smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+](C)C[C@@H]1CCN(C/C=C\CN2CC[C@H](C[NH+](C)C)C2)C1	ZINC000255766853	407477096	/nfs/dbraw/zinc/47/70/96/407477096.db2.gz	DHEFQRREMAUHFQ-SPCWZHTESA-N	2	3	308.514	1.310	10	0		DDAEHP
CCC(N)(CC)C(=O)N(CCC[NH+](C)C)CCC[NH+](C)C	ZINC000094244848	193354637	/nfs/dbraw/zinc/35/46/37/193354637.db2.gz	KJNOQIBAQQSTOP-UHFFFAOYSA-N	2	3	300.491	1.236	10	0		DDAEHP
CN(C)Cc1ccc2c(c1)[C@@H](C[NH3+])N(CCCC[NH+](C)C)C2	ZINC000071683827	191006993	/nfs/dbraw/zinc/00/69/93/191006993.db2.gz	VCFPIIUWXPQTJX-GOSISDBHSA-N	2	3	304.482	1.905	10	0		DDAEHP
CN(C)Cc1ccc2c(c1)[C@H](C[NH3+])N(CCCC[NH+](C)C)C2	ZINC000071683826	191006845	/nfs/dbraw/zinc/00/68/45/191006845.db2.gz	VCFPIIUWXPQTJX-SFHVURJKSA-N	2	3	304.482	1.905	10	0		DDAEHP
[NH3+]C1CCC([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CC1	ZINC000397507864	302355179	/nfs/dbraw/zinc/35/51/79/302355179.db2.gz	KMKZNYVCFVBYAM-UHFFFAOYSA-N	2	3	317.477	1.873	10	0		DDAEHP
C[NH+](C)C[C@@H]1CCN(C/C=C/CN2CC[C@H](C[NH+](C)C)C2)C1	ZINC000114480311	407582680	/nfs/dbraw/zinc/58/26/80/407582680.db2.gz	DHEFQRREMAUHFQ-FBLDJFESSA-N	2	3	308.514	1.310	10	0		DDAEHP
C(CN1CCN(CCC2CC[NH2+]CC2)CC1)C1CC[NH2+]CC1	ZINC000584647059	422301309	/nfs/dbraw/zinc/30/13/09/422301309.db2.gz	AUKDXQRYGNSJGT-UHFFFAOYSA-N	2	3	308.514	1.383	10	0		DDAEHP