smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[C@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1C)c1ccc(C)c(C)c1	ZINC000218584978	557208567	/nfs/dbraw/zinc/20/85/67/557208567.db2.gz	ZOWBKVPRUXBCPV-QHCPKHFHSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1C)c1ccc(C)cc1C	ZINC000218585075	557208656	/nfs/dbraw/zinc/20/86/56/557208656.db2.gz	COEKIANPCNTHEV-HSZRJFAPSA-N	-1	1	436.577	5.294	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)N[C@@H](C)c3cc(C)ccc3C)c2C)cc1	ZINC000218585445	557208705	/nfs/dbraw/zinc/20/87/05/557208705.db2.gz	CJKNIAMMEHPXBN-FQEVSTJZSA-N	-1	1	436.577	5.212	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2cc(C(=O)N[C@@H](C)c3ccc(C)c(C)c3)ccc2C)cc1	ZINC000218593836	557209361	/nfs/dbraw/zinc/20/93/61/557209361.db2.gz	ATKGHHXTVFLBIZ-FQEVSTJZSA-N	-1	1	436.577	5.212	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)N[C@@H](C)c3ccc(C)c(C)c3)c2C)cc1	ZINC000218585932	557208584	/nfs/dbraw/zinc/20/85/84/557208584.db2.gz	CCAXGJYTQSHMEQ-FQEVSTJZSA-N	-1	1	436.577	5.212	40	70		IKIBMM
CC[C@H](NC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccccc2)c1)c1ccc(C)c(C)c1	ZINC000218592861	557208904	/nfs/dbraw/zinc/20/89/04/557208904.db2.gz	SNOOAYWKGISGRS-QHCPKHFHSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1)c1ccc(C)cc1C	ZINC000218409348	557197583	/nfs/dbraw/zinc/19/75/83/557197583.db2.gz	DWCBVDOIOXOZJV-DEOSSOPVSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1C)c1ccc(C)c(C)c1	ZINC000218584937	557208621	/nfs/dbraw/zinc/20/86/21/557208621.db2.gz	ZOWBKVPRUXBCPV-HSZRJFAPSA-N	-1	1	436.577	5.294	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)N[C@H](C)c3ccc(C)c(C)c3)c2C)cc1	ZINC000218586007	557209024	/nfs/dbraw/zinc/20/90/24/557209024.db2.gz	CCAXGJYTQSHMEQ-HXUWFJFHSA-N	-1	1	436.577	5.212	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2cc(C(=O)N[C@H](C)c3cc(C)ccc3C)ccc2C)cc1	ZINC000218593449	557209296	/nfs/dbraw/zinc/20/92/96/557209296.db2.gz	LMEVYKYTAQYLLR-HXUWFJFHSA-N	-1	1	436.577	5.212	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N[C@H](C)c3ccc(C)c(C)c3)cc2C)cc1	ZINC000218604020	557209620	/nfs/dbraw/zinc/20/96/20/557209620.db2.gz	FBCGVAGLHMIGMD-HXUWFJFHSA-N	-1	1	436.577	5.212	40	70		IKIBMM
CC[C@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C)cc2)c1)c1ccc(C)c(C)c1	ZINC000218576329	557208349	/nfs/dbraw/zinc/20/83/49/557208349.db2.gz	LNJZNBGCVHWWGJ-DEOSSOPVSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C)cc2)c1)c1ccc(C)cc1C	ZINC000218576412	557208367	/nfs/dbraw/zinc/20/83/67/557208367.db2.gz	VPCSMWAULRHNOM-XMMPIXPASA-N	-1	1	436.577	5.294	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2cc(C(=O)N[C@H](C)c3ccc(C)c(C)c3)ccc2C)cc1	ZINC000218593902	557209243	/nfs/dbraw/zinc/20/92/43/557209243.db2.gz	ATKGHHXTVFLBIZ-HXUWFJFHSA-N	-1	1	436.577	5.212	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2cc(C(=O)N[C@@H](C)c3cc(C)ccc3C)ccc2C)cc1	ZINC000218593365	557209356	/nfs/dbraw/zinc/20/93/56/557209356.db2.gz	LMEVYKYTAQYLLR-FQEVSTJZSA-N	-1	1	436.577	5.212	40	70		IKIBMM
CC[C@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1C)c1ccc(C)cc1C	ZINC000218585147	557208673	/nfs/dbraw/zinc/20/86/73/557208673.db2.gz	COEKIANPCNTHEV-QHCPKHFHSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@@H](NC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccccc2)c1)c1ccc(C)c(C)c1	ZINC000218592811	557208955	/nfs/dbraw/zinc/20/89/55/557208955.db2.gz	SNOOAYWKGISGRS-HSZRJFAPSA-N	-1	1	436.577	5.294	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N[C@@H](C)c3cc(C)ccc3C)cc2C)cc1	ZINC000218603435	557209604	/nfs/dbraw/zinc/20/96/04/557209604.db2.gz	XFHDIPBHEDWIIH-FQEVSTJZSA-N	-1	1	436.577	5.212	40	70		IKIBMM
CC[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)c(C)c1)c1ccc(C)c(C)c1	ZINC000218602872	557209641	/nfs/dbraw/zinc/20/96/41/557209641.db2.gz	BKIOIMHNYCWAHV-HSZRJFAPSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1)c1ccc(C)c(C)c1	ZINC000218409164	557197632	/nfs/dbraw/zinc/19/76/32/557197632.db2.gz	JSMCRKKKMVIZIH-DEOSSOPVSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C)cc2)c1)c1ccc(C)c(C)c1	ZINC000218576257	557208181	/nfs/dbraw/zinc/20/81/81/557208181.db2.gz	LNJZNBGCVHWWGJ-XMMPIXPASA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C)cc2)c1)c1ccc(C)cc1C	ZINC000218576494	557208306	/nfs/dbraw/zinc/20/83/06/557208306.db2.gz	VPCSMWAULRHNOM-DEOSSOPVSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@H](NC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccccc2)c1)c1ccc(C)cc1C	ZINC000218593029	557209051	/nfs/dbraw/zinc/20/90/51/557209051.db2.gz	WRSXRTRDROFPBH-QHCPKHFHSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)c(C)c1)c1ccc(C)cc1C	ZINC000218603113	557209533	/nfs/dbraw/zinc/20/95/33/557209533.db2.gz	CKMBDHMUOFVLER-QHCPKHFHSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)c(C)c1)c1ccc(C)c(C)c1	ZINC000218602949	557209587	/nfs/dbraw/zinc/20/95/87/557209587.db2.gz	BKIOIMHNYCWAHV-QHCPKHFHSA-N	-1	1	436.577	5.294	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N[C@H](C)c3cc(C)ccc3C)cc2C)cc1	ZINC000218603509	557209600	/nfs/dbraw/zinc/20/96/00/557209600.db2.gz	XFHDIPBHEDWIIH-HXUWFJFHSA-N	-1	1	436.577	5.212	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N[C@@H](C)c3ccc(C)c(C)c3)cc2C)cc1	ZINC000218603929	557209734	/nfs/dbraw/zinc/20/97/34/557209734.db2.gz	FBCGVAGLHMIGMD-FQEVSTJZSA-N	-1	1	436.577	5.212	40	70		IKIBMM
CC[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1)c1ccc(C)c(C)c1	ZINC000218409093	557197557	/nfs/dbraw/zinc/19/75/57/557197557.db2.gz	JSMCRKKKMVIZIH-XMMPIXPASA-N	-1	1	436.577	5.294	40	70		IKIBMM
Cc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)N[C@H](C)c3cc(C)ccc3C)c2C)cc1	ZINC000218585524	557208687	/nfs/dbraw/zinc/20/86/87/557208687.db2.gz	CJKNIAMMEHPXBN-HXUWFJFHSA-N	-1	1	436.577	5.212	40	70		IKIBMM
CC[C@@H](NC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccccc2)c1)c1ccc(C)cc1C	ZINC000218592960	557208862	/nfs/dbraw/zinc/20/88/62/557208862.db2.gz	WRSXRTRDROFPBH-HSZRJFAPSA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1)c1ccc(C)cc1C	ZINC000218409257	557197709	/nfs/dbraw/zinc/19/77/09/557197709.db2.gz	DWCBVDOIOXOZJV-XMMPIXPASA-N	-1	1	436.577	5.294	40	70		IKIBMM
CC[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)c(C)c1)c1ccc(C)cc1C	ZINC000218603038	557209572	/nfs/dbraw/zinc/20/95/72/557209572.db2.gz	CKMBDHMUOFVLER-HSZRJFAPSA-N	-1	1	436.577	5.294	40	70		IKIBMM