smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=S(=O)(c1ccc([O-])cc1)c1ccc([O-])c(C23CC4CC(CC(C4)C2)C3)c1	ZINC000003995388	204022119	/nfs/dbraw/zinc/02/21/19/204022119.db2.gz	KHSIRGIMBIQHTA-UHFFFAOYSA-N	-2	3	384.497	4.398	50	0		GIAAHL
CCCCN(C)c1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)cc1C(=O)[O-]	ZINC000033253357	570861181	/nfs/dbraw/zinc/86/11/81/570861181.db2.gz	UGAJXPGSGXFFGM-UHFFFAOYSA-N	-2	3	390.505	4.039	50	0		GIAAHL
CCc1c(C)sc2[n-]c(=S)n([N-]C(=O)c3oc4ccccc4c3C)c(=O)c12	ZINC000017081728	570941230	/nfs/dbraw/zinc/94/12/30/570941230.db2.gz	XYNCLWGNKPBLCH-UHFFFAOYSA-N	-2	3	399.497	4.430	50	0		GIAAHL
O=C1[N-]C(=S)SC1=Cc1cc(Br)cc(Br)c1[O-]	ZINC000008970442	204294727	/nfs/dbraw/zinc/29/47/27/204294727.db2.gz	SZLSVNNBEXCILG-FARCUNLSSA-N	-2	3	395.097	4.246	50	0		GIAAHL
CCCOc1ccc2ccccc2c1C(c1c(C)[n-][nH]c1=O)c1c(C)[n-][nH]c1=O	ZINC000004540718	204050491	/nfs/dbraw/zinc/05/04/91/204050491.db2.gz	DHUODMFQYDKZEE-UHFFFAOYSA-N	-2	3	392.459	4.283	50	0		GIAAHL
CCCCN(CC)c1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1C(=O)[O-]	ZINC000033253557	570861347	/nfs/dbraw/zinc/86/13/47/570861347.db2.gz	YJZOQVXOUABGER-UHFFFAOYSA-N	-2	3	390.505	4.120	50	0		GIAAHL
CCCCN(CC)c1ccc([N-]S(=O)(=O)c2ccccc2C)cc1C(=O)[O-]	ZINC000033253567	570861416	/nfs/dbraw/zinc/86/14/16/570861416.db2.gz	LESSCLGWONNOBW-UHFFFAOYSA-N	-2	3	390.505	4.120	50	0		GIAAHL
CCCCCCOc1ccc(NC(=O)c2c([O-])[n-]c3ccccc3c2=O)cc1	ZINC000017043530	570938006	/nfs/dbraw/zinc/93/80/06/570938006.db2.gz	DVDUEHCCDDUWAY-UHFFFAOYSA-N	-2	3	380.444	4.445	50	0		GIAAHL
CC(C)(C)c1cc(O)c2oc(=O)c(-c3nc4cc(C(=O)[O-])ccc4[n-]3)cc2c1	ZINC000004370960	204041671	/nfs/dbraw/zinc/04/16/71/204041671.db2.gz	KBAZBBUQSBVIHV-UHFFFAOYSA-N	-2	3	378.384	4.038	50	0		GIAAHL
Cc1ccccc1Oc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2)cc1	ZINC000033625113	570528301	/nfs/dbraw/zinc/52/83/01/570528301.db2.gz	LFTJJXFNQQLSHU-UHFFFAOYSA-N	-2	3	383.425	4.286	50	0		GIAAHL
O=S(=O)([N-]c1ccc(-c2nc3ccccc3s2)c([O-])c1)c1ccccc1	ZINC000001207870	570794074	/nfs/dbraw/zinc/79/40/74/570794074.db2.gz	FXFWURMVUPSIAQ-UHFFFAOYSA-N	-2	3	382.466	4.470	50	0		GIAAHL
CCCN(CCC)c1ccc([N-]S(=O)(=O)c2ccccc2C)cc1C(=O)[O-]	ZINC000033253502	570861530	/nfs/dbraw/zinc/86/15/30/570861530.db2.gz	HHGLYTXTWLXZSX-UHFFFAOYSA-N	-2	3	390.505	4.120	50	0		GIAAHL
O=C([O-])c1ccc(-c2ccc(-c3nc4sc5c(c4c(=O)[n-]3)CCCC5)o2)cc1	ZINC000001085959	570953212	/nfs/dbraw/zinc/95/32/12/570953212.db2.gz	RPSBKFXZTQCIMI-UHFFFAOYSA-N	-2	3	392.436	4.489	50	0		GIAAHL
COC(=O)C[C@@H](c1c([O-])cc([O-])c2c(=O)cc(-c3ccccc3)oc21)C(C)C	ZINC000096114490	206117999	/nfs/dbraw/zinc/11/79/99/206117999.db2.gz	IBEOQSSKLWJOMF-CQSZACIVSA-N	-2	3	382.412	4.174	50	0		GIAAHL
CCN(CC)c1ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)cc1C(=O)[O-]	ZINC000033253646	570862011	/nfs/dbraw/zinc/86/20/11/570862011.db2.gz	PBCGKVAWRGALDZ-UHFFFAOYSA-N	-2	3	390.505	4.155	50	0		GIAAHL
Cc1[n-]n(-c2ccc(Oc3ccccc3)c(S(=O)(=O)[O-])c2)c(=O)c1C(C)C	ZINC000002831697	570305369	/nfs/dbraw/zinc/30/53/69/570305369.db2.gz	RSHHQSXOOUAHME-UHFFFAOYSA-N	-2	3	388.445	4.049	50	0		GIAAHL
CC1=Nc2c(c(=O)[n-]n2C2CCOCC2)[C@@H](c2ccc([O-])c(Cl)c2)S1	ZINC000095480305	208194232	/nfs/dbraw/zinc/19/42/32/208194232.db2.gz	PZAAIAUIYWPBAE-OAHLLOKOSA-N	-2	3	379.869	4.185	50	0		GIAAHL
O=c1nc(CSc2nnc([N-]c3ccccc3F)s2)[n-]c2ccsc21	ZINC000006566925	570478766	/nfs/dbraw/zinc/47/87/66/570478766.db2.gz	JYUDYCQXVFIHJA-UHFFFAOYSA-N	-2	3	391.478	4.011	50	0		GIAAHL
COc1cc([O-])c(-c2coc3cc([O-])ccc3c2=O)c(OC)c1CC=C(C)C	ZINC000014762987	207029930	/nfs/dbraw/zinc/02/99/30/207029930.db2.gz	GGWMNTNDTRKETA-UHFFFAOYSA-N	-2	3	382.412	4.397	50	0	endogenous,in-man	GIAAHL
O=C([N-]n1c(=O)c2cc(-c3ccccc3)sc2[n-]c1=S)c1cccs1	ZINC000017078719	207084247	/nfs/dbraw/zinc/08/42/47/207084247.db2.gz	KTBIKRUAWFAHNW-UHFFFAOYSA-N	-2	3	385.495	4.233	50	0		GIAAHL
Cc1cccc2c1Oc1nc(-c3cc(Br)ccc3[O-])[n-]c(=O)c1C2	ZINC000006748496	570566605	/nfs/dbraw/zinc/56/66/05/570566605.db2.gz	XCVVGEKTETWSER-UHFFFAOYSA-N	-2	3	385.217	4.322	50	0		GIAAHL
CCCCC(=O)[N-]C([N-]c1ccc(Cl)cn1)(C(F)(F)F)C(F)(F)F	ZINC000012419548	570657652	/nfs/dbraw/zinc/65/76/52/570657652.db2.gz	RZITYWKRPWBSJN-UHFFFAOYSA-N	-2	3	377.716	4.274	50	0		GIAAHL
CCCCN(C)c1ccc([N-]S(=O)(=O)c2cc(C)cc(C)c2)cc1C(=O)[O-]	ZINC000033253375	570861245	/nfs/dbraw/zinc/86/12/45/570861245.db2.gz	CCOKZKWASZAVFW-UHFFFAOYSA-N	-2	3	390.505	4.039	50	0		GIAAHL
COc1cc(/C=C/c2nc(-c3ccccc3)ncc2C(=O)[O-])cc(Cl)c1[O-]	ZINC000170618841	823921003	/nfs/dbraw/zinc/92/10/03/823921003.db2.gz	VIDPGXPSEARKQR-BQYQJAHWSA-N	-2	3	382.803	4.380	50	0		GIAAHL
Cc1[n-][nH]c(=O)c1C(c1ccc(-c2cccc(Cl)c2)o1)c1c(C)[n-][nH]c1=O	ZINC000004540536	206527810	/nfs/dbraw/zinc/52/78/10/206527810.db2.gz	CWEPOMLISBITJJ-UHFFFAOYSA-N	-2	3	384.823	4.254	50	0		GIAAHL
Cc1[n-][nH]c(=O)c1C(c1ccc(-c2ccc(Cl)cc2)o1)c1c(C)[n-][nH]c1=O	ZINC000033936105	570530239	/nfs/dbraw/zinc/53/02/39/570530239.db2.gz	WWAQEVYNNMDUAM-UHFFFAOYSA-N	-2	3	384.823	4.254	50	0		GIAAHL
CCCCN(C)c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c(C(=O)[O-])c1	ZINC000033007195	570620008	/nfs/dbraw/zinc/62/00/08/570620008.db2.gz	XENINGWFVSXAJW-UHFFFAOYSA-N	-2	3	396.896	4.075	50	0		GIAAHL
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)Nc3ccccc3[O-])cc2)cc1C	ZINC000012556925	570859303	/nfs/dbraw/zinc/85/93/03/570859303.db2.gz	DWQMHZNGANFFMT-UHFFFAOYSA-N	-2	3	396.468	4.062	50	0		GIAAHL
Cc1cccc(Oc2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])cc3)cc2)c1	ZINC000002861917	206442627	/nfs/dbraw/zinc/44/26/27/206442627.db2.gz	FITRMTXMRVJXPB-UHFFFAOYSA-N	-2	3	383.425	4.286	50	0		GIAAHL
O=c1[n-]n(C2CCCC2)c2c1[C@@H](c1ccc([O-])c(Cl)c1)SCC(=O)N2	ZINC000095480979	208195497	/nfs/dbraw/zinc/19/54/97/208195497.db2.gz	QIAJHRGAEQGKBO-OAHLLOKOSA-N	-2	3	379.869	4.075	50	0		GIAAHL
O=c1[n-]n(C2CCCCC2)c2c1[C@@H](c1ccc([O-])c(Cl)c1)SCC(=O)N2	ZINC000095480508	208196137	/nfs/dbraw/zinc/19/61/37/208196137.db2.gz	UVJGLAKFWARUDX-MRXNPFEDSA-N	-2	3	393.896	4.465	50	0		GIAAHL
O=C(Nc1nc(-c2ccc(Cl)cc2)cs1)c1c([O-])[n-]c2ccccc2c1=O	ZINC000017043373	221375704	/nfs/dbraw/zinc/37/57/04/221375704.db2.gz	ACANXMJIEYUDLY-UHFFFAOYSA-N	-2	3	397.843	4.263	50	0		GIAAHL
CCCCOc1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)[O-])cc1C(C)C	ZINC000011566005	570229599	/nfs/dbraw/zinc/22/95/99/570229599.db2.gz	ZZPSVZLBKCZQBE-UHFFFAOYSA-N	-2	3	391.489	4.488	50	0		GIAAHL
Cc1[n-][nH]c(=O)c1C(c1c(C)[n-][nH]c1=O)c1ccc(N(C)c2ccccc2)cc1	ZINC000004915933	570418040	/nfs/dbraw/zinc/41/80/40/570418040.db2.gz	BLSGFYDTABAMAS-UHFFFAOYSA-N	-2	3	389.459	4.109	50	0		GIAAHL
O=C([O-])[C@]1(c2ccccc2)CC[C@@H](/N=C/c2ccc(Br)cc2[O-])C1	ZINC000034870462	570381971	/nfs/dbraw/zinc/38/19/71/570381971.db2.gz	BQLNLGQODZRMBQ-FWQQEFPFSA-N	-2	3	388.261	4.149	50	0		GIAAHL
O=C([O-])c1ccc([C@H]2CC(=O)Nc3c2c(=O)[n-]n3C2CCCCCCC2)cc1	ZINC000071281898	570523758	/nfs/dbraw/zinc/52/37/58/570523758.db2.gz	XIZJOXKYYZSLAD-MRXNPFEDSA-N	-2	3	383.448	4.284	50	0		GIAAHL
Cc1cccc(-n2c(Cc3n[n-]c(=S)n3-c3cccc(C)c3)n[n-]c2=S)c1	ZINC000000624751	209251743	/nfs/dbraw/zinc/25/17/43/209251743.db2.gz	ALJBYRKCIRHETO-UHFFFAOYSA-N	-2	3	394.529	4.007	50	0		GIAAHL
CCCCN(C)c1ccc([N-]S(=O)(=O)c2ccc(C)cc2C)cc1C(=O)[O-]	ZINC000021883408	210399214	/nfs/dbraw/zinc/39/92/14/210399214.db2.gz	HPFLYIMDYCIDGC-UHFFFAOYSA-N	-2	3	390.505	4.039	50	0		GIAAHL
Cc1ccc2c(c1)Cc1c(=O)[n-]c(-c3cc(Br)ccc3[O-])nc1O2	ZINC000006748478	570566589	/nfs/dbraw/zinc/56/65/89/570566589.db2.gz	YAXWBPDJGKGPPR-UHFFFAOYSA-N	-2	3	385.217	4.322	50	0		GIAAHL
CC(C)CC(=O)[N-]C([N-]c1ccc(Cl)cn1)(C(F)(F)F)C(F)(F)F	ZINC000019944520	210310879	/nfs/dbraw/zinc/31/08/79/210310879.db2.gz	KAJLDBGTHRYVQD-UHFFFAOYSA-N	-2	3	377.716	4.130	50	0		GIAAHL
CCCCOc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2)cc1C(C)C	ZINC000011566007	570229795	/nfs/dbraw/zinc/22/97/95/570229795.db2.gz	MSICSYARPOYPJU-UHFFFAOYSA-N	-2	3	391.489	4.488	50	0		GIAAHL
COc1cc(/C=C/c2noc(-c3ccccc3[O-])n2)cc(Br)c1[O-]	ZINC000006668666	570527076	/nfs/dbraw/zinc/52/70/76/570527076.db2.gz	AAOUJZIBNGNXPI-VOTSOKGWSA-N	-2	3	389.205	4.089	50	0		GIAAHL
O=C([O-])c1sccc1Oc1ccc([N-]S(=O)(=O)c2ccccc2)cc1	ZINC000008857284	570542826	/nfs/dbraw/zinc/54/28/26/570542826.db2.gz	VMYLMMYZPCXXEZ-UHFFFAOYSA-N	-2	3	375.427	4.039	50	0		GIAAHL
CCC(=O)[N-]C([N-]c1cc(Cl)ccc1OC)(C(F)(F)F)C(F)(F)F	ZINC000002276990	209353990	/nfs/dbraw/zinc/35/39/90/209353990.db2.gz	KBLVCIWSTZTRPW-UHFFFAOYSA-N	-2	3	378.700	4.108	50	0		GIAAHL
CCCCCCOc1ccc(C(c2c(C)[n-][nH]c2=O)c2c(C)[n-][nH]c2=O)cc1	ZINC000021589998	210385290	/nfs/dbraw/zinc/38/52/90/210385290.db2.gz	UTKDVUWCSSNYPZ-UHFFFAOYSA-N	-2	3	384.480	4.300	50	0		GIAAHL
Cc1[n-][nH]c(=O)c1C(c1c(C)[n-][nH]c1=O)c1c(OC(C)C)ccc2ccccc21	ZINC000019974231	210311179	/nfs/dbraw/zinc/31/11/79/210311179.db2.gz	MXQDVLTXEKIUSA-UHFFFAOYSA-N	-2	3	392.459	4.281	50	0		GIAAHL
O=C([O-])[C@]1(c2ccccc2)CC[C@H](/N=C/c2ccc(Br)cc2[O-])C1	ZINC000034870460	570381963	/nfs/dbraw/zinc/38/19/63/570381963.db2.gz	BQLNLGQODZRMBQ-WKWJGNFBSA-N	-2	3	388.261	4.149	50	0		GIAAHL
Cc1ccc(Oc2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])cc3)cc2)cc1	ZINC000006623420	570506784	/nfs/dbraw/zinc/50/67/84/570506784.db2.gz	XIBBDHXCILZOTH-UHFFFAOYSA-N	-2	3	383.425	4.286	50	0		GIAAHL
CCCCOc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2)cc1C(C)C	ZINC000011566006	570229549	/nfs/dbraw/zinc/22/95/49/570229549.db2.gz	JBIBJLXORQXJCF-UHFFFAOYSA-N	-2	3	391.489	4.488	50	0		GIAAHL
Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)Nc3ccccc3[O-])c2)c1	ZINC000022024260	570302187	/nfs/dbraw/zinc/30/21/87/570302187.db2.gz	JOTMRVOFJXYXPB-UHFFFAOYSA-N	-2	3	396.468	4.062	50	0		GIAAHL
CCCCCC(=O)Nc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2)ccc1[O-]	ZINC000012735856	570979257	/nfs/dbraw/zinc/97/92/57/570979257.db2.gz	GNXYBEILBOTZJP-UHFFFAOYSA-N	-2	3	396.896	4.365	50	0		GIAAHL
O=C([O-])c1ccc([C@@H]2CC(=O)Nc3c2c(=O)[n-]n3C2CCCCCCC2)cc1	ZINC000071281897	211042839	/nfs/dbraw/zinc/04/28/39/211042839.db2.gz	XIZJOXKYYZSLAD-INIZCTEOSA-N	-2	3	383.448	4.284	50	0		GIAAHL
CCCN(CCC)c1ccc([N-]S(=O)(=O)c2cccc(C)c2)cc1C(=O)[O-]	ZINC000033253509	570861558	/nfs/dbraw/zinc/86/15/58/570861558.db2.gz	AXZYSVBIXABKOX-UHFFFAOYSA-N	-2	3	390.505	4.120	50	0		GIAAHL
CCCCCCOc1ccccc1C(c1c(C)[n-][nH]c1=O)c1c(C)[n-][nH]c1=O	ZINC000019811460	210300627	/nfs/dbraw/zinc/30/06/27/210300627.db2.gz	DCZIEVIGLHGNOE-UHFFFAOYSA-N	-2	3	384.480	4.300	50	0		GIAAHL
Cc1ccc(S(=O)(=O)[N-]c2ccccc2-c2nc3ccccc3c(=O)[n-]2)cc1	ZINC000100038343	570265512	/nfs/dbraw/zinc/26/55/12/570265512.db2.gz	PJUVRKPTCSHXQT-UHFFFAOYSA-N	-2	3	391.452	4.112	50	0		GIAAHL
CCCN(CCC)c1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1C(=O)[O-]	ZINC000033253492	570861223	/nfs/dbraw/zinc/86/12/23/570861223.db2.gz	ZFIAVNDCKIUYNO-UHFFFAOYSA-N	-2	3	390.505	4.120	50	0		GIAAHL
O=C([O-])c1ccc(F)c([N-]S(=O)(=O)c2ccc(C3CCCCC3)cc2)c1	ZINC000012771831	221229620	/nfs/dbraw/zinc/22/96/20/221229620.db2.gz	MAXQOITWWVUMEI-UHFFFAOYSA-N	-2	3	377.437	4.372	50	0		GIAAHL
CCOc1cccc(-c2cc(C(=O)[O-])c3nc(-c4ccccc4)[nH]c3n2)c1[O-]	ZINC000017315764	221383470	/nfs/dbraw/zinc/38/34/70/221383470.db2.gz	OTHIVCAOXCOFPK-UHFFFAOYSA-N	-2	3	375.384	4.094	50	0		GIAAHL
O=C([O-])c1ccccc1-c1ccc(-c2nc3sc4c(c3c(=O)[n-]2)CCCC4)o1	ZINC000001278465	212233342	/nfs/dbraw/zinc/23/33/42/212233342.db2.gz	WLHHTBTXOLTSFW-UHFFFAOYSA-N	-2	3	392.436	4.489	50	0		GIAAHL
CCCCN(C)c1ccc([N-]S(=O)(=O)c2ccc(C)cc2C)c(C(=O)[O-])c1	ZINC000033007263	570619732	/nfs/dbraw/zinc/61/97/32/570619732.db2.gz	VYOUXDMZZKZVGS-UHFFFAOYSA-N	-2	3	390.505	4.039	50	0		GIAAHL
O=C([N-]N=c1nc(-c2ccc(Cl)cc2)c2ccccc2[n-]1)c1cccnc1	ZINC000170614204	570674781	/nfs/dbraw/zinc/67/47/81/570674781.db2.gz	CKGSOIBSMPMDHE-UHFFFAOYSA-N	-2	3	375.819	4.102	50	0		GIAAHL
O=C([O-])[C@]1(c2ccccc2)CC[C@H](/N=C\c2ccc(Br)cc2[O-])C1	ZINC000006996118	570732949	/nfs/dbraw/zinc/73/29/49/570732949.db2.gz	BQLNLGQODZRMBQ-GXOMQTSMSA-N	-2	3	388.261	4.149	50	0		GIAAHL
O=C([O-])c1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)c1	ZINC000003263745	570844610	/nfs/dbraw/zinc/84/46/10/570844610.db2.gz	MKSSVFAWOHOREE-UHFFFAOYSA-N	-2	3	380.636	4.146	50	0		GIAAHL
O=C([O-])c1cccc(Oc2ccc(S(=O)(=O)[N-]c3ccc(F)cc3)cc2)c1	ZINC000009426715	221080719	/nfs/dbraw/zinc/08/07/19/221080719.db2.gz	GNSVEZUINVZXKC-UHFFFAOYSA-N	-2	3	387.388	4.117	50	0		GIAAHL
COC(=O)C[C@H](c1c([O-])cc([O-])c2c(=O)cc(-c3ccccc3)oc21)C(C)C	ZINC000096114491	222381330	/nfs/dbraw/zinc/38/13/30/222381330.db2.gz	IBEOQSSKLWJOMF-AWEZNQCLSA-N	-2	3	382.412	4.174	50	0		GIAAHL
O=C([O-])[C@]1(c2ccccc2)CC[C@@H](/N=C\c2ccc(Br)cc2[O-])C1	ZINC000252594297	570453482	/nfs/dbraw/zinc/45/34/82/570453482.db2.gz	BQLNLGQODZRMBQ-YXYOSGIWSA-N	-2	3	388.261	4.149	50	0		GIAAHL
Cc1ccc(S(=O)(=O)[N-]c2cccc(NC(=O)c3ccccc3[O-])c2)cc1C	ZINC000012769306	221229322	/nfs/dbraw/zinc/22/93/22/221229322.db2.gz	RRRDXSTYLDSHDU-UHFFFAOYSA-N	-2	3	396.468	4.062	50	0		GIAAHL
Cc1ccc(Oc2ccc([N-]S(=O)(=O)c3cccc(C(=O)[O-])c3)cc2)cc1	ZINC000003444759	817456916	/nfs/dbraw/zinc/45/69/16/817456916.db2.gz	SWDNOYFZSAOQBB-UHFFFAOYSA-N	-2	3	383.425	4.286	50	0		GIAAHL
Cc1cc(C(C)(C)C)cc(C)c1S(=O)(=O)[N-]c1ccc(CC(=O)[O-])cc1	ZINC000007974296	221017215	/nfs/dbraw/zinc/01/72/15/221017215.db2.gz	UBFDZYQJDKUOTH-UHFFFAOYSA-N	-2	3	375.490	4.029	50	0		GIAAHL
CCCCN(C)c1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)c(C(=O)[O-])c1	ZINC000033007231	570619988	/nfs/dbraw/zinc/61/99/88/570619988.db2.gz	PXDMHRGWGPSOCT-UHFFFAOYSA-N	-2	3	390.505	4.039	50	0		GIAAHL
CCCCN(CC)c1ccc([N-]S(=O)(=O)c2cccc(C)c2)cc1C(=O)[O-]	ZINC000033253574	570861209	/nfs/dbraw/zinc/86/12/09/570861209.db2.gz	BLFKHHQXJBHTSM-UHFFFAOYSA-N	-2	3	390.505	4.120	50	0		GIAAHL
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(F)ccc2Cl)cc(Cl)c1Cl	ZINC000084344427	571013907	/nfs/dbraw/zinc/01/39/07/571013907.db2.gz	ULPRGKMVZSCMHB-UHFFFAOYSA-N	-2	3	398.626	4.285	50	0		GIAAHL
CCCCCCn1c2ccccc2c([O-])c(-c2nc3ccccc3c(=O)[n-]2)c1=O	ZINC000100504356	222459735	/nfs/dbraw/zinc/45/97/35/222459735.db2.gz	LQTSLACJKILUIQ-UHFFFAOYSA-N	-2	3	389.455	4.191	50	0		GIAAHL
Cc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)Cc2ccccc2-3)cc1C(=O)[O-]	ZINC000013349889	221265944	/nfs/dbraw/zinc/26/59/44/221265944.db2.gz	LRFQYSFTRVKJCF-UHFFFAOYSA-N	-2	3	379.437	4.065	50	0		GIAAHL
O=C([O-])c1ccc(Cl)c(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)c1	ZINC000020255014	570250119	/nfs/dbraw/zinc/25/01/19/570250119.db2.gz	UUYRUEZVHAGNDD-UHFFFAOYSA-N	-2	3	380.636	4.146	50	0		GIAAHL