smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOc1ccc(-n2c(C)cc([C@@H]3NC[C@H](C(=O)[O-])S3)c2C)cc1	ZINC000408977433	457591548	/nfs/dbraw/zinc/59/15/48/457591548.db2.gz	IXIHXDRPUPBPJJ-IAGOWNOFSA-N	-1	1	346.452	3.281	40	10		EGCBMM
O=C1[N-]C(=S)S/C1=C/c1c(Cl)ccc([N+](=O)[O-])c1Cl	ZINC000113830413	454935884	/nfs/dbraw/zinc/93/58/84/454935884.db2.gz	AXBYXXFHRYXDHJ-XVNBXDOJSA-N	-1	1	335.193	3.390	40	10		EGCBMM
COc1ccc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)c2ccccc12	ZINC000409399634	457598540	/nfs/dbraw/zinc/59/85/40/457598540.db2.gz	KYFJYZMPPCVWQS-AQTBWJFISA-N	-1	1	344.370	3.310	40	10		EGCBMM
O=C1[N-]C(=S)S/C1=C\c1csc(COc2ccccc2)n1	ZINC000060421410	454288797	/nfs/dbraw/zinc/28/87/97/454288797.db2.gz	CIIAQYPYMYQREE-WDZFZDKYSA-N	-1	1	334.447	3.211	40	10		EGCBMM
CCc1cccc(C)c1-n1c(C)cc(/C=C2/NC(=S)[N-]C2=O)c1C	ZINC000408961616	457590456	/nfs/dbraw/zinc/59/04/56/457590456.db2.gz	TWSFXBYASILCNZ-MHWRWJLKSA-N	-1	1	339.464	3.310	40	10		EGCBMM
Cc1ccc(N2[N-]C(=O)/C(=C\c3c[nH]c4ccccc34)C2=O)c(C)c1	ZINC000059475176	454260650	/nfs/dbraw/zinc/26/06/50/454260650.db2.gz	CREDKCZVHJXYJP-MHWRWJLKSA-N	-1	1	331.375	3.246	40	10		EGCBMM
CCn1c(C)c(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)c2ccccc21	ZINC000409399614	457598764	/nfs/dbraw/zinc/59/87/64/457598764.db2.gz	KTHXRQKNHRDCQQ-AQTBWJFISA-N	-1	1	345.402	3.431	40	10		EGCBMM
O=C(Nc1cc(=O)n(-c2ccccc2)[n-]1)Nc1cccc(Cl)c1	ZINC000005603864	452888485	/nfs/dbraw/zinc/88/84/85/452888485.db2.gz	UMSUUXSWOUYAFX-UHFFFAOYSA-N	-1	1	328.759	3.212	40	10		EGCBMM
O=C1[N-]C(=S)S/C1=C/c1cc(Cc2ccccc2)ccc1O	ZINC000005774006	452902027	/nfs/dbraw/zinc/90/20/27/452902027.db2.gz	JVPGFWFHYFCALR-XNTDXEJSSA-N	-1	1	327.430	3.472	40	10		EGCBMM
Nc1ccc2nc(SCC(=O)c3ccc([O-])c(O)c3)sc2c1	ZINC000059417640	454259234	/nfs/dbraw/zinc/25/92/34/454259234.db2.gz	VVDRRPUUNGUOEB-UHFFFAOYSA-N	-1	1	332.406	3.265	40	10		EGCBMM
CCc1ccc(N2[N-]C(=O)/C(=C/c3ccc(N(C)CC)cc3)C2=O)cc1	ZINC000005586100	452886755	/nfs/dbraw/zinc/88/67/55/452886755.db2.gz	WHLBGXOVNWKTHX-RGEXLXHISA-N	-1	1	349.434	3.167	40	10		EGCBMM
O=C1[N-]C(=S)S/C1=C/c1ccc(-c2ccc3c(c2)C(=O)OC3)o1	ZINC000005771042	452902515	/nfs/dbraw/zinc/90/25/15/452902515.db2.gz	IFFQWKPCNLXIGN-AWNIVKPZSA-N	-1	1	343.385	3.106	40	10		EGCBMM
CCN(CC)c1ccc(/C=C2/C(=O)[N-]N(c3ccc(C)cc3)C2=O)cc1	ZINC000032099428	453864491	/nfs/dbraw/zinc/86/44/91/453864491.db2.gz	BCJIEYZMVXAMKO-RGEXLXHISA-N	-1	1	349.434	3.303	40	10		EGCBMM
Cc1cc([C@H]2NC[C@@H](C(=O)[O-])S2)c(C)n1-c1cccc(C)c1C	ZINC000408975676	257884342	/nfs/dbraw/zinc/88/43/42/257884342.db2.gz	BZVGACCHQHAJFE-IRXDYDNUSA-N	-1	1	330.453	3.499	40	10		EGCBMM
O=C(Nc1cc(=O)n(-c2ccccc2)[n-]1)Nc1ccc(Cl)cc1	ZINC000006927531	258052314	/nfs/dbraw/zinc/05/23/14/258052314.db2.gz	DEDSKRGBBXDWQI-UHFFFAOYSA-N	-1	1	328.759	3.212	40	10		EGCBMM
Cc1cc([C@@H]2NC[C@H](C(=O)[O-])S2)c(C)n1-c1cccc(C)c1C	ZINC000408975675	457590772	/nfs/dbraw/zinc/59/07/72/457590772.db2.gz	BZVGACCHQHAJFE-IAGOWNOFSA-N	-1	1	330.453	3.499	40	10		EGCBMM
CCOc1ccc(-n2c(C)cc([C@H]3NC[C@H](C(=O)[O-])S3)c2C)cc1	ZINC000408977550	257884324	/nfs/dbraw/zinc/88/43/24/257884324.db2.gz	IXIHXDRPUPBPJJ-SJORKVTESA-N	-1	1	346.452	3.281	40	10		EGCBMM
Cc1cc([C@@H]2NC[C@@H](C(=O)[O-])S2)c(C)n1-c1cccc(C)c1C	ZINC000408975674	457591619	/nfs/dbraw/zinc/59/16/19/457591619.db2.gz	BZVGACCHQHAJFE-DLBZAZTESA-N	-1	1	330.453	3.499	40	10		EGCBMM
CC(C)Oc1ccc2ccccc2c1/C=C1/C(=O)[N-]C(=S)NC1=O	ZINC000075286861	453876209	/nfs/dbraw/zinc/87/62/09/453876209.db2.gz	NJDCVRPJXYJBTM-UHFFFAOYSA-N	-1	1	340.404	3.382	40	10		EGCBMM
CC(C)Oc1ccc2ccccc2c1/C=C1\C(=O)[N-]C(=S)NC1=O	ZINC000075286861	453876210	/nfs/dbraw/zinc/87/62/10/453876210.db2.gz	NJDCVRPJXYJBTM-UHFFFAOYSA-N	-1	1	340.404	3.382	40	10		EGCBMM
CC(C)Oc1ccc2ccccc2c1C=C1C(=O)[N-]C(=S)NC1=O	ZINC000075286861	453876213	/nfs/dbraw/zinc/87/62/13/453876213.db2.gz	NJDCVRPJXYJBTM-UHFFFAOYSA-N	-1	1	340.404	3.382	40	10		EGCBMM
O=C1[N-]N(c2ccccc2)C(=O)/C1=C\c1cccn1-c1ccc(F)cc1	ZINC000108978563	454818264	/nfs/dbraw/zinc/81/82/64/454818264.db2.gz	JWGRXYCXXPQBHI-AQTBWJFISA-N	-1	1	347.349	3.078	40	10		EGCBMM
Cc1cc([C@H]2NC[C@H](C(=O)[O-])S2)c(C)n1-c1cccc(C)c1C	ZINC000408975677	257884556	/nfs/dbraw/zinc/88/45/56/257884556.db2.gz	BZVGACCHQHAJFE-SJORKVTESA-N	-1	1	330.453	3.499	40	10		EGCBMM
CC(C)Cn1cc(C=C2C(=O)[N-]C(=S)N(C)C2=O)c2ccccc21	ZINC000033316376	453913781	/nfs/dbraw/zinc/91/37/81/453913781.db2.gz	YRMJJPSZSLNNKP-ZSOIEALJSA-N	-1	1	341.436	3.394	40	10		EGCBMM
CCc1cccc2c(C=C3C(=O)[N-]C(=S)N(CC)C3=O)c[nH]c21	ZINC000033899430	453918191	/nfs/dbraw/zinc/91/81/91/453918191.db2.gz	URSOZQXCJLVBHE-MDWZMJQESA-N	-1	1	327.409	3.217	40	10		EGCBMM
O=C1[N-]C(=S)NC(=O)C1=Cc1ccc(-c2cccc3ccccc32)o1	ZINC000096193577	1292949077	/nfs/dbraw/zinc/94/90/77/1292949077.db2.gz	IIXBMZLLIXFZON-UHFFFAOYSA-N	-1	1	348.383	3.014	40	10		EGCBMM
CCc1ccc(-n2c(C)cc(/C=C3/NC(=S)[N-]C3=O)c2C)cc1	ZINC000000448577	452595031	/nfs/dbraw/zinc/59/50/31/452595031.db2.gz	LMFPXHZGEJPJRE-MHWRWJLKSA-N	-1	1	325.437	3.002	40	10		EGCBMM
CCCn1cc(C=C2C(=O)[N-]C(=S)N(C)C2=O)c2ccccc21	ZINC000033323070	1291386159	/nfs/dbraw/zinc/38/61/59/1291386159.db2.gz	RMOMGVYULXTJLO-LCYFTJDESA-N	-1	1	327.409	3.148	40	10		EGCBMM
COc1cc(C=C2SC(=S)[N-]C2=O)c(Br)cc1O	ZINC000002536833	452705119	/nfs/dbraw/zinc/70/51/19/452705119.db2.gz	JCDPWNPKKOXLAE-YCRREMRBSA-N	-1	1	346.227	3.063	40	10		EGCBMM
CCN1C(=O)/C(=C\c2ccc([O-])c(Br)c2)SC1=S	ZINC000005201159	452846733	/nfs/dbraw/zinc/84/67/33/452846733.db2.gz	SAFMAIWKWKCBCB-UXBLZVDNSA-N	-1	1	344.255	3.376	40	10		EGCBMM
O=C1[N-]N(c2ccccc2)C(=O)/C1=C/c1c(O)ccc2ccccc21	ZINC000027902646	453821234	/nfs/dbraw/zinc/82/12/34/453821234.db2.gz	BMWORLVHZYMOLL-SFQUDFHCSA-N	-1	1	330.343	3.007	40	10		EGCBMM
CC(C)(C)Oc1cccc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)c1	ZINC000107823963	454774617	/nfs/dbraw/zinc/77/46/17/454774617.db2.gz	QBFSOJIOVVBNOS-LGMDPLHJSA-N	-1	1	336.391	3.325	40	10		EGCBMM
O=C(c1ccccc1)c1cccc(NC=C2SC(=S)[N-]C2=O)c1	ZINC000090450624	454307083	/nfs/dbraw/zinc/30/70/83/454307083.db2.gz	PLIXJRSVSDXJGF-GXDHUFHOSA-N	-1	1	340.429	3.319	40	10		EGCBMM
CN(C)c1ccc(CNn2c(=S)[n-]nc2-c2ccccc2)cc1	ZINC000007365395	453063150	/nfs/dbraw/zinc/06/31/50/453063150.db2.gz	WLVJWBHANKLVRF-UHFFFAOYSA-N	-1	1	325.441	3.417	40	10		EGCBMM
CCOc1ccc(-n2c(C)cc([C@H]3NC[C@@H](C(=O)[O-])S3)c2C)cc1	ZINC000408977547	457591606	/nfs/dbraw/zinc/59/16/06/457591606.db2.gz	IXIHXDRPUPBPJJ-IRXDYDNUSA-N	-1	1	346.452	3.281	40	10		EGCBMM
Cc1cc(N2CCCC2)ccc1/C=C1/C(=O)[N-]N(c2ccccc2)C1=O	ZINC000409400506	457598034	/nfs/dbraw/zinc/59/80/34/457598034.db2.gz	SAGJXGJBPVOSLD-RGEXLXHISA-N	-1	1	347.418	3.057	40	10		EGCBMM
Cc1cc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)ccc1N1CCCC1	ZINC000033450419	453915040	/nfs/dbraw/zinc/91/50/40/453915040.db2.gz	GWPGADOBERVGBH-JXAWBTAJSA-N	-1	1	347.418	3.057	40	10		EGCBMM
Cc1cc(/C=C2/NC(=S)[N-]C2=O)c(C)n1-c1ccc(F)c(Cl)c1	ZINC000408818770	457588619	/nfs/dbraw/zinc/58/86/19/457588619.db2.gz	YVWIGSGORCZACO-MKMNVTDBSA-N	-1	1	349.818	3.232	40	10		EGCBMM
CCOc1ccc(C=C2C(=O)[N-]C(=S)N(C)C2=O)c2ccccc12	ZINC000033326333	453914367	/nfs/dbraw/zinc/91/43/67/453914367.db2.gz	SZCDSZKUVUODLE-UVTDQMKNSA-N	-1	1	340.404	3.335	40	10		EGCBMM
O=C1[N-]N(c2ccccc2)C(=O)/C1=C\c1cccn1-c1ccccc1F	ZINC000107937016	454776827	/nfs/dbraw/zinc/77/68/27/454776827.db2.gz	LKWSZKLDUYYHPL-SSZFMOIBSA-N	-1	1	347.349	3.078	40	10		EGCBMM
CCN(CC)c1ccc(C=C2C(=O)[N-]C(=S)N(CC)C2=O)cc1	ZINC000005823047	257867414	/nfs/dbraw/zinc/86/74/14/257867414.db2.gz	PKYAYTAPOLHRLG-SDNWHVSQSA-N	-1	1	331.441	3.020	40	10		EGCBMM
CN1C(=O)/C(=C/c2c3ccccc3cc3ccccc23)C(=O)[N-]C1=S	ZINC000408913192	457590413	/nfs/dbraw/zinc/59/04/13/457590413.db2.gz	UBZLDNNNVWWAKY-GZTJUZNOSA-N	-1	1	346.411	3.250	40	10		EGCBMM
CCN(Cc1ccccc1)c1ccc(/C=C2\NC(=S)[N-]C2=O)cc1	ZINC000013146262	211529868	/nfs/dbraw/zinc/52/98/68/211529868.db2.gz	NSQFHEKUVDCOHL-ATVHPVEESA-N	-1	1	337.448	3.058	40	10		EGCBMM
CC[C@@H](C)Oc1cccc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)c1	ZINC000107823946	454774767	/nfs/dbraw/zinc/77/47/67/454774767.db2.gz	MWACASQZRLSBCA-VVTMIQRTSA-N	-1	1	336.391	3.325	40	10		EGCBMM
CC(C)(C)Oc1ccccc1/C=C1/C(=O)[N-]N(c2ccccc2)C1=O	ZINC000033620828	453915937	/nfs/dbraw/zinc/91/59/37/453915937.db2.gz	UKSPLPQGZFXGNW-SSZFMOIBSA-N	-1	1	336.391	3.325	40	10		EGCBMM
CCc1ccccc1-n1c(C)cc(/C=C2/NC(=S)[N-]C2=O)c1C	ZINC000408965400	457589557	/nfs/dbraw/zinc/58/95/57/457589557.db2.gz	GWPPIUIKFNSJOL-XNTDXEJSSA-N	-1	1	325.437	3.002	40	10		EGCBMM
O=S(=O)([N-]c1ccc(O)cc1)c1ccc2c3c(cccc31)CC2	ZINC000226861735	205160430	/nfs/dbraw/zinc/16/04/30/205160430.db2.gz	NHKRQGJEJKXVIO-UHFFFAOYSA-N	-1	1	325.389	3.445	40	10		EGCBMM
Cc1nn(Cc2ccccc2)c(Cl)c1C=C1SC(=S)[N-]C1=O	ZINC000007740627	453111458	/nfs/dbraw/zinc/11/14/58/453111458.db2.gz	NCUZIMSXSCARRO-GHXNOFRVSA-N	-1	1	349.868	3.382	40	10		EGCBMM
CC[C@H](C)Oc1ccccc1/C=C1/C(=O)[N-]N(c2ccccc2)C1=O	ZINC000409400957	457598384	/nfs/dbraw/zinc/59/83/84/457598384.db2.gz	WLJFUQYSGDIZLX-ZSRMJVKVSA-N	-1	1	336.391	3.325	40	10		EGCBMM
Cc1cc(/C=C2/NC(=S)[N-]C2=O)c(C)n1-c1ccc(Cl)cc1	ZINC000000447615	206241093	/nfs/dbraw/zinc/24/10/93/206241093.db2.gz	CRQIQBOXJOFFDR-RIYZIHGNSA-N	-1	1	331.828	3.093	40	10		EGCBMM
CC(C)COc1ccccc1/C=C1/C(=O)[N-]N(c2ccccc2)C1=O	ZINC000408599118	257894769	/nfs/dbraw/zinc/89/47/69/257894769.db2.gz	FCAAIJXHQDALDN-ATVHPVEESA-N	-1	1	336.391	3.183	40	10		EGCBMM
CC[C@@H](C)Oc1ccccc1/C=C1/C(=O)[N-]N(c2ccccc2)C1=O	ZINC000409400956	457598589	/nfs/dbraw/zinc/59/85/89/457598589.db2.gz	WLJFUQYSGDIZLX-CPZHOGDASA-N	-1	1	336.391	3.325	40	10		EGCBMM
CC1=NN(C(=O)c2ccccc2)C(=O)/C1=C/c1ccc([O-])c(Cl)c1	ZINC000408942872	457590119	/nfs/dbraw/zinc/59/01/19/457590119.db2.gz	RBNFFNUBODYREQ-NTEUORMPSA-N	-1	1	340.766	3.488	40	10		EGCBMM
CCOc1cc(C=C2SC(=S)[N-]C2=O)ccc1OC(F)F	ZINC000020607882	212154281	/nfs/dbraw/zinc/15/42/81/212154281.db2.gz	XRVFEZFBWUYQRE-POHAHGRESA-N	-1	1	331.365	3.176	40	10		EGCBMM
CCC(=O)N1N=C(c2cccs2)C[C@H]1c1ccc([N+](=O)[O-])cc1[O-]	ZINC000009781645	211124683	/nfs/dbraw/zinc/12/46/83/211124683.db2.gz	FPEKMGJZMRNHLS-ZDUSSCGKSA-N	-1	1	345.380	3.450	40	10		EGCBMM
O=C1[N-]C(=S)S/C1=C/c1cc([N+](=O)[O-])c(Cl)cc1Cl	ZINC000006239989	452926515	/nfs/dbraw/zinc/92/65/15/452926515.db2.gz	ASNNRGKTLSIJDV-KRXBUXKQSA-N	-1	1	335.193	3.390	40	10		EGCBMM
Cc1cc(C=C2SC(=O)[N-]C2=O)c(C)n1-c1ccc([N+](=O)[O-])cc1	ZINC000113834830	454936159	/nfs/dbraw/zinc/93/61/59/454936159.db2.gz	LFMQFDGTQXPFSG-RIYZIHGNSA-N	-1	1	343.364	3.326	40	10		EGCBMM
CCOc1cc(C=C2SC(=S)[N-]C2=O)cc(Cl)c1OC	ZINC000006209264	257866854	/nfs/dbraw/zinc/86/68/54/257866854.db2.gz	YQTIXMHXMBSTDN-POHAHGRESA-N	-1	1	329.830	3.236	40	10		EGCBMM
CCn1cc(C=C2C(=O)[N-]C(=S)N(CC)C2=O)c2ccccc21	ZINC000033323688	1291386521	/nfs/dbraw/zinc/38/65/21/1291386521.db2.gz	AXMUDWARPFOUQA-LCYFTJDESA-N	-1	1	327.409	3.148	40	10		EGCBMM
O=C1[N-]C(=S)S/C1=C/c1c[nH]c2ccc(Br)cc12	ZINC000017163009	453630191	/nfs/dbraw/zinc/63/01/91/453630191.db2.gz	NMPUBLCCXWRDAV-XCVCLJGOSA-N	-1	1	339.239	3.419	40	10		EGCBMM
Cc1cccc(-n2cccc2/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)c1	ZINC000033722103	453916255	/nfs/dbraw/zinc/91/62/55/453916255.db2.gz	CSXYFXJPYTZHDB-RGEXLXHISA-N	-1	1	343.386	3.247	40	10		EGCBMM
O=C1[N-]N(c2ccccc2)C(=O)/C1=C/c1ccc(N2CCCCC2)cc1	ZINC000000340238	452565581	/nfs/dbraw/zinc/56/55/81/452565581.db2.gz	HPECCBUHLXJVOT-XDJHFCHBSA-N	-1	1	347.418	3.138	40	10		EGCBMM
Cc1ccccc1-n1cccc1/C=C1/C(=O)[N-]N(c2ccccc2)C1=O	ZINC000108920425	454816587	/nfs/dbraw/zinc/81/65/87/454816587.db2.gz	WCGFQUHREWWJPL-JXAWBTAJSA-N	-1	1	343.386	3.247	40	10		EGCBMM
Cc1nn(Cc2ccccc2)c(C)c1C=C1SC(=S)[N-]C1=O	ZINC000006626393	452960346	/nfs/dbraw/zinc/96/03/46/452960346.db2.gz	PDPVASXFFNSJSJ-ZSOIEALJSA-N	-1	1	329.450	3.037	40	10		EGCBMM
CCOc1ccc(-n2c(C)cc([C@@H]3NC[C@@H](C(=O)[O-])S3)c2C)cc1	ZINC000408977430	457590790	/nfs/dbraw/zinc/59/07/90/457590790.db2.gz	IXIHXDRPUPBPJJ-DLBZAZTESA-N	-1	1	346.452	3.281	40	10		EGCBMM
O=C1[N-]N(c2ccccc2)C(=O)/C1=C\c1c(O)ccc2ccccc21	ZINC000005519413	452880424	/nfs/dbraw/zinc/88/04/24/452880424.db2.gz	BMWORLVHZYMOLL-ATVHPVEESA-N	-1	1	330.343	3.007	40	10		EGCBMM
CC1=NN(c2ccc(C)cc2)C(=O)C1=CNc1ccc(C(=O)[O-])cc1	ZINC000101148991	219117984	/nfs/dbraw/zinc/11/79/84/219117984.db2.gz	RTRFZZGWYCUYAR-GZTJUZNOSA-N	-1	1	335.363	3.412	40	10		EGCBMM
Cc1[nH]n(-c2ccc(C)cc2)c(=O)c1C=Nc1ccc(C(=O)[O-])cc1	ZINC000101148991	219117987	/nfs/dbraw/zinc/11/79/87/219117987.db2.gz	RTRFZZGWYCUYAR-GZTJUZNOSA-N	-1	1	335.363	3.412	40	10		EGCBMM
CC[C@H](C)Oc1cccc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)c1	ZINC000107823954	454774997	/nfs/dbraw/zinc/77/49/97/454774997.db2.gz	MWACASQZRLSBCA-RVAQLADHSA-N	-1	1	336.391	3.325	40	10		EGCBMM
CCC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccc([N+](=O)[O-])cc1[O-]	ZINC000009781646	211124043	/nfs/dbraw/zinc/12/40/43/211124043.db2.gz	FPEKMGJZMRNHLS-CYBMUJFWSA-N	-1	1	345.380	3.450	40	10		EGCBMM
Cc1cc(/C=C2\NC(=S)[N-]C2=O)c(C)n1-c1ccc(C)c(C)c1	ZINC000015723885	453583084	/nfs/dbraw/zinc/58/30/84/453583084.db2.gz	DYTIONWLDVSGHI-SXGWCWSVSA-N	-1	1	325.437	3.056	40	10		EGCBMM
Cc1ccc(-n2cccc2/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)cc1	ZINC000107786971	454773321	/nfs/dbraw/zinc/77/33/21/454773321.db2.gz	MQPOOSYZFQFFDO-RGEXLXHISA-N	-1	1	343.386	3.247	40	10		EGCBMM
CCn1cc(C=C2C(=O)[N-]C(=S)N(C3CC3)C2=O)c2ccccc21	ZINC000033323694	1291386454	/nfs/dbraw/zinc/38/64/54/1291386454.db2.gz	LSZHJNPLNWYYMK-ZROIWOOFSA-N	-1	1	339.420	3.291	40	10		EGCBMM
CCOc1cccc(C=C2SC(=S)[N-]C2=O)c1OC(F)F	ZINC000007155230	453036777	/nfs/dbraw/zinc/03/67/77/453036777.db2.gz	AFMDDRNNLISKGZ-TWGQIWQCSA-N	-1	1	331.365	3.176	40	10		EGCBMM
COc1ccc2ccccc2c1/C=C1/C(=O)[N-]N(c2ccccc2)C1=O	ZINC000208738408	456018563	/nfs/dbraw/zinc/01/85/63/456018563.db2.gz	GKVFGVXDPGVAAF-AQTBWJFISA-N	-1	1	344.370	3.310	40	10		EGCBMM
C=CCn1cc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)c2ccccc21	ZINC000033388476	453914810	/nfs/dbraw/zinc/91/48/10/453914810.db2.gz	HKUPXRQMBZETSS-AQTBWJFISA-N	-1	1	343.386	3.289	40	10		EGCBMM
CCCc1cc2c(=O)c(-c3ccon3)coc2c(CN(C)C)c1[O-]	ZINC000000486191	452605336	/nfs/dbraw/zinc/60/53/36/452605336.db2.gz	JKUCAQAXBWPUGV-UHFFFAOYSA-N	-1	1	328.368	3.168	40	10	biogenic	EGCBMM