smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH2+]CCNS(=O)(=O)NC1CC1	160843051	571720359	/nfs/dbraw/zinc/72/03/59/571720359.db2.gz	LUAZKNRBIQVHHI-UHFFFAOYSA-N	1	0	193.272	-1.208	10	70		AAIERO
CNS(=O)(=O)NC[C@H]1CC[NH2+]C1	160929809	571795926	/nfs/dbraw/zinc/79/59/26/571795926.db2.gz	KDAVHALUWDAHGX-LURJTMIESA-N	1	0	193.272	-1.350	10	70		AAIERO
Cc1ccc(N([SiH3])[SiH3])[nH+]c1	584644637	346739696	/nfs/dbraw/zinc/73/96/96/346739696.db2.gz	NCIWBIJJXJAQRS-UHFFFAOYSA-N	1	0	168.348	-1.243	10	70		AAIERO
NC(=[NH2+])NCCn1ccnn1	159611879	344149278	/nfs/dbraw/zinc/14/92/78/344149278.db2.gz	UFPALQFNTSZPQF-UHFFFAOYSA-N	1	0	154.177	-1.239	10	70		AAIERO
[NH3+]CC1NNNN1	218362278	344412058	/nfs/dbraw/zinc/41/20/58/344412058.db2.gz	HTJCWMJXGNLGLL-UHFFFAOYSA-N	1	0	103.129	-2.612	10	70		AAIERO
Cn1cnc(CNC2=[NH+]CCN2)n1	218721483	344415280	/nfs/dbraw/zinc/41/52/80/344415280.db2.gz	KMJULCHOQCCNBO-UHFFFAOYSA-N	1	0	180.215	-1.136	10	70		AAIERO
Cn1cnc(CNC(N)=[NH2+])n1	218721581	344415360	/nfs/dbraw/zinc/41/53/60/344415360.db2.gz	PYCGADOBILLREL-UHFFFAOYSA-N	1	0	154.177	-1.202	10	70		AAIERO
C[C@H](CN(C)C)[NH+]([SiH3])[SiH3]	584607976	346724600	/nfs/dbraw/zinc/72/46/00/346724600.db2.gz	ZIRUCIAJZHTMAF-RXMQYKEDSA-N	1	0	162.385	-2.201	10	70		AAIERO
CN(C)CC[NH+]([SiH3])[SiH3]	584607766	346723894	/nfs/dbraw/zinc/72/38/94/346723894.db2.gz	ARSAPVGSPZVIAL-UHFFFAOYSA-N	1	0	148.358	-2.589	10	70		AAIERO
C[C@@H](CN(C)C)[NH+]([SiH3])[SiH3]	584607977	346724479	/nfs/dbraw/zinc/72/44/79/346724479.db2.gz	ZIRUCIAJZHTMAF-YFKPBYRVSA-N	1	0	162.385	-2.201	10	70		AAIERO
Cc1ccc[nH+]c1N([SiH3])[SiH3]	584608378	346724605	/nfs/dbraw/zinc/72/46/05/346724605.db2.gz	KNBADRVDWUHWFU-UHFFFAOYSA-N	1	0	168.348	-1.243	10	70		AAIERO
C[C@H]1C[NH+]([SiH3])C[C@H](C)N1[SiH3]	584615434	346729253	/nfs/dbraw/zinc/72/92/53/346729253.db2.gz	HMEWCNYJYQYZCO-WDSKDSINSA-N	1	0	174.396	-2.058	10	70		AAIERO
C[C@H]1C[N@H+]([SiH3])C[C@@H](C)N1[SiH3]	584615431	346729407	/nfs/dbraw/zinc/72/94/07/346729407.db2.gz	HMEWCNYJYQYZCO-OLQVQODUSA-N	1	0	174.396	-2.058	10	70		AAIERO
C[C@@H]1C[NH+]([SiH3])C[C@@H](C)N1[SiH3]	584615433	346729463	/nfs/dbraw/zinc/72/94/63/346729463.db2.gz	HMEWCNYJYQYZCO-PHDIDXHHSA-N	1	0	174.396	-2.058	10	70		AAIERO
[SiH3][NH+]([SiH3])Cc1ccccn1	584644612	346739700	/nfs/dbraw/zinc/73/97/00/346739700.db2.gz	JGEWNWYQZBQLOR-UHFFFAOYSA-N	1	0	168.348	-1.556	10	70		AAIERO
[SiH3][NH+]([SiH3])C1CC1	584644639	346739756	/nfs/dbraw/zinc/73/97/56/346739756.db2.gz	NEJQFWFFEPTEDB-UHFFFAOYSA-N	1	0	117.300	-1.988	10	70		AAIERO
Cc1cccc(N([SiH3])[SiH3])[nH+]1	584644620	346739776	/nfs/dbraw/zinc/73/97/76/346739776.db2.gz	KSTJFRCEOUYXPC-UHFFFAOYSA-N	1	0	168.348	-1.243	10	70		AAIERO
[SiH3][NH+]([SiH3])CCc1ccccn1	584644595	346739792	/nfs/dbraw/zinc/73/97/92/346739792.db2.gz	GVAAXHCBFQGCED-UHFFFAOYSA-N	1	0	182.375	-1.513	10	70		AAIERO
[SiH3][SiH2][NH2+]C1CCC1	584644607	346739823	/nfs/dbraw/zinc/73/98/23/346739823.db2.gz	IGPHXHBQHRYLLC-UHFFFAOYSA-N	1	0	131.327	-1.507	10	70		AAIERO
[SiH3][NH+]([SiH3])C1CCCC1	584644585	346740074	/nfs/dbraw/zinc/74/00/74/346740074.db2.gz	FNXNQNDDIUODLQ-UHFFFAOYSA-N	1	0	145.354	-1.208	10	70		AAIERO
Cc1cc[nH+]c(N([SiH3])[SiH3])c1	584644674	346740415	/nfs/dbraw/zinc/74/04/15/346740415.db2.gz	RPVDVHZRHWAFPO-UHFFFAOYSA-N	1	0	168.348	-1.243	10	70		AAIERO
C[C@H](CO)C[NH+](CCO)CCO	160941920	538053731	/nfs/dbraw/zinc/05/37/31/538053731.db2.gz	MPBBJCWBLXUNAC-QMMMGPOBSA-N	1	0	177.244	-1.099	10	70		AAIERO
C[C@@H](CO)C[NH+](CCO)CCO	160942053	538054688	/nfs/dbraw/zinc/05/46/88/538054688.db2.gz	MPBBJCWBLXUNAC-MRVPVSSYSA-N	1	0	177.244	-1.099	10	70		AAIERO