smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O	ZINC000003830383	552418576	/nfs/dbraw/zinc/41/85/76/552418576.db2.gz	XREUEWVEMYWFFA-NXTDKBKUSA-N	1	0	513.499	0.726	40	10		KCCBRO
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H]([NH3+])[C@@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O	ZINC000003830384	552418611	/nfs/dbraw/zinc/41/86/11/552418611.db2.gz	XREUEWVEMYWFFA-IPKAZTMASA-N	1	0	513.499	0.726	40	10		KCCBRO
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H]([NH3+])[C@H](O)[C@@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O	ZINC000003830385	552418535	/nfs/dbraw/zinc/41/85/35/552418535.db2.gz	XREUEWVEMYWFFA-YVGUCIIMSA-N	1	0	513.499	0.726	40	10		KCCBRO
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O	ZINC000003830386	552418574	/nfs/dbraw/zinc/41/85/74/552418574.db2.gz	XREUEWVEMYWFFA-LYOZYVGYSA-N	1	0	513.499	0.726	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1	ZINC000003830729	552419195	/nfs/dbraw/zinc/41/91/95/552419195.db2.gz	AOJJSUZBOXZQNB-ZGHKRRCESA-N	1	0	543.525	0.001	40	10	in-vitro	KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@H](C)O1	ZINC000003830730	552419168	/nfs/dbraw/zinc/41/91/68/552419168.db2.gz	AOJJSUZBOXZQNB-MFNXJEGDSA-N	1	0	543.525	0.001	40	10	in-vitro	KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@@H](C)O1	ZINC000003830731	552419202	/nfs/dbraw/zinc/41/92/02/552419202.db2.gz	AOJJSUZBOXZQNB-UURIJNAVSA-N	1	0	543.525	0.001	40	10	in-vitro	KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@H](C)O1	ZINC000003830732	552419172	/nfs/dbraw/zinc/41/91/72/552419172.db2.gz	AOJJSUZBOXZQNB-ROBWJDMWSA-N	1	0	543.525	0.001	40	10	in-vitro	KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@](O)(C(=O)CO)C[C@@H]3O[C@@H]1C[C@H]([NH3+])[C@@H](O)[C@H](C)O1	ZINC000003954475	552423952	/nfs/dbraw/zinc/42/39/52/552423952.db2.gz	AOJJSUZBOXZQNB-CEDKXOAUSA-N	1	0	543.525	0.001	40	10	in-vitro	KCCBRO
CCC(=O)OCC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@@H]2C[C@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O	ZINC000005104664	552493693	/nfs/dbraw/zinc/49/36/93/552493693.db2.gz	JVIBQTPDGKKAIB-ZAYRGIDDSA-N	1	0	599.589	0.962	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@](O)(C(=O)CO)C[C@H]3O[C@@H]1C[C@H]([NH3+])[C@H](O)[C@H](C)O1	ZINC000008035327	552983979	/nfs/dbraw/zinc/98/39/79/552983979.db2.gz	AOJJSUZBOXZQNB-PZFSKNLTSA-N	1	0	543.525	0.001	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1	ZINC000011616200	553339506	/nfs/dbraw/zinc/33/95/06/553339506.db2.gz	AOJJSUZBOXZQNB-OUSUFOHXSA-N	1	0	543.525	0.001	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@](O)(C(=O)CO)C[C@@H]3O[C@@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1	ZINC000011616201	553339579	/nfs/dbraw/zinc/33/95/79/553339579.db2.gz	AOJJSUZBOXZQNB-NIIZNPJHSA-N	1	0	543.525	0.001	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@@H]1C[C@@H]([NH3+])[C@H](O)[C@H](C)O1	ZINC000017654225	553598989	/nfs/dbraw/zinc/59/89/89/553598989.db2.gz	AOJJSUZBOXZQNB-QGHLZFFLSA-N	1	0	543.525	0.001	40	10	aggregator	KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1	ZINC000027640798	553835693	/nfs/dbraw/zinc/83/56/93/553835693.db2.gz	AOJJSUZBOXZQNB-BLYMWMEMSA-N	1	0	543.525	0.001	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@](O)(C(=O)CO)C[C@@H]3O[C@@H]1C[C@H]([NH3+])[C@@H](O)[C@@H](C)O1	ZINC000027640803	553835835	/nfs/dbraw/zinc/83/58/35/553835835.db2.gz	AOJJSUZBOXZQNB-XMAKMXSVSA-N	1	0	543.525	0.001	40	10	in-vitro	KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@@H]1C[C@@H]([NH3+])[C@@H](O)[C@H](C)O1	ZINC000029332500	553844595	/nfs/dbraw/zinc/84/45/95/553844595.db2.gz	AOJJSUZBOXZQNB-NKKDNBHFSA-N	1	0	543.525	0.001	40	10		KCCBRO
CCOC(OCC)C(=O)OCC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@@H]2C[C@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O	ZINC000040163294	554282400	/nfs/dbraw/zinc/28/24/00/554282400.db2.gz	XZSRRNFBEIOBDA-YBDJQKLYSA-N	1	0	673.668	0.951	40	10		KCCBRO
CCOC(OCC)C(=O)OCC(=O)[C@@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@@H]2C[C@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O	ZINC000040163295	554282453	/nfs/dbraw/zinc/28/24/53/554282453.db2.gz	XZSRRNFBEIOBDA-AYJXDXPLSA-N	1	0	673.668	0.951	40	10		KCCBRO
CCOC(OCC)C(=O)OCC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@@H]2C[C@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O	ZINC000040163296	554282478	/nfs/dbraw/zinc/28/24/78/554282478.db2.gz	XZSRRNFBEIOBDA-XNUARTNZSA-N	1	0	673.668	0.951	40	10		KCCBRO
CCOC(OCC)C(=O)OCC(=O)[C@@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@@H]2C[C@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O	ZINC000040163297	554282528	/nfs/dbraw/zinc/28/25/28/554282528.db2.gz	XZSRRNFBEIOBDA-WXQVFAGXSA-N	1	0	673.668	0.951	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@@H](C)O)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1	ZINC000060183584	554502733	/nfs/dbraw/zinc/50/27/33/554502733.db2.gz	HJEZFVLKJYFNQW-ZHFMPAJASA-N	1	0	529.542	0.821	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@@H](C)O)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@H](C)O1	ZINC000060183585	554502809	/nfs/dbraw/zinc/50/28/09/554502809.db2.gz	HJEZFVLKJYFNQW-AKUVFSMYSA-N	1	0	529.542	0.821	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@@H](C)O)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@@H](C)O1	ZINC000060183587	554502724	/nfs/dbraw/zinc/50/27/24/554502724.db2.gz	HJEZFVLKJYFNQW-ZWGLYWEOSA-N	1	0	529.542	0.821	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@@H](C)O)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@H](C)O1	ZINC000060183589	554502757	/nfs/dbraw/zinc/50/27/57/554502757.db2.gz	HJEZFVLKJYFNQW-XGDSUKHNSA-N	1	0	529.542	0.821	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@H]3O[C@H]1C[C@@H]([NH+](C)C)[C@@H](O)[C@@H](C)O1	ZINC000066123016	554528440	/nfs/dbraw/zinc/52/84/40/554528440.db2.gz	DJEFXYVVRUAFEB-ZTAYHRRFSA-N	1	0	571.579	0.604	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@H]3O[C@H]1C[C@@H]([NH+](C)C)[C@@H](O)[C@H](C)O1	ZINC000066123018	554528592	/nfs/dbraw/zinc/52/85/92/554528592.db2.gz	DJEFXYVVRUAFEB-IWKLVQEISA-N	1	0	571.579	0.604	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@H]3O[C@H]1C[C@@H]([NH+](C)C)[C@H](O)[C@@H](C)O1	ZINC000066123020	554528404	/nfs/dbraw/zinc/52/84/04/554528404.db2.gz	DJEFXYVVRUAFEB-XMAMQQPVSA-N	1	0	571.579	0.604	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@H]3O[C@H]1C[C@@H]([NH+](C)C)[C@H](O)[C@H](C)O1	ZINC000066123022	554528467	/nfs/dbraw/zinc/52/84/67/554528467.db2.gz	DJEFXYVVRUAFEB-JYIGFBPQSA-N	1	0	571.579	0.604	40	10		KCCBRO
O=C(C[C@@H]1CCN2C[C@@H]1/C=C\COc1ccc(N3CC[NH2+]CC3)cc1CNCC2=O)NCCN1CCOCC1	ZINC000067878986	554534549	/nfs/dbraw/zinc/53/45/49/554534549.db2.gz	BVERDQKFNCOCIA-UTTFWXOASA-N	1	0	540.709	0.438	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@H]3O[C@@H]1C[C@H]([NH3+])[C@H](O)[C@H](C)O1	ZINC000076945310	553654436	/nfs/dbraw/zinc/65/44/36/553654436.db2.gz	AOJJSUZBOXZQNB-IAJIOVCTSA-N	1	0	543.525	0.001	40	10	in-vitro	KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CN1CCOCC1)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1	ZINC000095749695	553712788	/nfs/dbraw/zinc/71/27/88/553712788.db2.gz	JQWTYSBYFQTQGG-NDAQAYMYSA-N	1	0	612.632	0.341	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CN1CCOCC1)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@H](C)O1	ZINC000095749696	553713282	/nfs/dbraw/zinc/71/32/82/553713282.db2.gz	JQWTYSBYFQTQGG-SAEJABOZSA-N	1	0	612.632	0.341	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CN1CCOCC1)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@@H](C)O1	ZINC000095749697	553713305	/nfs/dbraw/zinc/71/33/05/553713305.db2.gz	JQWTYSBYFQTQGG-KFGCNRBQSA-N	1	0	612.632	0.341	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CN1CCOCC1)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@H](C)O1	ZINC000095749698	553713308	/nfs/dbraw/zinc/71/33/08/553713308.db2.gz	JQWTYSBYFQTQGG-DUPCWEGSSA-N	1	0	612.632	0.341	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@H](C(=O)CO)C[C@@H]3O[C@H]1C[C@H]([NH3+])[C@H](O)[C@H](C)O1	ZINC000095749712	553713300	/nfs/dbraw/zinc/71/33/00/553713300.db2.gz	KXAYNEKSZHDBGO-LOGLVVABSA-N	1	0	527.526	0.886	40	10		KCCBRO
O=C(C[C@@H]1CCN2C[C@@H]1/C=C/COc1ccc(N3CC[NH2+]CC3)cc1CNCC2=O)NCCN1CCOCC1	ZINC000100035074	554187924	/nfs/dbraw/zinc/18/79/24/554187924.db2.gz	BVERDQKFNCOCIA-DRYSHGSZSA-N	1	0	540.709	0.438	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1CO[C@@H](C)[C@H](O)[C@@H]1[NH3+]	ZINC000100225675	554252978	/nfs/dbraw/zinc/25/29/78/554252978.db2.gz	UBWNRYMXTKTITN-MZDTWQRNSA-N	1	0	527.526	0.681	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1CO[C@@H](C)[C@@H](O)[C@@H]1[NH3+]	ZINC000100225679	554252921	/nfs/dbraw/zinc/25/29/21/554252921.db2.gz	UBWNRYMXTKTITN-GDJAIZSBSA-N	1	0	527.526	0.681	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1CO[C@@H](C)[C@H](O)[C@H]1[NH3+]	ZINC000100225681	554253003	/nfs/dbraw/zinc/25/30/03/554253003.db2.gz	UBWNRYMXTKTITN-NGRQLJRHSA-N	1	0	527.526	0.681	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1CO[C@@H](C)[C@@H](O)[C@H]1[NH3+]	ZINC000100225683	554253002	/nfs/dbraw/zinc/25/30/02/554253002.db2.gz	UBWNRYMXTKTITN-CFZIKUKQSA-N	1	0	527.526	0.681	40	10		KCCBRO
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@@H]2C[C@H]([NH3+])[C@@H](O)[C@@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O	ZINC000102960649	555175900	/nfs/dbraw/zinc/17/59/00/555175900.db2.gz	XREUEWVEMYWFFA-BRZUGXSLSA-N	1	0	513.499	0.726	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@H](C)O)C[C@@H]3O[C@H]1C[C@H]([NH3+])[C@@H](O)[C@H](C)O1	ZINC000103651509	555460988	/nfs/dbraw/zinc/46/09/88/555460988.db2.gz	HJEZFVLKJYFNQW-BDKNZTIZSA-N	1	0	529.542	0.821	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CN1CCN(C)CC1)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1	ZINC000104184570	571376241	/nfs/dbraw/zinc/37/62/41/571376241.db2.gz	GFGVYRFMNVPWFP-URNGZZJTSA-N	1	0	625.675	0.256	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CN1CCN(C)CC1)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@H](C)O1	ZINC000104184576	571376207	/nfs/dbraw/zinc/37/62/07/571376207.db2.gz	GFGVYRFMNVPWFP-RJZSXEEXSA-N	1	0	625.675	0.256	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CN1CCN(C)CC1)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@@H](C)O1	ZINC000104184579	571376250	/nfs/dbraw/zinc/37/62/50/571376250.db2.gz	GFGVYRFMNVPWFP-ARAXPWKSSA-N	1	0	625.675	0.256	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CN1CCN(C)CC1)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@H](C)O1	ZINC000104184582	571376238	/nfs/dbraw/zinc/37/62/38/571376238.db2.gz	GFGVYRFMNVPWFP-WKYABUKWSA-N	1	0	625.675	0.256	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@](O)(C(=O)CO)C[C@H]3O[C@@H]1C[C@H]([NH3+])[C@H](O)[C@@H](C)O1	ZINC000247720803	572243656	/nfs/dbraw/zinc/24/36/56/572243656.db2.gz	AOJJSUZBOXZQNB-ZKLGHBBCSA-N	1	0	543.525	0.001	40	10		KCCBRO
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@](O)(C(=O)CO)C[C@@H]3O[C@@H]1C[C@H]([NH3+])[C@H](O)[C@@H](C)O1	ZINC000247991047	572251436	/nfs/dbraw/zinc/25/14/36/572251436.db2.gz	AOJJSUZBOXZQNB-RPKLURCBSA-N	1	0	543.525	0.001	40	10	in-vitro	KCCBRO
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@@H]2C[C@H]([NH3+])[C@@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O	ZINC000253386706	562881815	/nfs/dbraw/zinc/88/18/15/562881815.db2.gz	XREUEWVEMYWFFA-KURZMFKTSA-N	1	0	513.499	0.726	40	10		KCCBRO
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@@H]2C[C@H]([NH3+])[C@H](O)[C@@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O	ZINC000253386709	562881797	/nfs/dbraw/zinc/88/17/97/562881797.db2.gz	XREUEWVEMYWFFA-SLGUTGSYSA-N	1	0	513.499	0.726	40	10		KCCBRO
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@@H]2C[C@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O	ZINC000253386711	562881814	/nfs/dbraw/zinc/88/18/14/562881814.db2.gz	XREUEWVEMYWFFA-XELSVMSRSA-N	1	0	513.499	0.726	40	10		KCCBRO
O=C(C[C@@H]1CCN2C[C@@H]1C=CCOc1ccc(N3CC[NH2+]CC3)cc1CNCC2=O)NCCN1CCOCC1	ZINC000958317595	1066282212	/nfs/dbraw/zinc/28/22/12/1066282212.db2.gz	BVERDQKFNCOCIA-ZEQRLZLVSA-N	1	0	540.709	0.438	40	10		KCCBRO
CC(=O)NCCNC(=O)C[C@@H]1CCN2C[C@@H]1C=CCOc1ccc(N3CC[NH2+]CC3)cc1CNCC2=O	ZINC000958317618	1066282241	/nfs/dbraw/zinc/28/22/41/1066282241.db2.gz	NCLXLLZXCRDVGP-VXKWHMMOSA-N	1	0	512.655	0.242	40	10		KCCBRO