smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)Oc1cccc(NC(=O)CC2CCN(C)CC2)c1	ZINC000216896109	376168544	/nfs/dbraw/zinc/16/85/44/376168544.db2.gz	LNKIVSNMBGKOTF-UHFFFAOYSA-N	0	3	290.407	3.144	40	70		CGIBHN
Cc1ccc([C@@H](C)NC(=O)CC2CCN(C)CC2)cc1C	ZINC000216905173	376168201	/nfs/dbraw/zinc/16/82/01/376168201.db2.gz	MVRLJJAMOBZPAF-OAHLLOKOSA-N	0	3	288.435	3.213	40	70		CGIBHN
CC[C@@H](NC(=O)C1CCN(C)CC1)c1ccc(C)cc1C	ZINC000216924825	376170265	/nfs/dbraw/zinc/17/02/65/376170265.db2.gz	QCRPGVLMNQBKRY-QGZVFWFLSA-N	0	3	288.435	3.213	40	70		CGIBHN
CSc1ccccc1NC(=O)CC1CCN(C)CC1	ZINC000216895638	376169052	/nfs/dbraw/zinc/16/90/52/376169052.db2.gz	STCCPDOISLBEIN-UHFFFAOYSA-N	0	3	278.421	3.079	40	70		CGIBHN
CN(C)CCOC(=O)[C@@]12C[C@H]3C[C@@](C)(C1)C[C@](C)(C3)C2	ZINC000217763067	262344463	/nfs/dbraw/zinc/34/44/63/262344463.db2.gz	RXPHWWJZBKFPIP-BGOPPPGBSA-N	0	3	279.424	3.088	40	70		CGIBHN
Cc1ccc([C@@H](C)NC(=O)CC2CCN(C)CC2)c(C)c1	ZINC000216901728	376168697	/nfs/dbraw/zinc/16/86/97/376168697.db2.gz	MTRNASDKFNQINB-OAHLLOKOSA-N	0	3	288.435	3.213	40	70		CGIBHN
CC[C@H](NC(=O)C1CCN(C)CC1)c1ccc(C)c(C)c1	ZINC000216924792	376170117	/nfs/dbraw/zinc/17/01/17/376170117.db2.gz	PWWWAEFFTSLFCS-KRWDZBQOSA-N	0	3	288.435	3.213	40	70		CGIBHN
CSc1cccc(NC(=O)CC2CCN(C)CC2)c1	ZINC000216893978	376168642	/nfs/dbraw/zinc/16/86/42/376168642.db2.gz	JKSAFZMGPRPIKW-UHFFFAOYSA-N	0	3	278.421	3.079	40	70		CGIBHN
CC[C@@]12C[C@H]3C[C@@H](C1)C[C@](C(=O)OCCN(C)C)(C3)C2	ZINC000217403993	376174469	/nfs/dbraw/zinc/17/44/69/376174469.db2.gz	DQKPQHOBMBCXJN-ZHZCFWQKSA-N	0	3	279.424	3.088	40	70		CGIBHN
CCSc1ccccc1NC(=O)CC1CCN(C)CC1	ZINC000216902376	189706984	/nfs/dbraw/zinc/70/69/84/189706984.db2.gz	XVGXYJGXVUGIKS-UHFFFAOYSA-N	0	3	292.448	3.469	40	70		CGIBHN
Cc1ccc(C)c([C@H](C)NC(=O)CC2CCN(C)CC2)c1	ZINC000216898572	376168321	/nfs/dbraw/zinc/16/83/21/376168321.db2.gz	DQAFXUUZTUNDTD-HNNXBMFYSA-N	0	3	288.435	3.213	40	70		CGIBHN
Cc1ccc([C@H](C)NC(=O)CC2CCN(C)CC2)c(C)c1	ZINC000216901759	376168412	/nfs/dbraw/zinc/16/84/12/376168412.db2.gz	MTRNASDKFNQINB-HNNXBMFYSA-N	0	3	288.435	3.213	40	70		CGIBHN
CC[C@H](NC(=O)CC1CCN(C)CC1)c1ccc(C)cc1	ZINC000216901936	376168502	/nfs/dbraw/zinc/16/85/02/376168502.db2.gz	QDTTYEZYOAZOCU-KRWDZBQOSA-N	0	3	288.435	3.294	40	70		CGIBHN
CC[C@H](NC(=O)C1CCN(C)CC1)c1ccc(C)cc1C	ZINC000216924846	376169950	/nfs/dbraw/zinc/16/99/50/376169950.db2.gz	QCRPGVLMNQBKRY-KRWDZBQOSA-N	0	3	288.435	3.213	40	70		CGIBHN
CC[C@@H](NC(=O)C1CCN(C)CC1)c1ccc(C)c(C)c1	ZINC000216924769	376170681	/nfs/dbraw/zinc/17/06/81/376170681.db2.gz	PWWWAEFFTSLFCS-QGZVFWFLSA-N	0	3	288.435	3.213	40	70		CGIBHN
CCc1cccc(CC)c1NC(=O)CC1CCN(C)CC1	ZINC000216894910	189706699	/nfs/dbraw/zinc/70/66/99/189706699.db2.gz	OSEPRQZOSDXPNH-UHFFFAOYSA-N	0	3	288.435	3.482	40	70		CGIBHN
CC[C@@H](NC(=O)CC1CCN(C)CC1)c1ccc(C)cc1	ZINC000216901899	376168867	/nfs/dbraw/zinc/16/88/67/376168867.db2.gz	QDTTYEZYOAZOCU-QGZVFWFLSA-N	0	3	288.435	3.294	40	70		CGIBHN
Cc1ccc([C@H](C)NC(=O)CC2CCN(C)CC2)cc1C	ZINC000216905206	376168310	/nfs/dbraw/zinc/16/83/10/376168310.db2.gz	MVRLJJAMOBZPAF-HNNXBMFYSA-N	0	3	288.435	3.213	40	70		CGIBHN
Cc1ccc(C)c([C@@H](C)NC(=O)CC2CCN(C)CC2)c1	ZINC000216898540	189706751	/nfs/dbraw/zinc/70/67/51/189706751.db2.gz	DQAFXUUZTUNDTD-OAHLLOKOSA-N	0	3	288.435	3.213	40	70		CGIBHN