smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#Cc1ccc2c(c1)CCCC[C@@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1	ZINC000481934180	568192993	/nfs/dbraw/zinc/19/29/93/568192993.db2.gz	RMQVCELEICTLDW-DEOSSOPVSA-N	2	0	359.517	4.711	20	30		FJEDRP
CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000481916496	568182624	/nfs/dbraw/zinc/18/26/24/568182624.db2.gz	GGAQDTUHSNSCJI-DEOSSOPVSA-N	2	0	361.533	4.956	20	30		FJEDRP
CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000481916499	568182679	/nfs/dbraw/zinc/18/26/79/568182679.db2.gz	GGAQDTUHSNSCJI-XMMPIXPASA-N	2	0	361.533	4.956	20	30		FJEDRP
C[C@H]([NH2+][C@@H]1CCCCc2cc(C#N)ccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1	ZINC000481991527	568216020	/nfs/dbraw/zinc/21/60/20/568216020.db2.gz	LDNRMTKHRDVXHV-XTQVGHSUSA-N	2	0	351.538	4.568	20	30		FJEDRP
N#Cc1ccc2c(c1)CCCC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1	ZINC000481673872	568085118	/nfs/dbraw/zinc/08/51/18/568085118.db2.gz	UFMPPGHIGJREBL-HSZRJFAPSA-N	2	0	351.538	4.712	20	30		FJEDRP
CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000481913118	568178309	/nfs/dbraw/zinc/17/83/09/568178309.db2.gz	LCDLTPNTNSIMQP-XMMPIXPASA-N	2	0	361.533	4.957	20	30		FJEDRP
N#Cc1ccc2c(c1)CCCC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1	ZINC000481935690	568193313	/nfs/dbraw/zinc/19/33/13/568193313.db2.gz	XDADOJBUIUBVLM-DEOSSOPVSA-N	2	0	359.517	4.711	20	30		FJEDRP
CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCCc3cc(C#N)ccc32)c1	ZINC000481656901	568082063	/nfs/dbraw/zinc/08/20/63/568082063.db2.gz	LQYZFYVEKOPJDJ-XMMPIXPASA-N	2	0	361.533	4.956	20	30		FJEDRP
CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCCc3cc(C#N)ccc32)c1	ZINC000481656900	568082260	/nfs/dbraw/zinc/08/22/60/568082260.db2.gz	LQYZFYVEKOPJDJ-DEOSSOPVSA-N	2	0	361.533	4.956	20	30		FJEDRP
N#Cc1ccc2c(c1)CCCC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1	ZINC000481673875	568085897	/nfs/dbraw/zinc/08/58/97/568085897.db2.gz	UFMPPGHIGJREBL-QHCPKHFHSA-N	2	0	351.538	4.712	20	30		FJEDRP
CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000481913117	568177642	/nfs/dbraw/zinc/17/76/42/568177642.db2.gz	LCDLTPNTNSIMQP-DEOSSOPVSA-N	2	0	361.533	4.957	20	30		FJEDRP
C[C@H]([NH2+][C@H]1CCCCc2cc(C#N)ccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1	ZINC000481991526	568215992	/nfs/dbraw/zinc/21/59/92/568215992.db2.gz	LDNRMTKHRDVXHV-WGGBDISSSA-N	2	0	351.538	4.568	20	30		FJEDRP
N#Cc1ccc2c(c1)CCCC[C@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1	ZINC000481934182	568192977	/nfs/dbraw/zinc/19/29/77/568192977.db2.gz	RMQVCELEICTLDW-XMMPIXPASA-N	2	0	359.517	4.711	20	30		FJEDRP
C[C@H]([NH2+][C@@H]1CCCCc2cc(C#N)ccc21)[C@H]1CCC[N@@H+](C2CCC2)C1	ZINC000481991524	568215998	/nfs/dbraw/zinc/21/59/98/568215998.db2.gz	LDNRMTKHRDVXHV-KPDCDPCYSA-N	2	0	351.538	4.568	20	30		FJEDRP
N#Cc1ccc2c(c1)CCCC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1	ZINC000481935900	568193335	/nfs/dbraw/zinc/19/33/35/568193335.db2.gz	XDADOJBUIUBVLM-XMMPIXPASA-N	2	0	359.517	4.711	20	30		FJEDRP
C[C@H]([NH2+][C@H]1CCCCc2cc(C#N)ccc21)[C@H]1CCC[N@@H+](C2CCC2)C1	ZINC000481991525	568216041	/nfs/dbraw/zinc/21/60/41/568216041.db2.gz	LDNRMTKHRDVXHV-NYDSKATKSA-N	2	0	351.538	4.568	20	30		FJEDRP