smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[NH+](CC)Cc1c(C)cccc1O	1688778	167171643	/nfs/dbraw/zinc/17/16/43/167171643.db2.gz	RONQOEJQZJMXTQ-UHFFFAOYSA-N	1	0	193.290	2.542	40	10		AFCBRO
C[C@@H]([NH3+])c1ccc2ccccc2c1O	6494379	168370519	/nfs/dbraw/zinc/37/05/19/168370519.db2.gz	QTHAZKYGFXXDAK-MRVPVSSYSA-N	1	0	187.242	2.565	40	10		AFCBRO
Nc1ccc2c3c(cccc13)C(=[NH2+])C=C2	4466584	169143140	/nfs/dbraw/zinc/14/31/40/169143140.db2.gz	IPXJBIPEQODDPF-UHFFFAOYSA-N	1	0	194.237	2.817	40	10		AFCBRO
[NH3+]Cc1cc(-c2ccccc2)ccc1O	6116703	169218415	/nfs/dbraw/zinc/21/84/15/169218415.db2.gz	YXUWHBIKMQIEJR-UHFFFAOYSA-N	1	0	199.253	2.518	40	10		AFCBRO
C[C@H]([NH3+])c1ccc2ccccc2c1O	1594247	342949828	/nfs/dbraw/zinc/94/98/28/342949828.db2.gz	QTHAZKYGFXXDAK-QMMMGPOBSA-N	1	0	187.242	2.565	40	10		AFCBRO
N#[N+]C1=C2C=CCC=C2c2ccccc21	5045893	351336530	/nfs/dbraw/zinc/33/65/30/351336530.db2.gz	LOBSPZHDUJUOES-UHFFFAOYSA-N	1	0	192.221	2.734	40	10		AFCBRO
C[C@H]1CC[C@@H](C)N1c1ccc(N)cc1	17957880	351384260	/nfs/dbraw/zinc/38/42/60/351384260.db2.gz	GMYNCBGKCCBWLC-AOOOYVTPSA-N	1	0	190.290	2.646	40	10		AFCBRO