smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[SiH3]C(c1ccccc1)c1ccccc1	196767283	487012621	/nfs/dbraw/zinc/01/26/21/487012621.db2.gz	LGPQXCREBFMTOH-UHFFFAOYSA-N	0	0	198.341	2.141	40	70		AEIBRN
C=Cc1ccc(OC2COC2)cc1	217802489	166222657	/nfs/dbraw/zinc/22/26/57/166222657.db2.gz	LPBYDTGHLFEXGE-UHFFFAOYSA-N	0	0	176.215	2.107	40	70		AEIBRN
CC(=O)c1ccoc1C(F)F	217644239	166331429	/nfs/dbraw/zinc/33/14/29/166331429.db2.gz	YYQXRIUTLHEWNN-UHFFFAOYSA-N	0	0	160.119	2.420	40	70		AEIBRN
CCCCCCCC[SiH3]	195763119	166851251	/nfs/dbraw/zinc/85/12/51/166851251.db2.gz	FPLYNRPOIZEADP-UHFFFAOYSA-N	0	0	144.334	2.131	40	70		AEIBRN
CCOC(=O)c1ccoc1C(F)F	217645319	167371668	/nfs/dbraw/zinc/37/16/68/167371668.db2.gz	WWTWLMIQJIRDDN-UHFFFAOYSA-N	0	0	190.145	2.394	40	70		AEIBRN
COC(=O)c1cccn1C1CCCC1	217654663	168134056	/nfs/dbraw/zinc/13/40/56/168134056.db2.gz	SISDPDOFADTWSD-UHFFFAOYSA-N	0	0	193.246	2.390	40	70		AEIBRN
CSc1ccc(C(F)(F)F)nn1	217608972	168311292	/nfs/dbraw/zinc/31/12/92/168311292.db2.gz	GKJAKTIVJAVREC-UHFFFAOYSA-N	0	0	194.181	2.217	40	70		AEIBRN
CSc1ncncc1C(F)(F)F	218729096	168316308	/nfs/dbraw/zinc/31/63/08/168316308.db2.gz	NZDNDIQFHGBSMY-UHFFFAOYSA-N	0	0	194.181	2.217	40	70		AEIBRN
Cn1cnc2c1CCCCCC2	217717843	169055410	/nfs/dbraw/zinc/05/54/10/169055410.db2.gz	LRNZPYKREXZZHY-UHFFFAOYSA-N	0	0	164.252	2.079	40	70		AEIBRN
Fc1nc2c(s1)CCCC2	217717586	169090189	/nfs/dbraw/zinc/09/01/89/169090189.db2.gz	STNTYNMAOVAJRO-UHFFFAOYSA-N	0	0	157.213	2.161	40	70		AEIBRN
C[SiH](C)C#CCOc1ccccc1	195819506	171200167	/nfs/dbraw/zinc/20/01/67/171200167.db2.gz	BVCUYSLPUOGDQI-UHFFFAOYSA-N	0	0	190.318	2.095	40	70		AEIBRN
CC1=NS(=O)(=O)c2ccccc2C1	218688701	344415191	/nfs/dbraw/zinc/41/51/91/344415191.db2.gz	IJAPKDZITDRQQQ-UHFFFAOYSA-N	0	0	195.243	2.361	40	70		AEIBRN
Fc1cnc(NCC2CC2)c(F)c1	160369187	344163692	/nfs/dbraw/zinc/16/36/92/344163692.db2.gz	ADXSJFHIXYJSFF-UHFFFAOYSA-N	0	0	184.189	2.182	40	70		AEIBRN
Fc1cnc(NCC(F)F)c(F)c1	160375716	344163768	/nfs/dbraw/zinc/16/37/68/344163768.db2.gz	AMMRVQMFSRIYLR-UHFFFAOYSA-N	0	0	194.131	2.037	40	70		AEIBRN
Fc1cnc(NC2CCC2)c(F)c1	160372955	344163952	/nfs/dbraw/zinc/16/39/52/344163952.db2.gz	KXEHWXUEKYCEAD-UHFFFAOYSA-N	0	0	184.189	2.324	40	70		AEIBRN
CC(C)CNc1ncc(F)cc1F	160368467	344164080	/nfs/dbraw/zinc/16/40/80/344164080.db2.gz	FFJSNUMZTHCPSC-UHFFFAOYSA-N	0	0	186.205	2.428	40	70		AEIBRN
CCCCn1c(C)cc(CO)c1C	161237075	344187762	/nfs/dbraw/zinc/18/77/62/344187762.db2.gz	XBFJHWQXSDJTHD-UHFFFAOYSA-N	0	0	181.279	2.397	40	70		AEIBRN
CC(=O)c1cc(C)c(F)cc1O	217519833	344402215	/nfs/dbraw/zinc/40/22/15/344402215.db2.gz	ZGIBRDBRUICKID-UHFFFAOYSA-N	0	0	168.167	2.042	40	70	in-vitro	AEIBRN
CC(C)n1cc(NC2=NCCC2)cn1	217802730	344406600	/nfs/dbraw/zinc/40/66/00/344406600.db2.gz	AYDUCZAEBKLTAK-UHFFFAOYSA-N	0	0	192.266	2.068	40	70		AEIBRN
CCCCCCCC[SiH2]	604936647	346966721	/nfs/dbraw/zinc/96/67/21/346966721.db2.gz	FULQYUYRHAMPTQ-UHFFFAOYSA-N	0	0	143.326	2.398	40	70		AEIBRN