smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CC[N+](C)(C)c1cccc([O-])c1	13586869	166207311	/nfs/dbraw/zinc/20/73/11/166207311.db2.gz	HACXKEPOUOHQGM-UHFFFAOYSA-O	0	3	178.255	2.145	1	30		AEEFHN
CC/C(C)=C1\CC[C@@H](CN(C)C)C1=O	1626175	166659208	/nfs/dbraw/zinc/65/92/08/166659208.db2.gz	JDFJWHJOLFCREU-SPQRFVMMSA-N	0	3	195.306	2.254	1	30		AEEFHN
[NH2+]=C(C[S-])N1CC2CCC(CC2)C1	147267079	169135867	/nfs/dbraw/zinc/13/58/67/169135867.db2.gz	UEESPPMOPAYTCG-UHFFFAOYSA-N	0	3	198.335	2.015	1	30		AEEFHN
CC(C)/C=C1\CC[C@H](CN(C)C)C1=O	1625808	170998944	/nfs/dbraw/zinc/99/89/44/170998944.db2.gz	NDYFREKJASARRR-PFEDMVJOSA-N	0	3	195.306	2.110	1	30		AEEFHN