKZBGCJFATQOM-TZIWHRDSSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000117278268 326054427 /nfs/dbraw/zinc/05/44/27/326054427.db2.gz TUKZBGCJFATQOM-TZIWHRDSSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000117278268 326054429 /nfs/dbraw/zinc/05/44/29/326054429.db2.gz TUKZBGCJFATQOM-TZIWHRDSSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000117278268 326054430 /nfs/dbraw/zinc/05/44/30/326054430.db2.gz TUKZBGCJFATQOM-TZIWHRDSSA-N 2 1 373.541 2.468 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(C[NH+]2CCC(CO)CC2)cc1 ZINC000164119158 327064920 /nfs/dbraw/zinc/06/49/20/327064920.db2.gz LMDQMWPNYMACFQ-LAUBAEHRSA-N 2 1 371.525 2.200 10 0 FEAEMP COc1ccc(NC(=O)CC[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc1 ZINC000170941665 327108563 /nfs/dbraw/zinc/10/85/63/327108563.db2.gz PYKGXVLSAVAMOR-INIZCTEOSA-N 2 1 363.502 2.048 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)NCc2ccc(OCCC[NH+](C)C)cc2)C1 ZINC000171351181 327134197 /nfs/dbraw/zinc/13/41/97/327134197.db2.gz ICRDFNAHWVMXGT-SFHVURJKSA-N 2 1 362.518 2.301 10 0 FEAEMP Cc1ccccc1C[NH+]1CCC(NC(=O)N2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000171900355 327168576 /nfs/dbraw/zinc/16/85/76/327168576.db2.gz HUMSWCWTPXXQET-FQEVSTJZSA-N 2 1 356.514 2.449 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)N1CCC[C@@H]1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000246392475 328613835 /nfs/dbraw/zinc/61/38/35/328613835.db2.gz ISJKLFHUAINQSH-INDMIFKZSA-N 2 1 368.566 2.246 10 0 FEAEMP FC(F)(F)COc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)ccn1 ZINC000261861075 328825194 /nfs/dbraw/zinc/82/51/94/328825194.db2.gz CDODYYLORLUFQA-RRFJBIMHSA-N 2 1 359.392 2.269 10 0 FEAEMP C([NH2+][C@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1)C1(N2CCSCC2)CCCC1 ZINC000262010230 328834974 /nfs/dbraw/zinc/83/49/74/328834974.db2.gz VLRZLSNNFOGTIZ-OKZBNKHCSA-N 2 1 353.576 2.095 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCC2CC[NH+](CCC(C)C)CC2)C[C@@H]1C ZINC000175774514 546347595 /nfs/dbraw/zinc/34/75/95/546347595.db2.gz PKTOZKIRONTXNB-SFHVURJKSA-N 2 1 368.566 2.107 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCC2CC[NH+](CCC(C)C)CC2)C[C@@H]1C ZINC000175774514 546347599 /nfs/dbraw/zinc/34/75/99/546347599.db2.gz PKTOZKIRONTXNB-SFHVURJKSA-N 2 1 368.566 2.107 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(CN(C)C(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000176867148 546498468 /nfs/dbraw/zinc/49/84/68/546498468.db2.gz OSNTYGIVRIVLAD-NQIIRXRSSA-N 2 1 373.541 2.202 10 0 FEAEMP CC(C)[N@@H+](C)CC(=O)N(C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000177455622 546623143 /nfs/dbraw/zinc/62/31/43/546623143.db2.gz WAKJQDMFMHYZRX-HXUWFJFHSA-N 2 1 361.530 2.231 10 0 FEAEMP CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000182641878 547526277 /nfs/dbraw/zinc/52/62/77/547526277.db2.gz VVVAJFINTVMOLG-PXNSSMCTSA-N 2 1 361.530 2.416 10 0 FEAEMP O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)N1CC[NH+]2CCCC[C@@H]2C1 ZINC000194432126 548481586 /nfs/dbraw/zinc/48/15/86/548481586.db2.gz ZLWKNSFKLZBAIM-WOJBJXKFSA-N 2 1 356.514 2.388 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000194432126 548481591 /nfs/dbraw/zinc/48/15/91/548481591.db2.gz ZLWKNSFKLZBAIM-WOJBJXKFSA-N 2 1 356.514 2.388 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](Cc2ccccc2)C1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000194432126 548481595 /nfs/dbraw/zinc/48/15/95/548481595.db2.gz ZLWKNSFKLZBAIM-WOJBJXKFSA-N 2 1 356.514 2.388 10 0 FEAEMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CC[NH+]4CCC[C@@H]4C3)cc2)C[C@H](C)O1 ZINC000195330589 548626072 /nfs/dbraw/zinc/62/60/72/548626072.db2.gz FZUGKFRPTQFQQJ-FUHIMQAGSA-N 2 1 357.498 2.216 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CC[NH+]4CCC[C@@H]4C3)cc2)C[C@H](C)O1 ZINC000195330589 548626074 /nfs/dbraw/zinc/62/60/74/548626074.db2.gz FZUGKFRPTQFQQJ-FUHIMQAGSA-N 2 1 357.498 2.216 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@@H+]4CCC[C@@H]4C3)cc2)C[C@H](C)O1 ZINC000195330589 548626081 /nfs/dbraw/zinc/62/60/81/548626081.db2.gz FZUGKFRPTQFQQJ-FUHIMQAGSA-N 2 1 357.498 2.216 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@H+]4CCC[C@@H]4C3)cc2)C[C@H](C)O1 ZINC000195330589 548626086 /nfs/dbraw/zinc/62/60/86/548626086.db2.gz FZUGKFRPTQFQQJ-FUHIMQAGSA-N 2 1 357.498 2.216 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)NCCO[C@H]1CCCC[C@H]1C ZINC000246979791 549256298 /nfs/dbraw/zinc/25/62/98/549256298.db2.gz JRBWZNKMAUWKSU-NEWSRXKRSA-N 2 1 362.518 2.367 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NCCO[C@H]1CCCC[C@H]1C ZINC000246979791 549256301 /nfs/dbraw/zinc/25/63/01/549256301.db2.gz JRBWZNKMAUWKSU-NEWSRXKRSA-N 2 1 362.518 2.367 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)NCCO[C@H]1CCCC[C@@H]1C ZINC000246979822 549256466 /nfs/dbraw/zinc/25/64/66/549256466.db2.gz JRBWZNKMAUWKSU-WDSOQIARSA-N 2 1 362.518 2.367 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NCCO[C@H]1CCCC[C@@H]1C ZINC000246979822 549256468 /nfs/dbraw/zinc/25/64/68/549256468.db2.gz JRBWZNKMAUWKSU-WDSOQIARSA-N 2 1 362.518 2.367 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)NCCO[C@@H]1CCCC[C@H]1C ZINC000246979806 549256938 /nfs/dbraw/zinc/25/69/38/549256938.db2.gz JRBWZNKMAUWKSU-NZSAHSFTSA-N 2 1 362.518 2.367 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NCCO[C@@H]1CCCC[C@H]1C ZINC000246979806 549256942 /nfs/dbraw/zinc/25/69/42/549256942.db2.gz JRBWZNKMAUWKSU-NZSAHSFTSA-N 2 1 362.518 2.367 10 0 FEAEMP COc1ccccc1COC[C@H](O)C[N@H+]1CCC[C@H]1Cn1ccnc1C ZINC000247032313 549269396 /nfs/dbraw/zinc/26/93/96/549269396.db2.gz MLNOIJAWHPJJRP-RBUKOAKNSA-N 2 1 359.470 2.242 10 0 FEAEMP C[C@@H]1C[C@@H](N(C)C(=O)NC[C@H]2CN(C)CCO2)CC[N@H+]1Cc1ccccc1 ZINC000247283284 549311006 /nfs/dbraw/zinc/31/10/06/549311006.db2.gz DGYZUIJRLLTWLE-HOJAQTOUSA-N 2 1 374.529 2.012 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@@H]2CC[NH+](C)[C@H]2c2ccccc2)CC[N@H+]1CCOC ZINC000247980031 549397675 /nfs/dbraw/zinc/39/76/75/549397675.db2.gz HHTUBKYNQPBJJJ-AQNXPRMDSA-N 2 1 374.529 2.184 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)CC[NH+]1CCOC ZINC000247980031 549397678 /nfs/dbraw/zinc/39/76/78/549397678.db2.gz HHTUBKYNQPBJJJ-AQNXPRMDSA-N 2 1 374.529 2.184 10 0 FEAEMP CC[C@@H]1CN(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)CC[NH+]1CCOC ZINC000247980031 549397681 /nfs/dbraw/zinc/39/76/81/549397681.db2.gz HHTUBKYNQPBJJJ-AQNXPRMDSA-N 2 1 374.529 2.184 10 0 FEAEMP CN(Cc1cccnc1)C[C@@H]1CC[N@@H+](C[C@@H](O)COCc2ccccc2)C1 ZINC000248661233 549479622 /nfs/dbraw/zinc/47/96/22/549479622.db2.gz WXPGGJOSKYVMQU-FCHUYYIVSA-N 2 1 369.509 2.413 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)cc1 ZINC000248764418 549497864 /nfs/dbraw/zinc/49/78/64/549497864.db2.gz NGAZUVHKGPAPSV-APWZRJJASA-N 2 1 374.529 2.312 10 0 FEAEMP O=C1CCCN1Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1 ZINC000261938512 549772264 /nfs/dbraw/zinc/77/22/64/549772264.db2.gz MPBMSLMPKKPKSZ-VAMGGRTRSA-N 2 1 357.498 2.056 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3COCCN3)c2)CCO1 ZINC000261965915 549775519 /nfs/dbraw/zinc/77/55/19/549775519.db2.gz PZMYJYBURGTGKM-BRKWEVRTSA-N 2 1 373.541 2.154 10 0 FEAEMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3COCCN3)c2)CCO1 ZINC000261965915 549775522 /nfs/dbraw/zinc/77/55/22/549775522.db2.gz PZMYJYBURGTGKM-BRKWEVRTSA-N 2 1 373.541 2.154 10 0 FEAEMP C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000261982491 549776956 /nfs/dbraw/zinc/77/69/56/549776956.db2.gz ROGOCDBXIWHROK-HOTGVXAUSA-N 2 1 351.516 2.219 10 0 FEAEMP C([NH2+][C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1)C1(N2CCSCC2)CCCCC1 ZINC000262011624 549779323 /nfs/dbraw/zinc/77/93/23/549779323.db2.gz VPYRWFZZDBVOHZ-IPMKNSEASA-N 2 1 367.603 2.485 10 0 FEAEMP O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653111062 677516325 /nfs/dbraw/zinc/51/63/25/677516325.db2.gz CHLVJYOGGBAAFI-ARFHVFGLSA-N 2 1 355.404 2.165 10 0 FEAEMP CCO[C@H]1C[C@H]([N@H+](C)Cc2cnc(N3CC[NH+](C)CC3)nc2)C12CCCC2 ZINC000093611073 542934822 /nfs/dbraw/zinc/93/48/22/542934822.db2.gz JHISWRISRCVXNL-OALUTQOASA-N 2 1 373.545 2.398 10 0 FEAEMP CCO[C@H]1C[C@H]([N@@H+](C)Cc2cnc(N3CC[NH+](C)CC3)nc2)C12CCCC2 ZINC000093611073 542934824 /nfs/dbraw/zinc/93/48/24/542934824.db2.gz JHISWRISRCVXNL-OALUTQOASA-N 2 1 373.545 2.398 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)Nc2cccc(Cl)c2)CC1 ZINC000106126278 543204439 /nfs/dbraw/zinc/20/44/39/543204439.db2.gz HPBOUGJIOMIDCV-CQSZACIVSA-N 2 1 353.894 2.303 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)Nc2ccc(F)cc2Cl)CC1 ZINC000106126289 543204907 /nfs/dbraw/zinc/20/49/07/543204907.db2.gz VWLBERABCBDAST-ZDUSSCGKSA-N 2 1 371.884 2.442 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000113607046 543492728 /nfs/dbraw/zinc/49/27/28/543492728.db2.gz DALKTWVRUWDLNO-SJLPKXTDSA-N 2 1 360.502 2.005 10 0 FEAEMP CC[N@@H+](CC(=O)NC[C@@H](c1ccc(C)s1)N1CCOCC1)C1CC1 ZINC000153324630 544761720 /nfs/dbraw/zinc/76/17/20/544761720.db2.gz RWUNOUUTFSNTLU-INIZCTEOSA-N 2 1 351.516 2.030 10 0 FEAEMP CSC[C@@H](O)C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000187879794 328052125 /nfs/dbraw/zinc/05/21/25/328052125.db2.gz OIXIUUJLDFBNIT-RBUKOAKNSA-N 2 1 352.544 2.088 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1)C[NH+]1CCCC1 ZINC000190697397 328225261 /nfs/dbraw/zinc/22/52/61/328225261.db2.gz BDMXDHGISWEFKP-AZUAARDMSA-N 2 1 373.545 2.277 10 0 FEAEMP CC[C@H](C)[N@@H+](C)CCNC(=O)N1CC[C@H](C[NH+](C)Cc2cccnc2)C1 ZINC000190705918 328226376 /nfs/dbraw/zinc/22/63/76/328226376.db2.gz VKLIAPVYPFOYCT-PKOBYXMFSA-N 2 1 361.534 2.275 10 0 FEAEMP CC[C@H](C)[NH+](C)CCNC(=O)N1CC[C@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000190705918 328226378 /nfs/dbraw/zinc/22/63/78/328226378.db2.gz VKLIAPVYPFOYCT-PKOBYXMFSA-N 2 1 361.534 2.275 10 0 FEAEMP CC[C@H]1CN(C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1CCOC ZINC000117309440 326056986 /nfs/dbraw/zinc/05/69/86/326056986.db2.gz RHKGDVIPCQSFIM-FQEVSTJZSA-N 2 1 359.514 2.465 10 0 FEAEMP CC[C@H]1CN(C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@H+]1CCOC ZINC000117309440 326056988 /nfs/dbraw/zinc/05/69/88/326056988.db2.gz RHKGDVIPCQSFIM-FQEVSTJZSA-N 2 1 359.514 2.465 10 0 FEAEMP COCCOc1ccccc1C[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000121138279 326316341 /nfs/dbraw/zinc/31/63/41/326316341.db2.gz RAAAUFBXZUVZRG-KRWDZBQOSA-N 2 1 350.503 2.236 10 0 FEAEMP C[N@@H+](Cc1c[nH]nc1-c1cccnc1)C1CCN(CCn2cccn2)CC1 ZINC000121230538 326323076 /nfs/dbraw/zinc/32/30/76/326323076.db2.gz UNNBUGITLOBHTH-UHFFFAOYSA-N 2 1 365.485 2.265 10 0 FEAEMP CC1CCN(CC(=O)NC[C@@H](c2cccs2)N2CCO[C@H](C)C2)CC1 ZINC000121993054 326379766 /nfs/dbraw/zinc/37/97/66/326379766.db2.gz VTZOGQPKDYDORI-SJORKVTESA-N 2 1 365.543 2.358 10 0 FEAEMP CCC[C@@H](C(=O)NCC1CC[NH+](Cc2nc(C)c(C)o2)CC1)[NH+](C)C ZINC000162106576 327017003 /nfs/dbraw/zinc/01/70/03/327017003.db2.gz GJDPTBYNWIVABS-KRWDZBQOSA-N 2 1 350.507 2.350 10 0 FEAEMP C[NH+](C)[C@H]1CCN(C(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)C1 ZINC000170832404 327101334 /nfs/dbraw/zinc/10/13/34/327101334.db2.gz XQXSXBWGFYFCMC-INIZCTEOSA-N 2 1 366.456 2.275 10 0 FEAEMP CCOCCOCc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000261962921 328832285 /nfs/dbraw/zinc/83/22/85/328832285.db2.gz PTSLBICPGSYWEB-HBMCJLEFSA-N 2 1 362.514 2.486 10 0 FEAEMP O[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1)c1ccc(OC(F)(F)F)cc1 ZINC000262023895 328836150 /nfs/dbraw/zinc/83/61/50/328836150.db2.gz WUBRJJBIBJJNEJ-QBPKDAKJSA-N 2 1 374.403 2.365 10 0 FEAEMP CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000177034108 546527439 /nfs/dbraw/zinc/52/74/39/546527439.db2.gz BYTRHDTZSLWGBX-WOJBJXKFSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000177034108 546527443 /nfs/dbraw/zinc/52/74/43/546527443.db2.gz BYTRHDTZSLWGBX-WOJBJXKFSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[NH+]1CCC[C@@H]1CN(C)C(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000177034108 546527447 /nfs/dbraw/zinc/52/74/47/546527447.db2.gz BYTRHDTZSLWGBX-WOJBJXKFSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[NH+]1CCC[C@@H]1CN(C)C(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000177034108 546527453 /nfs/dbraw/zinc/52/74/53/546527453.db2.gz BYTRHDTZSLWGBX-WOJBJXKFSA-N 2 1 359.514 2.220 10 0 FEAEMP Cc1ccc([C@@H](CNC(=O)NCC[N@H+](C)C(C)C)N2CCOCC2)s1 ZINC000178635846 546824057 /nfs/dbraw/zinc/82/40/57/546824057.db2.gz ITZXLHFQKPRUGG-MRXNPFEDSA-N 2 1 368.547 2.069 10 0 FEAEMP COc1ccc(NC(=O)NC(=O)C[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)cc1 ZINC000178753114 546844027 /nfs/dbraw/zinc/84/40/27/546844027.db2.gz OUUIILWJEGAIMP-MRXNPFEDSA-N 2 1 371.441 2.013 10 0 FEAEMP COc1ccc(NC(=O)NC(=O)C[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)cc1 ZINC000178753114 546844031 /nfs/dbraw/zinc/84/40/31/546844031.db2.gz OUUIILWJEGAIMP-MRXNPFEDSA-N 2 1 371.441 2.013 10 0 FEAEMP Cc1ccc(C[N@@H+]2CCCN(C(=O)C[NH2+][C@H](C)[C@@H]3CCCO3)CC2)cc1 ZINC000183146879 547610732 /nfs/dbraw/zinc/61/07/32/547610732.db2.gz MFWGPXXBBUWAQP-QUCCMNQESA-N 2 1 359.514 2.186 10 0 FEAEMP CC[N@@H+]1CCC[C@@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000194354527 548469409 /nfs/dbraw/zinc/46/94/09/548469409.db2.gz UJDSJWRHCSMZRP-LJQANCHMSA-N 2 1 360.502 2.167 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000194354527 548469416 /nfs/dbraw/zinc/46/94/16/548469416.db2.gz UJDSJWRHCSMZRP-LJQANCHMSA-N 2 1 360.502 2.167 10 0 FEAEMP CC(C)N1CC[C@H]([N@@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)C1=O ZINC000245468331 548929681 /nfs/dbraw/zinc/92/96/81/548929681.db2.gz KPGUYGSNACKWOT-LEWJYISDSA-N 2 1 373.541 2.373 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@H](C)C(=O)NC(=O)NCc1ccccc1 ZINC000245933454 549024291 /nfs/dbraw/zinc/02/42/91/549024291.db2.gz KBCNFCYBJWAECQ-CRAIPNDOSA-N 2 1 369.469 2.070 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@H](C)C(=O)NC(=O)NCc1ccccc1 ZINC000245933454 549024294 /nfs/dbraw/zinc/02/42/94/549024294.db2.gz KBCNFCYBJWAECQ-CRAIPNDOSA-N 2 1 369.469 2.070 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000246593686 549169932 /nfs/dbraw/zinc/16/99/32/549169932.db2.gz PNOFIXBURUNFFI-HKBOAZHASA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)C[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000246593686 549169935 /nfs/dbraw/zinc/16/99/35/549169935.db2.gz PNOFIXBURUNFFI-HKBOAZHASA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000246593686 549169936 /nfs/dbraw/zinc/16/99/36/549169936.db2.gz PNOFIXBURUNFFI-HKBOAZHASA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000246593686 549169939 /nfs/dbraw/zinc/16/99/39/549169939.db2.gz PNOFIXBURUNFFI-HKBOAZHASA-N 2 1 371.525 2.363 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000246899555 549238624 /nfs/dbraw/zinc/23/86/24/549238624.db2.gz FOVPUJAZOROWIZ-RHSMWYFYSA-N 2 1 370.453 2.454 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000246899555 549238626 /nfs/dbraw/zinc/23/86/26/549238626.db2.gz FOVPUJAZOROWIZ-RHSMWYFYSA-N 2 1 370.453 2.454 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)N[C@H]1CCOc2ccccc21 ZINC000246923857 549243748 /nfs/dbraw/zinc/24/37/48/549243748.db2.gz GROIALURYIZNKQ-WMZOPIPTSA-N 2 1 354.454 2.296 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)N[C@H]1CCOc2ccccc21 ZINC000246923857 549243750 /nfs/dbraw/zinc/24/37/50/549243750.db2.gz GROIALURYIZNKQ-WMZOPIPTSA-N 2 1 354.454 2.296 10 0 FEAEMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@H]1C ZINC000246995556 549259863 /nfs/dbraw/zinc/25/98/63/549259863.db2.gz FIPAMPYCVLNQDC-MJGOQNOKSA-N 2 1 371.529 2.447 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000247037430 549270429 /nfs/dbraw/zinc/27/04/29/549270429.db2.gz GMPLKBNRFVIVDD-NQIIRXRSSA-N 2 1 370.541 2.067 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(OCCC[NH+](C)C)cc1 ZINC000247255191 549307366 /nfs/dbraw/zinc/30/73/66/549307366.db2.gz NSCWBESUHGRISF-MJGOQNOKSA-N 2 1 374.529 2.395 10 0 FEAEMP C[NH+](C)C[C@H]1CC[N@H+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000247313597 549316560 /nfs/dbraw/zinc/31/65/60/549316560.db2.gz OEVDJURXVAXJII-UKRRQHHQSA-N 2 1 357.292 2.072 10 0 FEAEMP C[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc(Br)c2)C1 ZINC000247313597 549316561 /nfs/dbraw/zinc/31/65/61/549316561.db2.gz OEVDJURXVAXJII-UKRRQHHQSA-N 2 1 357.292 2.072 10 0 FEAEMP Cc1ccc(C)c(OC[C@@H](O)C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c1 ZINC000247817287 549384180 /nfs/dbraw/zinc/38/41/80/549384180.db2.gz WLROISGPCIXBOZ-ICSRJNTNSA-N 2 1 364.530 2.068 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[NH+]2CCCC[C@@H]2C)CC[N@H+]1C[C@H](C)O ZINC000248453973 549441670 /nfs/dbraw/zinc/44/16/70/549441670.db2.gz LRGSICZVGZGPGB-GBESFXJTSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)CC[NH+]1C[C@H](C)O ZINC000248453973 549441676 /nfs/dbraw/zinc/44/16/76/549441676.db2.gz LRGSICZVGZGPGB-GBESFXJTSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)CC[NH+]1C[C@H](C)O ZINC000248453973 549441680 /nfs/dbraw/zinc/44/16/80/549441680.db2.gz LRGSICZVGZGPGB-GBESFXJTSA-N 2 1 368.566 2.128 10 0 FEAEMP CCc1csc([C@@H]2CCCN([C@H](C)C(=O)N3CCN(CC)CC3)C2)n1 ZINC000249880284 549633957 /nfs/dbraw/zinc/63/39/57/549633957.db2.gz NHSXKSWBFHJDEQ-HZPDHXFCSA-N 2 1 364.559 2.438 10 0 FEAEMP COc1ccc([C@@H](CNC(=O)N2CC[N@H+]3CCC[C@H]3C2)[NH+]2CCCC2)cc1 ZINC000252442350 549665737 /nfs/dbraw/zinc/66/57/37/549665737.db2.gz VAPFZODQEBEKDY-AZUAARDMSA-N 2 1 372.513 2.322 10 0 FEAEMP CCOc1c(OC)cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)cc1OC ZINC000261853686 549762561 /nfs/dbraw/zinc/76/25/61/549762561.db2.gz BKJNNQWWXGRYIU-GVDBMIGSSA-N 2 1 364.486 2.349 10 0 FEAEMP COc1ccccc1CNC(=O)[C@H](C)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261892056 549766874 /nfs/dbraw/zinc/76/68/74/549766874.db2.gz ZUYZEAPYFGNRMB-DBVUQKKJSA-N 2 1 367.493 2.374 10 0 FEAEMP COc1ccccc1CNC(=O)[C@H](C)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261892056 549766876 /nfs/dbraw/zinc/76/68/76/549766876.db2.gz ZUYZEAPYFGNRMB-DBVUQKKJSA-N 2 1 367.493 2.374 10 0 FEAEMP C[C@H]1OCC[NH2+][C@@H]1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000262123676 549791116 /nfs/dbraw/zinc/79/11/16/549791116.db2.gz GAZZYFMHFFOILY-UZLBHIALSA-N 2 1 359.514 2.444 10 0 FEAEMP C[C@H]1OCC[NH2+][C@@H]1C(=O)NCc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000262123676 549791121 /nfs/dbraw/zinc/79/11/21/549791121.db2.gz GAZZYFMHFFOILY-UZLBHIALSA-N 2 1 359.514 2.444 10 0 FEAEMP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC(=O)[C@H]2[NH2+]CCO[C@@H]2C)C1 ZINC000262266149 549804009 /nfs/dbraw/zinc/80/40/09/549804009.db2.gz MOTQTKHFVOZKHY-YZLZLFLDSA-N 2 1 359.514 2.158 10 0 FEAEMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)[C@H]2[NH2+]CCO[C@@H]2C)C1 ZINC000262266149 549804012 /nfs/dbraw/zinc/80/40/12/549804012.db2.gz MOTQTKHFVOZKHY-YZLZLFLDSA-N 2 1 359.514 2.158 10 0 FEAEMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653151923 677517661 /nfs/dbraw/zinc/51/76/61/677517661.db2.gz XXBOCLJLNJIKSK-XZDPQHSOSA-N 2 1 355.404 2.021 10 0 FEAEMP Cc1ccc2[nH]c(C[NH+]3CCC4(CC3)C[N@H+](C)CCN4C)cc(=O)c2c1 ZINC000092020696 209011187 /nfs/dbraw/zinc/01/11/87/209011187.db2.gz CAKPGMUWPQEAPE-UHFFFAOYSA-N 2 1 354.498 2.461 10 0 FEAEMP Cc1[nH+]ccn1-c1cncc(N2CC[C@@H](OCC[NH+]3CCCCC3)C2)n1 ZINC000092923546 542896314 /nfs/dbraw/zinc/89/63/14/542896314.db2.gz FVOMJDGNBADYAZ-QGZVFWFLSA-N 2 1 356.474 2.052 10 0 FEAEMP CCO[C@@H]1C[C@H]([N@H+](C)Cc2cnc(N3CC[NH+](C)CC3)nc2)C12CCCC2 ZINC000093611072 542935218 /nfs/dbraw/zinc/93/52/18/542935218.db2.gz JHISWRISRCVXNL-RBUKOAKNSA-N 2 1 373.545 2.398 10 0 FEAEMP CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cnc(N3CC[NH+](C)CC3)nc2)C12CCCC2 ZINC000093611072 542935220 /nfs/dbraw/zinc/93/52/20/542935220.db2.gz JHISWRISRCVXNL-RBUKOAKNSA-N 2 1 373.545 2.398 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N2c3ccccc3CC[C@H]2C)CC1 ZINC000106125351 543204499 /nfs/dbraw/zinc/20/44/99/543204499.db2.gz XSLFWHSLVXQHPU-QZTJIDSGSA-N 2 1 373.541 2.379 10 0 FEAEMP CCCNC(=O)[C@H](C)[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106127863 543204868 /nfs/dbraw/zinc/20/48/68/543204868.db2.gz KYMJPRJSFHINQG-PXNSSMCTSA-N 2 1 361.530 2.279 10 0 FEAEMP CCC[C@@H](C(=O)N[C@H]1CC[N@H+](Cc2cc(OC)cc(OC)c2)C1)[NH+](C)C ZINC000153561838 544791374 /nfs/dbraw/zinc/79/13/74/544791374.db2.gz ZBAFSCKPMNLMEU-LPHOPBHVSA-N 2 1 363.502 2.125 10 0 FEAEMP CCC[C@@H](C(=O)N[C@H]1CC[N@@H+](Cc2cc(OC)cc(OC)c2)C1)[NH+](C)C ZINC000153561838 544791379 /nfs/dbraw/zinc/79/13/79/544791379.db2.gz ZBAFSCKPMNLMEU-LPHOPBHVSA-N 2 1 363.502 2.125 10 0 FEAEMP Cc1nc(C)n(C[C@@H]2CCC[N@H+](CCCN3CC[NH+](C(C)C)CC3)C2)n1 ZINC000191486047 328268123 /nfs/dbraw/zinc/26/81/23/328268123.db2.gz ATITZFCATDYUTG-HXUWFJFHSA-N 2 1 362.566 2.023 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC[NH+](C(C)(C)C)CC2)C[C@@H]1CC ZINC000117036518 326048104 /nfs/dbraw/zinc/04/81/04/326048104.db2.gz LMQMYTDRJZJALK-SFHVURJKSA-N 2 1 368.566 2.392 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CCC(C[NH+](C)C)CC2)C[C@H]1CC ZINC000119024651 326119345 /nfs/dbraw/zinc/11/93/45/326119345.db2.gz ISEOFJWENCSBHW-CTWPCTMYSA-N 2 1 368.566 2.249 10 0 FEAEMP [NH3+][C@H]1CC[C@H](C(=O)Nc2ccc3c(ccn3CC[NH+]3CCOCC3)c2)C1 ZINC000166161930 327081004 /nfs/dbraw/zinc/08/10/04/327081004.db2.gz DYUCAKRGPSRIAI-IRXDYDNUSA-N 2 1 356.470 2.039 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[N@@H+]3CCC[C@H]3C2)cc1F ZINC000171904624 327169045 /nfs/dbraw/zinc/16/90/45/327169045.db2.gz NRHIIKZMWVXIFI-INIZCTEOSA-N 2 1 357.433 2.309 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N2CC[N@H+]3CCC[C@H]3C2)cc1F ZINC000171904624 327169046 /nfs/dbraw/zinc/16/90/46/327169046.db2.gz NRHIIKZMWVXIFI-INIZCTEOSA-N 2 1 357.433 2.309 10 0 FEAEMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)[C@@H]([NH2+]C2CCOCC2)C(C)C)C1 ZINC000173157225 327238182 /nfs/dbraw/zinc/23/81/82/327238182.db2.gz NORNBPNONVDNAL-HKUYNNGSSA-N 2 1 362.518 2.402 10 0 FEAEMP CCOc1c(OC)cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)cc1OC ZINC000261853683 328824644 /nfs/dbraw/zinc/82/46/44/328824644.db2.gz BKJNNQWWXGRYIU-BRWVUGGUSA-N 2 1 364.486 2.349 10 0 FEAEMP FC(F)(F)COc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)ccn1 ZINC000261861073 328825129 /nfs/dbraw/zinc/82/51/29/328825129.db2.gz CDODYYLORLUFQA-RBSFLKMASA-N 2 1 359.392 2.269 10 0 FEAEMP COc1cccc(N2CCC[C@H]([NH2+][C@@H]3CCC[C@H]3[C@@H]3COCC[NH2+]3)C2)c1 ZINC000261925993 328829731 /nfs/dbraw/zinc/82/97/31/328829731.db2.gz LCOKRFINVVJPLF-ZXNZYJFHSA-N 2 1 359.514 2.411 10 0 FEAEMP O[C@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000263187998 328923446 /nfs/dbraw/zinc/92/34/46/328923446.db2.gz HOYYOTMLMNWJIE-ONGXEEELSA-N 2 1 369.181 2.018 10 0 FEAEMP C[C@H]1CN(C(=O)NCCC[N@H+](C)C2CCCCC2)C[C@H]1[NH+]1CCOCC1 ZINC000175668665 546330413 /nfs/dbraw/zinc/33/04/13/546330413.db2.gz ILAOPDLFSBYDKX-PKOBYXMFSA-N 2 1 366.550 2.003 10 0 FEAEMP C[C@H]1CN(C(=O)NCCC[N@@H+](C)C2CCCCC2)C[C@H]1[NH+]1CCOCC1 ZINC000175668665 546330415 /nfs/dbraw/zinc/33/04/15/546330415.db2.gz ILAOPDLFSBYDKX-PKOBYXMFSA-N 2 1 366.550 2.003 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CC(=O)NCCOc1cccc(C)c1 ZINC000178321141 546774830 /nfs/dbraw/zinc/77/48/30/546774830.db2.gz PELAKYYVPJLMLZ-GOSISDBHSA-N 2 1 356.470 2.160 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CC(=O)NCCOc1cccc(C)c1 ZINC000178321141 546774836 /nfs/dbraw/zinc/77/48/36/546774836.db2.gz PELAKYYVPJLMLZ-GOSISDBHSA-N 2 1 356.470 2.160 10 0 FEAEMP COC(=O)c1ccc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c(F)c1 ZINC000179525672 546971313 /nfs/dbraw/zinc/97/13/13/546971313.db2.gz FYOCCXIFZQSXRW-CQSZACIVSA-N 2 1 352.450 2.137 10 0 FEAEMP CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000182641898 547526570 /nfs/dbraw/zinc/52/65/70/547526570.db2.gz VVVAJFINTVMOLG-FXAWDEMLSA-N 2 1 361.530 2.416 10 0 FEAEMP COCc1noc([C@H](C)[NH2+]CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)n1 ZINC000183072286 547595576 /nfs/dbraw/zinc/59/55/76/547595576.db2.gz OHIXJRUMPCSWPI-MAUKXSAKSA-N 2 1 374.485 2.312 10 0 FEAEMP Cn1nccc1C1CC[NH+](CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)CC1 ZINC000184960258 547907624 /nfs/dbraw/zinc/90/76/24/547907624.db2.gz CLQPEDZRMOYFNO-HXUWFJFHSA-N 2 1 369.513 2.019 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)NCC2([NH+]3CCSCC3)CCCC2)C1 ZINC000194153218 548441835 /nfs/dbraw/zinc/44/18/35/548441835.db2.gz YPTPFPCMISQWGI-INIZCTEOSA-N 2 1 354.564 2.132 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C1 ZINC000246797801 549215448 /nfs/dbraw/zinc/21/54/48/549215448.db2.gz AWAVEDPJYUPQLL-BFYDXBDKSA-N 2 1 350.532 2.477 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC[NH+]1C[C@H](C)O ZINC000246919648 549242174 /nfs/dbraw/zinc/24/21/74/549242174.db2.gz QNWKMQZWVQKJRB-CEWLAPEOSA-N 2 1 373.541 2.202 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)NC(=O)N[C@H]1CCCC[C@@H]1C ZINC000246952854 549250848 /nfs/dbraw/zinc/25/08/48/549250848.db2.gz ICTZUUJTFZZHIO-XIRDDKMYSA-N 2 1 361.490 2.060 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NC(=O)N[C@H]1CCCC[C@@H]1C ZINC000246952854 549250849 /nfs/dbraw/zinc/25/08/49/549250849.db2.gz ICTZUUJTFZZHIO-XIRDDKMYSA-N 2 1 361.490 2.060 10 0 FEAEMP C[C@H](C(=O)N1c2ccccc2C[C@@H]1C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247772529 549379141 /nfs/dbraw/zinc/37/91/41/549379141.db2.gz PPJWLHPQQYDRCD-OKZBNKHCSA-N 2 1 373.541 2.377 10 0 FEAEMP CCS[C@H](C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000248132529 549409041 /nfs/dbraw/zinc/40/90/41/549409041.db2.gz OPKPFQNBIVUQBZ-UONOGXRCSA-N 2 1 356.536 2.408 10 0 FEAEMP CCS[C@H](C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000248132529 549409044 /nfs/dbraw/zinc/40/90/44/549409044.db2.gz OPKPFQNBIVUQBZ-UONOGXRCSA-N 2 1 356.536 2.408 10 0 FEAEMP CSC[C@H](O)C[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000249279496 549575615 /nfs/dbraw/zinc/57/56/15/549575615.db2.gz OIXIUUJLDFBNIT-MOPGFXCFSA-N 2 1 352.544 2.088 10 0 FEAEMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@H]3[C@@H]3COCCN3)C2)cc1 ZINC000261992572 549777616 /nfs/dbraw/zinc/77/76/16/549777616.db2.gz SXIFOMMUWZALCP-YSFYHYPLSA-N 2 1 357.542 2.298 10 0 FEAEMP O[C@H]1C[NH2+]C[C@H]1C[NH2+]Cc1ccc(Br)cc1C(F)(F)F ZINC000263243719 549888472 /nfs/dbraw/zinc/88/84/72/549888472.db2.gz OYSVZIQDKRZKDQ-SKDRFNHKSA-N 2 1 353.182 2.138 10 0 FEAEMP C[NH+](C)C1(C[NH2+]C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CCOCC1 ZINC000130152807 672071623 /nfs/dbraw/zinc/07/16/23/672071623.db2.gz KVTVUUVUVOGOEH-INIZCTEOSA-N 2 1 355.523 2.334 10 0 FEAEMP C[C@@H]([NH2+]C1CC[NH+](CCO)CC1)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000716584479 673075470 /nfs/dbraw/zinc/07/54/70/673075470.db2.gz UIMALCSBQKEFRR-OAHLLOKOSA-N 2 1 355.523 2.068 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)N(CC[NH+](C)C)Cc2cccc(F)c2)C1 ZINC000068587634 541612661 /nfs/dbraw/zinc/61/26/61/541612661.db2.gz RPQFIKDCIXKZFU-GOSISDBHSA-N 2 1 350.482 2.383 10 0 FEAEMP CNC(=O)c1nn(C)c2c1C[C@H]([NH2+]CC1([NH+]3CCCCC3)CCCC1)CC2 ZINC000032500572 208029551 /nfs/dbraw/zinc/02/95/51/208029551.db2.gz AYYMHITZTORXHW-MRXNPFEDSA-N 2 1 373.545 2.025 10 0 FEAEMP O=S(=O)(c1cn(C[C@H]2CCCC[NH2+]2)c2cc[nH+]cc12)c1ccccn1 ZINC000038930566 208176882 /nfs/dbraw/zinc/17/68/82/208176882.db2.gz MTRGGSFXZLGIEL-CQSZACIVSA-N 2 1 356.451 2.406 10 0 FEAEMP C[NH+](C)CCOc1cccc(CNC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)c1 ZINC000105114123 543159091 /nfs/dbraw/zinc/15/90/91/543159091.db2.gz ISLLRWIPZRHEDC-GOSISDBHSA-N 2 1 360.502 2.007 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cc(=O)oc3cc(O)ccc23)CC1 ZINC000106126244 543204659 /nfs/dbraw/zinc/20/46/59/543204659.db2.gz GZNPRMRBPZVQQG-AWEZNQCLSA-N 2 1 360.454 2.023 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CCC(=O)NCC2CCCCC2)CC1 ZINC000109005516 543310467 /nfs/dbraw/zinc/31/04/67/543310467.db2.gz FCYOYZRNIISFHQ-QGZVFWFLSA-N 2 1 353.551 2.098 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@@H](c2ccccc2)[NH+](C)C)CC[N@H+]1CCOC ZINC000117469315 543632203 /nfs/dbraw/zinc/63/22/03/543632203.db2.gz LBIUSZVWPJTPPL-MOPGFXCFSA-N 2 1 362.518 2.042 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N(CC[NH+](C)C)Cc1ccccn1 ZINC000152382957 544646276 /nfs/dbraw/zinc/64/62/76/544646276.db2.gz MMQJQRWTKBKLLQ-LJQANCHMSA-N 2 1 361.534 2.275 10 0 FEAEMP COc1cccc(OCC[N@@H+](C)C2CCN(CCn3cccn3)CC2)c1 ZINC000152666637 544681419 /nfs/dbraw/zinc/68/14/19/544681419.db2.gz OHVAEFGXOGQRIW-UHFFFAOYSA-N 2 1 358.486 2.367 10 0 FEAEMP CCC[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2cc(OC)cc(OC)c2)C1)[NH+](C)C ZINC000153561726 544791122 /nfs/dbraw/zinc/79/11/22/544791122.db2.gz ZBAFSCKPMNLMEU-VQIMIIECSA-N 2 1 363.502 2.125 10 0 FEAEMP CCC[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2cc(OC)cc(OC)c2)C1)[NH+](C)C ZINC000153561726 544791127 /nfs/dbraw/zinc/79/11/27/544791127.db2.gz ZBAFSCKPMNLMEU-VQIMIIECSA-N 2 1 363.502 2.125 10 0 FEAEMP CC[N@@H+](CCNC(=O)N1CC[C@@H](C[NH+](C)Cc2cccnc2)C1)C1CC1 ZINC000190705221 328226058 /nfs/dbraw/zinc/22/60/58/328226058.db2.gz NPZPEGVCNKWMDS-SFHVURJKSA-N 2 1 359.518 2.029 10 0 FEAEMP CCC[C@H](C(=O)N1CCC[C@@H]([N@H+](C)CC(=O)OC(C)(C)C)CC1)[NH+](C)C ZINC000191588504 328272911 /nfs/dbraw/zinc/27/29/11/328272911.db2.gz GIBMIBKFWIYZOK-IAGOWNOFSA-N 2 1 369.550 2.371 10 0 FEAEMP CCC[C@H](C(=O)N1CCC[C@@H]([N@@H+](C)CC(=O)OC(C)(C)C)CC1)[NH+](C)C ZINC000191588504 328272912 /nfs/dbraw/zinc/27/29/12/328272912.db2.gz GIBMIBKFWIYZOK-IAGOWNOFSA-N 2 1 369.550 2.371 10 0 FEAEMP CCC[C@@H](C(=O)NCc1ccc(C[NH+]2CCN(CC)CC2)cc1)[NH+](C)C ZINC000161590477 327003592 /nfs/dbraw/zinc/00/35/92/327003592.db2.gz YPBHJBFLVBVDHA-FQEVSTJZSA-N 2 1 360.546 2.171 10 0 FEAEMP [NH3+][C@H]1CC[C@@H](C(=O)Nc2ccc3c(ccn3CC[NH+]3CCOCC3)c2)C1 ZINC000166161818 327080951 /nfs/dbraw/zinc/08/09/51/327080951.db2.gz DYUCAKRGPSRIAI-SJORKVTESA-N 2 1 356.470 2.039 10 0 FEAEMP C[NH+](C)[C@H]1CCN(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000170835483 327101324 /nfs/dbraw/zinc/10/13/24/327101324.db2.gz JWALMVLFCJXSJJ-CVEARBPZSA-N 2 1 350.532 2.306 10 0 FEAEMP COC(=O)c1cc(F)ccc1C[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000170941663 327108649 /nfs/dbraw/zinc/10/86/49/327108649.db2.gz ZGPMWQGIUJRNIC-AWEZNQCLSA-N 2 1 352.450 2.137 10 0 FEAEMP O=C(CCC[NH+]1CCN(c2ccccc2)CC1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000171857367 327165917 /nfs/dbraw/zinc/16/59/17/327165917.db2.gz CHSXJTMPNDBYGR-OAQYLSRUSA-N 2 1 370.541 2.286 10 0 FEAEMP CN(C)[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)c1c(F)cccc1F ZINC000172159567 327184710 /nfs/dbraw/zinc/18/47/10/327184710.db2.gz VTVYCDVCGPPYEP-CJNGLKHVSA-N 2 1 352.429 2.057 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@@H](C)C1 ZINC000173627618 327272136 /nfs/dbraw/zinc/27/21/36/327272136.db2.gz IDMWMJWTGRXABJ-XMTFNYHQSA-N 2 1 366.550 2.142 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@@H](C)C1 ZINC000173627618 327272138 /nfs/dbraw/zinc/27/21/38/327272138.db2.gz IDMWMJWTGRXABJ-XMTFNYHQSA-N 2 1 366.550 2.142 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000173627618 327272140 /nfs/dbraw/zinc/27/21/40/327272140.db2.gz IDMWMJWTGRXABJ-XMTFNYHQSA-N 2 1 366.550 2.142 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000173627618 327272142 /nfs/dbraw/zinc/27/21/42/327272142.db2.gz IDMWMJWTGRXABJ-XMTFNYHQSA-N 2 1 366.550 2.142 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3CC[N@H+]4CCCC[C@@H]4C3)cc2)CC1 ZINC000173748813 327281129 /nfs/dbraw/zinc/28/11/29/327281129.db2.gz WMHQCBJMDPYULK-HXUWFJFHSA-N 2 1 356.514 2.139 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000174438946 327327082 /nfs/dbraw/zinc/32/70/82/327327082.db2.gz DIKPMJMGJDIJSD-RTBURBONSA-N 2 1 374.529 2.395 10 0 FEAEMP CC[N@H+]1CCCC[C@@H]1C(=O)NCC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000174855445 327355423 /nfs/dbraw/zinc/35/54/23/327355423.db2.gz XOEQKVRDTDRSLG-RTWAWAEBSA-N 2 1 373.541 2.423 10 0 FEAEMP CC(C)c1nn(C)c(N2CCOCC2)c1C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000175012829 327367954 /nfs/dbraw/zinc/36/79/54/327367954.db2.gz GFXFTDWXCNNFMA-SJORKVTESA-N 2 1 363.550 2.343 10 0 FEAEMP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1)c1ccc2c(c1)OCCO2 ZINC000261951232 328831477 /nfs/dbraw/zinc/83/14/77/328831477.db2.gz OJNGTAKRXLKSCR-KURKYZTESA-N 2 1 360.498 2.482 10 0 FEAEMP CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)c1 ZINC000261997093 328834177 /nfs/dbraw/zinc/83/41/77/328834177.db2.gz UEAJISYREFFNIK-YGWPLHOASA-N 2 1 359.514 2.462 10 0 FEAEMP c1ccc(-c2ccc(NCC[NH2+][C@@H]3CCC[C@@H]3[C@H]3COCC[NH2+]3)nn2)cc1 ZINC000262011564 328834964 /nfs/dbraw/zinc/83/49/64/328834964.db2.gz VOTFUXBZNDTAFQ-DFQSSKMNSA-N 2 1 367.497 2.302 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CCc2nc(-c3ccccc3)no2)CC1 ZINC000157961357 545804582 /nfs/dbraw/zinc/80/45/82/545804582.db2.gz STJGYLDEHJCDFJ-MRXNPFEDSA-N 2 1 358.486 2.304 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC[NH+](CC3CC3)CC2)C[C@@H]1CC ZINC000172125080 546236524 /nfs/dbraw/zinc/23/65/24/546236524.db2.gz KJUDJSRZTSOKRT-IBGZPJMESA-N 2 1 366.550 2.003 10 0 FEAEMP COc1ccc(CN(C)C(=O)C[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)cc1 ZINC000178334234 546777292 /nfs/dbraw/zinc/77/72/92/546777292.db2.gz BFALCHQAVYXDQF-SFHVURJKSA-N 2 1 356.470 2.323 10 0 FEAEMP COc1ccc(CN(C)C(=O)C[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)cc1 ZINC000178334234 546777297 /nfs/dbraw/zinc/77/72/97/546777297.db2.gz BFALCHQAVYXDQF-SFHVURJKSA-N 2 1 356.470 2.323 10 0 FEAEMP Cn1cc([C@H]2CCC[N@H+]2CCOCC[NH+]2CCC[C@H]2c2cnn(C)c2)cn1 ZINC000178636559 546824283 /nfs/dbraw/zinc/82/42/83/546824283.db2.gz OIOAINICHHRUMY-BGYRXZFFSA-N 2 1 372.517 2.144 10 0 FEAEMP Cn1cc([C@H]2CCC[NH+]2CCOCC[N@@H+]2CCC[C@H]2c2cnn(C)c2)cn1 ZINC000178636559 546824287 /nfs/dbraw/zinc/82/42/87/546824287.db2.gz OIOAINICHHRUMY-BGYRXZFFSA-N 2 1 372.517 2.144 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(N2CCOCC2)nc1C ZINC000182077309 547432882 /nfs/dbraw/zinc/43/28/82/547432882.db2.gz AAJOEPJQBOOWOV-IAGOWNOFSA-N 2 1 373.501 2.317 10 0 FEAEMP CC[NH+]1CCN(c2ccccc2NC(=O)N[C@H]2CCC[N@@H+](CC)C2)CC1 ZINC000194325669 548466253 /nfs/dbraw/zinc/46/62/53/548466253.db2.gz OOTIXOYSNMXBDX-KRWDZBQOSA-N 2 1 359.518 2.434 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N(C)C[C@H]2CCC[NH+]2CC)[C@H](C)C1 ZINC000245428875 548915985 /nfs/dbraw/zinc/91/59/85/548915985.db2.gz XTAREDKFGZPTCA-QRVBRYPASA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N(C)C[C@H]2CCC[N@@H+]2CC)[C@H](C)C1 ZINC000245428875 548915991 /nfs/dbraw/zinc/91/59/91/548915991.db2.gz XTAREDKFGZPTCA-QRVBRYPASA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N(C)C[C@H]2CCC[N@H+]2CC)[C@H](C)C1 ZINC000245428875 548915996 /nfs/dbraw/zinc/91/59/96/548915996.db2.gz XTAREDKFGZPTCA-QRVBRYPASA-N 2 1 368.566 2.249 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000246504656 549149087 /nfs/dbraw/zinc/14/90/87/549149087.db2.gz UJQCWWQNRBVDQP-RTWAWAEBSA-N 2 1 370.541 2.431 10 0 FEAEMP C[C@@H]1C[C@@H](NC(=O)N2CCO[C@@H](C[NH+](C)C)C2)CC[N@H+]1Cc1ccccc1 ZINC000246517418 549150619 /nfs/dbraw/zinc/15/06/19/549150619.db2.gz OFKYVPOCTDVADY-HOJAQTOUSA-N 2 1 374.529 2.012 10 0 FEAEMP CCCN1Cc2cccc(NC(=O)C(=O)N[C@@H]3C[N@H+](C(C)C)C[C@H]3C)c2C1 ZINC000246550381 549159384 /nfs/dbraw/zinc/15/93/84/549159384.db2.gz WAFQFQBIAMQLQN-DNVCBOLYSA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N[C@@H]3C[NH+](C(C)C)C[C@H]3C)c2C1 ZINC000246550381 549159391 /nfs/dbraw/zinc/15/93/91/549159391.db2.gz WAFQFQBIAMQLQN-DNVCBOLYSA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N[C@@H]3C[NH+](C(C)C)C[C@H]3C)c2C1 ZINC000246550381 549159394 /nfs/dbraw/zinc/15/93/94/549159394.db2.gz WAFQFQBIAMQLQN-DNVCBOLYSA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N[C@@H]3C[N@H+](C(C)C)C[C@H]3C)c2C1 ZINC000246550381 549159404 /nfs/dbraw/zinc/15/94/04/549159404.db2.gz WAFQFQBIAMQLQN-DNVCBOLYSA-N 2 1 372.513 2.196 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N2CC[NH+]3CCCC[C@H]3C2)[C@H](C)C1 ZINC000247272228 549309574 /nfs/dbraw/zinc/30/95/74/549309574.db2.gz RKGKOTJMQKZZDM-QYZOEREBSA-N 2 1 366.550 2.003 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2CC[N@@H+]3CCCC[C@H]3C2)[C@H](C)C1 ZINC000247272228 549309578 /nfs/dbraw/zinc/30/95/78/549309578.db2.gz RKGKOTJMQKZZDM-QYZOEREBSA-N 2 1 366.550 2.003 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2CC[N@H+]3CCCC[C@H]3C2)[C@H](C)C1 ZINC000247272228 549309582 /nfs/dbraw/zinc/30/95/82/549309582.db2.gz RKGKOTJMQKZZDM-QYZOEREBSA-N 2 1 366.550 2.003 10 0 FEAEMP C[C@H](C(=O)NC1CCC(C)CC1)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247805798 549381577 /nfs/dbraw/zinc/38/15/77/549381577.db2.gz SPTVJESGLKNMGR-DHADLLTHSA-N 2 1 353.551 2.094 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCC[NH+](C)C2CCCCC2)CC[N@H+]1C[C@H](C)O ZINC000248461138 549444363 /nfs/dbraw/zinc/44/43/63/549444363.db2.gz UCQOCQNLHIMJHL-ZWKOTPCHSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCC[N@H+](C)C2CCCCC2)CC[NH+]1C[C@H](C)O ZINC000248461138 549444369 /nfs/dbraw/zinc/44/43/69/549444369.db2.gz UCQOCQNLHIMJHL-ZWKOTPCHSA-N 2 1 368.566 2.128 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCC[N@@H+](C)C2CCCCC2)CC[NH+]1C[C@H](C)O ZINC000248461138 549444373 /nfs/dbraw/zinc/44/43/73/549444373.db2.gz UCQOCQNLHIMJHL-ZWKOTPCHSA-N 2 1 368.566 2.128 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000248717850 549489388 /nfs/dbraw/zinc/48/93/88/549489388.db2.gz FMPSZBQBCHONJA-HOJAQTOUSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000248717850 549489391 /nfs/dbraw/zinc/48/93/91/549489391.db2.gz FMPSZBQBCHONJA-HOJAQTOUSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248717850 549489393 /nfs/dbraw/zinc/48/93/93/549489393.db2.gz FMPSZBQBCHONJA-HOJAQTOUSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)[C@@](C)([NH3+])c1ccc(Br)cc1 ZINC000261749003 549751703 /nfs/dbraw/zinc/75/17/03/549751703.db2.gz MOHZPGMWENTQQZ-PVUWLOKVSA-N 2 1 366.303 2.318 10 0 FEAEMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@H]3[C@H]3COCCN3)C2)cc1 ZINC000261992570 549778170 /nfs/dbraw/zinc/77/81/70/549778170.db2.gz SXIFOMMUWZALCP-GXRSIYKFSA-N 2 1 357.542 2.298 10 0 FEAEMP O[C@@H](C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CCCO1)COCc1ccco1 ZINC000390985668 558613269 /nfs/dbraw/zinc/61/32/69/558613269.db2.gz XSABQFMTYHTCEF-PZJWPPBQSA-N 2 1 374.481 2.038 10 0 FEAEMP O[C@@H](C[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)COCc1ccco1 ZINC000390985668 558613271 /nfs/dbraw/zinc/61/32/71/558613271.db2.gz XSABQFMTYHTCEF-PZJWPPBQSA-N 2 1 374.481 2.038 10 0 FEAEMP CC1(C)C[N@H+](C2(CNC(=O)[C@@H]3CCC[C@@H]([NH3+])C3)CCCCC2)CCO1 ZINC000262285795 672912762 /nfs/dbraw/zinc/91/27/62/672912762.db2.gz MFIANRIAGCPJAH-IAGOWNOFSA-N 2 1 351.535 2.434 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(C[NH+]2CCC(CO)CC2)cc1 ZINC000247400612 549329163 /nfs/dbraw/zinc/32/91/63/549329163.db2.gz LMDQMWPNYMACFQ-UTKZUKDTSA-N 2 1 371.525 2.200 10 0 FEAEMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)NC[C@@H]2CN(C)CCO2)cc1 ZINC000104787290 543144038 /nfs/dbraw/zinc/14/40/38/543144038.db2.gz MTGMADARVPHIBX-FXAWDEMLSA-N 2 1 374.529 2.191 10 0 FEAEMP Cc1c(O)ccc2c(C[N@H+](C)CC3CC[NH+](C[C@H](C)O)CC3)cc(=O)oc12 ZINC000106126076 543204666 /nfs/dbraw/zinc/20/46/66/543204666.db2.gz ANJVNQCXJMJBCC-AWEZNQCLSA-N 2 1 374.481 2.332 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)N2CCO[C@@H](C[NH+](C)C)C2)cc1 ZINC000123308030 543753992 /nfs/dbraw/zinc/75/39/92/543753992.db2.gz FVGKEHHTONUZIG-BEFAXECRSA-N 2 1 371.485 2.214 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@@H]4CCC[N@@H+]4C[C@H]3C)cc2F)CC1 ZINC000247493237 549344268 /nfs/dbraw/zinc/34/42/68/549344268.db2.gz UKLZJEMYSPZMAL-AEFFLSMTSA-N 2 1 374.504 2.276 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@@H]4CCC[N@H+]4C[C@H]3C)cc2F)CC1 ZINC000247493237 549344270 /nfs/dbraw/zinc/34/42/70/549344270.db2.gz UKLZJEMYSPZMAL-AEFFLSMTSA-N 2 1 374.504 2.276 10 0 FEAEMP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)N1CCCC[C@H]1C[NH+]1CCOCC1 ZINC000152389800 544647504 /nfs/dbraw/zinc/64/75/04/544647504.db2.gz HUMUGZIAATUZBD-MOPGFXCFSA-N 2 1 366.550 2.003 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N1CCCC[C@H]1C[NH+]1CCOCC1 ZINC000152389800 544647507 /nfs/dbraw/zinc/64/75/07/544647507.db2.gz HUMUGZIAATUZBD-MOPGFXCFSA-N 2 1 366.550 2.003 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N3C[C@@H]4CCC[NH+]4C[C@@H]3C)c2C1 ZINC000190075489 328186118 /nfs/dbraw/zinc/18/61/18/328186118.db2.gz LAPXUYRBTYBWPR-RDJZCZTQSA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N3C[C@@H]4CCC[NH+]4C[C@@H]3C)c2C1 ZINC000190075489 328186120 /nfs/dbraw/zinc/18/61/20/328186120.db2.gz LAPXUYRBTYBWPR-RDJZCZTQSA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N3C[C@@H]4CCC[N@@H+]4C[C@@H]3C)c2C1 ZINC000190075489 328186122 /nfs/dbraw/zinc/18/61/22/328186122.db2.gz LAPXUYRBTYBWPR-RDJZCZTQSA-N 2 1 370.497 2.046 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N3C[C@@H]4CCC[N@H+]4C[C@@H]3C)c2C1 ZINC000190075489 328186123 /nfs/dbraw/zinc/18/61/23/328186123.db2.gz LAPXUYRBTYBWPR-RDJZCZTQSA-N 2 1 370.497 2.046 10 0 FEAEMP CC[N@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](CCOC)[C@H](C)C2)c1 ZINC000117486909 326062418 /nfs/dbraw/zinc/06/24/18/326062418.db2.gz ZHCPATCVUHPWSG-QGZVFWFLSA-N 2 1 362.518 2.000 10 0 FEAEMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](CCOC)[C@H](C)C2)c1 ZINC000117486909 326062422 /nfs/dbraw/zinc/06/24/22/326062422.db2.gz ZHCPATCVUHPWSG-QGZVFWFLSA-N 2 1 362.518 2.000 10 0 FEAEMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[N@H+](CCOC)[C@H](C)C2)c1 ZINC000117486909 326062426 /nfs/dbraw/zinc/06/24/26/326062426.db2.gz ZHCPATCVUHPWSG-QGZVFWFLSA-N 2 1 362.518 2.000 10 0 FEAEMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[N@@H+](CCOC)[C@H](C)C2)c1 ZINC000117486909 326062428 /nfs/dbraw/zinc/06/24/28/326062428.db2.gz ZHCPATCVUHPWSG-QGZVFWFLSA-N 2 1 362.518 2.000 10 0 FEAEMP CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000120929997 326299593 /nfs/dbraw/zinc/29/95/93/326299593.db2.gz XDGGFQKDLDMXOG-XLIONFOSSA-N 2 1 374.529 2.412 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000120929997 326299594 /nfs/dbraw/zinc/29/95/94/326299594.db2.gz XDGGFQKDLDMXOG-XLIONFOSSA-N 2 1 374.529 2.412 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000162499031 327027257 /nfs/dbraw/zinc/02/72/57/327027257.db2.gz AGNHEQQHVDWTAN-JLSDUUJJSA-N 2 1 350.482 2.456 10 0 FEAEMP COc1ccc([C@H](CNC(=O)N2CC[N@H+]3CCC[C@@H]3C2)[NH+]2CCCC2)cc1 ZINC000171896331 327167998 /nfs/dbraw/zinc/16/79/98/327167998.db2.gz VAPFZODQEBEKDY-QUCCMNQESA-N 2 1 372.513 2.322 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NCCC[NH+]2CCCCC2)C[C@@H]1CC ZINC000172117483 327181837 /nfs/dbraw/zinc/18/18/37/327181837.db2.gz BOKPLEQBBPANNK-SFHVURJKSA-N 2 1 354.539 2.005 10 0 FEAEMP Cc1[nH+]ccn1CCCC[NH2+]Cc1c(C(C)C)nn(C)c1N1CCOCC1 ZINC000174454003 327327747 /nfs/dbraw/zinc/32/77/47/327327747.db2.gz FDJYJCABBFRPLM-UHFFFAOYSA-N 2 1 374.533 2.455 10 0 FEAEMP O=c1ccccn1Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)cc1 ZINC000261972805 328832781 /nfs/dbraw/zinc/83/27/81/328832781.db2.gz QRWJFTYZBUYFEX-PWRODBHTSA-N 2 1 367.493 2.143 10 0 FEAEMP O[C@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccs1 ZINC000263195560 328924097 /nfs/dbraw/zinc/92/40/97/328924097.db2.gz IHXYDELGTKYRJL-WMZOPIPTSA-N 2 1 368.506 2.330 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)cn1 ZINC000157897094 545797340 /nfs/dbraw/zinc/79/73/40/545797340.db2.gz IQHUYRBPFAZUFT-WMLDXEAASA-N 2 1 356.474 2.104 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)cn1 ZINC000157897094 545797343 /nfs/dbraw/zinc/79/73/43/545797343.db2.gz IQHUYRBPFAZUFT-WMLDXEAASA-N 2 1 356.474 2.104 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CC(=O)N(C)CCOc1ccccc1F ZINC000178325627 546775631 /nfs/dbraw/zinc/77/56/31/546775631.db2.gz JCXGPVALYOEMHS-QGZVFWFLSA-N 2 1 374.460 2.332 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CC(=O)N(C)CCOc1ccccc1F ZINC000178325627 546775637 /nfs/dbraw/zinc/77/56/37/546775637.db2.gz JCXGPVALYOEMHS-QGZVFWFLSA-N 2 1 374.460 2.332 10 0 FEAEMP CC[C@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1C[C@H](C)O ZINC000245443476 548923224 /nfs/dbraw/zinc/92/32/24/548923224.db2.gz XFZYQWIQNMAXKQ-HOTGVXAUSA-N 2 1 373.497 2.412 10 0 FEAEMP CC[C@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@H+]1C[C@H](C)O ZINC000245443476 548923228 /nfs/dbraw/zinc/92/32/28/548923228.db2.gz XFZYQWIQNMAXKQ-HOTGVXAUSA-N 2 1 373.497 2.412 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)N1CC[C@@H]([NH+](C)C)C1 ZINC000246294222 549098749 /nfs/dbraw/zinc/09/87/49/549098749.db2.gz BHNHJPPEDBNUIG-BWPNAZKDSA-N 2 1 358.530 2.489 10 0 FEAEMP CC[N@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](CCOC)[C@@H](C)C2)c1 ZINC000247268868 549309653 /nfs/dbraw/zinc/30/96/53/549309653.db2.gz ZHCPATCVUHPWSG-KRWDZBQOSA-N 2 1 362.518 2.000 10 0 FEAEMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2CC[NH+](CCOC)[C@@H](C)C2)c1 ZINC000247268868 549309658 /nfs/dbraw/zinc/30/96/58/549309658.db2.gz ZHCPATCVUHPWSG-KRWDZBQOSA-N 2 1 362.518 2.000 10 0 FEAEMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[N@H+](CCOC)[C@@H](C)C2)c1 ZINC000247268868 549309662 /nfs/dbraw/zinc/30/96/62/549309662.db2.gz ZHCPATCVUHPWSG-KRWDZBQOSA-N 2 1 362.518 2.000 10 0 FEAEMP CC[NH+](C)Cc1cccc(CNC(=O)N2CC[N@@H+](CCOC)[C@@H](C)C2)c1 ZINC000247268868 549309664 /nfs/dbraw/zinc/30/96/64/549309664.db2.gz ZHCPATCVUHPWSG-KRWDZBQOSA-N 2 1 362.518 2.000 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C)C(=O)NCC2CCCCC2)CC1 ZINC000247767924 549377843 /nfs/dbraw/zinc/37/78/43/549377843.db2.gz OIKZUCHGFHPRKG-IAGOWNOFSA-N 2 1 353.551 2.096 10 0 FEAEMP CC(C)OC[C@H](O)C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000247780319 549381234 /nfs/dbraw/zinc/38/12/34/549381234.db2.gz XLTOMJROYMAUHQ-NHCUHLMSSA-N 2 1 364.530 2.150 10 0 FEAEMP C[C@@H](NC(=O)[C@H](C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1)c1ccccc1 ZINC000247807954 549382897 /nfs/dbraw/zinc/38/28/97/549382897.db2.gz TYFBZETYNLMBLR-KSZLIROESA-N 2 1 361.530 2.277 10 0 FEAEMP O=C(CN1CC[N@H+]2CCCC[C@H]2C1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000248345080 549420943 /nfs/dbraw/zinc/42/09/43/549420943.db2.gz MJFJGBSQBYGGFR-NRFANRHFSA-N 2 1 370.541 2.069 10 0 FEAEMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)C2([NH3+])CCOCC2)C1 ZINC000261872964 549765306 /nfs/dbraw/zinc/76/53/06/549765306.db2.gz OHRAOAXSAAHWRM-CALCHBBNSA-N 2 1 359.514 2.289 10 0 FEAEMP COc1cccc(N2CCC[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@H]3COCC[NH2+]3)C2)c1 ZINC000261925989 549770405 /nfs/dbraw/zinc/77/04/05/549770405.db2.gz LCOKRFINVVJPLF-VRXWPRPYSA-N 2 1 359.514 2.411 10 0 FEAEMP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1)c1ccc2c(c1)OCCO2 ZINC000261951234 549773409 /nfs/dbraw/zinc/77/34/09/549773409.db2.gz OJNGTAKRXLKSCR-KZNAEPCWSA-N 2 1 360.498 2.482 10 0 FEAEMP C([NH2+][C@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1)C1(N2CCSCC2)CCCC1 ZINC000262010228 549779844 /nfs/dbraw/zinc/77/98/44/549779844.db2.gz VLRZLSNNFOGTIZ-BZSNNMDCSA-N 2 1 353.576 2.095 10 0 FEAEMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1ccn([C@H]2CCC[NH2+]C2)n1 ZINC000262761751 549847020 /nfs/dbraw/zinc/84/70/20/549847020.db2.gz LNHUXNPRQNHTNO-WMZOPIPTSA-N 2 1 371.485 2.358 10 0 FEAEMP CCOc1cc2[nH+]ccc(NC[C@@H]3C[NH+]4CCN3CC4)c2cc1OCC ZINC000301801721 553681237 /nfs/dbraw/zinc/68/12/37/553681237.db2.gz WQCDAWKJENLYQH-OAHLLOKOSA-N 2 1 356.470 2.444 10 0 FEAEMP COCC[N@H+]1C[C@@H](CO)C2(C1)CC[NH+](Cc1cccc(Cl)c1)CC2 ZINC000169789519 672322570 /nfs/dbraw/zinc/32/25/70/672322570.db2.gz YEKMKYXPNXCTJG-KRWDZBQOSA-N 2 1 352.906 2.493 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)NC[C@H](C)[NH+](CC)CC)c2C1 ZINC000067497140 541472095 /nfs/dbraw/zinc/47/20/95/541472095.db2.gz VEVREOCFAYAPLJ-HNNXBMFYSA-N 2 1 360.502 2.197 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)NC[C@H](C)[NH+](CC)CC)c2C1 ZINC000067497140 541472099 /nfs/dbraw/zinc/47/20/99/541472099.db2.gz VEVREOCFAYAPLJ-HNNXBMFYSA-N 2 1 360.502 2.197 10 0 FEAEMP CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(NC3CC[NH+](C)CC3)nc2)C1 ZINC000011873378 207327573 /nfs/dbraw/zinc/32/75/73/207327573.db2.gz QBOZEYBBOHYRAA-QGZVFWFLSA-N 2 1 373.545 2.295 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)Cc2nnc(-c3ccccc3)n2C)CC1 ZINC000106124456 543204772 /nfs/dbraw/zinc/20/47/72/543204772.db2.gz GNVUCEGUGGBMNH-MRXNPFEDSA-N 2 1 357.502 2.007 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2nnc(-c3ccccc3)n2C)CC1 ZINC000106124456 543204776 /nfs/dbraw/zinc/20/47/76/543204776.db2.gz GNVUCEGUGGBMNH-MRXNPFEDSA-N 2 1 357.502 2.007 10 0 FEAEMP CCCC[NH+]1CCC(NC(=O)N2CC[N@@H+](CCOCC)[C@H](CC)C2)CC1 ZINC000117042099 543621537 /nfs/dbraw/zinc/62/15/37/543621537.db2.gz OWEIEZPCIWRPDC-LJQANCHMSA-N 2 1 368.566 2.393 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)CC1 ZINC000190905628 328239634 /nfs/dbraw/zinc/23/96/34/328239634.db2.gz ARMVYQBLDNZSIE-FDYSRKEFSA-N 2 1 352.519 2.421 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC[NH+](CC(C)C)CC2)C[C@@H]1CC ZINC000117029348 326048116 /nfs/dbraw/zinc/04/81/16/326048116.db2.gz ASFYRBRBMVASNG-IBGZPJMESA-N 2 1 368.566 2.249 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000117480726 326062736 /nfs/dbraw/zinc/06/27/36/326062736.db2.gz GBVVMTJIWUUBGS-UYAOXDASSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000117480726 326062740 /nfs/dbraw/zinc/06/27/40/326062740.db2.gz GBVVMTJIWUUBGS-UYAOXDASSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000117480726 326062743 /nfs/dbraw/zinc/06/27/43/326062743.db2.gz GBVVMTJIWUUBGS-UYAOXDASSA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000117480726 326062744 /nfs/dbraw/zinc/06/27/44/326062744.db2.gz GBVVMTJIWUUBGS-UYAOXDASSA-N 2 1 374.529 2.013 10 0 FEAEMP C[C@@H](O)C[N@H+]1CCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@@H]1C ZINC000120630782 326273937 /nfs/dbraw/zinc/27/39/37/326273937.db2.gz DTVGBRVNSGRNID-RBUKOAKNSA-N 2 1 374.573 2.104 10 0 FEAEMP COc1ccc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c(OC)c1OC ZINC000121097192 326313021 /nfs/dbraw/zinc/31/30/21/326313021.db2.gz CNBGQBKORLOINS-OAHLLOKOSA-N 2 1 366.502 2.237 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)N2CCO[C@@H](C[NH+](C)C)C2)cc1 ZINC000123308291 326427202 /nfs/dbraw/zinc/42/72/02/326427202.db2.gz FVGKEHHTONUZIG-KXBFYZLASA-N 2 1 371.485 2.214 10 0 FEAEMP Cc1ccc(OC[C@H](O)C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c(C)c1 ZINC000170941617 327108577 /nfs/dbraw/zinc/10/85/77/327108577.db2.gz UJDDKOORALPCPU-UYAOXDASSA-N 2 1 364.530 2.068 10 0 FEAEMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000171807360 327162742 /nfs/dbraw/zinc/16/27/42/327162742.db2.gz TULCCOPRSGYHHP-GOSISDBHSA-N 2 1 357.502 2.059 10 0 FEAEMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N1C[C@H]2CCC[N@@H+]2C[C@@H]1C ZINC000172134671 327182888 /nfs/dbraw/zinc/18/28/88/327182888.db2.gz FIPAMPYCVLNQDC-PKOBYXMFSA-N 2 1 371.529 2.447 10 0 FEAEMP CC[N@H+](Cc1ccc(C(=O)N2CC[NH+](C[C@@H](C)O)[C@H](C)C2)cc1)C(C)C ZINC000174324661 327319729 /nfs/dbraw/zinc/31/97/29/327319729.db2.gz QKYHMMBAWJLLIF-QZTJIDSGSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[N@@H+](Cc1ccc(C(=O)N2CC[NH+](C[C@@H](C)O)[C@H](C)C2)cc1)C(C)C ZINC000174324661 327319730 /nfs/dbraw/zinc/31/97/30/327319730.db2.gz QKYHMMBAWJLLIF-QZTJIDSGSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[NH+](Cc1ccc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)cc1)C(C)C ZINC000174324661 327319732 /nfs/dbraw/zinc/31/97/32/327319732.db2.gz QKYHMMBAWJLLIF-QZTJIDSGSA-N 2 1 361.530 2.444 10 0 FEAEMP CC[NH+](Cc1ccc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)cc1)C(C)C ZINC000174324661 327319734 /nfs/dbraw/zinc/31/97/34/327319734.db2.gz QKYHMMBAWJLLIF-QZTJIDSGSA-N 2 1 361.530 2.444 10 0 FEAEMP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)CC1 ZINC000261999778 328834371 /nfs/dbraw/zinc/83/43/71/328834371.db2.gz UJHAVTKWLJBMMD-OTNPHJDUSA-N 2 1 358.530 2.354 10 0 FEAEMP COc1ccc(C2(C[NH2+][C@@H]3CCC[C@H]3[C@H]3COCC[NH2+]3)CCOCC2)cc1 ZINC000262016162 328835449 /nfs/dbraw/zinc/83/54/49/328835449.db2.gz VZWZSTOEXYBUPV-NJDAHSKKSA-N 2 1 374.525 2.490 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC2CC[NH+](C3CCCC3)CC2)CC[N@H+]1CCOC ZINC000176010509 546389921 /nfs/dbraw/zinc/38/99/21/546389921.db2.gz PHIJSILGQXBKCL-GOSISDBHSA-N 2 1 366.550 2.146 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC1CC[NH+](CCOC(C)C)CC1 ZINC000176629567 546470463 /nfs/dbraw/zinc/47/04/63/546470463.db2.gz WNDBRJDUUYMHRP-SFHVURJKSA-N 2 1 354.539 2.002 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N(C)C[C@@H]1CCC[N@@H+]1CC)[NH+]1CCOCC1 ZINC000177344695 546597634 /nfs/dbraw/zinc/59/76/34/546597634.db2.gz SDFAQGQOQOGGAO-OALUTQOASA-N 2 1 368.566 2.249 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N(C)C[C@@H]1CCC[N@H+]1CC)[NH+]1CCOCC1 ZINC000177344695 546597640 /nfs/dbraw/zinc/59/76/40/546597640.db2.gz SDFAQGQOQOGGAO-OALUTQOASA-N 2 1 368.566 2.249 10 0 FEAEMP O=C(CN1CC[N@H+]2CCCC[C@@H]2C1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000177752454 546679674 /nfs/dbraw/zinc/67/96/74/546679674.db2.gz MJFJGBSQBYGGFR-OAQYLSRUSA-N 2 1 370.541 2.069 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ccccc2N2CCOCC2)CC1 ZINC000179517421 546969158 /nfs/dbraw/zinc/96/91/58/546969158.db2.gz FGOBYTXXGRPCPO-GOSISDBHSA-N 2 1 361.530 2.048 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NCC[C@@H](C)[NH+]2CCCCC2)C[C@@H]1CC ZINC000182691675 547534296 /nfs/dbraw/zinc/53/42/96/547534296.db2.gz KFQFMZFVHIGABP-MOPGFXCFSA-N 2 1 368.566 2.393 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC1CC[NH+](Cc2ccncc2)CC1 ZINC000245658653 548967460 /nfs/dbraw/zinc/96/74/60/548967460.db2.gz CWJMPYYDMBBGGK-PMACEKPBSA-N 2 1 371.529 2.314 10 0 FEAEMP Cn1cc([C@@H]2CCC[NH+]2CCOCC[N@@H+]2CCC[C@H]2c2cnn(C)c2)cn1 ZINC000247067106 549275893 /nfs/dbraw/zinc/27/58/93/549275893.db2.gz OIOAINICHHRUMY-PMACEKPBSA-N 2 1 372.517 2.144 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(OCC[NH+](C)C)cc1 ZINC000247245969 549306023 /nfs/dbraw/zinc/30/60/23/549306023.db2.gz NHKUNCHTTIRYHT-WMZOPIPTSA-N 2 1 360.502 2.005 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc(OCCC[NH+](C)C)cc1 ZINC000247255182 549307639 /nfs/dbraw/zinc/30/76/39/549307639.db2.gz NSCWBESUHGRISF-HKUYNNGSSA-N 2 1 374.529 2.395 10 0 FEAEMP CCCNC(=O)[C@@H](C)[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000247600538 549364824 /nfs/dbraw/zinc/36/48/24/549364824.db2.gz KYMJPRJSFHINQG-YLJYHZDGSA-N 2 1 361.530 2.279 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[NH+](C3CCC3)C2)C[C@H]1C ZINC000248407604 549430623 /nfs/dbraw/zinc/43/06/23/549430623.db2.gz ULKLLZTWYWHZPI-KURKYZTESA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[NH+](C3CCC3)C2)C[C@H]1C ZINC000248407604 549430626 /nfs/dbraw/zinc/43/06/26/549430626.db2.gz ULKLLZTWYWHZPI-KURKYZTESA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)C[C@H]1C ZINC000248407604 549430628 /nfs/dbraw/zinc/43/06/28/549430628.db2.gz ULKLLZTWYWHZPI-KURKYZTESA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C[C@H]1C ZINC000248407604 549430631 /nfs/dbraw/zinc/43/06/31/549430631.db2.gz ULKLLZTWYWHZPI-KURKYZTESA-N 2 1 366.550 2.002 10 0 FEAEMP CCC[N@H+]1CC[C@H](CNC(=O)N2CC[C@@H](C[NH+](C)Cc3cccnc3)C2)C1 ZINC000253203033 549680504 /nfs/dbraw/zinc/68/05/04/549680504.db2.gz FFISEDSZYNWODZ-UXHICEINSA-N 2 1 373.545 2.277 10 0 FEAEMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000253203033 549680506 /nfs/dbraw/zinc/68/05/06/549680506.db2.gz FFISEDSZYNWODZ-UXHICEINSA-N 2 1 373.545 2.277 10 0 FEAEMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000253203033 549680509 /nfs/dbraw/zinc/68/05/09/549680509.db2.gz FFISEDSZYNWODZ-UXHICEINSA-N 2 1 373.545 2.277 10 0 FEAEMP CC(C)C[NH+]1CC[C@@H](c2nnc3n2CC[N@H+](Cc2cccnc2)CC3)C1 ZINC000257194424 549715943 /nfs/dbraw/zinc/71/59/43/549715943.db2.gz UAOAYBSPVDVQLL-GOSISDBHSA-N 2 1 354.502 2.177 10 0 FEAEMP CN(C)[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1)c1c(F)cccc1F ZINC000261865569 549763974 /nfs/dbraw/zinc/76/39/74/549763974.db2.gz COKYCTIXOVERKZ-BNEJOLLZSA-N 2 1 353.457 2.314 10 0 FEAEMP NCc1nc(CN2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)no1 ZINC000261893508 549766688 /nfs/dbraw/zinc/76/66/88/549766688.db2.gz AOTLRJLQZDWQHZ-UHFFFAOYSA-N 2 1 369.391 2.255 10 0 FEAEMP CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000261997089 549778573 /nfs/dbraw/zinc/77/85/73/549778573.db2.gz UEAJISYREFFNIK-QLIIJSOBSA-N 2 1 359.514 2.462 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)NC2CCCCCCC2)CC1 ZINC000106126218 670809289 /nfs/dbraw/zinc/80/92/89/670809289.db2.gz ISJVHBSRRXYCKU-KRWDZBQOSA-N 2 1 353.551 2.240 10 0 FEAEMP O=C([C@@H]1C[NH2+]C[C@H]1C(F)(F)F)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000653043167 677512989 /nfs/dbraw/zinc/51/29/89/677512989.db2.gz FHWVPRUVTFBQPB-HZPDHXFCSA-N 2 1 355.404 2.119 10 0 FEAEMP C[C@@H]1C[C@@H](NC(=O)[C@@H]2C[NH2+]C[C@H]2C(F)(F)F)C[N@H+]1Cc1ccccc1 ZINC000653122371 677516677 /nfs/dbraw/zinc/51/66/77/677516677.db2.gz VDCQNENXEWYNNZ-DTZQCDIJSA-N 2 1 355.404 2.164 10 0 FEAEMP C[C@H](CCNC(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F)[N@@H+](C)Cc1ccccc1 ZINC000653123777 677516764 /nfs/dbraw/zinc/51/67/64/677516764.db2.gz HMLFTCZNYMARJO-FVQBIDKESA-N 2 1 357.420 2.411 10 0 FEAEMP CC(C)[NH+]1CCC([C@H]2[NH2+][C@](CO)(c3ccccc3)[C@H]3C[N@@H+](C)C[C@H]32)CC1 ZINC000065532554 541243761 /nfs/dbraw/zinc/24/37/61/541243761.db2.gz WOCKBKJIKFVCFL-CIAFKFPVSA-N 3 1 357.542 2.144 10 0 FEAEMP CC(C)[NH+]1CCC([C@H]2[NH2+][C@](CO)(c3ccccc3)[C@H]3CN(C)C[C@H]32)CC1 ZINC000065532554 541243764 /nfs/dbraw/zinc/24/37/64/541243764.db2.gz WOCKBKJIKFVCFL-CIAFKFPVSA-N 2 1 357.542 2.144 10 0 FEAEMP C[C@H]1CCCC[N@H+]1CCN(C)c1nc(-c2cccnc2)nc2c1CC[NH2+]C2 ZINC000071750811 541770080 /nfs/dbraw/zinc/77/00/80/541770080.db2.gz AIPWTHVPTCEWKW-INIZCTEOSA-N 2 1 366.513 2.495 10 0 FEAEMP CCN(CC)C(=O)C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000106128122 543205473 /nfs/dbraw/zinc/20/54/73/543205473.db2.gz RPNYZNHFEMLXHT-HXUWFJFHSA-N 2 1 361.530 2.232 10 0 FEAEMP CC(C)[NH+]1C[C@H](C)[C@H](NC(=O)NCC[N@H+](C)Cc2ccc(F)cc2)C1 ZINC000247458101 549336522 /nfs/dbraw/zinc/33/65/22/549336522.db2.gz UDTOHUABIKXZKZ-MAUKXSAKSA-N 2 1 350.482 2.285 10 0 FEAEMP CC(C)[NH+]1C[C@H](C)[C@H](NC(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)C1 ZINC000247458101 549336525 /nfs/dbraw/zinc/33/65/25/549336525.db2.gz UDTOHUABIKXZKZ-MAUKXSAKSA-N 2 1 350.482 2.285 10 0 FEAEMP Cc1nc(C[NH+]2CCC(C(=O)N3C[C@H]4CCC[N@H+]4C[C@H]3C)CC2)cs1 ZINC000247481717 549341537 /nfs/dbraw/zinc/34/15/37/549341537.db2.gz SSCSOXJOVYNTLJ-RDTXWAMCSA-N 2 1 362.543 2.359 10 0 FEAEMP Cc1nc(C[NH+]2CCC(C(=O)N3C[C@H]4CCC[N@@H+]4C[C@H]3C)CC2)cs1 ZINC000247481717 549341539 /nfs/dbraw/zinc/34/15/39/549341539.db2.gz SSCSOXJOVYNTLJ-RDTXWAMCSA-N 2 1 362.543 2.359 10 0 FEAEMP C[N@H+](Cc1cccnc1)C[C@H]1CCN(C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)C1 ZINC000190695013 328225608 /nfs/dbraw/zinc/22/56/08/328225608.db2.gz ULTFHNIDPZWAFR-RBUKOAKNSA-N 2 1 371.529 2.029 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@H]1CCN(C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000190695013 328225609 /nfs/dbraw/zinc/22/56/09/328225609.db2.gz ULTFHNIDPZWAFR-RBUKOAKNSA-N 2 1 371.529 2.029 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@H]1CCN(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)C1 ZINC000190695013 328225610 /nfs/dbraw/zinc/22/56/10/328225610.db2.gz ULTFHNIDPZWAFR-RBUKOAKNSA-N 2 1 371.529 2.029 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000191003427 328244847 /nfs/dbraw/zinc/24/48/47/328244847.db2.gz RPWBIPGISBFWMV-DDUYZKFLSA-N 2 1 364.530 2.420 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000191003427 328244848 /nfs/dbraw/zinc/24/48/48/328244848.db2.gz RPWBIPGISBFWMV-DDUYZKFLSA-N 2 1 364.530 2.420 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000191003427 328244849 /nfs/dbraw/zinc/24/48/49/328244849.db2.gz RPWBIPGISBFWMV-DDUYZKFLSA-N 2 1 364.530 2.420 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC[NH+](CC(C)C)CC2)C[C@H]1CC ZINC000117029347 326048145 /nfs/dbraw/zinc/04/81/45/326048145.db2.gz ASFYRBRBMVASNG-LJQANCHMSA-N 2 1 368.566 2.249 10 0 FEAEMP CC(C)[N@H+]1CCO[C@H](CN2CC[NH+](Cc3cccc4[nH]ccc43)CC2)C1 ZINC000121071520 326311424 /nfs/dbraw/zinc/31/14/24/326311424.db2.gz JRKFTHNVVQXYTR-LJQANCHMSA-N 2 1 356.514 2.395 10 0 FEAEMP CCC[C@@H](C(=O)Nc1ccc(C[N@H+]2CCC[C@H](C(N)=O)C2)cc1)[NH+](C)C ZINC000161904749 327012123 /nfs/dbraw/zinc/01/21/23/327012123.db2.gz OKKARFSMYOHIOG-WMZOPIPTSA-N 2 1 360.502 2.053 10 0 FEAEMP CC[NH+]1CCN(c2ccccc2NC(=O)N2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000171807569 327162815 /nfs/dbraw/zinc/16/28/15/327162815.db2.gz MAELXODYFFZSSK-KRWDZBQOSA-N 2 1 357.502 2.140 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCc2cccc(OCC[NH+](C)C)c2)[C@@H](C)C1 ZINC000157829032 545789888 /nfs/dbraw/zinc/78/98/88/545789888.db2.gz HNCDPSJEBJRHGR-LPHOPBHVSA-N 2 1 362.518 2.155 10 0 FEAEMP C[C@@H]1CN(C(=O)NCCC[N@H+](C)C2CCCCC2)C[C@@H]1[NH+]1CCOCC1 ZINC000175668612 546330292 /nfs/dbraw/zinc/33/02/92/546330292.db2.gz ILAOPDLFSBYDKX-MJGOQNOKSA-N 2 1 366.550 2.003 10 0 FEAEMP C[C@@H]1CN(C(=O)NCCC[N@@H+](C)C2CCCCC2)C[C@@H]1[NH+]1CCOCC1 ZINC000175668612 546330294 /nfs/dbraw/zinc/33/02/94/546330294.db2.gz ILAOPDLFSBYDKX-MJGOQNOKSA-N 2 1 366.550 2.003 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000181689542 547361548 /nfs/dbraw/zinc/36/15/48/547361548.db2.gz YOWPLUKWQSBTIG-KRWDZBQOSA-N 2 1 367.578 2.296 10 0 FEAEMP COc1cccc([C@@H]2[C@@H](NC(=O)N3CC[C@H]([NH+](C)C)C3)CC[N@H+]2C2CC2)c1 ZINC000183765080 547716110 /nfs/dbraw/zinc/71/61/10/547716110.db2.gz FSKLSHYFNHZOSO-YSIASYRMSA-N 2 1 372.513 2.319 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)NC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000194142259 548440697 /nfs/dbraw/zinc/44/06/97/548440697.db2.gz ZXXCMZCHFXKDPV-HXUWFJFHSA-N 2 1 358.530 2.477 10 0 FEAEMP CC[N@@H+]1CCC[C@H](NC(=O)NC[C@@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000194153260 548441897 /nfs/dbraw/zinc/44/18/97/548441897.db2.gz UHLOZQVDYFIBNY-ZBFHGGJFSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)NC[C@@H](C)[NH+]2CCc3sccc3C2)C1 ZINC000194153260 548441898 /nfs/dbraw/zinc/44/18/98/548441898.db2.gz UHLOZQVDYFIBNY-ZBFHGGJFSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)C1 ZINC000194153260 548441899 /nfs/dbraw/zinc/44/18/99/548441899.db2.gz UHLOZQVDYFIBNY-ZBFHGGJFSA-N 2 1 350.532 2.278 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)C1 ZINC000194153260 548441901 /nfs/dbraw/zinc/44/19/01/548441901.db2.gz UHLOZQVDYFIBNY-ZBFHGGJFSA-N 2 1 350.532 2.278 10 0 FEAEMP COC(=O)c1oc([C@H](C)[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc1C ZINC000245616916 548958212 /nfs/dbraw/zinc/95/82/12/548958212.db2.gz MUKHOHHCRXVSAO-GJZGRUSLSA-N 2 1 352.475 2.460 10 0 FEAEMP c1cc(CN2CC[N@H+]3CCC[C@H]3C2)ccc1CN1CC[NH+]2CCC[C@@H]2C1 ZINC000246252045 549089550 /nfs/dbraw/zinc/08/95/50/549089550.db2.gz FNHGOSTUZRKDCX-SZPZYZBQSA-N 2 1 354.542 2.247 10 0 FEAEMP c1cc(CN2CC[NH+]3CCC[C@H]3C2)ccc1CN1CC[N@@H+]2CCC[C@@H]2C1 ZINC000246252045 549089554 /nfs/dbraw/zinc/08/95/54/549089554.db2.gz FNHGOSTUZRKDCX-SZPZYZBQSA-N 2 1 354.542 2.247 10 0 FEAEMP c1cc(CN2CC[NH+]3CCC[C@H]3C2)ccc1CN1CC[N@H+]2CCC[C@@H]2C1 ZINC000246252045 549089558 /nfs/dbraw/zinc/08/95/58/549089558.db2.gz FNHGOSTUZRKDCX-SZPZYZBQSA-N 2 1 354.542 2.247 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NC[C@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000246724169 549196277 /nfs/dbraw/zinc/19/62/77/549196277.db2.gz AGNHEQQHVDWTAN-FHLIZLRMSA-N 2 1 350.482 2.456 10 0 FEAEMP CC(C)[NH+]1C[C@H](C)[C@H](NC(=O)NCCC[N@H+]2CCc3ccccc3C2)C1 ZINC000246741797 549201328 /nfs/dbraw/zinc/20/13/28/549201328.db2.gz AZVIJUKOWOYGBG-FXAWDEMLSA-N 2 1 358.530 2.463 10 0 FEAEMP C[C@H](c1ccc(NC(=O)N2CC[N@@H+]3CCC[C@H]3C2)cc1)[NH+]1CCOCC1 ZINC000246809920 549218405 /nfs/dbraw/zinc/21/84/05/549218405.db2.gz ZPTDTWCTRODVLD-APWZRJJASA-N 2 1 358.486 2.392 10 0 FEAEMP C[C@H](c1ccc(NC(=O)N2CC[N@H+]3CCC[C@H]3C2)cc1)[NH+]1CCOCC1 ZINC000246809920 549218411 /nfs/dbraw/zinc/21/84/11/549218411.db2.gz ZPTDTWCTRODVLD-APWZRJJASA-N 2 1 358.486 2.392 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[NH+]3C[C@H]2C)[C@H](C)C1 ZINC000247169949 549293884 /nfs/dbraw/zinc/29/38/84/549293884.db2.gz JNTGDXQFATVCIL-YRXWBPOGSA-N 2 1 366.550 2.002 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[N@@H+]3C[C@H]2C)[C@H](C)C1 ZINC000247169949 549293885 /nfs/dbraw/zinc/29/38/85/549293885.db2.gz JNTGDXQFATVCIL-YRXWBPOGSA-N 2 1 366.550 2.002 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)[C@H](C)C1 ZINC000247169949 549293888 /nfs/dbraw/zinc/29/38/88/549293888.db2.gz JNTGDXQFATVCIL-YRXWBPOGSA-N 2 1 366.550 2.002 10 0 FEAEMP [NH3+][C@H](C(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2)C1CCOCC1 ZINC000261780693 549755089 /nfs/dbraw/zinc/75/50/89/549755089.db2.gz MZFLDTVIXRDPKX-RBBKRZOGSA-N 2 1 371.525 2.255 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3COCCN3)c2)CCO1 ZINC000261965928 549775689 /nfs/dbraw/zinc/77/56/89/549775689.db2.gz PZMYJYBURGTGKM-YCZSINBZSA-N 2 1 373.541 2.154 10 0 FEAEMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3COCCN3)c2)CCO1 ZINC000261965928 549775692 /nfs/dbraw/zinc/77/56/92/549775692.db2.gz PZMYJYBURGTGKM-YCZSINBZSA-N 2 1 373.541 2.154 10 0 FEAEMP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1 ZINC000262048437 549784062 /nfs/dbraw/zinc/78/40/62/549784062.db2.gz ZIWDIYDVGRHTFR-BDTNDASRSA-N 3 1 373.541 2.408 10 0 FEAEMP O[C@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000263199820 549885256 /nfs/dbraw/zinc/88/52/56/549885256.db2.gz IXXJFMUGAMWQGN-CTNGQTDRSA-N 2 1 362.477 2.268 10 0 FEAEMP CN(C)c1ncc(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1C ZINC000311552026 553754943 /nfs/dbraw/zinc/75/49/43/553754943.db2.gz PVGMYGGEURXZGH-YSIASYRMSA-N 2 1 353.514 2.486 10 0 FEAEMP Cc1nn(C)c2ncc(C[NH2+]C[C@@H]3CC[N@H+](C)[C@H]3c3cccnc3)cc12 ZINC000328631987 553799854 /nfs/dbraw/zinc/79/98/54/553799854.db2.gz LBXGZKBJRHDUND-HKUYNNGSSA-N 2 1 350.470 2.454 10 0 FEAEMP Cc1nn(C)c2ncc(C[NH2+]C[C@@H]3CC[N@@H+](C)[C@H]3c3cccnc3)cc12 ZINC000328631987 553799855 /nfs/dbraw/zinc/79/98/55/553799855.db2.gz LBXGZKBJRHDUND-HKUYNNGSSA-N 2 1 350.470 2.454 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)S(=O)(=O)/C=C/c1ccccc1 ZINC000110099808 670847114 /nfs/dbraw/zinc/84/71/14/670847114.db2.gz ZLQXNILTQVLGEV-APEZIOSESA-N 2 1 365.543 2.335 10 0 FEAEMP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)S(=O)(=O)/C=C/c1ccccc1 ZINC000110099808 670847120 /nfs/dbraw/zinc/84/71/20/670847120.db2.gz ZLQXNILTQVLGEV-APEZIOSESA-N 2 1 365.543 2.335 10 0 FEAEMP CC(C)C[N@H+]1CCO[C@H](CNC(=O)C[NH2+][C@@H](C)c2cccc(Cl)c2)C1 ZINC000154537558 672218265 /nfs/dbraw/zinc/21/82/65/672218265.db2.gz FGFIWHPGHSHDEJ-MAUKXSAKSA-N 2 1 367.921 2.464 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N(CC[NH+](C)C)Cc2ccccc2F)C1 ZINC000194169973 672750582 /nfs/dbraw/zinc/75/05/82/672750582.db2.gz KOLONAQNJFCTJG-KRWDZBQOSA-N 2 1 350.482 2.383 10 0 FEAEMP O[C@H](Cn1ccc2ccccc21)C[NH+]1CCC([NH2+][C@H]2CCCC[C@@H]2O)CC1 ZINC000004299562 207011201 /nfs/dbraw/zinc/01/12/01/207011201.db2.gz YIKVGKGVFYPZHE-ONTIZHBOSA-N 2 1 371.525 2.360 10 0 FEAEMP Cc1[nH+]ccn1-c1cncc(N2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)n1 ZINC000091478873 542810048 /nfs/dbraw/zinc/81/00/48/542810048.db2.gz AMWBGBLBHVFHIC-IYBDPMFKSA-N 2 1 370.501 2.296 10 0 FEAEMP Cc1[nH+]ccn1-c1cncc(N2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)n1 ZINC000091478873 542810052 /nfs/dbraw/zinc/81/00/52/542810052.db2.gz AMWBGBLBHVFHIC-IYBDPMFKSA-N 2 1 370.501 2.296 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc(F)c2)CC1 ZINC000106125624 543204483 /nfs/dbraw/zinc/20/44/83/543204483.db2.gz BTGYIKPNDHSCOU-CABCVRRESA-N 2 1 351.466 2.177 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CCC(=O)Nc2ccc(F)cc2)CC1 ZINC000106124779 543204606 /nfs/dbraw/zinc/20/46/06/543204606.db2.gz RMXQKGDUOMKCDV-OAHLLOKOSA-N 2 1 351.466 2.179 10 0 FEAEMP CCn1cc(C2CC[NH+](CC(=O)NC3CC[NH+](C(C)C)CC3)CC2)cn1 ZINC000114456125 543517113 /nfs/dbraw/zinc/51/71/13/543517113.db2.gz WNBQOIBJAUTQIX-UHFFFAOYSA-N 2 1 361.534 2.071 10 0 FEAEMP Cn1cc(C[N@@H+]2CCCN(C(=O)Nc3cccc(C[NH+](C)C)c3)CC2)cn1 ZINC000115633969 543578535 /nfs/dbraw/zinc/57/85/35/543578535.db2.gz LXGUPDJWUIXCHJ-UHFFFAOYSA-N 2 1 370.501 2.222 10 0 FEAEMP Cn1cc(C[N@H+]2CCCN(C(=O)Nc3cccc(C[NH+](C)C)c3)CC2)cn1 ZINC000115633969 543578537 /nfs/dbraw/zinc/57/85/37/543578537.db2.gz LXGUPDJWUIXCHJ-UHFFFAOYSA-N 2 1 370.501 2.222 10 0 FEAEMP C[NH+](C)C[C@@H]1CN(C(=O)NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)CCO1 ZINC000117040259 543621636 /nfs/dbraw/zinc/62/16/36/543621636.db2.gz KOGCAFGKXDQRDK-VQTJNVASSA-N 2 1 374.529 2.013 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@@H](C)C[NH+]2CCCCC2)C[C@@H]1CC ZINC000117032124 543621671 /nfs/dbraw/zinc/62/16/71/543621671.db2.gz YKBGDKPNBYZTIZ-ROUUACIJSA-N 2 1 354.539 2.003 10 0 FEAEMP Cc1c(OCCCN2CC[NH+](C)CC2)cc(Cl)cc1N1CC[NH2+]CC1 ZINC000150325395 544462449 /nfs/dbraw/zinc/46/24/49/544462449.db2.gz SVQBXJZDAGXPOT-UHFFFAOYSA-N 2 1 366.937 2.074 10 0 FEAEMP CN(C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)n1 ZINC000192713107 328334777 /nfs/dbraw/zinc/33/47/77/328334777.db2.gz KMAZQBAJZCIILG-GOSISDBHSA-N 2 1 373.501 2.013 10 0 FEAEMP CN(C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)n1 ZINC000192713107 328334778 /nfs/dbraw/zinc/33/47/78/328334778.db2.gz KMAZQBAJZCIILG-GOSISDBHSA-N 2 1 373.501 2.013 10 0 FEAEMP CC(C)[C@H](C(=O)NC[C@H](O)C[N@H+]1CCc2ccccc2C1)[NH+]1CCCCC1 ZINC000119875821 326207574 /nfs/dbraw/zinc/20/75/74/326207574.db2.gz FFDVRMSVKGVZIE-LEWJYISDSA-N 2 1 373.541 2.032 10 0 FEAEMP CCn1ccnc1C[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000120302131 326247633 /nfs/dbraw/zinc/24/76/33/326247633.db2.gz DMOAFGGTHUBHPA-UHFFFAOYSA-N 2 1 361.534 2.107 10 0 FEAEMP CC[C@H](NC(=O)N1CC[C@H]([NH+](C)C)C1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000121909170 326375335 /nfs/dbraw/zinc/37/53/35/326375335.db2.gz ZATQOJWJTXFTHI-SLFFLAALSA-N 2 1 374.529 2.012 10 0 FEAEMP CC[C@H](NC(=O)N1CC[C@H]([NH+](C)C)C1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000121909170 326375336 /nfs/dbraw/zinc/37/53/36/326375336.db2.gz ZATQOJWJTXFTHI-SLFFLAALSA-N 2 1 374.529 2.012 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ccc(Br)cn2)CC1 ZINC000171960655 327173004 /nfs/dbraw/zinc/17/30/04/327173004.db2.gz HSPPHXOONZKKHA-ZDUSSCGKSA-N 2 1 356.308 2.369 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)c2ccc(-n3ccnc3)cc2)C[C@@H]1CC ZINC000172297029 327193457 /nfs/dbraw/zinc/19/34/57/327193457.db2.gz AZRRILNBAPIQJM-SFHVURJKSA-N 2 1 356.470 2.445 10 0 FEAEMP CCOCCN1CCN(C(=O)c2ccc(-n3ccnc3)cc2)C[C@@H]1CC ZINC000172297029 327193459 /nfs/dbraw/zinc/19/34/59/327193459.db2.gz AZRRILNBAPIQJM-SFHVURJKSA-N 2 1 356.470 2.445 10 0 FEAEMP COc1ccc(C2(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3COCC[NH2+]3)CCOCC2)cc1 ZINC000262016172 328835678 /nfs/dbraw/zinc/83/56/78/328835678.db2.gz VZWZSTOEXYBUPV-PWRODBHTSA-N 2 1 374.525 2.490 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NC2CC[NH+](Cc3ccccn3)CC2)C1 ZINC000157495537 545748318 /nfs/dbraw/zinc/74/83/18/545748318.db2.gz RXWGZDYPBJEAIN-APWZRJJASA-N 2 1 359.518 2.074 10 0 FEAEMP Cc1nccn1C[C@H]1CCC[N@@H+]1CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000158817701 545897690 /nfs/dbraw/zinc/89/76/90/545897690.db2.gz MOAMDYOCQVFJBR-UXHICEINSA-N 3 1 369.513 2.075 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)N(C)CCOc1ccccc1F ZINC000178325612 546775513 /nfs/dbraw/zinc/77/55/13/546775513.db2.gz JCXGPVALYOEMHS-KRWDZBQOSA-N 2 1 374.460 2.332 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)N(C)CCOc1ccccc1F ZINC000178325612 546775519 /nfs/dbraw/zinc/77/55/19/546775519.db2.gz JCXGPVALYOEMHS-KRWDZBQOSA-N 2 1 374.460 2.332 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000178749685 546843442 /nfs/dbraw/zinc/84/34/42/546843442.db2.gz OMPIYHLRHGOSGQ-LSDHHAIUSA-N 2 1 358.408 2.457 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000178749685 546843447 /nfs/dbraw/zinc/84/34/47/546843447.db2.gz OMPIYHLRHGOSGQ-LSDHHAIUSA-N 2 1 358.408 2.457 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@H](C)C(=O)Nc1ccc2c(c1)OCO2 ZINC000245980044 549031279 /nfs/dbraw/zinc/03/12/79/549031279.db2.gz YCBANVIDIVANHF-CZUORRHYSA-N 2 1 356.426 2.412 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@H](C)C(=O)Nc1ccc2c(c1)OCO2 ZINC000245980044 549031280 /nfs/dbraw/zinc/03/12/80/549031280.db2.gz YCBANVIDIVANHF-CZUORRHYSA-N 2 1 356.426 2.412 10 0 FEAEMP CC[N@H+](C)Cc1cccc(CNC(=O)N2C[C@H]([NH+]3CCOCC3)[C@@H](C)C2)c1 ZINC000246105044 549053429 /nfs/dbraw/zinc/05/34/29/549053429.db2.gz IZNCWAXYMFITFN-PXNSSMCTSA-N 2 1 374.529 2.000 10 0 FEAEMP CC[N@@H+](C)Cc1cccc(CNC(=O)N2C[C@H]([NH+]3CCOCC3)[C@@H](C)C2)c1 ZINC000246105044 549053431 /nfs/dbraw/zinc/05/34/31/549053431.db2.gz IZNCWAXYMFITFN-PXNSSMCTSA-N 2 1 374.529 2.000 10 0 FEAEMP CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)C[C@@H]2C[NH+](Cc3ccccc3)CCO2)C1 ZINC000246803092 549216513 /nfs/dbraw/zinc/21/65/13/549216513.db2.gz DCAWSBTUNCAWJB-MISYRCLQSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)C[C@@H]2C[NH+](Cc3ccccc3)CCO2)C1 ZINC000246803092 549216519 /nfs/dbraw/zinc/21/65/19/549216519.db2.gz DCAWSBTUNCAWJB-MISYRCLQSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)C[C@@H]2C[N@H+](Cc3ccccc3)CCO2)C1 ZINC000246803092 549216524 /nfs/dbraw/zinc/21/65/24/549216524.db2.gz DCAWSBTUNCAWJB-MISYRCLQSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)C[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)C1 ZINC000246803092 549216528 /nfs/dbraw/zinc/21/65/28/549216528.db2.gz DCAWSBTUNCAWJB-MISYRCLQSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)C[C@H]2C[NH+](Cc3ccccc3)CCO2)C1 ZINC000246803076 549217363 /nfs/dbraw/zinc/21/73/63/549217363.db2.gz DCAWSBTUNCAWJB-HOJAQTOUSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)C[C@H]2C[NH+](Cc3ccccc3)CCO2)C1 ZINC000246803076 549217366 /nfs/dbraw/zinc/21/73/66/549217366.db2.gz DCAWSBTUNCAWJB-HOJAQTOUSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@@H](NC(=O)C[C@H]2C[N@H+](Cc3ccccc3)CCO2)C1 ZINC000246803076 549217370 /nfs/dbraw/zinc/21/73/70/549217370.db2.gz DCAWSBTUNCAWJB-HOJAQTOUSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@@H](NC(=O)C[C@H]2C[N@@H+](Cc3ccccc3)CCO2)C1 ZINC000246803076 549217373 /nfs/dbraw/zinc/21/73/73/549217373.db2.gz DCAWSBTUNCAWJB-HOJAQTOUSA-N 2 1 359.514 2.122 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@H]2CCC[NH+]2Cc2ccccc2)CC[N@@H+]1CCOC ZINC000246980774 549256804 /nfs/dbraw/zinc/25/68/04/549256804.db2.gz FLQPJRVXFZNWAO-WOJBJXKFSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@H]2CCC[NH+]2Cc2ccccc2)CC[N@H+]1CCOC ZINC000246980774 549256806 /nfs/dbraw/zinc/25/68/06/549256806.db2.gz FLQPJRVXFZNWAO-WOJBJXKFSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@H]2CCC[N@@H+]2Cc2ccccc2)CC[NH+]1CCOC ZINC000246980774 549256809 /nfs/dbraw/zinc/25/68/09/549256809.db2.gz FLQPJRVXFZNWAO-WOJBJXKFSA-N 2 1 359.514 2.220 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)CC[NH+]1CCOC ZINC000246980774 549256813 /nfs/dbraw/zinc/25/68/13/549256813.db2.gz FLQPJRVXFZNWAO-WOJBJXKFSA-N 2 1 359.514 2.220 10 0 FEAEMP C[C@H](C(=O)N1c2ccccc2C[C@H]1C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247772525 549378787 /nfs/dbraw/zinc/37/87/87/549378787.db2.gz PPJWLHPQQYDRCD-FGTMMUONSA-N 2 1 373.541 2.377 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)CC1 ZINC000247772532 549378957 /nfs/dbraw/zinc/37/89/57/549378957.db2.gz PPJWLHPQQYDRCD-SQNIBIBYSA-N 2 1 373.541 2.377 10 0 FEAEMP CCN(C(=O)[C@H](C)[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1)c1ccccc1 ZINC000247870679 549387837 /nfs/dbraw/zinc/38/78/37/549387837.db2.gz XKVHQNFQJIMASX-ROUUACIJSA-N 2 1 361.530 2.453 10 0 FEAEMP C[C@H]1CCC[N@@H+](CCNC(=O)N2CC[C@@H](C[NH+](C)Cc3cccnc3)C2)C1 ZINC000251714076 549651768 /nfs/dbraw/zinc/65/17/68/549651768.db2.gz KSTMSSHEUVYRII-ICSRJNTNSA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@H]1CCC[NH+](CCNC(=O)N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000251714076 549651770 /nfs/dbraw/zinc/65/17/70/549651770.db2.gz KSTMSSHEUVYRII-ICSRJNTNSA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@H]1CCC[NH+](CCNC(=O)N2CC[C@@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000251714076 549651773 /nfs/dbraw/zinc/65/17/73/549651773.db2.gz KSTMSSHEUVYRII-ICSRJNTNSA-N 2 1 373.545 2.277 10 0 FEAEMP CC[C@@H](C)[N@@H+](C)CCNC(=O)N1CC[C@@H](C[NH+](C)Cc2cccnc2)C1 ZINC000251993660 549658896 /nfs/dbraw/zinc/65/88/96/549658896.db2.gz VKLIAPVYPFOYCT-MJGOQNOKSA-N 2 1 361.534 2.275 10 0 FEAEMP CC[C@@H](C)[NH+](C)CCNC(=O)N1CC[C@@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000251993660 549658899 /nfs/dbraw/zinc/65/88/99/549658899.db2.gz VKLIAPVYPFOYCT-MJGOQNOKSA-N 2 1 361.534 2.275 10 0 FEAEMP CC[C@@H](C)[NH+](C)CCNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000251993660 549658903 /nfs/dbraw/zinc/65/89/03/549658903.db2.gz VKLIAPVYPFOYCT-MJGOQNOKSA-N 2 1 361.534 2.275 10 0 FEAEMP COc1cccc(CNC(=O)[C@@H](C)[N@@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261732037 549748569 /nfs/dbraw/zinc/74/85/69/549748569.db2.gz LYLKZFLTBJTBNI-BSIFCXSSSA-N 2 1 367.493 2.374 10 0 FEAEMP COc1cccc(CNC(=O)[C@@H](C)[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261732037 549748572 /nfs/dbraw/zinc/74/85/72/549748572.db2.gz LYLKZFLTBJTBNI-BSIFCXSSSA-N 2 1 367.493 2.374 10 0 FEAEMP CC(C)c1csc([C@@H]2CCC[N@@H+](CCC(=O)N3CC[NH2+]CC3)C2)n1 ZINC000262008133 549779776 /nfs/dbraw/zinc/77/97/76/549779776.db2.gz FFJPNWJBKKWLSG-OAHLLOKOSA-N 2 1 350.532 2.268 10 0 FEAEMP Cc1ccc(NC(=O)[C@@H]2CC[C@@H]([NH3+])C2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000263270219 549891002 /nfs/dbraw/zinc/89/10/02/549891002.db2.gz OUTCBVRTIPOINU-HZPDHXFCSA-N 2 1 358.486 2.485 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CCC(=O)NCC2CCCCC2)CC1 ZINC000109005513 543310490 /nfs/dbraw/zinc/31/04/90/543310490.db2.gz FCYOYZRNIISFHQ-KRWDZBQOSA-N 2 1 353.551 2.098 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NC1CC[NH+](CCOC(C)C)CC1 ZINC000124406587 543819508 /nfs/dbraw/zinc/81/95/08/543819508.db2.gz CHELOXANUIMGOO-LJQANCHMSA-N 2 1 368.566 2.295 10 0 FEAEMP Cc1c(OCCC[NH+]2CCOCC2)cc(Cl)cc1N1CC[NH2+]CC1 ZINC000150197851 544460921 /nfs/dbraw/zinc/46/09/21/544460921.db2.gz VYHIONPWWCKWOF-UHFFFAOYSA-N 2 1 353.894 2.159 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N(C)C[C@@H]2CCC[N@H+]2CC)cc1 ZINC000189462945 328149697 /nfs/dbraw/zinc/14/96/97/328149697.db2.gz BHFCTTYKOMLJNP-IBGZPJMESA-N 2 1 374.529 2.410 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)cc1 ZINC000189495496 328151684 /nfs/dbraw/zinc/15/16/84/328151684.db2.gz KLURGIBCIBVVNS-QFBILLFUSA-N 2 1 372.513 2.162 10 0 FEAEMP C[C@H](C[NH+]1CCCCC1)NC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190692729 328225110 /nfs/dbraw/zinc/22/51/10/328225110.db2.gz WYWNCCZSUGKLOH-UYAOXDASSA-N 2 1 373.545 2.419 10 0 FEAEMP CCCC[NH+]1CCC(NC(=O)N2CC[N@@H+](CCOC)[C@H](CC)C2)CC1 ZINC000117488665 326062549 /nfs/dbraw/zinc/06/25/49/326062549.db2.gz AGXBNHBNRHZXQK-GOSISDBHSA-N 2 1 354.539 2.003 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)C[C@H](O)COc2ccc(Cl)cc2)CC1 ZINC000170941842 327108963 /nfs/dbraw/zinc/10/89/63/327108963.db2.gz HOSJUITULOFYQS-YJBOKZPZSA-N 2 1 370.921 2.104 10 0 FEAEMP c1ccc(-c2ccc(NCC[NH2+][C@@H]3CCC[C@H]3[C@H]3COCC[NH2+]3)nn2)cc1 ZINC000262011565 328834936 /nfs/dbraw/zinc/83/49/36/328834936.db2.gz VOTFUXBZNDTAFQ-MISYRCLQSA-N 2 1 367.497 2.302 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000177448880 546619930 /nfs/dbraw/zinc/61/99/30/546619930.db2.gz CZDRCGVTLKNINN-SFHVURJKSA-N 2 1 362.518 2.253 10 0 FEAEMP COCc1cccc(CNC(=O)C[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000178746250 546842514 /nfs/dbraw/zinc/84/25/14/546842514.db2.gz KJTTYHYICCTXCS-IBGZPJMESA-N 2 1 356.470 2.119 10 0 FEAEMP COCc1cccc(CNC(=O)C[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000178746250 546842518 /nfs/dbraw/zinc/84/25/18/546842518.db2.gz KJTTYHYICCTXCS-IBGZPJMESA-N 2 1 356.470 2.119 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@H](C)C(C)(C)C[NH+](C)C)C[C@@H]1CC ZINC000246373989 549118400 /nfs/dbraw/zinc/11/84/00/549118400.db2.gz RAIFTEDKNDIGFC-SJORKVTESA-N 2 1 356.555 2.105 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1C[C@H]2CCC[N@@H+]2C[C@H]1C ZINC000248783786 549501540 /nfs/dbraw/zinc/50/15/40/549501540.db2.gz IDKYZTZSRQAXAP-LFGUQSLTSA-N 2 1 356.514 2.385 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1C[C@H]2CCC[N@H+]2C[C@H]1C ZINC000248783786 549501541 /nfs/dbraw/zinc/50/15/41/549501541.db2.gz IDKYZTZSRQAXAP-LFGUQSLTSA-N 2 1 356.514 2.385 10 0 FEAEMP [NH3+]C1(C(=O)NC[C@H]2CCCC[N@H+]2Cc2cccc(Cl)c2)CCOCC1 ZINC000261929928 549770894 /nfs/dbraw/zinc/77/08/94/549770894.db2.gz WBRHVOFTAOYEIS-QGZVFWFLSA-N 2 1 365.905 2.319 10 0 FEAEMP O=C(Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c1)[C@H]1CCCO1 ZINC000262016359 549780463 /nfs/dbraw/zinc/78/04/63/549780463.db2.gz WCHBPIDEHZITOK-MTQWCTHYSA-N 2 1 373.497 2.051 10 0 FEAEMP O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000653120730 677516742 /nfs/dbraw/zinc/51/67/42/677516742.db2.gz YQJWEPFWAMFKGE-ARFHVFGLSA-N 2 1 355.404 2.165 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)NC2(c3ccccc3)CCC2)CC1 ZINC000106124724 543204397 /nfs/dbraw/zinc/20/43/97/543204397.db2.gz CDGAGSJBVVBIQT-GOSISDBHSA-N 2 1 373.541 2.207 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N1C[C@H]2CCC[N@@H+]2C[C@@H]1C)[NH+]1CCOCC1 ZINC000113586984 543491364 /nfs/dbraw/zinc/49/13/64/543491364.db2.gz OZEMXPCFWZJIFF-UHOSZYNNSA-N 2 1 366.550 2.002 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N1C[C@H]2CCC[N@H+]2C[C@@H]1C)[NH+]1CCOCC1 ZINC000113586984 543491367 /nfs/dbraw/zinc/49/13/67/543491367.db2.gz OZEMXPCFWZJIFF-UHOSZYNNSA-N 2 1 366.550 2.002 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCC(C)(C)[NH+]2CCCCC2)CC[N@H+]1CCOC ZINC000117470485 543632509 /nfs/dbraw/zinc/63/25/09/543632509.db2.gz CNYJOWDFHXBZJU-QGZVFWFLSA-N 2 1 354.539 2.003 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)[C@@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000127647186 544005964 /nfs/dbraw/zinc/00/59/64/544005964.db2.gz CLIRBZMBJIWYTK-SJORKVTESA-N 2 1 357.502 2.353 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000127647186 544005966 /nfs/dbraw/zinc/00/59/66/544005966.db2.gz CLIRBZMBJIWYTK-SJORKVTESA-N 2 1 357.502 2.353 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N[C@H](c2ccccc2)C2CC2)CC1 ZINC000247545228 549353562 /nfs/dbraw/zinc/35/35/62/549353562.db2.gz DLIMOKOBGJWPRS-VGOFRKELSA-N 2 1 373.541 2.279 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N[C@H](c2ccccc2)C2CC2)CC1 ZINC000247545226 549353816 /nfs/dbraw/zinc/35/38/16/549353816.db2.gz DLIMOKOBGJWPRS-HTAPYJJXSA-N 2 1 373.541 2.279 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1)[NH+](C)C1CC1 ZINC000190707536 328226480 /nfs/dbraw/zinc/22/64/80/328226480.db2.gz TVBXXXGBVWGPJX-WMZOPIPTSA-N 2 1 359.518 2.028 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[C@@H](C[NH+](C)Cc2cccnc2)C1)[N@H+](C)C1CC1 ZINC000190707536 328226482 /nfs/dbraw/zinc/22/64/82/328226482.db2.gz TVBXXXGBVWGPJX-WMZOPIPTSA-N 2 1 359.518 2.028 10 0 FEAEMP CC(C)[NH+]1CCN(CCC[N@H+]2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)CC1 ZINC000191592536 328273000 /nfs/dbraw/zinc/27/30/00/328273000.db2.gz DCARWOVWYPFSHK-FXAWDEMLSA-N 2 1 367.484 2.489 10 0 FEAEMP CC[NH+](CC)[C@@H](CNC(=O)[C@@H]1COCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000236830465 328495500 /nfs/dbraw/zinc/49/55/00/328495500.db2.gz XMIOIEYPLRELBV-HOTGVXAUSA-N 2 1 373.419 2.193 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)C[C@H]1CC ZINC000117023542 326047874 /nfs/dbraw/zinc/04/78/74/326047874.db2.gz UQYKRVTVCLJYTJ-QGZVFWFLSA-N 2 1 368.566 2.438 10 0 FEAEMP [NH3+][C@H]1CCC[C@@H](C(=O)Nc2ccc3c(ccn3CC[NH+]3CCOCC3)c2)C1 ZINC000166162566 327080836 /nfs/dbraw/zinc/08/08/36/327080836.db2.gz AVQMVYCUZUXTPR-MSOLQXFVSA-N 2 1 370.497 2.430 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CC[NH+](C)CC2)c1 ZINC000173471800 327259751 /nfs/dbraw/zinc/25/97/51/327259751.db2.gz BQADEWOKPAUVSK-NHCUHLMSSA-N 2 1 370.541 2.133 10 0 FEAEMP C([NH2+][C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1)C1(CN2CCOCC2)CCCCC1 ZINC000261841249 328823594 /nfs/dbraw/zinc/82/35/94/328823594.db2.gz AIQSDUOPEXKVDN-XUVXKRRUSA-N 2 1 365.562 2.016 10 0 FEAEMP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c(O[C@@H]2CCOC2)c1 ZINC000261951148 328831376 /nfs/dbraw/zinc/83/13/76/328831376.db2.gz OHIFJCJXQZQUBZ-IYWMVGAKSA-N 2 1 360.498 2.409 10 0 FEAEMP Cc1cc(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)n(CC[NH+](C)C)n1 ZINC000082097503 526253674 /nfs/dbraw/zinc/25/36/74/526253674.db2.gz JMZYXPBDSHGFGL-UHFFFAOYSA-N 2 1 369.513 2.020 10 0 FEAEMP C[C@@H]1C[C@H](NC(=O)N2CCO[C@H](C[NH+](C)C)C2)CC[N@H+]1Cc1ccccc1 ZINC000175645908 546327571 /nfs/dbraw/zinc/32/75/71/546327571.db2.gz OFKYVPOCTDVADY-MISYRCLQSA-N 2 1 374.529 2.012 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ccccc2N2CCOCC2)CC1 ZINC000179517410 546969604 /nfs/dbraw/zinc/96/96/04/546969604.db2.gz FGOBYTXXGRPCPO-SFHVURJKSA-N 2 1 361.530 2.048 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179751906 547007376 /nfs/dbraw/zinc/00/73/76/547007376.db2.gz KXRMYHPZYFUABS-LJQANCHMSA-N 2 1 359.518 2.424 10 0 FEAEMP C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N1CC[NH+](C2CCOCC2)CC1 ZINC000181321430 547292446 /nfs/dbraw/zinc/29/24/46/547292446.db2.gz HRXNBXRFNNMCKK-SFHVURJKSA-N 2 1 374.529 2.013 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(C)C(=O)[C@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000245438951 548919894 /nfs/dbraw/zinc/91/98/94/548919894.db2.gz YWOOGNCSWMBOFN-ICSRJNTNSA-N 2 1 359.514 2.127 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)[C@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000245438951 548919897 /nfs/dbraw/zinc/91/98/97/548919897.db2.gz YWOOGNCSWMBOFN-ICSRJNTNSA-N 2 1 359.514 2.127 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC[C@H](c1cccc(OC)c1)[NH+](C)C ZINC000245469032 548929455 /nfs/dbraw/zinc/92/94/55/548929455.db2.gz LILVOSCABSITBG-PKOBYXMFSA-N 2 1 362.518 2.424 10 0 FEAEMP c1ccc(CN2CC[N@H+]3CCC[C@H]3C2)c(CN2CC[NH+]3CCC[C@@H]3C2)c1 ZINC000245896119 549013265 /nfs/dbraw/zinc/01/32/65/549013265.db2.gz SLDXHXACUKOAOZ-SZPZYZBQSA-N 2 1 354.542 2.247 10 0 FEAEMP c1ccc(CN2CC[NH+]3CCC[C@H]3C2)c(CN2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000245896119 549013270 /nfs/dbraw/zinc/01/32/70/549013270.db2.gz SLDXHXACUKOAOZ-SZPZYZBQSA-N 2 1 354.542 2.247 10 0 FEAEMP c1ccc(CN2CC[NH+]3CCC[C@H]3C2)c(CN2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000245896119 549013273 /nfs/dbraw/zinc/01/32/73/549013273.db2.gz SLDXHXACUKOAOZ-SZPZYZBQSA-N 2 1 354.542 2.247 10 0 FEAEMP C[C@H](c1cn(-c2ccccc2)nn1)[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000246642936 549181419 /nfs/dbraw/zinc/18/14/19/549181419.db2.gz CLIRBZMBJIWYTK-DLBZAZTESA-N 2 1 357.502 2.353 10 0 FEAEMP C[C@H](c1cn(-c2ccccc2)nn1)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000246642936 549181423 /nfs/dbraw/zinc/18/14/23/549181423.db2.gz CLIRBZMBJIWYTK-DLBZAZTESA-N 2 1 357.502 2.353 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@@H]1C)[NH+]1CCc2sccc2C1 ZINC000246961304 549251634 /nfs/dbraw/zinc/25/16/34/549251634.db2.gz DJXINOAIJQGHCY-VYDXJSESSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[N@H+]2C[C@@H]1C)[NH+]1CCc2sccc2C1 ZINC000246961304 549251635 /nfs/dbraw/zinc/25/16/35/549251635.db2.gz DJXINOAIJQGHCY-VYDXJSESSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[NH+]2C[C@@H]1C)[N@@H+]1CCc2sccc2C1 ZINC000246961304 549251639 /nfs/dbraw/zinc/25/16/39/549251639.db2.gz DJXINOAIJQGHCY-VYDXJSESSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[NH+]2C[C@@H]1C)[N@H+]1CCc2sccc2C1 ZINC000246961304 549251643 /nfs/dbraw/zinc/25/16/43/549251643.db2.gz DJXINOAIJQGHCY-VYDXJSESSA-N 2 1 362.543 2.373 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000247115329 549285384 /nfs/dbraw/zinc/28/53/84/549285384.db2.gz RKAFRKQFAJUTNZ-PBHICJAKSA-N 2 1 355.442 2.393 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@H](C)C(=O)NC(=O)Nc1ccccc1 ZINC000247115329 549285389 /nfs/dbraw/zinc/28/53/89/549285389.db2.gz RKAFRKQFAJUTNZ-PBHICJAKSA-N 2 1 355.442 2.393 10 0 FEAEMP Cc1ccc(OC[C@H](O)C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c(C)c1 ZINC000247809431 549383145 /nfs/dbraw/zinc/38/31/45/549383145.db2.gz UJDDKOORALPCPU-AZUAARDMSA-N 2 1 364.530 2.068 10 0 FEAEMP CC[C@H](C)[N@@H+](C)CCNC(=O)N1CC[C@@H](C[NH+](C)Cc2cccnc2)C1 ZINC000251993656 549659664 /nfs/dbraw/zinc/65/96/64/549659664.db2.gz VKLIAPVYPFOYCT-HKUYNNGSSA-N 2 1 361.534 2.275 10 0 FEAEMP CC[C@H](C)[NH+](C)CCNC(=O)N1CC[C@@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000251993656 549659668 /nfs/dbraw/zinc/65/96/68/549659668.db2.gz VKLIAPVYPFOYCT-HKUYNNGSSA-N 2 1 361.534 2.275 10 0 FEAEMP CC[C@H](C)[NH+](C)CCNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000251993656 549659671 /nfs/dbraw/zinc/65/96/71/549659671.db2.gz VKLIAPVYPFOYCT-HKUYNNGSSA-N 2 1 361.534 2.275 10 0 FEAEMP CN(Cc1noc(C[NH3+])n1)CC1(c2ccc(Br)cc2)CC1 ZINC000261746047 549750813 /nfs/dbraw/zinc/75/08/13/549750813.db2.gz NBJPXYNSEUQGEB-UHFFFAOYSA-N 2 1 351.248 2.454 10 0 FEAEMP O[C@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000263220928 549886846 /nfs/dbraw/zinc/88/68/46/549886846.db2.gz LUOWEXUWBPUVMF-SKDRFNHKSA-N 2 1 353.182 2.138 10 0 FEAEMP CN(C)c1ncc(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1C ZINC000311552021 553755003 /nfs/dbraw/zinc/75/50/03/553755003.db2.gz PVGMYGGEURXZGH-DFQSSKMNSA-N 2 1 353.514 2.486 10 0 FEAEMP O[C@@H](C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CCCO1)COCc1ccco1 ZINC000390985666 558613185 /nfs/dbraw/zinc/61/31/85/558613185.db2.gz XSABQFMTYHTCEF-FPOVZHCZSA-N 2 1 374.481 2.038 10 0 FEAEMP O[C@@H](C[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)COCc1ccco1 ZINC000390985666 558613186 /nfs/dbraw/zinc/61/31/86/558613186.db2.gz XSABQFMTYHTCEF-FPOVZHCZSA-N 2 1 374.481 2.038 10 0 FEAEMP COCC[N@H+]1C[C@@H](CO)C2(C1)CC[NH+](Cc1ccc(F)c(F)c1)CC2 ZINC000169789531 672322767 /nfs/dbraw/zinc/32/27/67/672322767.db2.gz JHLUWOIQPYLPTA-INIZCTEOSA-N 2 1 354.441 2.118 10 0 FEAEMP C[C@H]([NH2+]C1CC[NH+](CCO)CC1)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000716584477 673075624 /nfs/dbraw/zinc/07/56/24/673075624.db2.gz UIMALCSBQKEFRR-HNNXBMFYSA-N 2 1 355.523 2.068 10 0 FEAEMP c1ccc(C[N@@H+]2CC[C@H](CCNc3ncnc4c3CC[NH2+]CC4)C2)cc1 ZINC000072427853 210064758 /nfs/dbraw/zinc/06/47/58/210064758.db2.gz RXXYUSYZEVUECO-SFHVURJKSA-N 2 1 351.498 2.489 10 0 FEAEMP COc1ccc(C[NH2+]Cc2ccncc2)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000012436240 539560326 /nfs/dbraw/zinc/56/03/26/539560326.db2.gz HJOUCSNSTJIWKI-IBGZPJMESA-N 2 1 373.497 2.460 10 0 FEAEMP CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H](C1CC[NH+](C(C)C)CC1)[NH2+][C@]2(CO)CC(C)C ZINC000065410055 221216655 /nfs/dbraw/zinc/21/66/55/221216655.db2.gz VPFMNFPZNHFNSF-MHTWAQMVSA-N 3 1 351.579 2.424 10 0 FEAEMP CCN1C[C@H]2[C@@H](C1)[C@@H](C1CC[NH+](C(C)C)CC1)[NH2+][C@]2(CO)CC(C)C ZINC000065410055 221216656 /nfs/dbraw/zinc/21/66/56/221216656.db2.gz VPFMNFPZNHFNSF-MHTWAQMVSA-N 2 1 351.579 2.424 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)NC2CCC(C)CC2)CC1 ZINC000106124995 543204757 /nfs/dbraw/zinc/20/47/57/543204757.db2.gz SPTVJESGLKNMGR-ISXWCOSWSA-N 2 1 353.551 2.094 10 0 FEAEMP Cc1ccc(CNC(=O)[C@@H](C)[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1 ZINC000106125717 543204931 /nfs/dbraw/zinc/20/49/31/543204931.db2.gz ILDVCOIPRHEGJR-QZTJIDSGSA-N 2 1 361.530 2.024 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1cccc(OCC[NH+](C)C)c1 ZINC000113589124 543491718 /nfs/dbraw/zinc/49/17/18/543491718.db2.gz USKDJCYMVAWSFZ-SJLPKXTDSA-N 2 1 360.502 2.005 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C[C@@H]1C ZINC000117476809 543633478 /nfs/dbraw/zinc/63/34/78/543633478.db2.gz HRTYBQVCSMTSIG-SFHVURJKSA-N 2 1 374.529 2.145 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C[C@@H]1C ZINC000117476809 543633482 /nfs/dbraw/zinc/63/34/82/543633482.db2.gz HRTYBQVCSMTSIG-SFHVURJKSA-N 2 1 374.529 2.145 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)c2ccc(C[NH+]3CCC(CO)CC3)cc2)[C@@H](C)C1 ZINC000121298677 326328183 /nfs/dbraw/zinc/32/81/83/326328183.db2.gz UYFVPONQXJKIKF-UWJYYQICSA-N 2 1 373.541 2.349 10 0 FEAEMP CC[C@@H]1CN(C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@H+]1C[C@@H](C)O ZINC000174623542 327339401 /nfs/dbraw/zinc/33/94/01/327339401.db2.gz JLPYUKYLCROOED-YLJYHZDGSA-N 2 1 359.514 2.200 10 0 FEAEMP O=C(c1ccccc1)N1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)CC1 ZINC000261958185 328831853 /nfs/dbraw/zinc/83/18/53/328831853.db2.gz PDFRZTTWRABACW-NJYVYQBISA-N 2 1 371.525 2.286 10 0 FEAEMP c1ccc(-c2ccc(NCC[NH2+][C@@H]3CCC[C@H]3[C@@H]3COCC[NH2+]3)nn2)cc1 ZINC000262011567 328834924 /nfs/dbraw/zinc/83/49/24/328834924.db2.gz VOTFUXBZNDTAFQ-RLLQIKCJSA-N 2 1 367.497 2.302 10 0 FEAEMP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1 ZINC000262048439 328838059 /nfs/dbraw/zinc/83/80/59/328838059.db2.gz ZIWDIYDVGRHTFR-VSKRKVRLSA-N 3 1 373.541 2.408 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCCC[NH+]2CCc3ccccc3C2)[C@@H](C)C1 ZINC000157178514 545710612 /nfs/dbraw/zinc/71/06/12/545710612.db2.gz AZVIJUKOWOYGBG-PXNSSMCTSA-N 2 1 358.530 2.463 10 0 FEAEMP CC(C)[NH+]1C[C@H](NC(=O)NCCC[N@@H+]2CCc3ccccc3C2)[C@@H](C)C1 ZINC000157178514 545710616 /nfs/dbraw/zinc/71/06/16/545710616.db2.gz AZVIJUKOWOYGBG-PXNSSMCTSA-N 2 1 358.530 2.463 10 0 FEAEMP CC(C)[NH+]1C[C@H](NC(=O)NCCC[N@H+]2CCc3ccccc3C2)[C@@H](C)C1 ZINC000157178514 545710619 /nfs/dbraw/zinc/71/06/19/545710619.db2.gz AZVIJUKOWOYGBG-PXNSSMCTSA-N 2 1 358.530 2.463 10 0 FEAEMP Cc1cnn([C@H]2CCC[N@@H+](CC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)C2)c1 ZINC000158423765 545860081 /nfs/dbraw/zinc/86/00/81/545860081.db2.gz ZPVKDPDJZATEPC-PMACEKPBSA-N 2 1 369.513 2.248 10 0 FEAEMP Cc1cnn([C@H]2CCC[N@H+](CC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)C2)c1 ZINC000158423765 545860085 /nfs/dbraw/zinc/86/00/85/545860085.db2.gz ZPVKDPDJZATEPC-PMACEKPBSA-N 2 1 369.513 2.248 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(C)C(=O)[C@@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000177422840 546614591 /nfs/dbraw/zinc/61/45/91/546614591.db2.gz YWOOGNCSWMBOFN-AZUAARDMSA-N 2 1 359.514 2.127 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)[C@@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000177422840 546614596 /nfs/dbraw/zinc/61/45/96/546614596.db2.gz YWOOGNCSWMBOFN-AZUAARDMSA-N 2 1 359.514 2.127 10 0 FEAEMP COc1cccc(CN(C)C(=O)C[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000178314175 546774241 /nfs/dbraw/zinc/77/42/41/546774241.db2.gz JFUQPNBYZVDMAR-SFHVURJKSA-N 2 1 356.470 2.323 10 0 FEAEMP COc1cccc(CN(C)C(=O)C[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000178314175 546774243 /nfs/dbraw/zinc/77/42/43/546774243.db2.gz JFUQPNBYZVDMAR-SFHVURJKSA-N 2 1 356.470 2.323 10 0 FEAEMP O=C(C[N@@H+]1CCCC[C@H]1c1cn[nH]c1)N1CCN(Cc2cccs2)CC1 ZINC000178871845 546864536 /nfs/dbraw/zinc/86/45/36/546864536.db2.gz UDWGJHOMINGYFB-SFHVURJKSA-N 2 1 373.526 2.343 10 0 FEAEMP CCO[C@@H]1C[C@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C12CCOCC2 ZINC000186372275 548126126 /nfs/dbraw/zinc/12/61/26/548126126.db2.gz YSLYOQDUMVNOMX-RBUKOAKNSA-N 2 1 354.535 2.440 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@@H]2CCCC[N@@H+]2Cc2ccccc2)CC1 ZINC000194526420 548494240 /nfs/dbraw/zinc/49/42/40/548494240.db2.gz PNHLRNPSLLOUPS-FQEVSTJZSA-N 2 1 374.529 2.015 10 0 FEAEMP COCC[NH+]1CCN(C(=O)NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)CC1 ZINC000194526420 548494248 /nfs/dbraw/zinc/49/42/48/548494248.db2.gz PNHLRNPSLLOUPS-FQEVSTJZSA-N 2 1 374.529 2.015 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)Nc2ccccc2CN2CCOCC2)C1 ZINC000246272158 549093910 /nfs/dbraw/zinc/09/39/10/549093910.db2.gz ARTASOPGTDHLEL-QFBILLFUSA-N 2 1 360.502 2.369 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NC[C@H](c2cccc(F)c2)[NH+](C)C)C1 ZINC000246724185 549196676 /nfs/dbraw/zinc/19/66/76/549196676.db2.gz AGNHEQQHVDWTAN-ZTFGCOKTSA-N 2 1 350.482 2.456 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@H]2CCC[NH+](C(C)C)C2)C[C@H]1CC ZINC000246924534 549242980 /nfs/dbraw/zinc/24/29/80/549242980.db2.gz BKEQHJYJTMECMR-RTBURBONSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@H]2CCC[N@@H+](C(C)C)C2)C[C@H]1CC ZINC000246924534 549242983 /nfs/dbraw/zinc/24/29/83/549242983.db2.gz BKEQHJYJTMECMR-RTBURBONSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)C[C@H]1CC ZINC000246924534 549242985 /nfs/dbraw/zinc/24/29/85/549242985.db2.gz BKEQHJYJTMECMR-RTBURBONSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCCN1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000247201078 549298869 /nfs/dbraw/zinc/29/88/69/549298869.db2.gz TUKZBGCJFATQOM-CTNGQTDRSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[N@@H+]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000247201078 549298872 /nfs/dbraw/zinc/29/88/72/549298872.db2.gz TUKZBGCJFATQOM-CTNGQTDRSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000247201078 549298874 /nfs/dbraw/zinc/29/88/74/549298874.db2.gz TUKZBGCJFATQOM-CTNGQTDRSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000247201078 549298877 /nfs/dbraw/zinc/29/88/77/549298877.db2.gz TUKZBGCJFATQOM-CTNGQTDRSA-N 2 1 373.541 2.468 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000247201078 549298880 /nfs/dbraw/zinc/29/88/80/549298880.db2.gz TUKZBGCJFATQOM-CTNGQTDRSA-N 2 1 373.541 2.468 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)cc1 ZINC000248764420 549497771 /nfs/dbraw/zinc/49/77/71/549497771.db2.gz NGAZUVHKGPAPSV-VQIMIIECSA-N 2 1 374.529 2.312 10 0 FEAEMP CC(C)n1cc(C[NH+]2CCC3(CC[C@@H](C[NH+]4CCOCC4)O3)CC2)cn1 ZINC000257188463 549714422 /nfs/dbraw/zinc/71/44/22/549714422.db2.gz FNCITFDPEJFPQT-IBGZPJMESA-N 2 1 362.518 2.310 10 0 FEAEMP COc1ccccc1CN(C)C(=O)C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261748303 549750711 /nfs/dbraw/zinc/75/07/11/549750711.db2.gz NCONIQUZNJVLSG-UXHICEINSA-N 2 1 367.493 2.328 10 0 FEAEMP COc1ccccc1CN(C)C(=O)C[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261748303 549750716 /nfs/dbraw/zinc/75/07/16/549750716.db2.gz NCONIQUZNJVLSG-UXHICEINSA-N 2 1 367.493 2.328 10 0 FEAEMP O=C1CCCN1Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)cc1 ZINC000261929388 549771430 /nfs/dbraw/zinc/77/14/30/549771430.db2.gz LLUVPYNLWDTLNM-XUVXKRRUSA-N 2 1 357.498 2.056 10 0 FEAEMP Fc1ccc(-n2ccc(CC[NH2+][C@@H]3CCC[C@H]3[C@H]3COCC[NH2+]3)n2)cc1 ZINC000261954394 549773521 /nfs/dbraw/zinc/77/35/21/549773521.db2.gz OTHIJYGRTWOFJP-VAMGGRTRSA-N 2 1 358.461 2.301 10 0 FEAEMP C[C@H](C(=O)NC(=O)NC1CCCCC1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262300773 549807961 /nfs/dbraw/zinc/80/79/61/549807961.db2.gz XKQYWKYAIQJIHK-SUMDDJOVSA-N 2 1 372.513 2.208 10 0 FEAEMP C[C@H](C(=O)NC(=O)NC1CCCCC1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262300773 549807966 /nfs/dbraw/zinc/80/79/66/549807966.db2.gz XKQYWKYAIQJIHK-SUMDDJOVSA-N 2 1 372.513 2.208 10 0 FEAEMP C[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000365115985 555489130 /nfs/dbraw/zinc/48/91/30/555489130.db2.gz HSGSCLNHLPXRFS-MWDXBVQZSA-N 2 1 353.507 2.085 10 0 FEAEMP C[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@@H]2CO1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000365115985 555489133 /nfs/dbraw/zinc/48/91/33/555489133.db2.gz HSGSCLNHLPXRFS-MWDXBVQZSA-N 2 1 353.507 2.085 10 0 FEAEMP O[C@](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1)(c1ccccc1)C(F)(F)F ZINC000261852285 672904166 /nfs/dbraw/zinc/90/41/66/672904166.db2.gz BINVCJUNBLNBQW-YLFCFFPRSA-N 2 1 358.404 2.183 10 0 FEAEMP C[N@H+](CC(=O)NC1CCCC1)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106128075 543204646 /nfs/dbraw/zinc/20/46/46/543204646.db2.gz UMFLNXLIXCAOMS-NRFANRHFSA-N 2 1 373.541 2.423 10 0 FEAEMP CCN(C(=O)[C@H](C)[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1)c1ccccc1 ZINC000106125713 543204797 /nfs/dbraw/zinc/20/47/97/543204797.db2.gz XKVHQNFQJIMASX-MSOLQXFVSA-N 2 1 361.530 2.453 10 0 FEAEMP CC(C)N(C(=O)C[N@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1)c1ccccc1 ZINC000106126741 543204956 /nfs/dbraw/zinc/20/49/56/543204956.db2.gz BYODCIYNLCXICZ-GOSISDBHSA-N 2 1 361.530 2.453 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N[C@@H](c2ccccc2)C2CC2)CC1 ZINC000106125063 543204976 /nfs/dbraw/zinc/20/49/76/543204976.db2.gz DLIMOKOBGJWPRS-JTSKRJEESA-N 2 1 373.541 2.279 10 0 FEAEMP Cc1nc(C[NH+]2CCC(C(=O)N3C[C@H]4CCC[N@H+]4C[C@@H]3C)CC2)cs1 ZINC000113231314 543478673 /nfs/dbraw/zinc/47/86/73/543478673.db2.gz SSCSOXJOVYNTLJ-KBXCAEBGSA-N 2 1 362.543 2.359 10 0 FEAEMP Cc1nc(C[NH+]2CCC(C(=O)N3C[C@H]4CCC[N@@H+]4C[C@@H]3C)CC2)cs1 ZINC000113231314 543478675 /nfs/dbraw/zinc/47/86/75/543478675.db2.gz SSCSOXJOVYNTLJ-KBXCAEBGSA-N 2 1 362.543 2.359 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC[C@H]1CC[NH+](CCc2ccccc2)C1 ZINC000247470025 549338481 /nfs/dbraw/zinc/33/84/81/549338481.db2.gz RPJKSKFEBDWEGA-NRSPTQNISA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000247470025 549338485 /nfs/dbraw/zinc/33/84/85/549338485.db2.gz RPJKSKFEBDWEGA-NRSPTQNISA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000247470025 549338490 /nfs/dbraw/zinc/33/84/90/549338490.db2.gz RPJKSKFEBDWEGA-NRSPTQNISA-N 2 1 370.541 2.429 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@H+](C)[C@@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000189181062 328133503 /nfs/dbraw/zinc/13/35/03/328133503.db2.gz JHLJMGMVNKKBJL-HOTGVXAUSA-N 2 1 364.538 2.264 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2nnnn2C2CCCCC2)CC1 ZINC000189181062 328133505 /nfs/dbraw/zinc/13/35/05/328133505.db2.gz JHLJMGMVNKKBJL-HOTGVXAUSA-N 2 1 364.538 2.264 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1)[NH+](C)C1CC1 ZINC000190707499 328226310 /nfs/dbraw/zinc/22/63/10/328226310.db2.gz TVBXXXGBVWGPJX-FUHWJXTLSA-N 2 1 359.518 2.028 10 0 FEAEMP C[C@@H](CNC(=O)N1CC[C@H](C[NH+](C)Cc2cccnc2)C1)[N@H+](C)C1CC1 ZINC000190707499 328226311 /nfs/dbraw/zinc/22/63/11/328226311.db2.gz TVBXXXGBVWGPJX-FUHWJXTLSA-N 2 1 359.518 2.028 10 0 FEAEMP COCCOc1cccc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c1 ZINC000121091476 326312582 /nfs/dbraw/zinc/31/25/82/326312582.db2.gz WWLDAFUOLRVNLR-QGZVFWFLSA-N 2 1 350.503 2.236 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)NCCCC2CCCCC2)CC1 ZINC000170941720 327109029 /nfs/dbraw/zinc/10/90/29/327109029.db2.gz LSFNYEVZEAKYCE-SFHVURJKSA-N 2 1 367.578 2.488 10 0 FEAEMP CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)[C@@H]([NH2+]C2CCOCC2)C(C)C)C1 ZINC000173157214 327238119 /nfs/dbraw/zinc/23/81/19/327238119.db2.gz NORNBPNONVDNAL-MJGOQNOKSA-N 2 1 362.518 2.402 10 0 FEAEMP CC[C@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1C[C@@H](C)O ZINC000173361821 327252132 /nfs/dbraw/zinc/25/21/32/327252132.db2.gz XFZYQWIQNMAXKQ-CVEARBPZSA-N 2 1 373.497 2.412 10 0 FEAEMP CC[C@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@H+]1C[C@@H](C)O ZINC000173361821 327252133 /nfs/dbraw/zinc/25/21/33/327252133.db2.gz XFZYQWIQNMAXKQ-CVEARBPZSA-N 2 1 373.497 2.412 10 0 FEAEMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)Nc2ccn(CC[NH+](C)C)n2)C1 ZINC000173954688 327297500 /nfs/dbraw/zinc/29/75/00/327297500.db2.gz FFKFORMMQKJWTH-HNNXBMFYSA-N 2 1 359.478 2.073 10 0 FEAEMP COc1cc(OC)c(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)c(OC)c1 ZINC000261901890 328828132 /nfs/dbraw/zinc/82/81/32/328828132.db2.gz HTDNBZBAVHRIMJ-NXHRZFHOSA-N 2 1 364.486 2.002 10 0 FEAEMP C[C@H]1CN(C(=O)NCCCCC[NH+]2CCCCC2)C[C@@H]1[NH+]1CCOCC1 ZINC000175800765 546353166 /nfs/dbraw/zinc/35/31/66/546353166.db2.gz MCBILILKTWWTRU-OALUTQOASA-N 2 1 366.550 2.005 10 0 FEAEMP Cn1cc(C[N@H+]2CCCN(CC[NH+](C)Cc3ccc(F)cc3)CC2)cn1 ZINC000181691054 547360873 /nfs/dbraw/zinc/36/08/73/547360873.db2.gz CHRRHPQVJCGVFA-UHFFFAOYSA-N 2 1 359.493 2.199 10 0 FEAEMP Cn1cc(C[NH+]2CCCN(CC[N@H+](C)Cc3ccc(F)cc3)CC2)cn1 ZINC000181691054 547360878 /nfs/dbraw/zinc/36/08/78/547360878.db2.gz CHRRHPQVJCGVFA-UHFFFAOYSA-N 2 1 359.493 2.199 10 0 FEAEMP Cn1cc(C[NH+]2CCCN(CC[N@@H+](C)Cc3ccc(F)cc3)CC2)cn1 ZINC000181691054 547360883 /nfs/dbraw/zinc/36/08/83/547360883.db2.gz CHRRHPQVJCGVFA-UHFFFAOYSA-N 2 1 359.493 2.199 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2ccc(CNC(=O)N3CC[C@@H]([NH+](C)C)C3)cc2)C[C@H](C)O1 ZINC000245996935 549033123 /nfs/dbraw/zinc/03/31/23/549033123.db2.gz CEXMRVQVWBLRMD-FUHIMQAGSA-N 2 1 374.529 2.141 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C1 ZINC000246797864 549215399 /nfs/dbraw/zinc/21/53/99/549215399.db2.gz AWAVEDPJYUPQLL-ZMSDIMECSA-N 2 1 350.532 2.477 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@H](c2cccs2)[NH+](C)C)CC[N@H+]1CCOC ZINC000246972110 549254338 /nfs/dbraw/zinc/25/43/38/549254338.db2.gz DXAJSNXCPNLEST-HZPDHXFCSA-N 2 1 368.547 2.103 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)N2CCC(OCC[NH+]3CCCC3)CC2)C1 ZINC000247053502 549273665 /nfs/dbraw/zinc/27/36/65/549273665.db2.gz IJQYLXBBWOEJFW-IEBWSBKVSA-N 2 1 366.550 2.002 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000247070413 549276360 /nfs/dbraw/zinc/27/63/60/549276360.db2.gz OMPIYHLRHGOSGQ-CABCVRRESA-N 2 1 358.408 2.457 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000247070413 549276363 /nfs/dbraw/zinc/27/63/63/549276363.db2.gz OMPIYHLRHGOSGQ-CABCVRRESA-N 2 1 358.408 2.457 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000247159670 549292427 /nfs/dbraw/zinc/29/24/27/549292427.db2.gz QMGVUTOLGXPJGD-ICSRJNTNSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC000247159670 549292430 /nfs/dbraw/zinc/29/24/30/549292430.db2.gz QMGVUTOLGXPJGD-ICSRJNTNSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[NH+]1CCN(C(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000247159670 549292434 /nfs/dbraw/zinc/29/24/34/549292434.db2.gz QMGVUTOLGXPJGD-ICSRJNTNSA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[NH+]1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000247159670 549292437 /nfs/dbraw/zinc/29/24/37/549292437.db2.gz QMGVUTOLGXPJGD-ICSRJNTNSA-N 2 1 359.514 2.078 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCCC[NH+]1CCc2ccccc2C1 ZINC000247185521 549295814 /nfs/dbraw/zinc/29/58/14/549295814.db2.gz LCXRCEDBRDFZHD-XLIONFOSSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCCC[N@@H+]1CCc2ccccc2C1 ZINC000247185521 549295817 /nfs/dbraw/zinc/29/58/17/549295817.db2.gz LCXRCEDBRDFZHD-XLIONFOSSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000247185521 549295820 /nfs/dbraw/zinc/29/58/20/549295820.db2.gz LCXRCEDBRDFZHD-XLIONFOSSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@@H]1C[C@@H](C)CN(C(=O)CN2CC[C@@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000248651345 549477690 /nfs/dbraw/zinc/47/76/90/549477690.db2.gz MVBRSTBTHVCCAN-GGPKGHCWSA-N 2 1 358.530 2.340 10 0 FEAEMP C[C@@H]1C[C@@H](C)CN(C(=O)C[N@@H+]2CC[C@@H](CN(C)Cc3cccnc3)C2)C1 ZINC000248651345 549477694 /nfs/dbraw/zinc/47/76/94/549477694.db2.gz MVBRSTBTHVCCAN-GGPKGHCWSA-N 2 1 358.530 2.340 10 0 FEAEMP Cc1cnn([C@H]2CCC[N@@H+](CC(=O)NC[C@H](c3ccccc3)[NH+](C)C)C2)c1 ZINC000249379939 549585603 /nfs/dbraw/zinc/58/56/03/549585603.db2.gz ZPVKDPDJZATEPC-VQTJNVASSA-N 2 1 369.513 2.248 10 0 FEAEMP Cc1cnn([C@H]2CCC[N@H+](CC(=O)NC[C@H](c3ccccc3)[NH+](C)C)C2)c1 ZINC000249379939 549585606 /nfs/dbraw/zinc/58/56/06/549585606.db2.gz ZPVKDPDJZATEPC-VQTJNVASSA-N 2 1 369.513 2.248 10 0 FEAEMP CC[N@H+]1CCCC[C@H]1CNC(=O)N1CC[C@@H](C[NH+](C)Cc2cccnc2)C1 ZINC000251845074 549654316 /nfs/dbraw/zinc/65/43/16/549654316.db2.gz OSPNCIFVDNNUBR-PMACEKPBSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[NH+]1CCCC[C@H]1CNC(=O)N1CC[C@@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000251845074 549654319 /nfs/dbraw/zinc/65/43/19/549654319.db2.gz OSPNCIFVDNNUBR-PMACEKPBSA-N 2 1 373.545 2.419 10 0 FEAEMP CC[NH+]1CCCC[C@H]1CNC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000251845074 549654324 /nfs/dbraw/zinc/65/43/24/549654324.db2.gz OSPNCIFVDNNUBR-PMACEKPBSA-N 2 1 373.545 2.419 10 0 FEAEMP COc1ccc(CN(C)C(=O)C[N@@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cc1 ZINC000261844983 549761696 /nfs/dbraw/zinc/76/16/96/549761696.db2.gz UVBWOGXMQKGLHW-CTNGQTDRSA-N 2 1 367.493 2.328 10 0 FEAEMP COc1ccc(CN(C)C(=O)C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cc1 ZINC000261844983 549761699 /nfs/dbraw/zinc/76/16/99/549761699.db2.gz UVBWOGXMQKGLHW-CTNGQTDRSA-N 2 1 367.493 2.328 10 0 FEAEMP CN(C)[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1)c1c(F)cccc1F ZINC000261865580 549764179 /nfs/dbraw/zinc/76/41/79/549764179.db2.gz COKYCTIXOVERKZ-OKDNKWQNSA-N 2 1 353.457 2.314 10 0 FEAEMP Clc1cc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)cc2c1OCCO2 ZINC000261936027 549770983 /nfs/dbraw/zinc/77/09/83/549770983.db2.gz MEYVLFUJUWDXLA-DJIMGWMZSA-N 2 1 366.889 2.400 10 0 FEAEMP CCOc1cc(C[NH2+]C[C@H]2C[NH2+]C[C@H]2O)ccc1OCc1ccccc1 ZINC000263293433 549893053 /nfs/dbraw/zinc/89/30/53/549893053.db2.gz VYPNMYSHDAJZST-RBUKOAKNSA-N 2 1 356.466 2.334 10 0 FEAEMP CN(C)c1ncc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)n1C ZINC000311552028 553754928 /nfs/dbraw/zinc/75/49/28/553754928.db2.gz PVGMYGGEURXZGH-YZGWKJHDSA-N 2 1 353.514 2.486 10 0 FEAEMP O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F ZINC000638804398 677150399 /nfs/dbraw/zinc/15/03/99/677150399.db2.gz UJCXINKZEMOQLN-ARFHVFGLSA-N 2 1 355.404 2.023 10 0 FEAEMP O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)[C@@H]1C[NH2+]CCC1(F)F ZINC000649305151 677329132 /nfs/dbraw/zinc/32/91/32/677329132.db2.gz GPSUODOOHCYZRM-SJORKVTESA-N 2 1 351.441 2.402 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N2CCC[NH+](Cc3ccc(OC)cc3)CC2)C1 ZINC000052594504 540476692 /nfs/dbraw/zinc/47/66/92/540476692.db2.gz JJHMCMKUMDQVLM-IBGZPJMESA-N 2 1 374.529 2.397 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)N2CCC[N@H+](Cc3ccc(OC)cc3)CC2)C1 ZINC000052594504 540476695 /nfs/dbraw/zinc/47/66/95/540476695.db2.gz JJHMCMKUMDQVLM-IBGZPJMESA-N 2 1 374.529 2.397 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)N2CCC[N@@H+](Cc3ccc(OC)cc3)CC2)C1 ZINC000052594504 540476699 /nfs/dbraw/zinc/47/66/99/540476699.db2.gz JJHMCMKUMDQVLM-IBGZPJMESA-N 2 1 374.529 2.397 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCc2ccccc2OCC[NH+](C)C)C1 ZINC000247388305 549326731 /nfs/dbraw/zinc/32/67/31/549326731.db2.gz QFDODSOSQMXESP-SJLPKXTDSA-N 2 1 362.518 2.155 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N[C@@H](CC(C)C)C[NH+](C)C)c2C1 ZINC000067531363 541476020 /nfs/dbraw/zinc/47/60/20/541476020.db2.gz DNUUTWCSZBDMAO-KRWDZBQOSA-N 2 1 374.529 2.443 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N[C@@H](CC(C)C)C[NH+](C)C)c2C1 ZINC000067531363 541476022 /nfs/dbraw/zinc/47/60/22/541476022.db2.gz DNUUTWCSZBDMAO-KRWDZBQOSA-N 2 1 374.529 2.443 10 0 FEAEMP O[C@@]1(C[N@@H+]2CCCN(c3nc4ccc(Cl)cc4s3)CC2)CC[NH2+]C1 ZINC000077452247 542384066 /nfs/dbraw/zinc/38/40/66/542384066.db2.gz DGSDMSJJOCPSNR-KRWDZBQOSA-N 2 1 366.918 2.186 10 0 FEAEMP O[C@@]1(C[N@H+]2CCCN(c3nc4ccc(Cl)cc4s3)CC2)CC[NH2+]C1 ZINC000077452247 542384069 /nfs/dbraw/zinc/38/40/69/542384069.db2.gz DGSDMSJJOCPSNR-KRWDZBQOSA-N 2 1 366.918 2.186 10 0 FEAEMP CCCN(CCC)C(=O)CCc1ccc(N2C(=[NH2+])NC(=[NH2+])NC2(C)C)cc1 ZINC000016954725 132377745 /nfs/dbraw/zinc/37/77/45/132377745.db2.gz XXULWKITEYWCRF-UHFFFAOYSA-N 2 1 372.517 2.453 10 0 FEAEMP CCn1c(C)nnc1C[N@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000106127185 543204267 /nfs/dbraw/zinc/20/42/67/543204267.db2.gz ZZEWODUMMULFTQ-HXUWFJFHSA-N 2 1 371.529 2.484 10 0 FEAEMP CCn1c(C)nnc1C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000106127185 543204269 /nfs/dbraw/zinc/20/42/69/543204269.db2.gz ZZEWODUMMULFTQ-HXUWFJFHSA-N 2 1 371.529 2.484 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)Nc2cc(Cl)ccc2F)CC1 ZINC000106126413 543204448 /nfs/dbraw/zinc/20/44/48/543204448.db2.gz RKACOCKZKTVBPB-ZDUSSCGKSA-N 2 1 371.884 2.442 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](NC(=O)NCC[NH+](C)Cc2ccc(F)cc2)[C@@H](C)C1 ZINC000122724097 543720096 /nfs/dbraw/zinc/72/00/96/543720096.db2.gz UDTOHUABIKXZKZ-YJBOKZPZSA-N 2 1 350.482 2.285 10 0 FEAEMP CC(C)[NH+]1C[C@H](NC(=O)NCC[N@H+](C)Cc2ccc(F)cc2)[C@@H](C)C1 ZINC000122724097 543720099 /nfs/dbraw/zinc/72/00/99/543720099.db2.gz UDTOHUABIKXZKZ-YJBOKZPZSA-N 2 1 350.482 2.285 10 0 FEAEMP CC(C)[NH+]1C[C@H](NC(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)[C@@H](C)C1 ZINC000122724097 543720102 /nfs/dbraw/zinc/72/01/02/543720102.db2.gz UDTOHUABIKXZKZ-YJBOKZPZSA-N 2 1 350.482 2.285 10 0 FEAEMP CC(C)[NH+]1CCC(C(=O)N2CC[C@@H](C[N@@H+](C)Cc3cccnc3)C2)CC1 ZINC000190591798 328218528 /nfs/dbraw/zinc/21/85/28/328218528.db2.gz JKFKJMZMBGCORG-IBGZPJMESA-N 2 1 358.530 2.482 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C[C@H]1C ZINC000117472258 326061497 /nfs/dbraw/zinc/06/14/97/326061497.db2.gz QRHNOGALVVYZKL-GOSISDBHSA-N 2 1 374.529 2.145 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C[C@H]1C ZINC000117472258 326061501 /nfs/dbraw/zinc/06/15/01/326061501.db2.gz QRHNOGALVVYZKL-GOSISDBHSA-N 2 1 374.529 2.145 10 0 FEAEMP COCC[N@H+]1CCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@H]1C ZINC000120823580 326291015 /nfs/dbraw/zinc/29/10/15/326291015.db2.gz RMKZHYIDRPKPRJ-LJQANCHMSA-N 2 1 374.573 2.370 10 0 FEAEMP COCCN1CC[N@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@H]1C ZINC000120823580 326291016 /nfs/dbraw/zinc/29/10/16/326291016.db2.gz RMKZHYIDRPKPRJ-LJQANCHMSA-N 2 1 374.573 2.370 10 0 FEAEMP COCCN1CC[N@@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@H]1C ZINC000120823580 326291017 /nfs/dbraw/zinc/29/10/17/326291017.db2.gz RMKZHYIDRPKPRJ-LJQANCHMSA-N 2 1 374.573 2.370 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC000163759098 327058008 /nfs/dbraw/zinc/05/80/08/327058008.db2.gz CKAVPNIGSQLSAR-IBGZPJMESA-N 2 1 373.541 2.468 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC000163759098 327058009 /nfs/dbraw/zinc/05/80/09/327058009.db2.gz CKAVPNIGSQLSAR-IBGZPJMESA-N 2 1 373.541 2.468 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)C1 ZINC000170832402 327101278 /nfs/dbraw/zinc/10/12/78/327101278.db2.gz XQXSXBWGFYFCMC-MRXNPFEDSA-N 2 1 366.456 2.275 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)NCCCC2CCCCC2)CC1 ZINC000170941721 327109037 /nfs/dbraw/zinc/10/90/37/327109037.db2.gz LSFNYEVZEAKYCE-GOSISDBHSA-N 2 1 367.578 2.488 10 0 FEAEMP COc1ccc(CNC(=O)C[N@H+]2CC[C@@H](CNc3cccc(C)[nH+]3)C2)cc1 ZINC000171652990 327152271 /nfs/dbraw/zinc/15/22/71/327152271.db2.gz BMQRMJGTVBEDOZ-SFHVURJKSA-N 2 1 368.481 2.449 10 0 FEAEMP CC(C)N1CC[C@H]([N@@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)C1=O ZINC000175191684 327378781 /nfs/dbraw/zinc/37/87/81/327378781.db2.gz KPGUYGSNACKWOT-SFTDATJTSA-N 2 1 373.541 2.373 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000175438620 327393002 /nfs/dbraw/zinc/39/30/02/327393002.db2.gz PNOFIXBURUNFFI-NJDAHSKKSA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)C[C@@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000175438620 327393003 /nfs/dbraw/zinc/39/30/03/327393003.db2.gz PNOFIXBURUNFFI-NJDAHSKKSA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)C[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000175438620 327393004 /nfs/dbraw/zinc/39/30/04/327393004.db2.gz PNOFIXBURUNFFI-NJDAHSKKSA-N 2 1 371.525 2.363 10 0 FEAEMP CC[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000175438620 327393005 /nfs/dbraw/zinc/39/30/05/327393005.db2.gz PNOFIXBURUNFFI-NJDAHSKKSA-N 2 1 371.525 2.363 10 0 FEAEMP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c(O[C@H]2CCOC2)c1 ZINC000261951146 328831559 /nfs/dbraw/zinc/83/15/59/328831559.db2.gz OHIFJCJXQZQUBZ-HAGHYFMRSA-N 2 1 360.498 2.409 10 0 FEAEMP COc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c(OC)c1OC ZINC000261960096 328832035 /nfs/dbraw/zinc/83/20/35/328832035.db2.gz PLFQGGWLUCZZPX-GVDBMIGSSA-N 2 1 364.486 2.002 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CCc2nc(-c3ccccc3)no2)CC1 ZINC000157961212 545805140 /nfs/dbraw/zinc/80/51/40/545805140.db2.gz STJGYLDEHJCDFJ-INIZCTEOSA-N 2 1 358.486 2.304 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC[NH+](CC3CC3)CC2)C[C@H]1CC ZINC000172125077 546236556 /nfs/dbraw/zinc/23/65/56/546236556.db2.gz KJUDJSRZTSOKRT-LJQANCHMSA-N 2 1 366.550 2.003 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@@H](c2cccs2)[NH+](C)C)CC[N@H+]1CCOC ZINC000172320805 546246733 /nfs/dbraw/zinc/24/67/33/546246733.db2.gz DXAJSNXCPNLEST-CVEARBPZSA-N 2 1 368.547 2.103 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NCCC2CC[NH+](CC)CC2)C[C@@H]1CC ZINC000175952195 546379088 /nfs/dbraw/zinc/37/90/88/546379088.db2.gz SHOSWAZHWUCIQR-IBGZPJMESA-N 2 1 368.566 2.251 10 0 FEAEMP CC[C@H]1CN(C(=O)NC2CC[NH+](C3CCCC3)CC2)CC[N@H+]1CCOC ZINC000176010523 546390222 /nfs/dbraw/zinc/39/02/22/546390222.db2.gz PHIJSILGQXBKCL-SFHVURJKSA-N 2 1 366.550 2.146 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@@H]2CCC[C@H]([NH+](C)C)C2)C[C@@H]1CC ZINC000176612867 546467829 /nfs/dbraw/zinc/46/78/29/546467829.db2.gz IVMSJLFBLNUUBG-SQNIBIBYSA-N 2 1 354.539 2.002 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N(C)C[C@@H]2CCC[N@H+]2CC)c1 ZINC000176903810 546505313 /nfs/dbraw/zinc/50/53/13/546505313.db2.gz XCMWSEOUNVQZKM-IBGZPJMESA-N 2 1 374.529 2.410 10 0 FEAEMP Cc1nccn1C[C@H]1CCC[N@@H+]1CC(=O)NCCCN(C)c1ccccc1 ZINC000178303440 546772408 /nfs/dbraw/zinc/77/24/08/546772408.db2.gz WJOASTVIQUUBMP-HXUWFJFHSA-N 2 1 369.513 2.299 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1CC(=O)NCCCN(C)c1ccccc1 ZINC000178303440 546772418 /nfs/dbraw/zinc/77/24/18/546772418.db2.gz WJOASTVIQUUBMP-HXUWFJFHSA-N 2 1 369.513 2.299 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccc2c(c1)OCO2 ZINC000178316082 546774136 /nfs/dbraw/zinc/77/41/36/546774136.db2.gz NEVLIMFCJOORNQ-INIZCTEOSA-N 2 1 356.426 2.413 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccc2c(c1)OCO2 ZINC000178316082 546774141 /nfs/dbraw/zinc/77/41/41/546774141.db2.gz NEVLIMFCJOORNQ-INIZCTEOSA-N 2 1 356.426 2.413 10 0 FEAEMP COCc1ccccc1CNC(=O)C[N@H+]1CCC[C@@H]1Cn1ccnc1C ZINC000178751079 546843305 /nfs/dbraw/zinc/84/33/05/546843305.db2.gz DTSLIZIVPOMDMY-LJQANCHMSA-N 2 1 356.470 2.119 10 0 FEAEMP COCc1ccccc1CNC(=O)C[N@@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000178751079 546843308 /nfs/dbraw/zinc/84/33/08/546843308.db2.gz DTSLIZIVPOMDMY-LJQANCHMSA-N 2 1 356.470 2.119 10 0 FEAEMP COCc1ccccc1CNC(=O)C[N@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000178751079 546843311 /nfs/dbraw/zinc/84/33/11/546843311.db2.gz DTSLIZIVPOMDMY-LJQANCHMSA-N 2 1 356.470 2.119 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NCCOc1c(C)cccc1C ZINC000178755460 546844419 /nfs/dbraw/zinc/84/44/19/546844419.db2.gz ZIEYUQFQLAGJAV-IBGZPJMESA-N 2 1 370.497 2.468 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)NCCOc1c(C)cccc1C ZINC000178755460 546844423 /nfs/dbraw/zinc/84/44/23/546844423.db2.gz ZIEYUQFQLAGJAV-IBGZPJMESA-N 2 1 370.497 2.468 10 0 FEAEMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000195222912 548598540 /nfs/dbraw/zinc/59/85/40/548598540.db2.gz FKRODCWZQBDSIE-LJQANCHMSA-N 2 1 371.529 2.449 10 0 FEAEMP CCC[C@@H]([NH3+])C(=O)NCCC[NH+]1CCN(c2ccccc2Cl)CC1 ZINC000236943419 548789022 /nfs/dbraw/zinc/78/90/22/548789022.db2.gz GYRMCXVOURRMTE-MRXNPFEDSA-N 2 1 352.910 2.096 10 0 FEAEMP C[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000246325461 549106680 /nfs/dbraw/zinc/10/66/80/549106680.db2.gz AWJMRFPPJOIIAY-PXNSSMCTSA-N 2 1 372.513 2.262 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000246325461 549106684 /nfs/dbraw/zinc/10/66/84/549106684.db2.gz AWJMRFPPJOIIAY-PXNSSMCTSA-N 2 1 372.513 2.262 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)N2CCC(OCC[NH+]3CCCC3)CC2)C1 ZINC000247053525 549273707 /nfs/dbraw/zinc/27/37/07/549273707.db2.gz IJQYLXBBWOEJFW-PKOBYXMFSA-N 2 1 366.550 2.002 10 0 FEAEMP CC[N@H+]1CCCC[C@@H]1C(=O)NCC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000247063447 549274964 /nfs/dbraw/zinc/27/49/64/549274964.db2.gz XOEQKVRDTDRSLG-NHCUHLMSSA-N 2 1 373.541 2.423 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)cn1 ZINC000247062830 549275101 /nfs/dbraw/zinc/27/51/01/549275101.db2.gz IQHUYRBPFAZUFT-PBHICJAKSA-N 2 1 356.474 2.104 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)N[C@H]2C[N@@H+](C(C)C)C[C@H]2C)cn1 ZINC000247062830 549275102 /nfs/dbraw/zinc/27/51/02/549275102.db2.gz IQHUYRBPFAZUFT-PBHICJAKSA-N 2 1 356.474 2.104 10 0 FEAEMP COc1cccc(CNC(=O)[C@@H](C)[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000247122263 549287353 /nfs/dbraw/zinc/28/73/53/549287353.db2.gz RVLBWWZFSRSCKO-CRAIPNDOSA-N 2 1 356.470 2.369 10 0 FEAEMP COc1cccc(CNC(=O)[C@@H](C)[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000247122263 549287358 /nfs/dbraw/zinc/28/73/58/549287358.db2.gz RVLBWWZFSRSCKO-CRAIPNDOSA-N 2 1 356.470 2.369 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000247159684 549292634 /nfs/dbraw/zinc/29/26/34/549292634.db2.gz QMGVUTOLGXPJGD-QUCCMNQESA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000247159684 549292636 /nfs/dbraw/zinc/29/26/36/549292636.db2.gz QMGVUTOLGXPJGD-QUCCMNQESA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[NH+]1CCN(C(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000247159684 549292640 /nfs/dbraw/zinc/29/26/40/549292640.db2.gz QMGVUTOLGXPJGD-QUCCMNQESA-N 2 1 359.514 2.078 10 0 FEAEMP COCC[NH+]1CCN(C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000247159684 549292643 /nfs/dbraw/zinc/29/26/43/549292643.db2.gz QMGVUTOLGXPJGD-QUCCMNQESA-N 2 1 359.514 2.078 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCCC[NH+]1CCc2ccccc2C1 ZINC000247185504 549295799 /nfs/dbraw/zinc/29/57/99/549295799.db2.gz LCXRCEDBRDFZHD-PXNSSMCTSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCCC[N@@H+]1CCc2ccccc2C1 ZINC000247185504 549295801 /nfs/dbraw/zinc/29/58/01/549295801.db2.gz LCXRCEDBRDFZHD-PXNSSMCTSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H]1C[NH+]2CCC[C@H]2CN1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000247185504 549295804 /nfs/dbraw/zinc/29/58/04/549295804.db2.gz LCXRCEDBRDFZHD-PXNSSMCTSA-N 2 1 356.514 2.313 10 0 FEAEMP C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247809016 549382774 /nfs/dbraw/zinc/38/27/74/549382774.db2.gz UGRHBIDBWQSTCK-NTDBWNAOSA-N 2 1 353.551 2.094 10 0 FEAEMP O=C([C@@H](c1ccccc1)N1CCSCC1)N1CCN2CCCC[C@H]2C1 ZINC000250198570 549639347 /nfs/dbraw/zinc/63/93/47/549639347.db2.gz ACVMDQQBUNCQGV-RBUKOAKNSA-N 2 1 359.539 2.473 10 0 FEAEMP C[N@H+](Cc1cccnc1)C[C@H]1CCN(C(=O)NC[C@H]2CC[NH+](C3CC3)C2)C1 ZINC000251948238 549659219 /nfs/dbraw/zinc/65/92/19/549659219.db2.gz ULTFHNIDPZWAFR-RTBURBONSA-N 2 1 371.529 2.029 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@H]1CCN(C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000251948238 549659222 /nfs/dbraw/zinc/65/92/22/549659222.db2.gz ULTFHNIDPZWAFR-RTBURBONSA-N 2 1 371.529 2.029 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@H]1CCN(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)C1 ZINC000251948238 549659228 /nfs/dbraw/zinc/65/92/28/549659228.db2.gz ULTFHNIDPZWAFR-RTBURBONSA-N 2 1 371.529 2.029 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)[C@](C)([NH3+])c1ccc(Br)cc1 ZINC000261749005 549751935 /nfs/dbraw/zinc/75/19/35/549751935.db2.gz MOHZPGMWENTQQZ-SRCQZFHVSA-N 2 1 366.303 2.318 10 0 FEAEMP CCN1CC[NH+](Cc2ccc(N[C@@H]3CCC[C@@H]3[C@H]3COCC[NH2+]3)cc2)CC1 ZINC000261956992 549773839 /nfs/dbraw/zinc/77/38/39/549773839.db2.gz PCQGQNZBAGNVKI-BHDDXSALSA-N 2 1 372.557 2.393 10 0 FEAEMP CC[NH+](CC(=O)[O-])C1CC(N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000263528520 549906766 /nfs/dbraw/zinc/90/67/66/549906766.db2.gz VHNVWUJWZHWNLG-YUKKFIBKSA-N 2 1 359.514 2.424 10 0 FEAEMP CC[NH+](CC(=O)[O-])C1CC(N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000263528520 549906769 /nfs/dbraw/zinc/90/67/69/549906769.db2.gz VHNVWUJWZHWNLG-YUKKFIBKSA-N 2 1 359.514 2.424 10 0 FEAEMP CC(C)c1nc(CN(C)C(=O)[C@H]2CC3(C[N@H+]2C)CC[NH2+]CC3)cs1 ZINC000072410013 670495762 /nfs/dbraw/zinc/49/57/62/670495762.db2.gz AJDZZVDYEHBJLF-OAHLLOKOSA-N 2 1 350.532 2.299 10 0 FEAEMP C[NH+](C)C1(C[NH2+][C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)CCOCC1 ZINC000183512799 672470625 /nfs/dbraw/zinc/47/06/25/672470625.db2.gz WXFACLCWJFIZAS-MRXNPFEDSA-N 2 1 355.523 2.476 10 0 FEAEMP CC(C)(C)c1nn(-c2ccccc2Cl)cc1C[NH2+]C[C@@H]1C[NH2+]C[C@H]1O ZINC000262197994 672910726 /nfs/dbraw/zinc/91/07/26/672910726.db2.gz ZQEBEMMJUKLJDD-CXAGYDPISA-N 2 1 362.905 2.493 10 0 FEAEMP [NH3+]CCCN1C(=O)CC[C@H]2C[N@H+](Cc3ccnc4ccccc34)CC[C@H]21 ZINC000072457551 541817138 /nfs/dbraw/zinc/81/71/38/541817138.db2.gz IVWWKQCTMSGFLJ-FXAWDEMLSA-N 2 1 352.482 2.397 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCc2ccc(F)c(C[NH+](C)C)c2)C1 ZINC000247402114 549329270 /nfs/dbraw/zinc/32/92/70/549329270.db2.gz RESBDEHEFPRANH-RDTXWAMCSA-N 2 1 350.482 2.415 10 0 FEAEMP Cn1c(C(=O)N2CCC[NH+](C)CC2)cc2c1CC[N@@H+](Cc1ccccc1)C2 ZINC000065210815 221180466 /nfs/dbraw/zinc/18/04/66/221180466.db2.gz LRKNVIZSAKXYFM-UHFFFAOYSA-N 2 1 366.509 2.361 10 0 FEAEMP Cn1c(C(=O)N2CCC[NH+](C)CC2)cc2c1CC[N@H+](Cc1ccccc1)C2 ZINC000065210815 221180468 /nfs/dbraw/zinc/18/04/68/221180468.db2.gz LRKNVIZSAKXYFM-UHFFFAOYSA-N 2 1 366.509 2.361 10 0 FEAEMP Cn1c(C(=O)N2CCC[N@H+](C)CC2)cc2c1CC[NH+](Cc1ccccc1)C2 ZINC000065210815 221180469 /nfs/dbraw/zinc/18/04/69/221180469.db2.gz LRKNVIZSAKXYFM-UHFFFAOYSA-N 2 1 366.509 2.361 10 0 FEAEMP Cn1c(C(=O)N2CCC[N@@H+](C)CC2)cc2c1CC[NH+](Cc1ccccc1)C2 ZINC000065210815 221180471 /nfs/dbraw/zinc/18/04/71/221180471.db2.gz LRKNVIZSAKXYFM-UHFFFAOYSA-N 2 1 366.509 2.361 10 0 FEAEMP C[C@H](Cc1ccc2c(c1)OCO2)C[N@H+]1CCN(C)C2(CC[NH+](C)CC2)C1 ZINC000067725589 221277505 /nfs/dbraw/zinc/27/75/05/221277505.db2.gz RPQVLYHTXURZSY-QGZVFWFLSA-N 2 1 359.514 2.306 10 0 FEAEMP C[NH+](C)CCCOc1ccc(CNC(=O)N2CC[N@H+]3CCCC[C@H]3C2)cc1 ZINC000105244068 543166943 /nfs/dbraw/zinc/16/69/43/543166943.db2.gz IADJDGPALVGOJP-IBGZPJMESA-N 2 1 374.529 2.397 10 0 FEAEMP CCN(C)[C@H](C(=O)N1CCCN(Cc2cnn(C)c2)CC1)c1ccccc1 ZINC000109284695 543320125 /nfs/dbraw/zinc/32/01/25/543320125.db2.gz VXHSOQYINTZGNW-FQEVSTJZSA-N 2 1 369.513 2.147 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)[NH+](C)C)c1 ZINC000113580457 543490893 /nfs/dbraw/zinc/49/08/93/543490893.db2.gz QDYDYASIHCWXSJ-WDYCEAGBSA-N 2 1 360.502 2.176 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N2CC[NH+]3CCCC[C@@H]3C2)[C@H](C)C1 ZINC000115851573 543590653 /nfs/dbraw/zinc/59/06/53/543590653.db2.gz RKGKOTJMQKZZDM-QRVBRYPASA-N 2 1 366.550 2.003 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)[C@H](C)C1 ZINC000115851573 543590656 /nfs/dbraw/zinc/59/06/56/543590656.db2.gz RKGKOTJMQKZZDM-QRVBRYPASA-N 2 1 366.550 2.003 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)[C@H](C)C1 ZINC000115851573 543590660 /nfs/dbraw/zinc/59/06/60/543590660.db2.gz RKGKOTJMQKZZDM-QRVBRYPASA-N 2 1 366.550 2.003 10 0 FEAEMP CC[C@H]1CN(C(=O)NCC(C)(C)[NH+]2CCCCC2)CC[N@H+]1CCOC ZINC000117470487 543632681 /nfs/dbraw/zinc/63/26/81/543632681.db2.gz CNYJOWDFHXBZJU-KRWDZBQOSA-N 2 1 354.539 2.003 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@H+](C)[C@@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000127646948 544005970 /nfs/dbraw/zinc/00/59/70/544005970.db2.gz CLIRBZMBJIWYTK-IRXDYDNUSA-N 2 1 357.502 2.353 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2cn(-c3ccccc3)nn2)CC1 ZINC000127646948 544005971 /nfs/dbraw/zinc/00/59/71/544005971.db2.gz CLIRBZMBJIWYTK-IRXDYDNUSA-N 2 1 357.502 2.353 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@@H](C)C[NH+]2CCCCC2)C[C@H]1CC ZINC000117036621 326048401 /nfs/dbraw/zinc/04/84/01/326048401.db2.gz NQGHDPAIIUIPKN-RTBURBONSA-N 2 1 368.566 2.251 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CCC(C[NH+](C)C)CC2)C[C@@H]1CC ZINC000119024742 326119250 /nfs/dbraw/zinc/11/92/50/326119250.db2.gz ISEOFJWENCSBHW-ACBHZAAOSA-N 2 1 368.566 2.249 10 0 FEAEMP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000119428846 326161568 /nfs/dbraw/zinc/16/15/68/326161568.db2.gz YWTSBWBHGMYLIZ-WOJBJXKFSA-N 2 1 359.514 2.124 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)[C@H]1C[NH+](Cc2ccccc2)CCO1 ZINC000119428846 326161571 /nfs/dbraw/zinc/16/15/71/326161571.db2.gz YWTSBWBHGMYLIZ-WOJBJXKFSA-N 2 1 359.514 2.124 10 0 FEAEMP CC(C)C[NH+]1CCC[C@@H]1CNC(=O)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000119428846 326161573 /nfs/dbraw/zinc/16/15/73/326161573.db2.gz YWTSBWBHGMYLIZ-WOJBJXKFSA-N 2 1 359.514 2.124 10 0 FEAEMP CC(C)C[NH+]1CCC[C@@H]1CNC(=O)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000119428846 326161575 /nfs/dbraw/zinc/16/15/75/326161575.db2.gz YWTSBWBHGMYLIZ-WOJBJXKFSA-N 2 1 359.514 2.124 10 0 FEAEMP CC[C@H](NC(=O)N1CC[C@H]([NH+](C)C)C1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000121908858 326375132 /nfs/dbraw/zinc/37/51/32/326375132.db2.gz ZATQOJWJTXFTHI-UFYCRDLUSA-N 2 1 374.529 2.012 10 0 FEAEMP CC1CCN(CC(=O)NC[C@H](c2cccs2)N2CCO[C@H](C)C2)CC1 ZINC000121993361 326379754 /nfs/dbraw/zinc/37/97/54/326379754.db2.gz VTZOGQPKDYDORI-IAGOWNOFSA-N 2 1 365.543 2.358 10 0 FEAEMP Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N1CC[N@H+]2CCC[C@H]2C1 ZINC000171807361 327162631 /nfs/dbraw/zinc/16/26/31/327162631.db2.gz TULCCOPRSGYHHP-SFHVURJKSA-N 2 1 357.502 2.059 10 0 FEAEMP CC[NH+]1CCN(c2ccccc2NC(=O)N2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000171807566 327162718 /nfs/dbraw/zinc/16/27/18/327162718.db2.gz MAELXODYFFZSSK-QGZVFWFLSA-N 2 1 357.502 2.140 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ccc(Br)cn2)CC1 ZINC000171960660 327172863 /nfs/dbraw/zinc/17/28/63/327172863.db2.gz HSPPHXOONZKKHA-CYBMUJFWSA-N 2 1 356.308 2.369 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000172080463 327179713 /nfs/dbraw/zinc/17/97/13/327179713.db2.gz GMPLKBNRFVIVDD-GHTZIAJQSA-N 2 1 370.541 2.067 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC1CC[NH+](Cc2ccccn2)CC1 ZINC000173745917 327280687 /nfs/dbraw/zinc/28/06/87/327280687.db2.gz HVBWHOCHEMFVRK-WOJBJXKFSA-N 2 1 371.529 2.314 10 0 FEAEMP CC(C)CO[C@@H](C)c1noc(C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000173885646 327291429 /nfs/dbraw/zinc/29/14/29/327291429.db2.gz WNSVEXANBZJZET-CVEARBPZSA-N 2 1 368.522 2.328 10 0 FEAEMP CC(C)CO[C@@H](C)c1noc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)n1 ZINC000173885646 327291430 /nfs/dbraw/zinc/29/14/30/327291430.db2.gz WNSVEXANBZJZET-CVEARBPZSA-N 2 1 368.522 2.328 10 0 FEAEMP CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000174261400 327315764 /nfs/dbraw/zinc/31/57/64/327315764.db2.gz JHWAQVOXAYJIBN-DLBZAZTESA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000174261400 327315765 /nfs/dbraw/zinc/31/57/65/327315765.db2.gz JHWAQVOXAYJIBN-DLBZAZTESA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000174261400 327315766 /nfs/dbraw/zinc/31/57/66/327315766.db2.gz JHWAQVOXAYJIBN-DLBZAZTESA-N 2 1 362.543 2.374 10 0 FEAEMP CC[C@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000174261400 327315767 /nfs/dbraw/zinc/31/57/67/327315767.db2.gz JHWAQVOXAYJIBN-DLBZAZTESA-N 2 1 362.543 2.374 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NC[C@@H](C)[NH+]2CCc3ccccc3C2)C1 ZINC000156789953 545660738 /nfs/dbraw/zinc/66/07/38/545660738.db2.gz MPVWXSSMRUWYJK-HLIPFELVSA-N 2 1 358.530 2.461 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@@H](NC(=O)NC[C@@H](C)[N@@H+]2CCc3ccccc3C2)C1 ZINC000156789953 545660742 /nfs/dbraw/zinc/66/07/42/545660742.db2.gz MPVWXSSMRUWYJK-HLIPFELVSA-N 2 1 358.530 2.461 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@@H](c1cccc(OC)c1)[NH+](C)C ZINC000176151891 546414612 /nfs/dbraw/zinc/41/46/12/546414612.db2.gz LILVOSCABSITBG-MJGOQNOKSA-N 2 1 362.518 2.424 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@@H]2CCC[C@H]([NH+](C)C)C2)C[C@H]1CC ZINC000176612851 546467372 /nfs/dbraw/zinc/46/73/72/546467372.db2.gz IVMSJLFBLNUUBG-KURKYZTESA-N 2 1 354.539 2.002 10 0 FEAEMP Cc1cc(C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)ccc1-n1cncn1 ZINC000179515203 546969319 /nfs/dbraw/zinc/96/93/19/546969319.db2.gz XUUDXFCHKDXNPV-KRWDZBQOSA-N 2 1 357.502 2.100 10 0 FEAEMP CN1CC[C@H](NC(=O)N2CC[N@H+]3CCC[C@@H]3C2)[C@@H]1c1ccc(F)c(F)c1 ZINC000179548088 546975421 /nfs/dbraw/zinc/97/54/21/546975421.db2.gz JJGGPZXPBOCRHI-JLSDUUJJSA-N 2 1 364.440 2.200 10 0 FEAEMP CC[NH+]1CCN(c2cccc(NC(=O)N[C@H]3CCC[N@@H+](CC)C3)c2)CC1 ZINC000184910021 547898435 /nfs/dbraw/zinc/89/84/35/547898435.db2.gz HLGOAQVYEFGLFF-SFHVURJKSA-N 2 1 359.518 2.434 10 0 FEAEMP O=C(NCC[N@H+]1CCCOCC1)NC[C@@H]1CCCC[NH+]1Cc1ccccc1 ZINC000187053949 548247702 /nfs/dbraw/zinc/24/77/02/548247702.db2.gz ZNOBBPZIVGYBBX-FQEVSTJZSA-N 2 1 374.529 2.063 10 0 FEAEMP O=C(NCC[NH+]1CCCOCC1)NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000187053949 548247709 /nfs/dbraw/zinc/24/77/09/548247709.db2.gz ZNOBBPZIVGYBBX-FQEVSTJZSA-N 2 1 374.529 2.063 10 0 FEAEMP O=C(NCC[NH+]1CCCOCC1)NC[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000187053949 548247714 /nfs/dbraw/zinc/24/77/14/548247714.db2.gz ZNOBBPZIVGYBBX-FQEVSTJZSA-N 2 1 374.529 2.063 10 0 FEAEMP Cc1ncsc1CN(C)C[C@H]1CC[N@H+]([C@@H]2CCN(C(C)C)C2=O)C1 ZINC000195267889 548607572 /nfs/dbraw/zinc/60/75/72/548607572.db2.gz AKWNITMTWLMKNH-HZPDHXFCSA-N 2 1 350.532 2.215 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@@H+]4CCC[C@@H]4C3)cc2)C[C@@H](C)O1 ZINC000195330602 548625981 /nfs/dbraw/zinc/62/59/81/548625981.db2.gz FZUGKFRPTQFQQJ-MBOZVWFJSA-N 2 1 357.498 2.216 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@H+]4CCC[C@@H]4C3)cc2)C[C@@H](C)O1 ZINC000195330602 548625983 /nfs/dbraw/zinc/62/59/83/548625983.db2.gz FZUGKFRPTQFQQJ-MBOZVWFJSA-N 2 1 357.498 2.216 10 0 FEAEMP CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC1CC[NH+](CCOC(C)C)CC1 ZINC000245469277 548930102 /nfs/dbraw/zinc/93/01/02/548930102.db2.gz LREXUHZKGINITQ-OALUTQOASA-N 2 1 366.550 2.144 10 0 FEAEMP C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)C(=O)N3CC[C@@H]([NH+](C)C)C3)cc2)C1 ZINC000246036823 549039366 /nfs/dbraw/zinc/03/93/66/549039366.db2.gz WJJHPJHLMUAXSN-VQIMIIECSA-N 2 1 372.513 2.020 10 0 FEAEMP O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)N1CC[NH+]2CCC[C@H]2C1 ZINC000246696804 549191050 /nfs/dbraw/zinc/19/10/50/549191050.db2.gz AROAXUWFEJQGOE-UXHICEINSA-N 2 1 356.514 2.041 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@@H+]2CCC[C@H]2C1 ZINC000246696804 549191054 /nfs/dbraw/zinc/19/10/54/549191054.db2.gz AROAXUWFEJQGOE-UXHICEINSA-N 2 1 356.514 2.041 10 0 FEAEMP O=C(NC[C@H]1CC[NH+](CCc2ccccc2)C1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000246696804 549191059 /nfs/dbraw/zinc/19/10/59/549191059.db2.gz AROAXUWFEJQGOE-UXHICEINSA-N 2 1 356.514 2.041 10 0 FEAEMP C[C@H](C(=O)N[C@@H]1CCCC[C@H]1C)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247809022 549382931 /nfs/dbraw/zinc/38/29/31/549382931.db2.gz UGRHBIDBWQSTCK-SFNKJDCFSA-N 2 1 353.551 2.094 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[NH+](C3CCC3)C2)C[C@@H]1C ZINC000248407603 549430288 /nfs/dbraw/zinc/43/02/88/549430288.db2.gz ULKLLZTWYWHZPI-KSZLIROESA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[NH+](C3CCC3)C2)C[C@@H]1C ZINC000248407603 549430291 /nfs/dbraw/zinc/43/02/91/549430291.db2.gz ULKLLZTWYWHZPI-KSZLIROESA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)C[C@@H]1C ZINC000248407603 549430294 /nfs/dbraw/zinc/43/02/94/549430294.db2.gz ULKLLZTWYWHZPI-KSZLIROESA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C[C@@H]1C ZINC000248407603 549430297 /nfs/dbraw/zinc/43/02/97/549430297.db2.gz ULKLLZTWYWHZPI-KSZLIROESA-N 2 1 366.550 2.002 10 0 FEAEMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH2+][C@H](C)[C@H]2CCCO2)CC1 ZINC000248629620 549471473 /nfs/dbraw/zinc/47/14/73/549471473.db2.gz WAVGIFGLJCSKGV-UYAOXDASSA-N 2 1 359.514 2.186 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@@H+]4CCC[C@H]4C3)cc2)C[C@@H](C)O1 ZINC000249820573 549631367 /nfs/dbraw/zinc/63/13/67/549631367.db2.gz FZUGKFRPTQFQQJ-HLIPFELVSA-N 2 1 357.498 2.216 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@H+]4CCC[C@H]4C3)cc2)C[C@@H](C)O1 ZINC000249820573 549631370 /nfs/dbraw/zinc/63/13/70/549631370.db2.gz FZUGKFRPTQFQQJ-HLIPFELVSA-N 2 1 357.498 2.216 10 0 FEAEMP C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CC[NH+]4CCC[C@H]4C3)cc2)C[C@H](C)O1 ZINC000249820576 549631402 /nfs/dbraw/zinc/63/14/02/549631402.db2.gz FZUGKFRPTQFQQJ-QKLQHJQFSA-N 2 1 357.498 2.216 10 0 FEAEMP C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CC[NH+]4CCC[C@H]4C3)cc2)C[C@H](C)O1 ZINC000249820576 549631405 /nfs/dbraw/zinc/63/14/05/549631405.db2.gz FZUGKFRPTQFQQJ-QKLQHJQFSA-N 2 1 357.498 2.216 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@@H+]4CCC[C@H]4C3)cc2)C[C@H](C)O1 ZINC000249820576 549631408 /nfs/dbraw/zinc/63/14/08/549631408.db2.gz FZUGKFRPTQFQQJ-QKLQHJQFSA-N 2 1 357.498 2.216 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CC[N@H+]4CCC[C@H]4C3)cc2)C[C@H](C)O1 ZINC000249820576 549631410 /nfs/dbraw/zinc/63/14/10/549631410.db2.gz FZUGKFRPTQFQQJ-QKLQHJQFSA-N 2 1 357.498 2.216 10 0 FEAEMP CCc1csc([C@H]2CCCN([C@H](C)C(=O)N3CCN(CC)CC3)C2)n1 ZINC000249880275 549634164 /nfs/dbraw/zinc/63/41/64/549634164.db2.gz NHSXKSWBFHJDEQ-CVEARBPZSA-N 2 1 364.559 2.438 10 0 FEAEMP Cc1nnc([C@@H]2CC3(C[N@@H+]2Cc2ccccc2)CC[NH+](CCO)CC3)o1 ZINC000257191958 549715292 /nfs/dbraw/zinc/71/52/92/549715292.db2.gz RXNXRYCOAZZQCB-SFHVURJKSA-N 2 1 356.470 2.400 10 0 FEAEMP Cc1nnc([C@@H]2CC3(C[N@H+]2Cc2ccccc2)CC[NH+](CCO)CC3)o1 ZINC000257191958 549715295 /nfs/dbraw/zinc/71/52/95/549715295.db2.gz RXNXRYCOAZZQCB-SFHVURJKSA-N 2 1 356.470 2.400 10 0 FEAEMP C([NH2+][C@@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1)C1(CN2CCOCC2)CCCCC1 ZINC000261841255 549761604 /nfs/dbraw/zinc/76/16/04/549761604.db2.gz AIQSDUOPEXKVDN-ZCNNSNEGSA-N 2 1 365.562 2.016 10 0 FEAEMP O=C1CCCN1Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1 ZINC000261938514 549771996 /nfs/dbraw/zinc/77/19/96/549771996.db2.gz MPBMSLMPKKPKSZ-XUVXKRRUSA-N 2 1 357.498 2.056 10 0 FEAEMP CCOCCOCc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000261962925 549774719 /nfs/dbraw/zinc/77/47/19/549774719.db2.gz PTSLBICPGSYWEB-NJYVYQBISA-N 2 1 362.514 2.486 10 0 FEAEMP O=C(CC[N@@H+]1CCC[C@H]1c1nc(-c2ccc(F)cc2)c[nH]1)N1CC[NH2+]CC1 ZINC000262152240 549793322 /nfs/dbraw/zinc/79/33/22/549793322.db2.gz PHCAGZPFRRILOF-SFHVURJKSA-N 2 1 371.460 2.175 10 0 FEAEMP C[C@@H]1C[C@@H](CCNC(=O)[C@@H]2CC(F)(F)CN2)C[N@H+]1Cc1ccccc1 ZINC000262695560 549840327 /nfs/dbraw/zinc/84/03/27/549840327.db2.gz BDTWYVVEWCRNFU-OIISXLGYSA-N 2 1 351.441 2.401 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(CCN(C)C)S(=O)(=O)/C=C/c1ccccc1 ZINC000110099810 670847274 /nfs/dbraw/zinc/84/72/74/670847274.db2.gz ZLQXNILTQVLGEV-BAILOTOSSA-N 2 1 365.543 2.335 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)S(=O)(=O)/C=C/c1ccccc1 ZINC000110099810 670847282 /nfs/dbraw/zinc/84/72/82/670847282.db2.gz ZLQXNILTQVLGEV-BAILOTOSSA-N 2 1 365.543 2.335 10 0 FEAEMP FC(F)(F)CN1CCC(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)CC1 ZINC000261919598 672905156 /nfs/dbraw/zinc/90/51/56/672905156.db2.gz KCYGYJIADLZQKF-BRWVUGGUSA-N 2 1 363.468 2.398 10 0 FEAEMP O[C@H](Cn1ccc2ccccc21)C[NH+]1CCC([NH2+][C@@H]2CCCC[C@@H]2O)CC1 ZINC000004299560 539381912 /nfs/dbraw/zinc/38/19/12/539381912.db2.gz YIKVGKGVFYPZHE-VWPQPMDRSA-N 2 1 371.525 2.360 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)[NH+](C)C)c1 ZINC000247411614 549330499 /nfs/dbraw/zinc/33/04/99/549330499.db2.gz QDYDYASIHCWXSJ-AYBZRNKSSA-N 2 1 360.502 2.176 10 0 FEAEMP Cc1ccc2cc(C[NH+]3CCC4(CC3)C[N@H+](C)CCN4C)c(=O)[nH]c2c1 ZINC000067674607 221267763 /nfs/dbraw/zinc/26/77/63/221267763.db2.gz VUKPUUJJWXSVOB-UHFFFAOYSA-N 2 1 354.498 2.048 10 0 FEAEMP C[N@H+](CC(=O)NC(C)(C)C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106128125 543206018 /nfs/dbraw/zinc/20/60/18/543206018.db2.gz DPIGSIZUKHDRPY-IBGZPJMESA-N 2 1 361.530 2.279 10 0 FEAEMP CCc1nnc(C[N@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)n1C ZINC000106127175 543204597 /nfs/dbraw/zinc/20/45/97/543204597.db2.gz YSUSCHQAUGOHMF-LJQANCHMSA-N 2 1 371.529 2.255 10 0 FEAEMP CCc1nnc(C[N@@H+](C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)n1C ZINC000106127175 543204598 /nfs/dbraw/zinc/20/45/98/543204598.db2.gz YSUSCHQAUGOHMF-LJQANCHMSA-N 2 1 371.529 2.255 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N2c3ccccc3CC[C@@H]2C)CC1 ZINC000106125354 543204804 /nfs/dbraw/zinc/20/48/04/543204804.db2.gz XSLFWHSLVXQHPU-ZWKOTPCHSA-N 2 1 373.541 2.379 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C)C(=O)NC2CCC(C)CC2)CC1 ZINC000106124992 543204849 /nfs/dbraw/zinc/20/48/49/543204849.db2.gz SPTVJESGLKNMGR-VZDIDWBNSA-N 2 1 353.551 2.094 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)C[C@H]1C ZINC000117478074 543633164 /nfs/dbraw/zinc/63/31/64/543633164.db2.gz WRDREYKDDUFAHW-QUCCMNQESA-N 2 1 374.529 2.186 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)C[C@H]1C ZINC000117478074 543633168 /nfs/dbraw/zinc/63/31/68/543633168.db2.gz WRDREYKDDUFAHW-QUCCMNQESA-N 2 1 374.529 2.186 10 0 FEAEMP Cc1nc(C[NH+]2CCC(C(=O)N3C[C@@H]4CCC[N@H+]4C[C@H]3C)CC2)cs1 ZINC000247481708 549341632 /nfs/dbraw/zinc/34/16/32/549341632.db2.gz SSCSOXJOVYNTLJ-KDOFPFPSSA-N 2 1 362.543 2.359 10 0 FEAEMP Cc1nc(C[NH+]2CCC(C(=O)N3C[C@@H]4CCC[N@@H+]4C[C@H]3C)CC2)cs1 ZINC000247481708 549341636 /nfs/dbraw/zinc/34/16/36/549341636.db2.gz SSCSOXJOVYNTLJ-KDOFPFPSSA-N 2 1 362.543 2.359 10 0 FEAEMP O=C1C[NH2+]CCN1CCCC[NH+]1CCN(c2cccc3sccc32)CC1 ZINC000145226904 544433364 /nfs/dbraw/zinc/43/33/64/544433364.db2.gz KKBLPGVFIQMYJR-UHFFFAOYSA-N 2 1 372.538 2.235 10 0 FEAEMP Cc1c(CCCN2CC[NH+](C)CC2)cc(Cl)cc1N1CC[NH2+]CC1 ZINC000150277163 544461721 /nfs/dbraw/zinc/46/17/21/544461721.db2.gz VUXMSFJFJYGLMZ-UHFFFAOYSA-N 2 1 350.938 2.238 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)NC(=O)NC1CCCCC1 ZINC000154540035 544918477 /nfs/dbraw/zinc/91/84/77/544918477.db2.gz CDUSFBCHLUNBRB-WMLDXEAASA-N 2 1 361.490 2.203 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)NC(=O)NC1CCCCC1 ZINC000154540035 544918480 /nfs/dbraw/zinc/91/84/80/544918480.db2.gz CDUSFBCHLUNBRB-WMLDXEAASA-N 2 1 361.490 2.203 10 0 FEAEMP CNC(=O)c1cccc(NC(=O)[C@H](C)[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000154572014 544922869 /nfs/dbraw/zinc/92/28/69/544922869.db2.gz SPHYXGNGRKFNQU-KSSFIOAISA-N 2 1 369.469 2.043 10 0 FEAEMP CNC(=O)c1cccc(NC(=O)[C@H](C)[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000154572014 544922872 /nfs/dbraw/zinc/92/28/72/544922872.db2.gz SPHYXGNGRKFNQU-KSSFIOAISA-N 2 1 369.469 2.043 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N[C@@H]2CCC[N@@H+](CC)C2)cc1 ZINC000189428034 328147631 /nfs/dbraw/zinc/14/76/31/328147631.db2.gz BRKZNPBVWNAJOD-GOSISDBHSA-N 2 1 360.502 2.067 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)CC1 ZINC000190915549 328240019 /nfs/dbraw/zinc/24/00/19/328240019.db2.gz OGEPESRBBLFLFG-ZJRDLVKKSA-N 2 1 352.519 2.279 10 0 FEAEMP CC1CC[NH+](CCN2CCC([N@H+](C)CC(=O)OC(C)(C)C)CC2)CC1 ZINC000191983912 328291748 /nfs/dbraw/zinc/29/17/48/328291748.db2.gz KBYFOBVLZMJJGU-UHFFFAOYSA-N 2 1 353.551 2.456 10 0 FEAEMP CC1CC[NH+](CCN2CCC([N@@H+](C)CC(=O)OC(C)(C)C)CC2)CC1 ZINC000191983912 328291749 /nfs/dbraw/zinc/29/17/49/328291749.db2.gz KBYFOBVLZMJJGU-UHFFFAOYSA-N 2 1 353.551 2.456 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cn(C)nc2-c2ccncc2)CC1 ZINC000121145870 326316627 /nfs/dbraw/zinc/31/66/27/326316627.db2.gz TYEFPKDTQXDGOE-MRXNPFEDSA-N 2 1 357.502 2.007 10 0 FEAEMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N1CC[NH+]2CCC[C@@H]2C1 ZINC000171905502 327169332 /nfs/dbraw/zinc/16/93/32/327169332.db2.gz QGSMYJPEVDVVRH-DLBZAZTESA-N 2 1 362.543 2.450 10 0 FEAEMP O=C(NC[C@@H]1CCC[NH+](Cc2cccs2)C1)N1CC[N@@H+]2CCC[C@@H]2C1 ZINC000171905502 327169334 /nfs/dbraw/zinc/16/93/34/327169334.db2.gz QGSMYJPEVDVVRH-DLBZAZTESA-N 2 1 362.543 2.450 10 0 FEAEMP Clc1cccnc1N1CC[C@H]([NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)C1 ZINC000261903309 328828334 /nfs/dbraw/zinc/82/83/34/328828334.db2.gz HXTYGLVSBSOOSU-XOSAIJSUSA-N 2 1 350.894 2.060 10 0 FEAEMP O=C(Nc1cccc(C[NH2+]C[C@H]2C[NH2+]C[C@@H]2O)c1)c1ccccc1Cl ZINC000263159761 328921006 /nfs/dbraw/zinc/92/10/06/328921006.db2.gz DRUIINFMRUTQEM-KSSFIOAISA-N 2 1 359.857 2.262 10 0 FEAEMP O=C(Nc1cccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2O)c1)c1ccc(Cl)cc1 ZINC000263178868 328922450 /nfs/dbraw/zinc/92/24/50/328922450.db2.gz GLIIOLVCUGZCHS-CRAIPNDOSA-N 2 1 359.857 2.262 10 0 FEAEMP Cc1ccccc1Cc1noc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000175648276 546326915 /nfs/dbraw/zinc/32/69/15/546326915.db2.gz QZJCVTCAIUBXFC-KRWDZBQOSA-N 2 1 372.513 2.493 10 0 FEAEMP Cc1ccccc1Cc1noc(C[N@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)n1 ZINC000175648276 546326919 /nfs/dbraw/zinc/32/69/19/546326919.db2.gz QZJCVTCAIUBXFC-KRWDZBQOSA-N 2 1 372.513 2.493 10 0 FEAEMP Cc1cc(C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)ccc1-n1cncn1 ZINC000179515188 546970153 /nfs/dbraw/zinc/97/01/53/546970153.db2.gz XUUDXFCHKDXNPV-QGZVFWFLSA-N 2 1 357.502 2.100 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179751923 547007658 /nfs/dbraw/zinc/00/76/58/547007658.db2.gz KXRMYHPZYFUABS-IBGZPJMESA-N 2 1 359.518 2.424 10 0 FEAEMP COCc1noc(C[N@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)n1 ZINC000182236748 547458029 /nfs/dbraw/zinc/45/80/29/547458029.db2.gz HHIDPXMHUULWEM-SFHVURJKSA-N 2 1 374.485 2.093 10 0 FEAEMP COCc1noc(C[N@@H+](C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)n1 ZINC000182236748 547458035 /nfs/dbraw/zinc/45/80/35/547458035.db2.gz HHIDPXMHUULWEM-SFHVURJKSA-N 2 1 374.485 2.093 10 0 FEAEMP Cc1ncsc1CN(C)C[C@@H]1CC[N@H+]([C@@H]2CCN(C(C)C)C2=O)C1 ZINC000195267874 548608079 /nfs/dbraw/zinc/60/80/79/548608079.db2.gz AKWNITMTWLMKNH-JKSUJKDBSA-N 2 1 350.532 2.215 10 0 FEAEMP CCC[C@@H](C(=O)NCCC[N@H+]1CCN(C)C[C@H]1c1ccccc1)[NH+](C)C ZINC000245639920 548963448 /nfs/dbraw/zinc/96/34/48/548963448.db2.gz AUBSNJJPWDWORO-PMACEKPBSA-N 2 1 360.546 2.212 10 0 FEAEMP CCC[C@@H](C(=O)NCCCN1CC[N@H+](C)C[C@H]1c1ccccc1)[NH+](C)C ZINC000245639920 548963451 /nfs/dbraw/zinc/96/34/51/548963451.db2.gz AUBSNJJPWDWORO-PMACEKPBSA-N 2 1 360.546 2.212 10 0 FEAEMP CCC[C@@H](C(=O)NCCCN1CC[N@@H+](C)C[C@H]1c1ccccc1)[NH+](C)C ZINC000245639920 548963457 /nfs/dbraw/zinc/96/34/57/548963457.db2.gz AUBSNJJPWDWORO-PMACEKPBSA-N 2 1 360.546 2.212 10 0 FEAEMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)NC[C@H]1CN(C)CCO1 ZINC000246509188 549149612 /nfs/dbraw/zinc/14/96/12/549149612.db2.gz UPTIYLNEASQJSA-XLIONFOSSA-N 2 1 374.529 2.191 10 0 FEAEMP CCCN1Cc2cccc(NC(=O)C(=O)N[C@H]3C[N@H+](C(C)C)C[C@H]3C)c2C1 ZINC000246550368 549159865 /nfs/dbraw/zinc/15/98/65/549159865.db2.gz WAFQFQBIAMQLQN-BEFAXECRSA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N[C@H]3C[NH+](C(C)C)C[C@H]3C)c2C1 ZINC000246550368 549159867 /nfs/dbraw/zinc/15/98/67/549159867.db2.gz WAFQFQBIAMQLQN-BEFAXECRSA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N[C@H]3C[NH+](C(C)C)C[C@H]3C)c2C1 ZINC000246550368 549159871 /nfs/dbraw/zinc/15/98/71/549159871.db2.gz WAFQFQBIAMQLQN-BEFAXECRSA-N 2 1 372.513 2.196 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N[C@H]3C[N@H+](C(C)C)C[C@H]3C)c2C1 ZINC000246550368 549159876 /nfs/dbraw/zinc/15/98/76/549159876.db2.gz WAFQFQBIAMQLQN-BEFAXECRSA-N 2 1 372.513 2.196 10 0 FEAEMP CC(C)[N@@H+](C)CCNC(=O)NC[C@H](c1cccs1)N1CCO[C@@H](C)C1 ZINC000246721768 549196542 /nfs/dbraw/zinc/19/65/42/549196542.db2.gz GELOIEIDKLAZPF-JKSUJKDBSA-N 2 1 368.547 2.149 10 0 FEAEMP Cc1ccc(N2CC[C@H]([N@H+](C)CC3CC[NH+](C[C@H](C)O)CC3)C2=O)cc1 ZINC000246776347 549209094 /nfs/dbraw/zinc/20/90/94/549209094.db2.gz OJKKRFNSBNXRRS-PXNSSMCTSA-N 2 1 359.514 2.125 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000246899525 549238494 /nfs/dbraw/zinc/23/84/94/549238494.db2.gz FOVPUJAZOROWIZ-PBHICJAKSA-N 2 1 370.453 2.454 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000246899525 549238499 /nfs/dbraw/zinc/23/84/99/549238499.db2.gz FOVPUJAZOROWIZ-PBHICJAKSA-N 2 1 370.453 2.454 10 0 FEAEMP CC[C@H]1CN(C(=O)NCCCCC[NH+]2CCCCC2)CC[N@H+]1C[C@H](C)O ZINC000248484256 549449465 /nfs/dbraw/zinc/44/94/65/549449465.db2.gz JXNPIKGQOOJLHN-OALUTQOASA-N 2 1 368.566 2.129 10 0 FEAEMP CC(C)n1cc(C[NH+]2CCC3(CC[C@H](C[NH+]4CCOCC4)O3)CC2)cn1 ZINC000257188464 549714726 /nfs/dbraw/zinc/71/47/26/549714726.db2.gz FNCITFDPEJFPQT-LJQANCHMSA-N 2 1 362.518 2.310 10 0 FEAEMP CN(C)C(=O)COc1ccccc1C[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261632661 549737469 /nfs/dbraw/zinc/73/74/69/549737469.db2.gz FOTLVWGQAJTNKH-UXHICEINSA-N 2 1 367.493 2.328 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)[C@](C)([NH3+])c1ccc(Br)cc1 ZINC000261749001 549751508 /nfs/dbraw/zinc/75/15/08/549751508.db2.gz MOHZPGMWENTQQZ-ISTRZQFTSA-N 2 1 366.303 2.318 10 0 FEAEMP C[C@H](NC(=O)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1)c1ccc(Br)cc1 ZINC000262473351 549822944 /nfs/dbraw/zinc/82/29/44/549822944.db2.gz JLRKDJKGVZEEIP-DDUYRFODSA-N 2 1 366.303 2.295 10 0 FEAEMP C[C@H](NC(=O)C[N@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1)c1ccc(Br)cc1 ZINC000262473351 549822945 /nfs/dbraw/zinc/82/29/45/549822945.db2.gz JLRKDJKGVZEEIP-DDUYRFODSA-N 2 1 366.303 2.295 10 0 FEAEMP CN(C(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000653448417 677531498 /nfs/dbraw/zinc/53/14/98/677531498.db2.gz RVJJLRLLDRNWAR-ARFHVFGLSA-N 2 1 355.404 2.117 10 0 FEAEMP COc1ccc(NC(=O)[C@H](C)[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1 ZINC000106125614 543204842 /nfs/dbraw/zinc/20/48/42/543204842.db2.gz QXOAMAGMMFZALZ-CVEARBPZSA-N 2 1 363.502 2.047 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccccc1OCC[NH+](C)C ZINC000113607048 543492832 /nfs/dbraw/zinc/49/28/32/543492832.db2.gz DALKTWVRUWDLNO-FUHWJXTLSA-N 2 1 360.502 2.005 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1CC[N@H+](CCOC)[C@H](C)C1)c1ccco1 ZINC000117486181 543633564 /nfs/dbraw/zinc/63/35/64/543633564.db2.gz HFUXBWICSRKFCA-IAGOWNOFSA-N 2 1 366.506 2.025 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1CC[N@@H+](CCOC)[C@H](C)C1)c1ccco1 ZINC000117486181 543633566 /nfs/dbraw/zinc/63/35/66/543633566.db2.gz HFUXBWICSRKFCA-IAGOWNOFSA-N 2 1 366.506 2.025 10 0 FEAEMP C[C@H](NC[C@H](O)C[N@@H+]1CCc2ccccc2C1)c1ccc([S@](C)=O)cc1 ZINC000151793674 544580158 /nfs/dbraw/zinc/58/01/58/544580158.db2.gz CYHLBFXAFKKYIF-SKNUGPPASA-N 2 1 372.534 2.494 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N(CC[NH+](C)C)Cc1ccco1 ZINC000152405952 544649064 /nfs/dbraw/zinc/64/90/64/544649064.db2.gz CHWIZYQSTCMYDD-QGZVFWFLSA-N 2 1 350.507 2.473 10 0 FEAEMP C[N@H+](Cc1cccnc1)C[C@@H]1CCN(C(=O)NC[C@@H]2CC[NH+](C3CC3)C2)C1 ZINC000190694988 328225652 /nfs/dbraw/zinc/22/56/52/328225652.db2.gz ULTFHNIDPZWAFR-OALUTQOASA-N 2 1 371.529 2.029 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@@H]1CCN(C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000190694988 328225653 /nfs/dbraw/zinc/22/56/53/328225653.db2.gz ULTFHNIDPZWAFR-OALUTQOASA-N 2 1 371.529 2.029 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@@H]1CCN(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)C1 ZINC000190694988 328225655 /nfs/dbraw/zinc/22/56/55/328225655.db2.gz ULTFHNIDPZWAFR-OALUTQOASA-N 2 1 371.529 2.029 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)C1 ZINC000121167176 326318653 /nfs/dbraw/zinc/31/86/53/326318653.db2.gz HQSGLGHDHKIFNU-JLSDUUJJSA-N 2 1 350.482 2.456 10 0 FEAEMP CC[NH+]1CCN(c2ccc(NC(=O)N3CC[N@H+]4CCC[C@H]4C3)c(C)c2)CC1 ZINC000171806954 327162789 /nfs/dbraw/zinc/16/27/89/327162789.db2.gz PSFQMQDMRRVGSN-IBGZPJMESA-N 2 1 371.529 2.449 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3CC[N@H+]4CCCC[C@H]4C3)cc2)CC1 ZINC000173748826 327281149 /nfs/dbraw/zinc/28/11/49/327281149.db2.gz WMHQCBJMDPYULK-FQEVSTJZSA-N 2 1 356.514 2.139 10 0 FEAEMP COc1cc(OC)cc(Oc2ccc(C[NH2+]C[C@@H]3C[NH2+]C[C@@H]3O)cc2)c1 ZINC000263298490 328931393 /nfs/dbraw/zinc/93/13/93/328931393.db2.gz WROLZOJVDALVQS-QRWLVFNGSA-N 2 1 358.438 2.166 10 0 FEAEMP CC(C)[N@@H+](C)CCNC(=O)NC[C@@H](c1cccs1)N1CCO[C@H](C)C1 ZINC000178635350 546824961 /nfs/dbraw/zinc/82/49/61/546824961.db2.gz GELOIEIDKLAZPF-CVEARBPZSA-N 2 1 368.547 2.149 10 0 FEAEMP CCOc1cccc(CNC(=O)C[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000178753646 546844677 /nfs/dbraw/zinc/84/46/77/546844677.db2.gz YKUVOJNQJAOGMM-SFHVURJKSA-N 2 1 356.470 2.371 10 0 FEAEMP CCOc1cccc(CNC(=O)C[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000178753646 546844680 /nfs/dbraw/zinc/84/46/80/546844680.db2.gz YKUVOJNQJAOGMM-SFHVURJKSA-N 2 1 356.470 2.371 10 0 FEAEMP CC[C@@H]1CCCCN1C(=O)[C@H](C)[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247567633 549359902 /nfs/dbraw/zinc/35/99/02/549359902.db2.gz GUSGBMIIHABZFG-JENIJYKNSA-N 2 1 353.551 2.191 10 0 FEAEMP CCCNC(=O)[C@H](C)[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000247600529 549364737 /nfs/dbraw/zinc/36/47/37/549364737.db2.gz KYMJPRJSFHINQG-FXAWDEMLSA-N 2 1 361.530 2.279 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)NC[C@H]2C[NH+](Cc3ccccc3)CCCO2)C1 ZINC000248656294 549478589 /nfs/dbraw/zinc/47/85/89/549478589.db2.gz DMBRDHLZQQQMJE-PMACEKPBSA-N 2 1 374.529 2.061 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@H]2C[N@H+](Cc3ccccc3)CCCO2)C1 ZINC000248656294 549478594 /nfs/dbraw/zinc/47/85/94/549478594.db2.gz DMBRDHLZQQQMJE-PMACEKPBSA-N 2 1 374.529 2.061 10 0 FEAEMP CC[NH+]1CCC[C@H](NC(=O)NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)C1 ZINC000248656294 549478599 /nfs/dbraw/zinc/47/85/99/549478599.db2.gz DMBRDHLZQQQMJE-PMACEKPBSA-N 2 1 374.529 2.061 10 0 FEAEMP COC1CC[NH+](C2(CN[C@@H]3CCC[C@@H]3[C@@H]3COCC[NH2+]3)CCCC2)CC1 ZINC000261886633 549765616 /nfs/dbraw/zinc/76/56/16/549765616.db2.gz FYXOLDNNEWCIRX-ZCNNSNEGSA-N 3 1 365.562 2.157 10 0 FEAEMP O=C1CCCN1Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)cc1 ZINC000261929381 549771156 /nfs/dbraw/zinc/77/11/56/549771156.db2.gz LLUVPYNLWDTLNM-AQNXPRMDSA-N 2 1 357.498 2.056 10 0 FEAEMP C[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@H]2CO1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000365115986 555489016 /nfs/dbraw/zinc/48/90/16/555489016.db2.gz HSGSCLNHLPXRFS-VVLHAWIVSA-N 2 1 353.507 2.085 10 0 FEAEMP C[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@H]2CO1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000365115986 555489018 /nfs/dbraw/zinc/48/90/18/555489018.db2.gz HSGSCLNHLPXRFS-VVLHAWIVSA-N 2 1 353.507 2.085 10 0 FEAEMP C[C@@H](CCNC(=O)[C@@H]1C[NH2+]C[C@H]1C(F)(F)F)[N@@H+](C)Cc1ccccc1 ZINC000653123778 677516684 /nfs/dbraw/zinc/51/66/84/677516684.db2.gz HMLFTCZNYMARJO-NUEKZKHPSA-N 2 1 357.420 2.411 10 0 FEAEMP Cc1cc(N2CCC(NC(=O)N[C@H]3C[N@H+](C(C)C)C[C@H]3C)CC2)nc(C)[nH+]1 ZINC000247390722 549328256 /nfs/dbraw/zinc/32/82/56/549328256.db2.gz QKQFELVKGPRFFC-KDOFPFPSSA-N 2 1 374.533 2.090 10 0 FEAEMP Cc1cc(N2CCC(NC(=O)N[C@H]3C[N@@H+](C(C)C)C[C@H]3C)CC2)nc(C)[nH+]1 ZINC000247390722 549328259 /nfs/dbraw/zinc/32/82/59/549328259.db2.gz QKQFELVKGPRFFC-KDOFPFPSSA-N 2 1 374.533 2.090 10 0 FEAEMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)NC[C@@H]3CN(C)CCO3)cc2)C1 ZINC000104787348 543143706 /nfs/dbraw/zinc/14/37/06/543143706.db2.gz SLDMGCILWWBPQY-FXAWDEMLSA-N 2 1 374.529 2.048 10 0 FEAEMP CCN(CC)C(=O)C[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106128120 543205808 /nfs/dbraw/zinc/20/58/08/543205808.db2.gz RPNYZNHFEMLXHT-FQEVSTJZSA-N 2 1 361.530 2.232 10 0 FEAEMP C[NH+](C)C[C@@H]1CN(C(=O)NC[C@H]2CCCC[N@H+]2Cc2ccccc2)CCO1 ZINC000117040263 543621999 /nfs/dbraw/zinc/62/19/99/543621999.db2.gz KOGCAFGKXDQRDK-WOJBJXKFSA-N 2 1 374.529 2.013 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1Cc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000131619495 544198280 /nfs/dbraw/zinc/19/82/80/544198280.db2.gz GHNSYZOPJLCNNK-QGZVFWFLSA-N 2 1 362.499 2.106 10 0 FEAEMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1Cc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000131619495 544198284 /nfs/dbraw/zinc/19/82/84/544198284.db2.gz GHNSYZOPJLCNNK-QGZVFWFLSA-N 2 1 362.499 2.106 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000187682590 328039453 /nfs/dbraw/zinc/03/94/53/328039453.db2.gz DXOIAWGJRQKARN-CVEARBPZSA-N 2 1 368.543 2.176 10 0 FEAEMP Cc1cccc2nc(C[NH+]3CCC(Cc4[nH+]ccn4C)CC3)cc(=O)n12 ZINC000106166575 325587727 /nfs/dbraw/zinc/58/77/27/325587727.db2.gz KQEZMWQBQSKREI-UHFFFAOYSA-N 2 1 351.454 2.191 10 0 FEAEMP O=C(NC1CC[NH+](CCc2ccccc2)CC1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000171900333 327168701 /nfs/dbraw/zinc/16/87/01/327168701.db2.gz DSALQISPHNPPHK-HXUWFJFHSA-N 2 1 356.514 2.183 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)Cn2c(C)nc3ccccc32)C[C@H]1CC ZINC000172297853 327193664 /nfs/dbraw/zinc/19/36/64/327193664.db2.gz UEMVDLJFYNNLJQ-QGZVFWFLSA-N 2 1 358.486 2.304 10 0 FEAEMP CCOCCN1CCN(C(=O)Cn2c(C)nc3ccccc32)C[C@H]1CC ZINC000172297853 327193665 /nfs/dbraw/zinc/19/36/65/327193665.db2.gz UEMVDLJFYNNLJQ-QGZVFWFLSA-N 2 1 358.486 2.304 10 0 FEAEMP O=C1CCCN1Cc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000261913244 328829028 /nfs/dbraw/zinc/82/90/28/328829028.db2.gz JGPMRBMUUDDHOT-AQNXPRMDSA-N 2 1 357.498 2.056 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCc2cccc(OCC[NH+](C)C)c2)C1 ZINC000157828890 545789587 /nfs/dbraw/zinc/78/95/87/545789587.db2.gz HNCDPSJEBJRHGR-APWZRJJASA-N 2 1 362.518 2.155 10 0 FEAEMP CC[N@@H+](C)[C@H](C(=O)N(C)CC1CC[NH+](C[C@@H](C)O)CC1)c1ccccc1 ZINC000176861856 546497327 /nfs/dbraw/zinc/49/73/27/546497327.db2.gz DAZAREUENWBZKR-XLIONFOSSA-N 2 1 361.530 2.231 10 0 FEAEMP COc1cc(OC)c(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c(OC)c1 ZINC000179517143 546970078 /nfs/dbraw/zinc/97/00/78/546970078.db2.gz JBWAYXAGZPTMOJ-HNNXBMFYSA-N 2 1 366.502 2.237 10 0 FEAEMP CC[C@H]1CN(C(=O)NCC[C@@H](C)[NH+]2CCCCC2)CC[N@H+]1CCOC ZINC000182688717 547534560 /nfs/dbraw/zinc/53/45/60/547534560.db2.gz PLWXHUQNXDPSSN-MSOLQXFVSA-N 2 1 354.539 2.003 10 0 FEAEMP COCc1noc([C@@H](C)[NH2+]CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)n1 ZINC000183072304 547595710 /nfs/dbraw/zinc/59/57/10/547595710.db2.gz OHIXJRUMPCSWPI-CRAIPNDOSA-N 2 1 374.485 2.312 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N[C@H]2CCC[N@@H+](CC)C2)c1 ZINC000194156846 548443249 /nfs/dbraw/zinc/44/32/49/548443249.db2.gz XOTBERAMUMAOOU-SFHVURJKSA-N 2 1 360.502 2.067 10 0 FEAEMP Cc1ncsc1CN(C)C[C@@H]1CC[N@H+]([C@@H](C)C(=O)NCC(C)C)C1 ZINC000195266639 548608255 /nfs/dbraw/zinc/60/82/55/548608255.db2.gz HVHQIOMOZXFCDR-HOTGVXAUSA-N 2 1 352.548 2.366 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@@H]2CCC[C@@H]([NH+](C)C)C2)C[C@@H]1CC ZINC000246964698 549253272 /nfs/dbraw/zinc/25/32/72/549253272.db2.gz IVMSJLFBLNUUBG-FGTMMUONSA-N 2 1 354.539 2.002 10 0 FEAEMP CC[C@H](C)NC(=O)C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000247807305 549381920 /nfs/dbraw/zinc/38/19/20/549381920.db2.gz SYSHJKURENFJSE-FXAWDEMLSA-N 2 1 361.530 2.279 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)C[C@H]1C ZINC000248407605 549430234 /nfs/dbraw/zinc/43/02/34/549430234.db2.gz ULKLLZTWYWHZPI-KZNAEPCWSA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)C[C@H]1C ZINC000248407605 549430238 /nfs/dbraw/zinc/43/02/38/549430238.db2.gz ULKLLZTWYWHZPI-KZNAEPCWSA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)C[C@H]1C ZINC000248407605 549430241 /nfs/dbraw/zinc/43/02/41/549430241.db2.gz ULKLLZTWYWHZPI-KZNAEPCWSA-N 2 1 366.550 2.002 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C[C@H]1C ZINC000248407605 549430243 /nfs/dbraw/zinc/43/02/43/549430243.db2.gz ULKLLZTWYWHZPI-KZNAEPCWSA-N 2 1 366.550 2.002 10 0 FEAEMP CCO[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)C12CCOCC2 ZINC000249054381 549543218 /nfs/dbraw/zinc/54/32/18/549543218.db2.gz XHSQQFZMKKDHAV-QHAWAJNXSA-N 2 1 374.525 2.317 10 0 FEAEMP c1cc(CN2CC[NH+]3CCC[C@@H]3C2)cc(CN2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000252692195 549676687 /nfs/dbraw/zinc/67/66/87/549676687.db2.gz RHCGKEHUIMLOBR-SZPZYZBQSA-N 2 1 354.542 2.247 10 0 FEAEMP c1cc(CN2CC[N@@H+]3CCC[C@@H]3C2)cc(CN2CC[NH+]3CCC[C@H]3C2)c1 ZINC000252692195 549676691 /nfs/dbraw/zinc/67/66/91/549676691.db2.gz RHCGKEHUIMLOBR-SZPZYZBQSA-N 2 1 354.542 2.247 10 0 FEAEMP c1cc(CN2CC[N@H+]3CCC[C@@H]3C2)cc(CN2CC[NH+]3CCC[C@H]3C2)c1 ZINC000252692195 549676695 /nfs/dbraw/zinc/67/66/95/549676695.db2.gz RHCGKEHUIMLOBR-SZPZYZBQSA-N 2 1 354.542 2.247 10 0 FEAEMP COc1cccc(CN(C)C(=O)C[N@@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261606876 549733811 /nfs/dbraw/zinc/73/38/11/549733811.db2.gz BIDTUNCEKVVABM-CTNGQTDRSA-N 2 1 367.493 2.328 10 0 FEAEMP COc1cccc(CN(C)C(=O)C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c1 ZINC000261606876 549733813 /nfs/dbraw/zinc/73/38/13/549733813.db2.gz BIDTUNCEKVVABM-CTNGQTDRSA-N 2 1 367.493 2.328 10 0 FEAEMP Fc1cccc(F)c1N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)C1 ZINC000261871770 549763961 /nfs/dbraw/zinc/76/39/61/549763961.db2.gz DFHOCZAOHZECFE-ZZCKCESHSA-N 2 1 351.441 2.290 10 0 FEAEMP Clc1cccnc1N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)C1 ZINC000261903307 549767880 /nfs/dbraw/zinc/76/78/80/549767880.db2.gz HXTYGLVSBSOOSU-XJNFMUPTSA-N 2 1 350.894 2.060 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000263164825 549882723 /nfs/dbraw/zinc/88/27/23/549882723.db2.gz FCSUOHGFLAHMBK-BXUZGUMPSA-N 2 1 368.300 2.243 10 0 FEAEMP OC[C@@H]1C[N@@H+](Cc2cc(Br)ccc2F)CC12CC[NH2+]CC2 ZINC000169783920 672322468 /nfs/dbraw/zinc/32/24/68/672322468.db2.gz SKUJXEZTQLMHME-ZDUSSCGKSA-N 2 1 357.267 2.382 10 0 FEAEMP OC[C@H]1CCCC[N@H+]1CCNc1nc(-c2ccccc2)nc2c1CC[NH2+]C2 ZINC000067724049 221276908 /nfs/dbraw/zinc/27/69/08/221276908.db2.gz GNVRKIXFMUUNSU-QGZVFWFLSA-N 2 1 367.497 2.048 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)[NH+](C)C)c1 ZINC000113580455 543490930 /nfs/dbraw/zinc/49/09/30/543490930.db2.gz QDYDYASIHCWXSJ-SUMDDJOVSA-N 2 1 360.502 2.176 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@@H]2CCC[NH+](C(C)C)C2)C[C@H]1CC ZINC000117046078 543621841 /nfs/dbraw/zinc/62/18/41/543621841.db2.gz BKEQHJYJTMECMR-RBUKOAKNSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](C(C)C)C2)C[C@H]1CC ZINC000117046078 543621844 /nfs/dbraw/zinc/62/18/44/543621844.db2.gz BKEQHJYJTMECMR-RBUKOAKNSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCC[NH+]1CCN(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)C[C@H]1CC ZINC000117046078 543621847 /nfs/dbraw/zinc/62/18/47/543621847.db2.gz BKEQHJYJTMECMR-RBUKOAKNSA-N 2 1 368.566 2.249 10 0 FEAEMP C[NH+](C)C[C@H]1CN(C(=O)NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)CCO1 ZINC000117040261 543622051 /nfs/dbraw/zinc/62/20/51/543622051.db2.gz KOGCAFGKXDQRDK-PMACEKPBSA-N 2 1 374.529 2.013 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N[C@H]2CCC[N@@H+](CC)C2)cc1 ZINC000189428009 328147514 /nfs/dbraw/zinc/14/75/14/328147514.db2.gz BRKZNPBVWNAJOD-SFHVURJKSA-N 2 1 360.502 2.067 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc(C[NH+]3CCC(CO)CC3)cc2)C1 ZINC000121298517 326327960 /nfs/dbraw/zinc/32/79/60/326327960.db2.gz UYFVPONQXJKIKF-UTKZUKDTSA-N 2 1 373.541 2.349 10 0 FEAEMP CC[C@H](C)NC(=O)C[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000170942107 327108929 /nfs/dbraw/zinc/10/89/29/327108929.db2.gz SYSHJKURENFJSE-PXNSSMCTSA-N 2 1 361.530 2.279 10 0 FEAEMP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1 ZINC000262048440 328838173 /nfs/dbraw/zinc/83/81/73/328838173.db2.gz ZIWDIYDVGRHTFR-YPAWHYETSA-N 3 1 373.541 2.408 10 0 FEAEMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)[C@H]3[NH2+]CCO[C@@H]3C)cc2)C1 ZINC000262330303 328859410 /nfs/dbraw/zinc/85/94/10/328859410.db2.gz SEYJIXWCGORCDK-VIPLHTEESA-N 2 1 359.514 2.158 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1C[C@H](C)[C@H]([NH+]2CCOCC2)C1)CC(C)C ZINC000175652365 546328166 /nfs/dbraw/zinc/32/81/66/546328166.db2.gz ONXQREIBYDCEMB-GBESFXJTSA-N 2 1 368.566 2.105 10 0 FEAEMP CCc1oc(C(=O)OC)cc1C[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1 ZINC000177133384 546552095 /nfs/dbraw/zinc/55/20/95/546552095.db2.gz NWVACGXZWPPOAP-CQSZACIVSA-N 2 1 352.475 2.153 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)CC[NH+]1C[C@@H](C)O ZINC000184844217 547886417 /nfs/dbraw/zinc/88/64/17/547886417.db2.gz LRGSICZVGZGPGB-IPMKNSEASA-N 2 1 368.566 2.128 10 0 FEAEMP CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)[C@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000245438953 548920333 /nfs/dbraw/zinc/92/03/33/548920333.db2.gz YWOOGNCSWMBOFN-QUCCMNQESA-N 2 1 359.514 2.127 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)[C@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000245438953 548920338 /nfs/dbraw/zinc/92/03/38/548920338.db2.gz YWOOGNCSWMBOFN-QUCCMNQESA-N 2 1 359.514 2.127 10 0 FEAEMP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000246116858 549055802 /nfs/dbraw/zinc/05/58/02/549055802.db2.gz IDMWMJWTGRXABJ-BRSBDYLESA-N 2 1 366.550 2.142 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000246116858 549055803 /nfs/dbraw/zinc/05/58/03/549055803.db2.gz IDMWMJWTGRXABJ-BRSBDYLESA-N 2 1 366.550 2.142 10 0 FEAEMP CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000246567216 549163921 /nfs/dbraw/zinc/16/39/21/549163921.db2.gz XDGGFQKDLDMXOG-YLJYHZDGSA-N 2 1 374.529 2.412 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)Nc2ccc(CC[NH+]3CCOCC3)cc2)C1 ZINC000246567216 549163927 /nfs/dbraw/zinc/16/39/27/549163927.db2.gz XDGGFQKDLDMXOG-YLJYHZDGSA-N 2 1 374.529 2.412 10 0 FEAEMP COCCN1CCN(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000246989582 549258458 /nfs/dbraw/zinc/25/84/58/549258458.db2.gz GBVVMTJIWUUBGS-QUCCMNQESA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)N[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000246989582 549258461 /nfs/dbraw/zinc/25/84/61/549258461.db2.gz GBVVMTJIWUUBGS-QUCCMNQESA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)N[C@H]2CCC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC000246989582 549258463 /nfs/dbraw/zinc/25/84/63/549258463.db2.gz GBVVMTJIWUUBGS-QUCCMNQESA-N 2 1 374.529 2.013 10 0 FEAEMP COCC[NH+]1CCN(C(=O)N[C@H]2CCC[N@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000246989582 549258465 /nfs/dbraw/zinc/25/84/65/549258465.db2.gz GBVVMTJIWUUBGS-QUCCMNQESA-N 2 1 374.529 2.013 10 0 FEAEMP CCOc1ccc(OC[C@@H](O)C[N@H+]2CCC[C@H]2Cn2ccnc2C)cc1 ZINC000247019158 549266984 /nfs/dbraw/zinc/26/69/84/549266984.db2.gz LSEXLIGOHVMKOW-ROUUACIJSA-N 2 1 359.470 2.495 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@H](C)c2nc(-c3cccnc3)no2)CC1 ZINC000247138913 549290056 /nfs/dbraw/zinc/29/00/56/549290056.db2.gz XQEZHVRXPZTXHT-HUUCEWRRSA-N 2 1 359.474 2.217 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[NH+]3C[C@@H]2C)[C@@H](C)C1 ZINC000247169939 549293562 /nfs/dbraw/zinc/29/35/62/549293562.db2.gz JNTGDXQFATVCIL-VJANTYMQSA-N 2 1 366.550 2.002 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[N@@H+]3C[C@@H]2C)[C@@H](C)C1 ZINC000247169939 549293566 /nfs/dbraw/zinc/29/35/66/549293566.db2.gz JNTGDXQFATVCIL-VJANTYMQSA-N 2 1 366.550 2.002 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)[C@@H](C)C1 ZINC000247169939 549293569 /nfs/dbraw/zinc/29/35/69/549293569.db2.gz JNTGDXQFATVCIL-VJANTYMQSA-N 2 1 366.550 2.002 10 0 FEAEMP COc1ccccc1CNC(=O)[C@@H](C)[N@@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000247218459 549301211 /nfs/dbraw/zinc/30/12/11/549301211.db2.gz YIMDJPHQCIDTDY-QAPCUYQASA-N 2 1 356.470 2.369 10 0 FEAEMP COc1ccccc1CNC(=O)[C@@H](C)[N@H+]1CCC[C@H]1Cn1cc[nH+]c1C ZINC000247218459 549301213 /nfs/dbraw/zinc/30/12/13/549301213.db2.gz YIMDJPHQCIDTDY-QAPCUYQASA-N 2 1 356.470 2.369 10 0 FEAEMP O=C(Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c1)[C@H]1CCCO1 ZINC000262016369 549780759 /nfs/dbraw/zinc/78/07/59/549780759.db2.gz WCHBPIDEHZITOK-ZGXWSNOMSA-N 2 1 373.497 2.051 10 0 FEAEMP O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1ccn([C@@H]2CCC[NH2+]C2)n1 ZINC000262761745 549847071 /nfs/dbraw/zinc/84/70/71/549847071.db2.gz LNHUXNPRQNHTNO-AEFFLSMTSA-N 2 1 371.485 2.358 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000263199822 549885278 /nfs/dbraw/zinc/88/52/78/549885278.db2.gz IXXJFMUGAMWQGN-PZJWPPBQSA-N 2 1 362.477 2.268 10 0 FEAEMP C[NH+](C)C1(C[NH2+][C@H]2CCCN(C(=O)OC(C)(C)C)CC2)CCOCC1 ZINC000183512781 672470751 /nfs/dbraw/zinc/47/07/51/672470751.db2.gz WXFACLCWJFIZAS-INIZCTEOSA-N 2 1 355.523 2.476 10 0 FEAEMP COc1cccc([C@H](CNC(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)[NH+](C)C)c1 ZINC000247411616 549329830 /nfs/dbraw/zinc/32/98/30/549329830.db2.gz QDYDYASIHCWXSJ-IEZWGBDMSA-N 2 1 360.502 2.176 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(Cc1ccon1)CC1CC[NH+](CCOC)CC1 ZINC000020999828 220348020 /nfs/dbraw/zinc/34/80/20/220348020.db2.gz AXECRNWGQBXZON-HXUWFJFHSA-N 2 1 364.534 2.319 10 0 FEAEMP Cc1ccc(C2(C[NH+]3CCN(C(=O)c4ccco4)CC3)CC[NH2+]CC2)nc1 ZINC000065492346 221225884 /nfs/dbraw/zinc/22/58/84/221225884.db2.gz OLTYIPYWYJTIEU-UHFFFAOYSA-N 2 1 368.481 2.062 10 0 FEAEMP OC[C@@H]1CCCC[N@H+]1CCNc1nc(-c2ccccc2)nc2c1CC[NH2+]C2 ZINC000067724051 221276235 /nfs/dbraw/zinc/27/62/35/221276235.db2.gz GNVRKIXFMUUNSU-KRWDZBQOSA-N 2 1 367.497 2.048 10 0 FEAEMP CCO[C@H]1C[C@@H]([N@H+](C)Cc2cnc(N3CC[NH+](C)CC3)nc2)C12CCCC2 ZINC000093611075 542934855 /nfs/dbraw/zinc/93/48/55/542934855.db2.gz JHISWRISRCVXNL-MOPGFXCFSA-N 2 1 373.545 2.398 10 0 FEAEMP CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cnc(N3CC[NH+](C)CC3)nc2)C12CCCC2 ZINC000093611075 542934857 /nfs/dbraw/zinc/93/48/57/542934857.db2.gz JHISWRISRCVXNL-MOPGFXCFSA-N 2 1 373.545 2.398 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)C[C@@H](O)COc2ccccc2Cl)CC1 ZINC000247471081 549339233 /nfs/dbraw/zinc/33/92/33/549339233.db2.gz RRDHBEPNCBCPAA-NVXWUHKLSA-N 2 1 370.921 2.104 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)Cc2nc(-c3ccccc3F)no2)CC1 ZINC000189010323 328123128 /nfs/dbraw/zinc/12/31/28/328123128.db2.gz VPUAJSZIEWIEDG-CQSZACIVSA-N 2 1 362.449 2.400 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2nc(-c3ccccc3F)no2)CC1 ZINC000189010323 328123131 /nfs/dbraw/zinc/12/31/31/328123131.db2.gz VPUAJSZIEWIEDG-CQSZACIVSA-N 2 1 362.449 2.400 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000191003409 328244858 /nfs/dbraw/zinc/24/48/58/328244858.db2.gz RPWBIPGISBFWMV-XBPCWFMRSA-N 2 1 364.530 2.420 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000191003409 328244859 /nfs/dbraw/zinc/24/48/59/328244859.db2.gz RPWBIPGISBFWMV-XBPCWFMRSA-N 2 1 364.530 2.420 10 0 FEAEMP CCOC(=O)C1CCC(O)(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000191003409 328244860 /nfs/dbraw/zinc/24/48/60/328244860.db2.gz RPWBIPGISBFWMV-XBPCWFMRSA-N 2 1 364.530 2.420 10 0 FEAEMP CC[C@H]1CN(C(=O)NC2CC[NH+](C(C)(C)C)CC2)CC[N@H+]1CCOC ZINC000117482911 326062572 /nfs/dbraw/zinc/06/25/72/326062572.db2.gz NORPHYSAXIAYLO-KRWDZBQOSA-N 2 1 354.539 2.002 10 0 FEAEMP C[C@@H](O)C[N@H+]1CCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@H]1C ZINC000120630638 326274028 /nfs/dbraw/zinc/27/40/28/326274028.db2.gz DTVGBRVNSGRNID-RTBURBONSA-N 2 1 374.573 2.104 10 0 FEAEMP COCC[N@H+]1CCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@@H]1C ZINC000120823719 326291111 /nfs/dbraw/zinc/29/11/11/326291111.db2.gz RMKZHYIDRPKPRJ-IBGZPJMESA-N 2 1 374.573 2.370 10 0 FEAEMP COCCN1CC[N@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@@H]1C ZINC000120823719 326291113 /nfs/dbraw/zinc/29/11/13/326291113.db2.gz RMKZHYIDRPKPRJ-IBGZPJMESA-N 2 1 374.573 2.370 10 0 FEAEMP COCCN1CC[N@@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)C[C@@H]1C ZINC000120823719 326291115 /nfs/dbraw/zinc/29/11/15/326291115.db2.gz RMKZHYIDRPKPRJ-IBGZPJMESA-N 2 1 374.573 2.370 10 0 FEAEMP CN(C)[C@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)c1c(F)cccc1F ZINC000172159571 327184775 /nfs/dbraw/zinc/18/47/75/327184775.db2.gz VTVYCDVCGPPYEP-CZUORRHYSA-N 2 1 352.429 2.057 10 0 FEAEMP C[C@@H](c1ccc(NC(=O)N2CC[N@@H+]3CCC[C@@H]3C2)cc1)[NH+]1CCOCC1 ZINC000172250250 327190242 /nfs/dbraw/zinc/19/02/42/327190242.db2.gz ZPTDTWCTRODVLD-QFBILLFUSA-N 2 1 358.486 2.392 10 0 FEAEMP C[C@@H](c1ccc(NC(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc1)[NH+]1CCOCC1 ZINC000172250250 327190243 /nfs/dbraw/zinc/19/02/43/327190243.db2.gz ZPTDTWCTRODVLD-QFBILLFUSA-N 2 1 358.486 2.392 10 0 FEAEMP CCc1[nH+]ccn1[C@H]1CCCN(C(=O)[C@H]([NH2+]C2CCOCC2)C(C)C)C1 ZINC000173157204 327238138 /nfs/dbraw/zinc/23/81/38/327238138.db2.gz NORNBPNONVDNAL-PKOBYXMFSA-N 2 1 362.518 2.402 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)CC[NH+]2CCN(c3cccc(C)c3)CC2)C1 ZINC000174645116 327341221 /nfs/dbraw/zinc/34/12/21/327341221.db2.gz ILTSYXDYLHXMIY-LJQANCHMSA-N 2 1 358.530 2.108 10 0 FEAEMP CCn1cc(C[N@@H+]2CCCN(C(=O)C3CC[NH+](C(C)C)CC3)CC2)cn1 ZINC000174654885 327341731 /nfs/dbraw/zinc/34/17/31/327341731.db2.gz JNCMBOFXUIAPRX-UHFFFAOYSA-N 2 1 361.534 2.058 10 0 FEAEMP CCn1cc(C[N@H+]2CCCN(C(=O)C3CC[NH+](C(C)C)CC3)CC2)cn1 ZINC000174654885 327341732 /nfs/dbraw/zinc/34/17/32/327341732.db2.gz JNCMBOFXUIAPRX-UHFFFAOYSA-N 2 1 361.534 2.058 10 0 FEAEMP CC(C)c1nn(C)c(N2CCOCC2)c1C[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000175012877 327367994 /nfs/dbraw/zinc/36/79/94/327367994.db2.gz GFXFTDWXCNNFMA-DLBZAZTESA-N 2 1 363.550 2.343 10 0 FEAEMP CC[NH+](CC)[C@H](CNC(=O)N1C[C@@H](C)[C@H]([NH+]2CCOCC2)C1)CC(C)C ZINC000175652401 327404926 /nfs/dbraw/zinc/40/49/26/327404926.db2.gz ONXQREIBYDCEMB-CEXWTWQISA-N 2 1 368.566 2.105 10 0 FEAEMP COc1cc(OC)c(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)c(OC)c1 ZINC000261901888 328828089 /nfs/dbraw/zinc/82/80/89/328828089.db2.gz HTDNBZBAVHRIMJ-KBAYOESNSA-N 2 1 364.486 2.002 10 0 FEAEMP c1sc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)nc1-c1ccncc1 ZINC000261985668 328833544 /nfs/dbraw/zinc/83/35/44/328833544.db2.gz SAWCEOHVZQWFAP-GVDBMIGSSA-N 2 1 358.511 2.494 10 0 FEAEMP COc1ccc(C2(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3COCC[NH2+]3)CCOCC2)cc1 ZINC000262016168 328835458 /nfs/dbraw/zinc/83/54/58/328835458.db2.gz VZWZSTOEXYBUPV-NJYVYQBISA-N 2 1 374.525 2.490 10 0 FEAEMP Cn1cc([C@H]2CC[N@@H+](CCCC[NH+]3CC[C@@H](c4cnn(C)c4)C3)C2)cn1 ZINC000158414403 545857263 /nfs/dbraw/zinc/85/72/63/545857263.db2.gz LPAKCHZRANQZAH-HDICACEKSA-N 2 1 356.518 2.213 10 0 FEAEMP Cn1cc([C@H]2CC[NH+](CCCC[N@@H+]3CC[C@@H](c4cnn(C)c4)C3)C2)cn1 ZINC000158414403 545857268 /nfs/dbraw/zinc/85/72/68/545857268.db2.gz LPAKCHZRANQZAH-HDICACEKSA-N 2 1 356.518 2.213 10 0 FEAEMP Cn1cc([C@H]2CC[NH+](CCCC[N@H+]3CC[C@@H](c4cnn(C)c4)C3)C2)cn1 ZINC000158414403 545857272 /nfs/dbraw/zinc/85/72/72/545857272.db2.gz LPAKCHZRANQZAH-HDICACEKSA-N 2 1 356.518 2.213 10 0 FEAEMP C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000177144064 546553970 /nfs/dbraw/zinc/55/39/70/546553970.db2.gz AWJMRFPPJOIIAY-YLJYHZDGSA-N 2 1 372.513 2.262 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000177144064 546553973 /nfs/dbraw/zinc/55/39/73/546553973.db2.gz AWJMRFPPJOIIAY-YLJYHZDGSA-N 2 1 372.513 2.262 10 0 FEAEMP CC[NH+](CC)[C@@H](CNC(=O)[C@H]1COCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000236836183 548783602 /nfs/dbraw/zinc/78/36/02/548783602.db2.gz XMIOIEYPLRELBV-CVEARBPZSA-N 2 1 373.419 2.193 10 0 FEAEMP CC[C@@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1C[C@H](C)O ZINC000245443477 548923290 /nfs/dbraw/zinc/92/32/90/548923290.db2.gz XFZYQWIQNMAXKQ-JKSUJKDBSA-N 2 1 373.497 2.412 10 0 FEAEMP CC[C@@H]1CN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@H+]1C[C@H](C)O ZINC000245443477 548923292 /nfs/dbraw/zinc/92/32/92/548923292.db2.gz XFZYQWIQNMAXKQ-JKSUJKDBSA-N 2 1 373.497 2.412 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCCN2CCc3sccc3C2)C1 ZINC000246862429 549230063 /nfs/dbraw/zinc/23/00/63/549230063.db2.gz FPYGXGSJTRWHOM-GOEBONIOSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[N@@H+]1C[C@H](C)[C@H](NC(=O)NCC[NH+]2CCc3sccc3C2)C1 ZINC000246862429 549230065 /nfs/dbraw/zinc/23/00/65/549230065.db2.gz FPYGXGSJTRWHOM-GOEBONIOSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCC[NH+]2CCc3sccc3C2)C1 ZINC000246862429 549230068 /nfs/dbraw/zinc/23/00/68/549230068.db2.gz FPYGXGSJTRWHOM-GOEBONIOSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[NH+]1C[C@H](C)[C@H](NC(=O)NCC[N@@H+]2CCc3sccc3C2)C1 ZINC000246862429 549230069 /nfs/dbraw/zinc/23/00/69/549230069.db2.gz FPYGXGSJTRWHOM-GOEBONIOSA-N 2 1 350.532 2.134 10 0 FEAEMP CC(C)[NH+]1C[C@H](C)[C@H](NC(=O)NCC[N@H+]2CCc3sccc3C2)C1 ZINC000246862429 549230071 /nfs/dbraw/zinc/23/00/71/549230071.db2.gz FPYGXGSJTRWHOM-GOEBONIOSA-N 2 1 350.532 2.134 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)NC(=O)N[C@H]1CCCC[C@H]1C ZINC000246952823 549250477 /nfs/dbraw/zinc/25/04/77/549250477.db2.gz ICTZUUJTFZZHIO-PVAVHDDUSA-N 2 1 361.490 2.060 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)NC(=O)N[C@H]1CCCC[C@H]1C ZINC000246952823 549250482 /nfs/dbraw/zinc/25/04/82/549250482.db2.gz ICTZUUJTFZZHIO-PVAVHDDUSA-N 2 1 361.490 2.060 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@H]1C)[NH+]1CCc2sccc2C1 ZINC000246961276 549252427 /nfs/dbraw/zinc/25/24/27/549252427.db2.gz DJXINOAIJQGHCY-INMHGKMJSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[N@H+]2C[C@H]1C)[NH+]1CCc2sccc2C1 ZINC000246961276 549252430 /nfs/dbraw/zinc/25/24/30/549252430.db2.gz DJXINOAIJQGHCY-INMHGKMJSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[NH+]2C[C@H]1C)[N@@H+]1CCc2sccc2C1 ZINC000246961276 549252431 /nfs/dbraw/zinc/25/24/31/549252431.db2.gz DJXINOAIJQGHCY-INMHGKMJSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@@H]2CCC[NH+]2C[C@H]1C)[N@H+]1CCc2sccc2C1 ZINC000246961276 549252433 /nfs/dbraw/zinc/25/24/33/549252433.db2.gz DJXINOAIJQGHCY-INMHGKMJSA-N 2 1 362.543 2.373 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)N[C@H](C)C[NH+]2CCCCC2)C[C@H]1CC ZINC000247260351 549308858 /nfs/dbraw/zinc/30/88/58/549308858.db2.gz YKBGDKPNBYZTIZ-QZTJIDSGSA-N 2 1 354.539 2.003 10 0 FEAEMP Cc1ncsc1CN(C)C[C@@H]1CC[N@@H+](CC(=O)N2CCC[C@@H](C)C2)C1 ZINC000248642405 549474917 /nfs/dbraw/zinc/47/49/17/549474917.db2.gz DGEHBFXLJCMNST-WBVHZDCISA-N 2 1 364.559 2.464 10 0 FEAEMP Cc1ncsc1CN(C)C[C@@H]1CC[N@H+](CC(=O)N2CCC[C@@H](C)C2)C1 ZINC000248642405 549474920 /nfs/dbraw/zinc/47/49/20/549474920.db2.gz DGEHBFXLJCMNST-WBVHZDCISA-N 2 1 364.559 2.464 10 0 FEAEMP C[N@H+](Cc1cccnc1)C[C@@H]1CCN(C(=O)NC[C@H]2CC[NH+](C3CC3)C2)C1 ZINC000251948235 549659264 /nfs/dbraw/zinc/65/92/64/549659264.db2.gz ULTFHNIDPZWAFR-MOPGFXCFSA-N 2 1 371.529 2.029 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@@H]1CCN(C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000251948235 549659268 /nfs/dbraw/zinc/65/92/68/549659268.db2.gz ULTFHNIDPZWAFR-MOPGFXCFSA-N 2 1 371.529 2.029 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@@H]1CCN(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)C1 ZINC000251948235 549659273 /nfs/dbraw/zinc/65/92/73/549659273.db2.gz ULTFHNIDPZWAFR-MOPGFXCFSA-N 2 1 371.529 2.029 10 0 FEAEMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3COCCN3)C2)cc1 ZINC000261992571 549777915 /nfs/dbraw/zinc/77/79/15/549777915.db2.gz SXIFOMMUWZALCP-MBDNFAEBSA-N 2 1 357.542 2.298 10 0 FEAEMP O[C@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccs1 ZINC000263195550 549885251 /nfs/dbraw/zinc/88/52/51/549885251.db2.gz IHXYDELGTKYRJL-AEFFLSMTSA-N 2 1 368.506 2.330 10 0 FEAEMP Cc1ccc(NC(=O)[C@@H]2CC[C@H]([NH3+])C2)cc1NC(=O)C[NH+]1CCCCC1 ZINC000263270216 549890927 /nfs/dbraw/zinc/89/09/27/549890927.db2.gz OUTCBVRTIPOINU-CVEARBPZSA-N 2 1 358.486 2.485 10 0 FEAEMP C[NH+](C)C[C@@H]1C[N@@H+](C2CCOCC2)C[C@H]1NC(=O)c1ccc(Cl)cc1 ZINC000169790920 672322783 /nfs/dbraw/zinc/32/27/83/672322783.db2.gz KCHIPHMJFOWKRN-CRAIPNDOSA-N 2 1 365.905 2.111 10 0 FEAEMP C[NH+](C)C[C@@H]1C[N@H+](C2CCOCC2)C[C@H]1NC(=O)c1ccc(Cl)cc1 ZINC000169790920 672322785 /nfs/dbraw/zinc/32/27/85/672322785.db2.gz KCHIPHMJFOWKRN-CRAIPNDOSA-N 2 1 365.905 2.111 10 0 FEAEMP C[N@H+](CC(=O)N1CCCCC1)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106128337 543205936 /nfs/dbraw/zinc/20/59/36/543205936.db2.gz OFPFATFAYIZLNQ-NRFANRHFSA-N 2 1 373.541 2.376 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)c1 ZINC000150778459 544469547 /nfs/dbraw/zinc/46/95/47/544469547.db2.gz KZRVHIUUIMCLNZ-QFBILLFUSA-N 2 1 374.529 2.312 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)cc1 ZINC000189471823 328150184 /nfs/dbraw/zinc/15/01/84/328150184.db2.gz NGAZUVHKGPAPSV-LPHOPBHVSA-N 2 1 374.529 2.312 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)N(CC[NH+](C)C)Cc2cccc(OC)c2)C1 ZINC000191131250 328251168 /nfs/dbraw/zinc/25/11/68/328251168.db2.gz PFJHYHZIQYUUPS-GOSISDBHSA-N 2 1 362.518 2.253 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000119470230 326166131 /nfs/dbraw/zinc/16/61/31/326166131.db2.gz JLCIHRJUBWUXII-OAQYLSRUSA-N 2 1 372.557 2.284 10 0 FEAEMP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000119470230 326166134 /nfs/dbraw/zinc/16/61/34/326166134.db2.gz JLCIHRJUBWUXII-OAQYLSRUSA-N 2 1 372.557 2.284 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000119470230 326166136 /nfs/dbraw/zinc/16/61/36/326166136.db2.gz JLCIHRJUBWUXII-OAQYLSRUSA-N 2 1 372.557 2.284 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCc2ccc(F)c(C[NH+](C)C)c2)C1 ZINC000120835028 326292041 /nfs/dbraw/zinc/29/20/41/326292041.db2.gz RESBDEHEFPRANH-KDOFPFPSSA-N 2 1 350.482 2.415 10 0 FEAEMP CC[N@H+]1CCC[C@@H](NC(=O)N(C)C2CC[NH+](CCc3ccccn3)CC2)C1 ZINC000171048350 327114445 /nfs/dbraw/zinc/11/44/45/327114445.db2.gz VCRKARVYACEQPH-LJQANCHMSA-N 2 1 373.545 2.214 10 0 FEAEMP Cc1cccc(NC[C@@H]2CC[N@H+](CCN3C(=O)c4ccccc4C3=O)C2)[nH+]1 ZINC000171653508 327152154 /nfs/dbraw/zinc/15/21/54/327152154.db2.gz PKGMVYHMCLBTGS-INIZCTEOSA-N 2 1 364.449 2.420 10 0 FEAEMP Cc1cccc(NC[C@@H]2CC[N@@H+](CCN3C(=O)c4ccccc4C3=O)C2)[nH+]1 ZINC000171653508 327152155 /nfs/dbraw/zinc/15/21/55/327152155.db2.gz PKGMVYHMCLBTGS-INIZCTEOSA-N 2 1 364.449 2.420 10 0 FEAEMP O=C(NC1CC[NH+](CCc2ccccc2)CC1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000171900334 327168615 /nfs/dbraw/zinc/16/86/15/327168615.db2.gz DSALQISPHNPPHK-FQEVSTJZSA-N 2 1 356.514 2.183 10 0 FEAEMP CCC(CC)[C@@H](C(=O)N1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1)[NH+]1CCOCC1 ZINC000261804491 328820988 /nfs/dbraw/zinc/82/09/88/328820988.db2.gz RBYUXLCYKYPRLJ-HKBOAZHASA-N 2 1 373.541 2.324 10 0 FEAEMP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1)c1ccc2c(c1)OCCO2 ZINC000261951236 328831483 /nfs/dbraw/zinc/83/14/83/328831483.db2.gz OJNGTAKRXLKSCR-RCCFBDPRSA-N 2 1 360.498 2.482 10 0 FEAEMP CCC(CC)[C@H](CNC(=O)N[C@@H]1C[N@H+](C(C)C)C[C@@H]1C)[NH+]1CCOCC1 ZINC000156988605 545685508 /nfs/dbraw/zinc/68/55/08/545685508.db2.gz MSZVQPVGPJEUGE-UHOSZYNNSA-N 2 1 368.566 2.151 10 0 FEAEMP CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC1CC[NH+](CCOC(C)C)CC1 ZINC000176629546 546470141 /nfs/dbraw/zinc/47/01/41/546470141.db2.gz WNDBRJDUUYMHRP-GOSISDBHSA-N 2 1 354.539 2.002 10 0 FEAEMP COc1cccc(CNC(=O)[C@H](C)[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000178290936 546770606 /nfs/dbraw/zinc/77/06/06/546770606.db2.gz RVLBWWZFSRSCKO-YJBOKZPZSA-N 2 1 356.470 2.369 10 0 FEAEMP COc1cccc(CNC(=O)[C@H](C)[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000178290936 546770608 /nfs/dbraw/zinc/77/06/08/546770608.db2.gz RVLBWWZFSRSCKO-YJBOKZPZSA-N 2 1 356.470 2.369 10 0 FEAEMP c1nc2n(n1)C[C@H]([NH2+][C@H]1CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]31)CC2 ZINC000183150199 547609880 /nfs/dbraw/zinc/60/98/80/547609880.db2.gz YYIZJBVCOGJZGD-NMLBUPMWSA-N 2 1 351.498 2.483 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2)C1 ZINC000194169862 548443957 /nfs/dbraw/zinc/44/39/57/548443957.db2.gz UPOMCEUSIHIDMK-SFHVURJKSA-N 2 1 350.482 2.383 10 0 FEAEMP COC(=O)c1oc([C@@H](C)[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc1C ZINC000245616922 548958673 /nfs/dbraw/zinc/95/86/73/548958673.db2.gz MUKHOHHCRXVSAO-LSDHHAIUSA-N 2 1 352.475 2.460 10 0 FEAEMP Cc1nc(N2CCOCC2)ccc1NC(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@H]1C ZINC000245687898 548975555 /nfs/dbraw/zinc/97/55/55/548975555.db2.gz OAGMLEANVHEZQF-RHSMWYFYSA-N 2 1 361.490 2.077 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)C1 ZINC000246797818 549215824 /nfs/dbraw/zinc/21/58/24/549215824.db2.gz AWAVEDPJYUPQLL-INMHGKMJSA-N 2 1 350.532 2.477 10 0 FEAEMP CC[C@@H]1CN(C(=O)NC[C@H](c2ccccc2)[NH+](C)C)CC[N@H+]1CCOC ZINC000247075147 549277910 /nfs/dbraw/zinc/27/79/10/549277910.db2.gz LBIUSZVWPJTPPL-RTBURBONSA-N 2 1 362.518 2.042 10 0 FEAEMP CC[C@@H](C)NC(=O)C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000247807307 549382136 /nfs/dbraw/zinc/38/21/36/549382136.db2.gz SYSHJKURENFJSE-YLJYHZDGSA-N 2 1 361.530 2.279 10 0 FEAEMP CC[C@@H]1CN(C(=O)NCC[C@H](C)[NH+]2CCCCC2)CC[N@H+]1CCOC ZINC000248493693 549450155 /nfs/dbraw/zinc/45/01/55/549450155.db2.gz PLWXHUQNXDPSSN-ZWKOTPCHSA-N 2 1 354.539 2.003 10 0 FEAEMP COc1ccccc1CNC(=O)[C@@H](C)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261892055 549766984 /nfs/dbraw/zinc/76/69/84/549766984.db2.gz ZUYZEAPYFGNRMB-AHRSYUTCSA-N 2 1 367.493 2.374 10 0 FEAEMP COc1ccccc1CNC(=O)[C@@H](C)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261892055 549766986 /nfs/dbraw/zinc/76/69/86/549766986.db2.gz ZUYZEAPYFGNRMB-AHRSYUTCSA-N 2 1 367.493 2.374 10 0 FEAEMP COCCN(C)c1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cn1 ZINC000261930548 549771241 /nfs/dbraw/zinc/77/12/41/549771241.db2.gz LMGVRUIUKCUADU-UXHICEINSA-N 2 1 354.498 2.339 10 0 FEAEMP C[C@H](NC(=O)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1)c1ccc(Br)cc1 ZINC000262473360 549822767 /nfs/dbraw/zinc/82/27/67/549822767.db2.gz JLRKDJKGVZEEIP-MZGVZZPPSA-N 2 1 366.303 2.295 10 0 FEAEMP C[C@H](NC(=O)C[N@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1)c1ccc(Br)cc1 ZINC000262473360 549822772 /nfs/dbraw/zinc/82/27/72/549822772.db2.gz JLRKDJKGVZEEIP-MZGVZZPPSA-N 2 1 366.303 2.295 10 0 FEAEMP CC[N@H+]1CC[C@H](NS(=O)(=O)c2ccc(C[NH2+]C3CCCC3)cc2)C1 ZINC000072317310 541799324 /nfs/dbraw/zinc/79/93/24/541799324.db2.gz HDDYBPBBORAKQQ-KRWDZBQOSA-N 2 1 351.516 2.091 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C)C(=O)NCC2CCCCC2)CC1 ZINC000106126514 543204699 /nfs/dbraw/zinc/20/46/99/543204699.db2.gz OIKZUCHGFHPRKG-SJORKVTESA-N 2 1 353.551 2.096 10 0 FEAEMP Cc1ccc(CNC(=O)[C@H](C)[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1 ZINC000106125720 543204918 /nfs/dbraw/zinc/20/49/18/543204918.db2.gz ILDVCOIPRHEGJR-MSOLQXFVSA-N 2 1 361.530 2.024 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[N@@H+]2C[C@@H]1C)[NH+]1CCc2sccc2C1 ZINC000113596201 543492245 /nfs/dbraw/zinc/49/22/45/543492245.db2.gz DJXINOAIJQGHCY-HLLBOEOZSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[N@H+]2C[C@@H]1C)[NH+]1CCc2sccc2C1 ZINC000113596201 543492248 /nfs/dbraw/zinc/49/22/48/543492248.db2.gz DJXINOAIJQGHCY-HLLBOEOZSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[NH+]2C[C@@H]1C)[N@@H+]1CCc2sccc2C1 ZINC000113596201 543492251 /nfs/dbraw/zinc/49/22/51/543492251.db2.gz DJXINOAIJQGHCY-HLLBOEOZSA-N 2 1 362.543 2.373 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[NH+]2C[C@@H]1C)[N@H+]1CCc2sccc2C1 ZINC000113596201 543492253 /nfs/dbraw/zinc/49/22/53/543492253.db2.gz DJXINOAIJQGHCY-HLLBOEOZSA-N 2 1 362.543 2.373 10 0 FEAEMP Cc1cc(N2CCC(NC(=O)N[C@@H]3C[N@H+](C(C)C)C[C@@H]3C)CC2)nc(C)[nH+]1 ZINC000132199123 544222922 /nfs/dbraw/zinc/22/29/22/544222922.db2.gz QKQFELVKGPRFFC-KBXCAEBGSA-N 2 1 374.533 2.090 10 0 FEAEMP Cc1cc(N2CCC(NC(=O)N[C@@H]3C[N@@H+](C(C)C)C[C@@H]3C)CC2)nc(C)[nH+]1 ZINC000132199123 544222925 /nfs/dbraw/zinc/22/29/25/544222925.db2.gz QKQFELVKGPRFFC-KBXCAEBGSA-N 2 1 374.533 2.090 10 0 FEAEMP COc1ccccc1N1CC[C@@H]([N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)C1=O ZINC000154126176 544867221 /nfs/dbraw/zinc/86/72/21/544867221.db2.gz XRDYZOQEURDAHH-FUHWJXTLSA-N 2 1 354.454 2.470 10 0 FEAEMP COc1ccccc1N1CC[C@@H]([N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)C1=O ZINC000154126176 544867226 /nfs/dbraw/zinc/86/72/26/544867226.db2.gz XRDYZOQEURDAHH-FUHWJXTLSA-N 2 1 354.454 2.470 10 0 FEAEMP C[NH+](CCNC(=O)N1CC[C@@H](C[N@H+](C)Cc2cccnc2)C1)C1CCCC1 ZINC000190708161 328226544 /nfs/dbraw/zinc/22/65/44/328226544.db2.gz JXFJKLVEOZQQGE-IBGZPJMESA-N 2 1 373.545 2.419 10 0 FEAEMP C[NH+](Cc1cccnc1)C[C@@H]1CCN(C(=O)NCC[N@H+](C)C2CCCC2)C1 ZINC000190708161 328226545 /nfs/dbraw/zinc/22/65/45/328226545.db2.gz JXFJKLVEOZQQGE-IBGZPJMESA-N 2 1 373.545 2.419 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC[C@@H](C)C[NH+]2CCCCC2)C[C@@H]1CC ZINC000117036622 326048015 /nfs/dbraw/zinc/04/80/15/326048015.db2.gz NQGHDPAIIUIPKN-MOPGFXCFSA-N 2 1 368.566 2.251 10 0 FEAEMP CC(C)C[C@@H](C[NH+](C)C)NC(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000118881478 326110109 /nfs/dbraw/zinc/11/01/09/326110109.db2.gz FUKKSBWIEFCKLA-FQEVSTJZSA-N 2 1 360.546 2.140 10 0 FEAEMP Cc1ccc(N2CC[C@@H]([N@H+](C)CC3CC[NH+](C[C@@H](C)O)CC3)C2=O)cc1 ZINC000119184545 326135433 /nfs/dbraw/zinc/13/54/33/326135433.db2.gz OJKKRFNSBNXRRS-YLJYHZDGSA-N 2 1 359.514 2.125 10 0 FEAEMP C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)C(=O)N3CC[C@H]([NH+](C)C)C3)cc2)C1 ZINC000170844819 327102181 /nfs/dbraw/zinc/10/21/81/327102181.db2.gz WJJHPJHLMUAXSN-APWZRJJASA-N 2 1 372.513 2.020 10 0 FEAEMP CC[C@@H](C)NC(=O)C[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000170942104 327108874 /nfs/dbraw/zinc/10/88/74/327108874.db2.gz SYSHJKURENFJSE-XLIONFOSSA-N 2 1 361.530 2.279 10 0 FEAEMP CCC[N@@H+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@@H]3CCC[NH+]3CC)c2C1 ZINC000176894012 546502807 /nfs/dbraw/zinc/50/28/07/546502807.db2.gz XKNPRHXENDJTMM-KRWDZBQOSA-N 2 1 372.513 2.293 10 0 FEAEMP CCC[N@H+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@@H]3CCC[NH+]3CC)c2C1 ZINC000176894012 546502812 /nfs/dbraw/zinc/50/28/12/546502812.db2.gz XKNPRHXENDJTMM-KRWDZBQOSA-N 2 1 372.513 2.293 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@@H]3CCC[N@@H+]3CC)c2C1 ZINC000176894012 546502816 /nfs/dbraw/zinc/50/28/16/546502816.db2.gz XKNPRHXENDJTMM-KRWDZBQOSA-N 2 1 372.513 2.293 10 0 FEAEMP CCC[NH+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@@H]3CCC[N@H+]3CC)c2C1 ZINC000176894012 546502818 /nfs/dbraw/zinc/50/28/18/546502818.db2.gz XKNPRHXENDJTMM-KRWDZBQOSA-N 2 1 372.513 2.293 10 0 FEAEMP COC(=O)c1ccc(F)c(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c1 ZINC000181925640 547406276 /nfs/dbraw/zinc/40/62/76/547406276.db2.gz KCUDIXZVVDYVSL-CQSZACIVSA-N 2 1 352.450 2.137 10 0 FEAEMP CCO[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)C12CCOCC2 ZINC000186499226 548144577 /nfs/dbraw/zinc/14/45/77/548144577.db2.gz XHSQQFZMKKDHAV-PCCBWWKXSA-N 2 1 374.525 2.317 10 0 FEAEMP CC[N@H+]1CCC[C@H](NC(=O)NC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000194142243 548441061 /nfs/dbraw/zinc/44/10/61/548441061.db2.gz ZXXCMZCHFXKDPV-FQEVSTJZSA-N 2 1 358.530 2.477 10 0 FEAEMP CCOCCC[N@H+]1CC[C@H](NC(=O)N(C)C[C@H]2CCC[NH+]2CC)[C@@H](C)C1 ZINC000245428874 548916705 /nfs/dbraw/zinc/91/67/05/548916705.db2.gz XTAREDKFGZPTCA-OTWHNJEPSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N(C)C[C@H]2CCC[N@@H+]2CC)[C@@H](C)C1 ZINC000245428874 548916707 /nfs/dbraw/zinc/91/67/07/548916707.db2.gz XTAREDKFGZPTCA-OTWHNJEPSA-N 2 1 368.566 2.249 10 0 FEAEMP CCOCCC[NH+]1CC[C@H](NC(=O)N(C)C[C@H]2CCC[N@H+]2CC)[C@@H](C)C1 ZINC000245428874 548916709 /nfs/dbraw/zinc/91/67/09/548916709.db2.gz XTAREDKFGZPTCA-OTWHNJEPSA-N 2 1 368.566 2.249 10 0 FEAEMP CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC1CC[NH+](Cc2ccncc2)CC1 ZINC000245658661 548968310 /nfs/dbraw/zinc/96/83/10/548968310.db2.gz CWJMPYYDMBBGGK-UXHICEINSA-N 2 1 371.529 2.314 10 0 FEAEMP C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CCC[NH+]1CCN(c2ccccc2)CC1 ZINC000246779122 549210344 /nfs/dbraw/zinc/21/03/44/549210344.db2.gz BDUCJJOBULNFSR-FPOVZHCZSA-N 2 1 370.541 2.284 10 0 FEAEMP CC[C@@H]1CN(C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC[NH+]1C[C@H](C)O ZINC000246919729 549242454 /nfs/dbraw/zinc/24/24/54/549242454.db2.gz QNWKMQZWVQKJRB-SESVDKBCSA-N 2 1 373.541 2.202 10 0 FEAEMP COc1cccc(CNC(=O)[C@@H](C)[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000247122276 549288248 /nfs/dbraw/zinc/28/82/48/549288248.db2.gz RVLBWWZFSRSCKO-QAPCUYQASA-N 2 1 356.470 2.369 10 0 FEAEMP COc1cccc(CNC(=O)[C@@H](C)[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C)c1 ZINC000247122276 549288249 /nfs/dbraw/zinc/28/82/49/549288249.db2.gz RVLBWWZFSRSCKO-QAPCUYQASA-N 2 1 356.470 2.369 10 0 FEAEMP C[C@H](c1nc(-c2cccnc2)no1)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000247138921 549290676 /nfs/dbraw/zinc/29/06/76/549290676.db2.gz XQEZHVRXPZTXHT-LSDHHAIUSA-N 2 1 359.474 2.217 10 0 FEAEMP C[C@@H]1C[C@H](N(C)C(=O)NC[C@H]2CN(C)CCO2)CC[N@H+]1Cc1ccccc1 ZINC000247283300 549310806 /nfs/dbraw/zinc/31/08/06/549310806.db2.gz DGYZUIJRLLTWLE-RLLQIKCJSA-N 2 1 374.529 2.012 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)[C@@H](C(=O)NC2CC2)c2ccccc2)CC1 ZINC000247577368 549361159 /nfs/dbraw/zinc/36/11/59/549361159.db2.gz HYJLBVRAJWGLER-OXQOHEQNSA-N 2 1 359.514 2.031 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000248717855 549489403 /nfs/dbraw/zinc/48/94/03/549489403.db2.gz FMPSZBQBCHONJA-MISYRCLQSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000248717855 549489407 /nfs/dbraw/zinc/48/94/07/549489407.db2.gz FMPSZBQBCHONJA-MISYRCLQSA-N 2 1 356.514 2.387 10 0 FEAEMP C[C@@H]1C[NH+]2CCC[C@@H]2CN1C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248717855 549489411 /nfs/dbraw/zinc/48/94/11/549489411.db2.gz FMPSZBQBCHONJA-MISYRCLQSA-N 2 1 356.514 2.387 10 0 FEAEMP Cc1nccn1C[C@H]1CCC[N@@H+]1CC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000249296656 549577984 /nfs/dbraw/zinc/57/79/84/549577984.db2.gz MOAMDYOCQVFJBR-WOJBJXKFSA-N 2 1 369.513 2.075 10 0 FEAEMP C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000261982495 549777082 /nfs/dbraw/zinc/77/70/82/549777082.db2.gz ROGOCDBXIWHROK-JKSUJKDBSA-N 2 1 351.516 2.219 10 0 FEAEMP CC[C@H](C)NC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c1 ZINC000261997082 549777844 /nfs/dbraw/zinc/77/78/44/549777844.db2.gz UEAJISYREFFNIK-KCUHQSDYSA-N 2 1 359.514 2.462 10 0 FEAEMP C[C@H](NC(=O)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1)c1ccc(Br)cc1 ZINC000262473356 549823077 /nfs/dbraw/zinc/82/30/77/549823077.db2.gz JLRKDJKGVZEEIP-DLKVLKDVSA-N 2 1 366.303 2.295 10 0 FEAEMP C[C@H](NC(=O)C[N@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1)c1ccc(Br)cc1 ZINC000262473356 549823080 /nfs/dbraw/zinc/82/30/80/549823080.db2.gz JLRKDJKGVZEEIP-DLKVLKDVSA-N 2 1 366.303 2.295 10 0 FEAEMP C[C@@H](Cc1ccc2c(c1)OCO2)C[N@H+]1CCN(C)C2(CC[NH+](C)CC2)C1 ZINC000067725587 221278210 /nfs/dbraw/zinc/27/82/10/221278210.db2.gz RPQVLYHTXURZSY-KRWDZBQOSA-N 2 1 359.514 2.306 10 0 FEAEMP O=C(Nc1ccc(CCN2CCOCC2)cc1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000105013085 543155063 /nfs/dbraw/zinc/15/50/63/543155063.db2.gz YMTVJCTUIZKCIU-FQEVSTJZSA-N 2 1 372.513 2.263 10 0 FEAEMP CC(C)CNC(=O)C[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106128137 543205980 /nfs/dbraw/zinc/20/59/80/543205980.db2.gz AWMZNULSBPEYQM-FQEVSTJZSA-N 2 1 361.530 2.136 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cc(=O)oc3cc(O)ccc23)CC1 ZINC000106126248 543204628 /nfs/dbraw/zinc/20/46/28/543204628.db2.gz GZNPRMRBPZVQQG-CQSZACIVSA-N 2 1 360.454 2.023 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(OCC[NH+](C)C)cc1 ZINC000113589089 543491294 /nfs/dbraw/zinc/49/12/94/543491294.db2.gz NHKUNCHTTIRYHT-SJLPKXTDSA-N 2 1 360.502 2.005 10 0 FEAEMP CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NC1CC[NH+](Cc2ccccn2)CC1 ZINC000152364467 544643634 /nfs/dbraw/zinc/64/36/34/544643634.db2.gz MCACLAKCJMSXAO-HXUWFJFHSA-N 2 1 373.545 2.466 10 0 FEAEMP CC[N@@H+](CC(=O)NC[C@@H](c1cccs1)N1CCO[C@H](C)C1)C1CC1 ZINC000153326120 544761617 /nfs/dbraw/zinc/76/16/17/544761617.db2.gz DYDFACBFRVKYFA-ZBFHGGJFSA-N 2 1 351.516 2.110 10 0 FEAEMP CCN(CC(=O)NC[C@@H](c1cccs1)N1CCO[C@H](C)C1)C1CC1 ZINC000153326120 544761621 /nfs/dbraw/zinc/76/16/21/544761621.db2.gz DYDFACBFRVKYFA-ZBFHGGJFSA-N 2 1 351.516 2.110 10 0 FEAEMP CNC(=O)c1cccc(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000154572127 544922785 /nfs/dbraw/zinc/92/27/85/544922785.db2.gz SPHYXGNGRKFNQU-KBXCAEBGSA-N 2 1 369.469 2.043 10 0 FEAEMP CNC(=O)c1cccc(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000154572127 544922787 /nfs/dbraw/zinc/92/27/87/544922787.db2.gz SPHYXGNGRKFNQU-KBXCAEBGSA-N 2 1 369.469 2.043 10 0 FEAEMP CC[NH+](CC)Cc1ccc(NC(=O)C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)cc1 ZINC000189471802 328150203 /nfs/dbraw/zinc/15/02/03/328150203.db2.gz NGAZUVHKGPAPSV-QFBILLFUSA-N 2 1 374.529 2.312 10 0 FEAEMP C[C@H](C[NH+]1CCCCC1)NC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190692769 328225061 /nfs/dbraw/zinc/22/50/61/328225061.db2.gz WYWNCCZSUGKLOH-QUCCMNQESA-N 2 1 373.545 2.419 10 0 FEAEMP CC[N@H+]1CCCC[C@H]1C(=O)N1CCC(N(C)CC(=O)OC(C)(C)C)CC1 ZINC000191904403 328287928 /nfs/dbraw/zinc/28/79/28/328287928.db2.gz SSCRNWXJEDKWMQ-KRWDZBQOSA-N 2 1 367.534 2.125 10 0 FEAEMP CC[N@@H+]1CCCC[C@H]1C(=O)N1CCC([NH+](C)CC(=O)OC(C)(C)C)CC1 ZINC000191904403 328287929 /nfs/dbraw/zinc/28/79/29/328287929.db2.gz SSCRNWXJEDKWMQ-KRWDZBQOSA-N 2 1 367.534 2.125 10 0 FEAEMP CC[N@H+]1CCCC[C@H]1C(=O)N1CCC([NH+](C)CC(=O)OC(C)(C)C)CC1 ZINC000191904403 328287930 /nfs/dbraw/zinc/28/79/30/328287930.db2.gz SSCRNWXJEDKWMQ-KRWDZBQOSA-N 2 1 367.534 2.125 10 0 FEAEMP CC[NH+]1CCCC[C@H]1C(=O)N1CCC([N@@H+](C)CC(=O)OC(C)(C)C)CC1 ZINC000191904403 328287932 /nfs/dbraw/zinc/28/79/32/328287932.db2.gz SSCRNWXJEDKWMQ-KRWDZBQOSA-N 2 1 367.534 2.125 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000091232626 325382062 /nfs/dbraw/zinc/38/20/62/325382062.db2.gz PPAHLGKPFOITAH-VQIMIIECSA-N 2 1 357.502 2.176 10 0 FEAEMP COCC[N@@H+]1CCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C[C@@H]1C ZINC000117472259 326061448 /nfs/dbraw/zinc/06/14/48/326061448.db2.gz QRHNOGALVVYZKL-SFHVURJKSA-N 2 1 374.529 2.145 10 0 FEAEMP COCC[N@H+]1CCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C[C@@H]1C ZINC000117472259 326061450 /nfs/dbraw/zinc/06/14/50/326061450.db2.gz QRHNOGALVVYZKL-SFHVURJKSA-N 2 1 374.529 2.145 10 0 FEAEMP CCC[C@H](C(=O)Nc1ccc(C[N@H+]2CCC[C@H](C(N)=O)C2)cc1)[NH+](C)C ZINC000161904899 327012086 /nfs/dbraw/zinc/01/20/86/327012086.db2.gz OKKARFSMYOHIOG-FUHWJXTLSA-N 2 1 360.502 2.053 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cncc(Br)c2)CC1 ZINC000170941752 327108901 /nfs/dbraw/zinc/10/89/01/327108901.db2.gz CBJFHPHPFVMLQN-ZDUSSCGKSA-N 2 1 356.308 2.369 10 0 FEAEMP O=C(NCC1CC[NH+](Cc2cccs2)CC1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000171905461 327169270 /nfs/dbraw/zinc/16/92/70/327169270.db2.gz WWGTVMPXYFBIFZ-KRWDZBQOSA-N 2 1 362.543 2.450 10 0 FEAEMP Cc1ccc([C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)N2CCOCC2)cc1 ZINC000261956930 328831757 /nfs/dbraw/zinc/83/17/57/328831757.db2.gz OZFJZEWUIBFHKC-LRSLUSHPSA-N 2 1 373.541 2.115 10 0 FEAEMP C([NH2+][C@H]1CCC[C@H]1[C@H]1COCC[NH2+]1)C1(N2CCSCC2)CCCC1 ZINC000262010229 328834919 /nfs/dbraw/zinc/83/49/19/328834919.db2.gz VLRZLSNNFOGTIZ-FGTMMUONSA-N 2 1 353.576 2.095 10 0 FEAEMP CC[N@@H+]1CCC[C@H]1CN(C)C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000177424470 546615072 /nfs/dbraw/zinc/61/50/72/546615072.db2.gz KUPKNBGZPYFBNR-INIZCTEOSA-N 2 1 350.532 2.232 10 0 FEAEMP CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCC[NH+]1CCc2sccc2C1 ZINC000177424470 546615074 /nfs/dbraw/zinc/61/50/74/546615074.db2.gz KUPKNBGZPYFBNR-INIZCTEOSA-N 2 1 350.532 2.232 10 0 FEAEMP CC[NH+]1CCC[C@H]1CN(C)C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000177424470 546615079 /nfs/dbraw/zinc/61/50/79/546615079.db2.gz KUPKNBGZPYFBNR-INIZCTEOSA-N 2 1 350.532 2.232 10 0 FEAEMP CC[NH+]1CCC[C@H]1CN(C)C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000177424470 546615083 /nfs/dbraw/zinc/61/50/83/546615083.db2.gz KUPKNBGZPYFBNR-INIZCTEOSA-N 2 1 350.532 2.232 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000178749676 546843199 /nfs/dbraw/zinc/84/31/99/546843199.db2.gz OMPIYHLRHGOSGQ-GJZGRUSLSA-N 2 1 358.408 2.457 10 0 FEAEMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000178749676 546843203 /nfs/dbraw/zinc/84/32/03/546843203.db2.gz OMPIYHLRHGOSGQ-GJZGRUSLSA-N 2 1 358.408 2.457 10 0 FEAEMP CC[NH+](CC)Cc1cccc(NC(=O)C(=O)N[C@@H]2CCC[N@@H+](CC)C2)c1 ZINC000194156865 548443536 /nfs/dbraw/zinc/44/35/36/548443536.db2.gz XOTBERAMUMAOOU-GOSISDBHSA-N 2 1 360.502 2.067 10 0 FEAEMP COc1ccccc1CNC(=O)[C@@H](C)[N@@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000247218445 549300797 /nfs/dbraw/zinc/30/07/97/549300797.db2.gz YIMDJPHQCIDTDY-CRAIPNDOSA-N 2 1 356.470 2.369 10 0 FEAEMP COc1ccccc1CNC(=O)[C@@H](C)[N@H+]1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000247218445 549300804 /nfs/dbraw/zinc/30/08/04/549300804.db2.gz YIMDJPHQCIDTDY-CRAIPNDOSA-N 2 1 356.470 2.369 10 0 FEAEMP C[C@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)N2c3ccccc3CC[C@@H]2C)CC1 ZINC000247871816 549387362 /nfs/dbraw/zinc/38/73/62/549387362.db2.gz XSLFWHSLVXQHPU-ROUUACIJSA-N 2 1 373.541 2.379 10 0 FEAEMP C[C@H]([NH2+][C@H](CO)c1ccccc1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000248461301 549443942 /nfs/dbraw/zinc/44/39/42/549443942.db2.gz XHSWIYAXYUGLHW-DZFGPLHGSA-N 2 1 367.493 2.089 10 0 FEAEMP C[C@H]([NH2+][C@H](CO)c1ccccc1)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000248461301 549443947 /nfs/dbraw/zinc/44/39/47/549443947.db2.gz XHSWIYAXYUGLHW-DZFGPLHGSA-N 2 1 367.493 2.089 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@H]1C ZINC000248783780 549501433 /nfs/dbraw/zinc/50/14/33/549501433.db2.gz IDKYZTZSRQAXAP-JYBIWHBTSA-N 2 1 356.514 2.385 10 0 FEAEMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N1C[C@@H]2CCC[N@H+]2C[C@H]1C ZINC000248783780 549501435 /nfs/dbraw/zinc/50/14/35/549501435.db2.gz IDKYZTZSRQAXAP-JYBIWHBTSA-N 2 1 356.514 2.385 10 0 FEAEMP C[NH+](C)[C@H]1CCC[C@H](NC(=O)N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000252032643 549662209 /nfs/dbraw/zinc/66/22/09/549662209.db2.gz ZVGAEGZFXSYVKV-UFYCRDLUSA-N 2 1 373.545 2.418 10 0 FEAEMP C[NH+](C)[C@H]1CCC[C@@H](NC(=O)N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000252032646 549662460 /nfs/dbraw/zinc/66/24/60/549662460.db2.gz ZVGAEGZFXSYVKV-ZCNNSNEGSA-N 2 1 373.545 2.418 10 0 FEAEMP O[C@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000263245656 549889147 /nfs/dbraw/zinc/88/91/47/549889147.db2.gz PERICHAMIBBZOJ-YOEHRIQHSA-N 2 1 354.479 2.271 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)CC(=O)NC2CCCCCCC2)CC1 ZINC000106126221 670808819 /nfs/dbraw/zinc/80/88/19/670808819.db2.gz ISJVHBSRRXYCKU-QGZVFWFLSA-N 2 1 353.551 2.240 10 0 FEAEMP CC1(C)C[N@H+](C2(CNC(=O)[C@H]3CCC[C@@H]([NH3+])C3)CCCCC2)CCO1 ZINC000262285792 672912736 /nfs/dbraw/zinc/91/27/36/672912736.db2.gz MFIANRIAGCPJAH-DLBZAZTESA-N 2 1 351.535 2.434 10 0 FEAEMP C[NH+](C)CCN1CC2(CC[NH+](Cc3cc(C(C)(C)C)n[nH]3)CC2)OC1=O ZINC000072418434 541808291 /nfs/dbraw/zinc/80/82/91/541808291.db2.gz GIKPAGUOODSEOJ-UHFFFAOYSA-N 2 1 363.506 2.056 10 0 FEAEMP CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCc2ccc(F)c(C[NH+](C)C)c2)C1 ZINC000247402103 549329065 /nfs/dbraw/zinc/32/90/65/549329065.db2.gz RESBDEHEFPRANH-KBXCAEBGSA-N 2 1 350.482 2.415 10 0 FEAEMP Cc1csc([C@@H]2CCC[N@@H+](Cc3cnc(N4CC[NH+](C)CC4)nc3)C2)n1 ZINC000092788247 542887606 /nfs/dbraw/zinc/88/76/06/542887606.db2.gz DPMYLRFHCCKRHC-QGZVFWFLSA-N 2 1 372.542 2.373 10 0 FEAEMP Cc1csc([C@@H]2CCC[N@H+](Cc3cnc(N4CC[NH+](C)CC4)nc3)C2)n1 ZINC000092788247 542887610 /nfs/dbraw/zinc/88/76/10/542887610.db2.gz DPMYLRFHCCKRHC-QGZVFWFLSA-N 2 1 372.542 2.373 10 0 FEAEMP C[NH+](C)CCOc1ccccc1CNC(=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000105205425 543164272 /nfs/dbraw/zinc/16/42/72/543164272.db2.gz FWZBRUSAFVNHFM-SFHVURJKSA-N 2 1 360.502 2.007 10 0 FEAEMP CC[N@@H+]1CCC[C@H](NS(=O)(=O)c2ccc(C[NH2+]C3CCCC3)cc2)C1 ZINC000098178630 222230610 /nfs/dbraw/zinc/23/06/10/222230610.db2.gz FBBKDQITFFRACC-SFHVURJKSA-N 2 1 365.543 2.481 10 0 FEAEMP CC[N@H+]1CCC[C@H](NS(=O)(=O)c2ccc(C[NH2+]C3CCCC3)cc2)C1 ZINC000098178630 222230612 /nfs/dbraw/zinc/23/06/12/222230612.db2.gz FBBKDQITFFRACC-SFHVURJKSA-N 2 1 365.543 2.481 10 0 FEAEMP COCc1noc([C@H](C)[NH2+]CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)n1 ZINC000183072247 327799965 /nfs/dbraw/zinc/79/99/65/327799965.db2.gz OHIXJRUMPCSWPI-YJBOKZPZSA-N 2 1 374.485 2.312 10 0 FEAEMP CC[C@@H](C)[N@@H+](C)CCNC(=O)N1CC[C@H](C[NH+](C)Cc2cccnc2)C1 ZINC000190705898 328226297 /nfs/dbraw/zinc/22/62/97/328226297.db2.gz VKLIAPVYPFOYCT-IEBWSBKVSA-N 2 1 361.534 2.275 10 0 FEAEMP CC[C@@H](C)[NH+](C)CCNC(=O)N1CC[C@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000190705898 328226298 /nfs/dbraw/zinc/22/62/98/328226298.db2.gz VKLIAPVYPFOYCT-IEBWSBKVSA-N 2 1 361.534 2.275 10 0 FEAEMP C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(C[NH+]2CCC(CO)CC2)cc1 ZINC000164119022 327064899 /nfs/dbraw/zinc/06/48/99/327064899.db2.gz LMDQMWPNYMACFQ-DYESRHJHSA-N 2 1 371.525 2.200 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@@H]4CCC[N@H+]4C[C@@H]3C)cc2)CC1 ZINC000173749295 327281063 /nfs/dbraw/zinc/28/10/63/327281063.db2.gz ZTUKICSSBPCZIX-PXNSSMCTSA-N 2 1 356.514 2.137 10 0 FEAEMP CN(C)CC[NH2+]Cc1ccc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000020167839 521787366 /nfs/dbraw/zinc/78/73/66/521787366.db2.gz CBMJWMOUGXEZPE-NRFANRHFSA-N 2 1 371.525 2.210 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCCC[NH+]2CCc3ccccc3C2)C1 ZINC000157178337 545710395 /nfs/dbraw/zinc/71/03/95/545710395.db2.gz AZVIJUKOWOYGBG-XLIONFOSSA-N 2 1 358.530 2.463 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@@H](NC(=O)NCCC[N@@H+]2CCc3ccccc3C2)C1 ZINC000157178337 545710399 /nfs/dbraw/zinc/71/03/99/545710399.db2.gz AZVIJUKOWOYGBG-XLIONFOSSA-N 2 1 358.530 2.463 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@@H](NC(=O)NCCC[N@H+]2CCc3ccccc3C2)C1 ZINC000157178337 545710403 /nfs/dbraw/zinc/71/04/03/545710403.db2.gz AZVIJUKOWOYGBG-XLIONFOSSA-N 2 1 358.530 2.463 10 0 FEAEMP Cc1ccccc1C[N@@H+]1CCCN(C(=O)C[NH2+][C@@H](C)[C@@H]2CCCO2)CC1 ZINC000183090160 547599900 /nfs/dbraw/zinc/59/99/00/547599900.db2.gz WAVGIFGLJCSKGV-ICSRJNTNSA-N 2 1 359.514 2.186 10 0 FEAEMP CCN1CC[NH+](Cc2ccc(N[C@@H]3CCC[C@H]3[C@@H]3COCC[NH2+]3)cc2)CC1 ZINC000261956993 549773527 /nfs/dbraw/zinc/77/35/27/549773527.db2.gz PCQGQNZBAGNVKI-VSKRKVRLSA-N 2 1 372.557 2.393 10 0 FEAEMP C[C@H]1OCC[NH2+][C@@H]1C(=O)NCc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000262330301 549811813 /nfs/dbraw/zinc/81/18/13/549811813.db2.gz SEYJIXWCGORCDK-LJCCNALRSA-N 2 1 359.514 2.158 10 0 FEAEMP COc1cc(C[NH2+]C[C@@H]2C[NH2+]C[C@@H]2O)ccc1OCc1ccc(F)cc1 ZINC000263224683 549886923 /nfs/dbraw/zinc/88/69/23/549886923.db2.gz MPPKELOYJLIRGM-AEFFLSMTSA-N 2 1 360.429 2.083 10 0 FEAEMP O[C@](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1)(c1ccccc1)C(F)(F)F ZINC000261852278 672904157 /nfs/dbraw/zinc/90/41/57/672904157.db2.gz BINVCJUNBLNBQW-VVLHAWIVSA-N 2 1 358.404 2.183 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N[C@H]3CCC[N@H+](CC)C3)cc2F)CC1 ZINC000066921991 541393968 /nfs/dbraw/zinc/39/39/68/541393968.db2.gz OULPDGNSRVHNII-KRWDZBQOSA-N 2 1 362.493 2.182 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N[C@H]3CCC[N@@H+](CC)C3)cc2F)CC1 ZINC000066921991 541393970 /nfs/dbraw/zinc/39/39/70/541393970.db2.gz OULPDGNSRVHNII-KRWDZBQOSA-N 2 1 362.493 2.182 10 0 FEAEMP C[NH+](C)CCOc1ccc(CNC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cc1 ZINC000105113802 543159135 /nfs/dbraw/zinc/15/91/35/543159135.db2.gz LDGAWMDZJGKQMD-GOSISDBHSA-N 2 1 360.502 2.007 10 0 FEAEMP CC(C)NC(=O)CC[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106127458 543204652 /nfs/dbraw/zinc/20/46/52/543204652.db2.gz SWXZXZKLMLJELN-FQEVSTJZSA-N 2 1 361.530 2.279 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[N@H+]2C[C@H]1C)[NH+]1CCc2ccccc2C1 ZINC000113596121 543492276 /nfs/dbraw/zinc/49/22/76/543492276.db2.gz CTOQFUQCGAAYQB-MBOZVWFJSA-N 2 1 356.514 2.311 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[NH+]2C[C@H]1C)[N@@H+]1CCc2ccccc2C1 ZINC000113596121 543492279 /nfs/dbraw/zinc/49/22/79/543492279.db2.gz CTOQFUQCGAAYQB-MBOZVWFJSA-N 2 1 356.514 2.311 10 0 FEAEMP C[C@H](CNC(=O)N1C[C@H]2CCC[NH+]2C[C@H]1C)[N@H+]1CCc2ccccc2C1 ZINC000113596121 543492282 /nfs/dbraw/zinc/49/22/82/543492282.db2.gz CTOQFUQCGAAYQB-MBOZVWFJSA-N 2 1 356.514 2.311 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCC[NH+](C)Cc2ccc(F)cc2)C1 ZINC000122723870 543720131 /nfs/dbraw/zinc/72/01/31/543720131.db2.gz UDTOHUABIKXZKZ-QAPCUYQASA-N 2 1 350.482 2.285 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@@H](NC(=O)NCC[N@H+](C)Cc2ccc(F)cc2)C1 ZINC000122723870 543720133 /nfs/dbraw/zinc/72/01/33/543720133.db2.gz UDTOHUABIKXZKZ-QAPCUYQASA-N 2 1 350.482 2.285 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@@H](NC(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)C1 ZINC000122723870 543720135 /nfs/dbraw/zinc/72/01/35/543720135.db2.gz UDTOHUABIKXZKZ-QAPCUYQASA-N 2 1 350.482 2.285 10 0 FEAEMP Cc1ccc(C[NH+](C)C)cc1NC(=O)C(=O)NC[C@H]1CCC[N@@H+]1CC(C)C ZINC000129560499 544118094 /nfs/dbraw/zinc/11/80/94/544118094.db2.gz FFBKXGFBBKRTBX-GOSISDBHSA-N 2 1 374.529 2.232 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cn1 ZINC000153363282 544767088 /nfs/dbraw/zinc/76/70/88/544767088.db2.gz WMCRTKHPEWEVJS-GOSISDBHSA-N 2 1 370.501 2.495 10 0 FEAEMP Cc1[nH+]ccn1-c1ccc(CNC(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cn1 ZINC000153363282 544767096 /nfs/dbraw/zinc/76/70/96/544767096.db2.gz WMCRTKHPEWEVJS-GOSISDBHSA-N 2 1 370.501 2.495 10 0 FEAEMP CCC[N@H+]1CC[C@H](CNC(=O)N2CC[C@H](C[NH+](C)Cc3cccnc3)C2)C1 ZINC000190499287 328211806 /nfs/dbraw/zinc/21/18/06/328211806.db2.gz FFISEDSZYNWODZ-WOJBJXKFSA-N 2 1 373.545 2.277 10 0 FEAEMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)C1 ZINC000190499287 328211807 /nfs/dbraw/zinc/21/18/07/328211807.db2.gz FFISEDSZYNWODZ-WOJBJXKFSA-N 2 1 373.545 2.277 10 0 FEAEMP CCC[NH+]1CC[C@H](CNC(=O)N2CC[C@H](C[N@@H+](C)Cc3cccnc3)C2)C1 ZINC000190499287 328211809 /nfs/dbraw/zinc/21/18/09/328211809.db2.gz FFISEDSZYNWODZ-WOJBJXKFSA-N 2 1 373.545 2.277 10 0 FEAEMP C[C@@H](C[NH+]1CCCCC1)NC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000190692711 328224945 /nfs/dbraw/zinc/22/49/45/328224945.db2.gz WYWNCCZSUGKLOH-AZUAARDMSA-N 2 1 373.545 2.419 10 0 FEAEMP CCOCC[N@H+]1CCN(C(=O)NC2CC[NH+](C(C)(C)C)CC2)C[C@H]1CC ZINC000117036516 326048175 /nfs/dbraw/zinc/04/81/75/326048175.db2.gz LMQMYTDRJZJALK-GOSISDBHSA-N 2 1 368.566 2.392 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2cncc(Br)c2)CC1 ZINC000170941753 327108856 /nfs/dbraw/zinc/10/88/56/327108856.db2.gz CBJFHPHPFVMLQN-CYBMUJFWSA-N 2 1 356.308 2.369 10 0 FEAEMP O=C(NCC1([NH+]2CCSCC2)CCCCC1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000171978554 327174051 /nfs/dbraw/zinc/17/40/51/327174051.db2.gz ILQVQYVIFFVZQR-KRWDZBQOSA-N 2 1 366.575 2.228 10 0 FEAEMP C[C@@H](O)C[NH+]1CCC(C[N@@H+](C)Cc2ccc3c(c2)CCC(=O)N3C)CC1 ZINC000186942689 548224995 /nfs/dbraw/zinc/22/49/95/548224995.db2.gz NPCQYCXIABGOHM-MRXNPFEDSA-N 2 1 359.514 2.120 10 0 FEAEMP C[NH+](C)[C@@H]1CCN(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)C1 ZINC000245747857 548987519 /nfs/dbraw/zinc/98/75/19/548987519.db2.gz ANFWQCUQWJMVQV-IXDOHACOSA-N 2 1 350.894 2.431 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)N1CCC[C@H]1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000246392468 549123239 /nfs/dbraw/zinc/12/32/39/549123239.db2.gz ISJKLFHUAINQSH-HCXYKTFWSA-N 2 1 368.566 2.246 10 0 FEAEMP CC(C)C[C@H](C[NH+](C)C)NC(=O)N1CCC[C@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000246392468 549123243 /nfs/dbraw/zinc/12/32/43/549123243.db2.gz ISJKLFHUAINQSH-HCXYKTFWSA-N 2 1 368.566 2.246 10 0 FEAEMP COc1ccccc1N1CC[C@H]([N@H+]2CCC[C@@H]2Cn2ccnc2C)C1=O ZINC000246573440 549165406 /nfs/dbraw/zinc/16/54/06/549165406.db2.gz XRDYZOQEURDAHH-AEFFLSMTSA-N 2 1 354.454 2.470 10 0 FEAEMP COc1ccccc1N1CC[C@H]([N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C)C1=O ZINC000246573440 549165409 /nfs/dbraw/zinc/16/54/09/549165409.db2.gz XRDYZOQEURDAHH-AEFFLSMTSA-N 2 1 354.454 2.470 10 0 FEAEMP CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)C[C@H]2C[NH+](Cc3ccccc3)CCO2)C1 ZINC000246803118 549217022 /nfs/dbraw/zinc/21/70/22/549217022.db2.gz DCAWSBTUNCAWJB-YZGWKJHDSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)C[C@H]2C[NH+](Cc3ccccc3)CCO2)C1 ZINC000246803118 549217024 /nfs/dbraw/zinc/21/70/24/549217024.db2.gz DCAWSBTUNCAWJB-YZGWKJHDSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)C[C@H]2C[N@H+](Cc3ccccc3)CCO2)C1 ZINC000246803118 549217028 /nfs/dbraw/zinc/21/70/28/549217028.db2.gz DCAWSBTUNCAWJB-YZGWKJHDSA-N 2 1 359.514 2.122 10 0 FEAEMP CC(C)[NH+]1C[C@@H](C)[C@H](NC(=O)C[C@H]2C[N@@H+](Cc3ccccc3)CCO2)C1 ZINC000246803118 549217031 /nfs/dbraw/zinc/21/70/31/549217031.db2.gz DCAWSBTUNCAWJB-YZGWKJHDSA-N 2 1 359.514 2.122 10 0 FEAEMP C[C@H](C(=O)Nc1cccc(F)c1)[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1 ZINC000246965031 549253141 /nfs/dbraw/zinc/25/31/41/549253141.db2.gz BTGYIKPNDHSCOU-LSDHHAIUSA-N 2 1 351.466 2.177 10 0 FEAEMP CC[NH+]1CCN(c2ccc(C(=O)N3C[C@H]4CCC[N@H+]4C[C@H]3C)cc2)CC1 ZINC000247259947 549308636 /nfs/dbraw/zinc/30/86/36/549308636.db2.gz ZTUKICSSBPCZIX-YLJYHZDGSA-N 2 1 356.514 2.137 10 0 FEAEMP COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000249208572 549569783 /nfs/dbraw/zinc/56/97/83/549569783.db2.gz CFNRDAZZCJNZHE-FHWLQOOXSA-N 2 1 351.535 2.209 10 0 FEAEMP Cc1ccc([C@H](C[NH2+][C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)N2CCOCC2)cc1 ZINC000261956929 549773869 /nfs/dbraw/zinc/77/38/69/549773869.db2.gz OZFJZEWUIBFHKC-CZYKHXBRSA-N 2 1 373.541 2.115 10 0 FEAEMP COC[C@H]([NH3+])C(=O)N(CC[N@@H+](C)Cc1ccccc1)Cc1ccccc1 ZINC000262314357 549809380 /nfs/dbraw/zinc/80/93/80/549809380.db2.gz DFFHINFVLXSYHI-FQEVSTJZSA-N 2 1 355.482 2.121 10 0 FEAEMP C[C@H](NC(=O)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1)c1ccc(Br)cc1 ZINC000262473364 549822780 /nfs/dbraw/zinc/82/27/80/549822780.db2.gz JLRKDJKGVZEEIP-YUDUHTQSSA-N 2 1 366.303 2.295 10 0 FEAEMP C[C@H](NC(=O)C[N@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1)c1ccc(Br)cc1 ZINC000262473364 549822783 /nfs/dbraw/zinc/82/27/83/549822783.db2.gz JLRKDJKGVZEEIP-YUDUHTQSSA-N 2 1 366.303 2.295 10 0 FEAEMP O[C@@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccs1 ZINC000263195554 549885041 /nfs/dbraw/zinc/88/50/41/549885041.db2.gz IHXYDELGTKYRJL-FUHWJXTLSA-N 2 1 368.506 2.330 10 0 FEAEMP O[C@H]1C[NH2+]C[C@@H]1C[NH2+]Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000263220926 549886563 /nfs/dbraw/zinc/88/65/63/549886563.db2.gz LUOWEXUWBPUVMF-CABZTGNLSA-N 2 1 353.182 2.138 10 0 FEAEMP C[C@H]1C[C@@H](NC(=O)[C@@H]2C[NH2+]C[C@H]2C(F)(F)F)C[N@H+]1Cc1ccccc1 ZINC000653122372 677516788 /nfs/dbraw/zinc/51/67/88/677516788.db2.gz VDCQNENXEWYNNZ-LCGIIJARSA-N 2 1 355.404 2.164 10 0 FEAEMP