smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[N+]1(C2CCC([N+]3(CC)CCCC3)CC2)CCCC1	ZINC000606422334	570314165	/nfs/dbraw/zinc/31/41/65/570314165.db2.gz	NWUNABAELFBWDX-UHFFFAOYSA-N	2	0	280.500	3.559	50	5		CHBARP
C[N+](C)(C)c1ccc(-c2ccc([N+](C)(C)C)cc2)cc1	ZINC000002014445	570380847	/nfs/dbraw/zinc/38/08/47/570380847.db2.gz	IQYXODYDRLRVCI-UHFFFAOYSA-N	2	0	270.420	3.747	50	5		CHBARP
CCC[N+]1(CCCCCC[N+](C)(C)C)CCCCC1	ZINC000606422215	570314172	/nfs/dbraw/zinc/31/41/72/570314172.db2.gz	OFOMQDGQMRATDZ-UHFFFAOYSA-N	2	0	270.505	3.664	50	5		CHBARP
CC(C)C[N+](C)(C)CCCCC[N+](C)(C)CC(C)C	ZINC000606422272	570314034	/nfs/dbraw/zinc/31/40/34/570314034.db2.gz	BDKAVKFVMHSWKD-UHFFFAOYSA-N	2	0	272.521	3.622	50	5		CHBARP
CC[N+](CC)(CC)CCCC[N+]1(CC)CCCCC1	ZINC000585152322	570253729	/nfs/dbraw/zinc/25/37/29/570253729.db2.gz	PAYYGQIIYLCQRM-UHFFFAOYSA-N	2	0	270.505	3.664	50	5		CHBARP
C[N+](C)(CC[N+](C)(C)Cc1ccccc1)Cc1ccccc1	ZINC000001473427	566895071	/nfs/dbraw/zinc/89/50/71/566895071.db2.gz	MBHULKQWRVEFAN-UHFFFAOYSA-N	2	0	298.474	3.540	50	5		CHBARP
C[N+]1(C)Cc2ccccc2C[N+](C)(C)Cc2ccccc2C1	ZINC000003132296	567851574	/nfs/dbraw/zinc/85/15/74/567851574.db2.gz	ZYMKKTGMNBHLDS-UHFFFAOYSA-N	2	0	296.458	3.553	50	5		CHBARP
C[N+](C)(CCCCCC[N+](C)(C)CC1CC1)CC1CC1	ZINC000526051554	567928755	/nfs/dbraw/zinc/92/87/55/567928755.db2.gz	OYBIVZRWINMJQQ-UHFFFAOYSA-N	2	0	282.516	3.520	50	5		CHBARP
C[N+](C)(CC[N+](C)(C)CC1CCCC1)CC1CCCC1	ZINC000526051550	567928931	/nfs/dbraw/zinc/92/89/31/567928931.db2.gz	FYEQPSYTTUFFKK-UHFFFAOYSA-N	2	0	282.516	3.520	50	5		CHBARP
CC[N+](CC)(CC)CCCCC[N+](CC)(CC)CC	ZINC000001622103	567839772	/nfs/dbraw/zinc/83/97/72/567839772.db2.gz	NAOPLBVQLUZMQA-UHFFFAOYSA-N	2	0	272.521	3.910	50	5		CHBARP
CC[N+](CC)(CC)CCCCC[N+]1(CC)CCCC1	ZINC000005955428	567947010	/nfs/dbraw/zinc/94/70/10/567947010.db2.gz	WINGICYIBJOBEV-UHFFFAOYSA-N	2	0	270.505	3.664	50	5		CHBARP
C[N+](C)(C)CCCCCCCCCC[N+](C)(C)C	ZINC000001532339	169712356	/nfs/dbraw/zinc/71/23/56/169712356.db2.gz	MTCUAOILFDZKCO-UHFFFAOYSA-N	2	0	258.494	3.520	50	5	world	CHBARP