smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H](NCc1ccccc1O)c1ccc(Cl)cc1Cl ZINC000019917700 170926397 /nfs/dbraw/zinc/92/63/97/170926397.db2.gz SJABPDGWDQZYAM-SNVBAGLBSA-N 0 3 296.197 4.550 20 10 CJCDHN CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1ccccc1[O-] ZINC000020121987 171002257 /nfs/dbraw/zinc/00/22/57/171002257.db2.gz ULQWNSAEVWBBGY-BLLLJJGKSA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1ccccc1[O-] ZINC000020121988 171001934 /nfs/dbraw/zinc/00/19/34/171001934.db2.gz ULQWNSAEVWBBGY-LRDDRELGSA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1ccccc1[O-] ZINC000020121989 171001722 /nfs/dbraw/zinc/00/17/22/171001722.db2.gz ULQWNSAEVWBBGY-MLGOLLRUSA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1ccccc1[O-] ZINC000020121990 171002071 /nfs/dbraw/zinc/00/20/71/171002071.db2.gz ULQWNSAEVWBBGY-WBMJQRKESA-N 0 3 289.806 4.848 20 10 CJCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000020122029 171001779 /nfs/dbraw/zinc/00/17/79/171001779.db2.gz VRNAGOBFRRHLGE-OLZOCXBDSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000020122030 171002029 /nfs/dbraw/zinc/00/20/29/171002029.db2.gz VRNAGOBFRRHLGE-STQMWFEESA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000020122031 171001976 /nfs/dbraw/zinc/00/19/76/171001976.db2.gz VRNAGOBFRRHLGE-CHWSQXEVSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000020122032 171001842 /nfs/dbraw/zinc/00/18/42/171001842.db2.gz VRNAGOBFRRHLGE-QWHCGFSZSA-N 0 3 289.806 4.766 20 10 CJCDHN CC[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccccc1[O-] ZINC000020124092 171005679 /nfs/dbraw/zinc/00/56/79/171005679.db2.gz WRLNHUJVUKFXHC-BLLLJJGKSA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccccc1[O-] ZINC000020124093 171005299 /nfs/dbraw/zinc/00/52/99/171005299.db2.gz WRLNHUJVUKFXHC-LRDDRELGSA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccccc1[O-] ZINC000020124094 171005509 /nfs/dbraw/zinc/00/55/09/171005509.db2.gz WRLNHUJVUKFXHC-MLGOLLRUSA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccccc1[O-] ZINC000020124095 171005900 /nfs/dbraw/zinc/00/59/00/171005900.db2.gz WRLNHUJVUKFXHC-WBMJQRKESA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccccc1[O-] ZINC000020124282 171006480 /nfs/dbraw/zinc/00/64/80/171006480.db2.gz SXMZJHMPWZEPOQ-BLLLJJGKSA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccccc1[O-] ZINC000020124283 171006205 /nfs/dbraw/zinc/00/62/05/171006205.db2.gz SXMZJHMPWZEPOQ-LRDDRELGSA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1ccccc1[O-] ZINC000020124284 171006436 /nfs/dbraw/zinc/00/64/36/171006436.db2.gz SXMZJHMPWZEPOQ-MLGOLLRUSA-N 0 3 289.806 4.848 20 10 CJCDHN CC[C@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1ccccc1[O-] ZINC000020124285 171006185 /nfs/dbraw/zinc/00/61/85/171006185.db2.gz SXMZJHMPWZEPOQ-WBMJQRKESA-N 0 3 289.806 4.848 20 10 CJCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c([O-])c1 ZINC000020124324 171006457 /nfs/dbraw/zinc/00/64/57/171006457.db2.gz LVTSVOMCQLRRPS-OLZOCXBDSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c([O-])c1 ZINC000020124326 171006672 /nfs/dbraw/zinc/00/66/72/171006672.db2.gz LVTSVOMCQLRRPS-CHWSQXEVSA-N 0 3 289.806 4.766 20 10 CJCDHN CC[C@@H]([NH2+][C@@H](C)c1ccccc1C)c1ccccc1[O-] ZINC000020126268 171010614 /nfs/dbraw/zinc/01/06/14/171010614.db2.gz QPFXUZRUIIILRZ-WMLDXEAASA-N 0 3 269.388 4.503 20 10 CJCDHN CC[C@H]([NH2+][C@@H](C)c1ccccc1C)c1ccccc1[O-] ZINC000020126269 171010290 /nfs/dbraw/zinc/01/02/90/171010290.db2.gz QPFXUZRUIIILRZ-YOEHRIQHSA-N 0 3 269.388 4.503 20 10 CJCDHN CC[C@@H]([NH2+][C@H](C)c1ccccc1C)c1ccccc1[O-] ZINC000020126270 171010271 /nfs/dbraw/zinc/01/02/71/171010271.db2.gz QPFXUZRUIIILRZ-RHSMWYFYSA-N 0 3 269.388 4.503 20 10 CJCDHN CC[C@H]([NH2+][C@H](C)c1ccccc1C)c1ccccc1[O-] ZINC000020126271 171010197 /nfs/dbraw/zinc/01/01/97/171010197.db2.gz QPFXUZRUIIILRZ-PBHICJAKSA-N 0 3 269.388 4.503 20 10 CJCDHN CC[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccccc1[O-] ZINC000020133702 171021711 /nfs/dbraw/zinc/02/17/11/171021711.db2.gz BGDLIKNQCRWVQA-QZTJIDSGSA-N 0 3 281.399 4.511 20 10 CJCDHN CC[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccccc1[O-] ZINC000020133706 171022228 /nfs/dbraw/zinc/02/22/28/171022228.db2.gz BGDLIKNQCRWVQA-ZWKOTPCHSA-N 0 3 281.399 4.511 20 10 CJCDHN CC[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1ccccc1[O-] ZINC000020133710 171021968 /nfs/dbraw/zinc/02/19/68/171021968.db2.gz BGDLIKNQCRWVQA-MSOLQXFVSA-N 0 3 281.399 4.511 20 10 CJCDHN CC[C@H]([NH2+][C@H]1CCCc2ccccc21)c1ccccc1[O-] ZINC000020133713 171021984 /nfs/dbraw/zinc/02/19/84/171021984.db2.gz BGDLIKNQCRWVQA-ROUUACIJSA-N 0 3 281.399 4.511 20 10 CJCDHN COc1ccc(CN[C@@H](C)c2cc(C)sc2C)cc1C ZINC000035252962 172082858 /nfs/dbraw/zinc/08/28/58/172082858.db2.gz UVOHLQJJKSJYLQ-ZDUSSCGKSA-N 0 3 289.444 4.533 20 10 CJCDHN COc1ccc(CN[C@H](C)c2cc(C)sc2C)cc1C ZINC000035252964 172082493 /nfs/dbraw/zinc/08/24/93/172082493.db2.gz UVOHLQJJKSJYLQ-CYBMUJFWSA-N 0 3 289.444 4.533 20 10 CJCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c1 ZINC000035628761 172308271 /nfs/dbraw/zinc/30/82/71/172308271.db2.gz REDDVSISUZVSCP-QWHCGFSZSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c1 ZINC000035628762 172308369 /nfs/dbraw/zinc/30/83/69/172308369.db2.gz REDDVSISUZVSCP-STQMWFEESA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c1 ZINC000035628763 172308145 /nfs/dbraw/zinc/30/81/45/172308145.db2.gz REDDVSISUZVSCP-CHWSQXEVSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c1 ZINC000035628764 172308463 /nfs/dbraw/zinc/30/84/63/172308463.db2.gz REDDVSISUZVSCP-OLZOCXBDSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc(O)c([C@@H](C)N[C@@H](C)c2ccccc2Cl)c1 ZINC000035628783 172308204 /nfs/dbraw/zinc/30/82/04/172308204.db2.gz DXERXOQEGKHITB-QWHCGFSZSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc(O)c([C@H](C)N[C@@H](C)c2ccccc2Cl)c1 ZINC000035628784 172308043 /nfs/dbraw/zinc/30/80/43/172308043.db2.gz DXERXOQEGKHITB-STQMWFEESA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc(O)c([C@@H](C)N[C@H](C)c2ccccc2Cl)c1 ZINC000035628785 172308265 /nfs/dbraw/zinc/30/82/65/172308265.db2.gz DXERXOQEGKHITB-CHWSQXEVSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc(O)c([C@H](C)N[C@H](C)c2ccccc2Cl)c1 ZINC000035628786 172307886 /nfs/dbraw/zinc/30/78/86/172307886.db2.gz DXERXOQEGKHITB-OLZOCXBDSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c1 ZINC000035628789 172308411 /nfs/dbraw/zinc/30/84/11/172308411.db2.gz JIEGSKHQOQMCJX-CHWSQXEVSA-N 0 3 289.806 4.766 20 10 CJCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c1 ZINC000035628790 172307979 /nfs/dbraw/zinc/30/79/79/172307979.db2.gz JIEGSKHQOQMCJX-OLZOCXBDSA-N 0 3 289.806 4.766 20 10 CJCDHN CSc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000036994448 526073139 /nfs/dbraw/zinc/07/31/39/526073139.db2.gz QADHALFFCYJTAN-STQMWFEESA-N 0 3 287.428 4.526 20 10 CJCDHN CSc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000036994449 526062985 /nfs/dbraw/zinc/06/29/85/526062985.db2.gz QADHALFFCYJTAN-OLZOCXBDSA-N 0 3 287.428 4.526 20 10 CJCDHN CSc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000036994450 526076725 /nfs/dbraw/zinc/07/67/25/526076725.db2.gz QADHALFFCYJTAN-QWHCGFSZSA-N 0 3 287.428 4.526 20 10 CJCDHN CSc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000036994451 526062221 /nfs/dbraw/zinc/06/22/21/526062221.db2.gz QADHALFFCYJTAN-CHWSQXEVSA-N 0 3 287.428 4.526 20 10 CJCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCSc3ccccc32)c([O-])c1 ZINC000037127980 525744677 /nfs/dbraw/zinc/74/46/77/525744677.db2.gz WSDXMONVWSDWGQ-CZUORRHYSA-N 0 3 299.439 4.588 20 10 CJCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCSc3ccccc32)c([O-])c1 ZINC000037127981 525941733 /nfs/dbraw/zinc/94/17/33/525941733.db2.gz WSDXMONVWSDWGQ-XJKSGUPXSA-N 0 3 299.439 4.588 20 10 CJCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCSc3ccccc32)c([O-])c1 ZINC000037127982 525749696 /nfs/dbraw/zinc/74/96/96/525749696.db2.gz WSDXMONVWSDWGQ-CJNGLKHVSA-N 0 3 299.439 4.588 20 10 CJCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCSc3ccccc32)c([O-])c1 ZINC000037127983 525946834 /nfs/dbraw/zinc/94/68/34/525946834.db2.gz WSDXMONVWSDWGQ-BBRMVZONSA-N 0 3 299.439 4.588 20 10 CJCDHN CC[C@H]([NH2+][C@@H]1CCSc2ccccc21)c1ccccc1[O-] ZINC000037128047 522723406 /nfs/dbraw/zinc/72/34/06/522723406.db2.gz SJILXGBPPADGAA-JKSUJKDBSA-N 0 3 299.439 4.670 20 10 CJCDHN CC[C@@H]([NH2+][C@@H]1CCSc2ccccc21)c1ccccc1[O-] ZINC000037128048 522927645 /nfs/dbraw/zinc/92/76/45/522927645.db2.gz SJILXGBPPADGAA-HZPDHXFCSA-N 0 3 299.439 4.670 20 10 CJCDHN CC[C@H]([NH2+][C@H]1CCSc2ccccc21)c1ccccc1[O-] ZINC000037128049 522759203 /nfs/dbraw/zinc/75/92/03/522759203.db2.gz SJILXGBPPADGAA-HOTGVXAUSA-N 0 3 299.439 4.670 20 10 CJCDHN CC[C@@H]([NH2+][C@H]1CCSc2ccccc21)c1ccccc1[O-] ZINC000037128050 522950902 /nfs/dbraw/zinc/95/09/02/522950902.db2.gz SJILXGBPPADGAA-CVEARBPZSA-N 0 3 299.439 4.670 20 10 CJCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCSc3ccccc32)c1 ZINC000037128166 525362817 /nfs/dbraw/zinc/36/28/17/525362817.db2.gz QDKKPMCTJODCGP-CZUORRHYSA-N 0 3 299.439 4.588 20 10 CJCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCSc3ccccc32)c1 ZINC000037128167 525364362 /nfs/dbraw/zinc/36/43/62/525364362.db2.gz QDKKPMCTJODCGP-XJKSGUPXSA-N 0 3 299.439 4.588 20 10 CJCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCSc3ccccc32)c1 ZINC000037128168 525362335 /nfs/dbraw/zinc/36/23/35/525362335.db2.gz QDKKPMCTJODCGP-CJNGLKHVSA-N 0 3 299.439 4.588 20 10 CJCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCSc3ccccc32)c1 ZINC000037128169 525364819 /nfs/dbraw/zinc/36/48/19/525364819.db2.gz QDKKPMCTJODCGP-BBRMVZONSA-N 0 3 299.439 4.588 20 10 CJCDHN CC[C@H]([NH2+][C@@H]1CCCc2sccc21)c1ccccc1[O-] ZINC000061331061 522716364 /nfs/dbraw/zinc/71/63/64/522716364.db2.gz XOLZWSJEEBSRRV-LSDHHAIUSA-N 0 3 287.428 4.572 20 10 CJCDHN CC[C@@H]([NH2+][C@@H]1CCCc2sccc21)c1ccccc1[O-] ZINC000061331063 522923952 /nfs/dbraw/zinc/92/39/52/522923952.db2.gz XOLZWSJEEBSRRV-HUUCEWRRSA-N 0 3 287.428 4.572 20 10 CJCDHN CC[C@H]([NH2+][C@H]1CCCc2sccc21)c1ccccc1[O-] ZINC000061331064 522752920 /nfs/dbraw/zinc/75/29/20/522752920.db2.gz XOLZWSJEEBSRRV-GJZGRUSLSA-N 0 3 287.428 4.572 20 10 CJCDHN CC[C@@H]([NH2+][C@H]1CCCc2sccc21)c1ccccc1[O-] ZINC000061331065 522948321 /nfs/dbraw/zinc/94/83/21/522948321.db2.gz XOLZWSJEEBSRRV-CABCVRRESA-N 0 3 287.428 4.572 20 10 CJCDHN CC[C@H]([NH2+][C@@H](c1ncccc1C)C(C)C)c1ccccc1[O-] ZINC000155850211 261108710 /nfs/dbraw/zinc/10/87/10/261108710.db2.gz BCWOLWLXIRIRBV-FUHWJXTLSA-N 0 3 298.430 4.534 20 10 CJCDHN CC[C@@H]([NH2+][C@@H](c1ncccc1C)C(C)C)c1ccccc1[O-] ZINC000155850322 261108886 /nfs/dbraw/zinc/10/88/86/261108886.db2.gz BCWOLWLXIRIRBV-SJLPKXTDSA-N 0 3 298.430 4.534 20 10 CJCDHN CC[C@H]([NH2+][C@H](c1ncccc1C)C(C)C)c1ccccc1[O-] ZINC000155850431 261108929 /nfs/dbraw/zinc/10/89/29/261108929.db2.gz BCWOLWLXIRIRBV-WMZOPIPTSA-N 0 3 298.430 4.534 20 10 CJCDHN CC[C@@H]([NH2+][C@H](c1ncccc1C)C(C)C)c1ccccc1[O-] ZINC000155850558 261108565 /nfs/dbraw/zinc/10/85/65/261108565.db2.gz BCWOLWLXIRIRBV-AEFFLSMTSA-N 0 3 298.430 4.534 20 10 CJCDHN C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])c1ccc(F)c(Cl)c1 ZINC000179884033 261822288 /nfs/dbraw/zinc/82/22/88/261822288.db2.gz LOSGQEZEQPNVBC-GHMZBOCLSA-N 0 3 293.769 4.597 20 10 CJCDHN CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000192706825 528204441 /nfs/dbraw/zinc/20/44/41/528204441.db2.gz IOQCMTXOOHBLCI-CABCVRRESA-N 0 3 299.414 4.591 20 10 CJCDHN CC(C)Oc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000192706837 528208542 /nfs/dbraw/zinc/20/85/42/528208542.db2.gz IOQCMTXOOHBLCI-GJZGRUSLSA-N 0 3 299.414 4.591 20 10 CJCDHN CC(C)Oc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000192706853 528204715 /nfs/dbraw/zinc/20/47/15/528204715.db2.gz IOQCMTXOOHBLCI-HUUCEWRRSA-N 0 3 299.414 4.591 20 10 CJCDHN CC(C)Oc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000192706865 528208376 /nfs/dbraw/zinc/20/83/76/528208376.db2.gz IOQCMTXOOHBLCI-LSDHHAIUSA-N 0 3 299.414 4.591 20 10 CJCDHN CC(C)Oc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000192759369 528240752 /nfs/dbraw/zinc/24/07/52/528240752.db2.gz GFFAUXDYXBSGOT-CABCVRRESA-N 0 3 299.414 4.591 20 10 CJCDHN CC(C)Oc1cccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000192759382 528242688 /nfs/dbraw/zinc/24/26/88/528242688.db2.gz GFFAUXDYXBSGOT-GJZGRUSLSA-N 0 3 299.414 4.591 20 10 CJCDHN CC(C)Oc1cccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000192759392 528239869 /nfs/dbraw/zinc/23/98/69/528239869.db2.gz GFFAUXDYXBSGOT-HUUCEWRRSA-N 0 3 299.414 4.591 20 10 CJCDHN CC(C)Oc1cccc([C@H](C)[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000192759403 528242861 /nfs/dbraw/zinc/24/28/61/528242861.db2.gz GFFAUXDYXBSGOT-LSDHHAIUSA-N 0 3 299.414 4.591 20 10 CJCDHN CC[C@H]([NH2+][C@@H](C)c1ccccc1[O-])c1ccc(Cl)s1 ZINC000272797239 522697491 /nfs/dbraw/zinc/69/74/91/522697491.db2.gz AVIKBSZXJWKHTP-JQWIXIFHSA-N 0 3 295.835 4.909 20 10 CJCDHN Cc1ccsc1[C@H](C)NCc1c(C)c2ccccc2n1C ZINC000479452927 331730838 /nfs/dbraw/zinc/73/08/38/331730838.db2.gz JATATDPKDCVVTA-AWEZNQCLSA-N 0 3 298.455 4.707 20 10 CJCDHN Cc1ccsc1[C@@H](C)NCc1c(C)c2ccccc2n1C ZINC000479452938 331730879 /nfs/dbraw/zinc/73/08/79/331730879.db2.gz JATATDPKDCVVTA-CQSZACIVSA-N 0 3 298.455 4.707 20 10 CJCDHN Cc1cccc([C@@H]([NH2+][C@H](C)c2ccccc2[O-])C(C)C)c1 ZINC000528006297 330303411 /nfs/dbraw/zinc/30/34/11/330303411.db2.gz BCAZYEJBGPZBRZ-BEFAXECRSA-N 0 3 283.415 4.749 20 10 CJCDHN Cc1cccc([C@H]([NH2+][C@H](C)c2ccccc2[O-])C(C)C)c1 ZINC000528006302 330303378 /nfs/dbraw/zinc/30/33/78/330303378.db2.gz BCAZYEJBGPZBRZ-DNVCBOLYSA-N 0 3 283.415 4.749 20 10 CJCDHN Cc1cccc([C@H]([NH2+][C@@H](C)c2ccccc2[O-])C(C)C)c1 ZINC000528006304 330303463 /nfs/dbraw/zinc/30/34/63/330303463.db2.gz BCAZYEJBGPZBRZ-HNAYVOBHSA-N 0 3 283.415 4.749 20 10 CJCDHN Cc1cccc([C@@H]([NH2+][C@@H](C)c2ccccc2[O-])C(C)C)c1 ZINC000528006305 330303393 /nfs/dbraw/zinc/30/33/93/330303393.db2.gz BCAZYEJBGPZBRZ-KXBFYZLASA-N 0 3 283.415 4.749 20 10 CJCDHN