smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCCCCC	ZINC000001531085	342946604	/nfs/dbraw/zinc/94/66/04/342946604.db2.gz	SNRUBQQJIBEYMU-UHFFFAOYSA-N	0	0	170.340	4.927	50	30	endogenous,in-man	AJEARN
CCCCCCCCc1ccccc1	ZINC000001596324	342950339	/nfs/dbraw/zinc/95/03/39/342950339.db2.gz	CDKDZKXSXLNROY-UHFFFAOYSA-N	0	0	190.330	4.590	50	30		AJEARN
C=C(C)CCCCCCCCC	ZINC000001609595	166116779	/nfs/dbraw/zinc/11/67/79/166116779.db2.gz	SJVKHZYVCVKEGM-UHFFFAOYSA-N	0	0	168.324	4.703	50	30		AJEARN
CCCCCCCCCCCCC#N	ZINC000001672897	170999495	/nfs/dbraw/zinc/99/94/95/170999495.db2.gz	WKJHMKQSIBMURP-UHFFFAOYSA-N	0	0	195.350	4.821	50	30		AJEARN
CCCCCCCC1CCCCC1	ZINC000001680056	171000203	/nfs/dbraw/zinc/00/02/03/171000203.db2.gz	MSTLSCNJAHAQNU-UHFFFAOYSA-N	0	0	182.351	4.927	50	30		AJEARN
CCCCCCCCCCC	ZINC000001693211	171000950	/nfs/dbraw/zinc/00/09/50/171000950.db2.gz	RSJKGSCJYJTIGS-UHFFFAOYSA-N	0	0	156.313	4.537	50	30	endogenous,in-man	AJEARN
C=CCCCCCCCCCC	ZINC000001718715	171001866	/nfs/dbraw/zinc/00/18/66/171001866.db2.gz	CRSBERNSMYQZNG-UHFFFAOYSA-N	0	0	168.324	4.703	50	30	biogenic,in-man	AJEARN
CCCCCCCCc1cccs1	ZINC000001845594	342965001	/nfs/dbraw/zinc/96/50/01/342965001.db2.gz	GIFWAJGKWIDXMY-UHFFFAOYSA-N	0	0	196.359	4.651	50	30		AJEARN
CCCCCCCCCCCCF	ZINC000002040783	171004434	/nfs/dbraw/zinc/00/44/34/171004434.db2.gz	YHYBNVZCQIDLSQ-UHFFFAOYSA-N	0	0	188.330	4.877	50	30		AJEARN
C=C1CCCCCCCCCCC1	ZINC000002145730	166144479	/nfs/dbraw/zinc/14/44/79/166144479.db2.gz	FCUMNEBCUZTVQN-UHFFFAOYSA-N	0	0	180.335	4.847	50	30		AJEARN
CCCCCCCCc1ccsc1	ZINC000002159763	342970045	/nfs/dbraw/zinc/97/00/45/342970045.db2.gz	WQYWXQCOYRZFAV-UHFFFAOYSA-N	0	0	196.359	4.651	50	30		AJEARN
CCCCCCCCC(F)=C(F)F	ZINC000002530943	171006728	/nfs/dbraw/zinc/00/67/28/171006728.db2.gz	VAKNUCCHIZRRRF-UHFFFAOYSA-N	0	0	194.240	4.815	50	30		AJEARN
CC/C=C/CCCCCCCC	ZINC000002539709	171163624	/nfs/dbraw/zinc/16/36/24/171163624.db2.gz	WLTSXAIICPDFKI-FNORWQNLSA-N	0	0	168.324	4.703	50	30		AJEARN
C#CCCCCCCCCCCC	ZINC000002560573	166016278	/nfs/dbraw/zinc/01/62/78/166016278.db2.gz	GZEDKDBFUBPZNG-UHFFFAOYSA-N	0	0	180.335	4.541	50	30		AJEARN
C#CCCCCCCCCCCCC	ZINC000002560574	166016315	/nfs/dbraw/zinc/01/63/15/166016315.db2.gz	DZEFNRWGWQDGTR-UHFFFAOYSA-N	0	0	194.362	4.931	50	30		AJEARN
CCCCCCCC[C@H](C)CC	ZINC000002564124	342977170	/nfs/dbraw/zinc/97/71/70/342977170.db2.gz	HTZWVZNRDDOFEI-GFCCVEGCSA-N	0	0	170.340	4.783	50	30		AJEARN
C=C(Cl)CCCCCCCCC	ZINC000002567442	166135429	/nfs/dbraw/zinc/13/54/29/166135429.db2.gz	LWABGZMRUSFJAS-UHFFFAOYSA-N	0	0	188.742	4.880	50	30		AJEARN
C=CCC/C=C/CC/C=C/CCC=C	ZINC000002569757	166165040	/nfs/dbraw/zinc/16/50/40/166165040.db2.gz	DHLQCLRZNQGXIE-WGDLNXRISA-N	0	0	190.330	4.811	50	30		AJEARN
CCCCCCCCCC(C)C	ZINC000002575425	171008058	/nfs/dbraw/zinc/00/80/58/171008058.db2.gz	GTJOHISYCKPIMT-UHFFFAOYSA-N	0	0	170.340	4.783	50	30	in-man	AJEARN
CCCC/C=C/CCCCCC	ZINC000002576966	342978355	/nfs/dbraw/zinc/97/83/55/342978355.db2.gz	ZOKYTRIEIDWYSG-PKNBQFBNSA-N	0	0	168.324	4.703	50	30		AJEARN
CCCCCCC#CCCCCCC	ZINC000002579233	171008051	/nfs/dbraw/zinc/00/80/51/171008051.db2.gz	AFNWSIIBAYUTTL-UHFFFAOYSA-N	0	0	194.362	4.931	50	30		AJEARN
C=C1C[C@H]2C[C@@H](C1)CCCCCCC2	ZINC000071786563	166149112	/nfs/dbraw/zinc/14/91/12/166149112.db2.gz	APTLAPONWYBZQC-OKILXGFUSA-N	0	0	192.346	4.703	50	30		AJEARN
CCCCCCCC[C@@H](C)CC	ZINC000100005161	343708294	/nfs/dbraw/zinc/70/82/94/343708294.db2.gz	HTZWVZNRDDOFEI-LBPRGKRZSA-N	0	0	170.340	4.783	50	30		AJEARN
CCCCCCCCC=C(C)C	ZINC000100993466	171205208	/nfs/dbraw/zinc/20/52/08/171205208.db2.gz	SMDXUIYTBVHJNX-UHFFFAOYSA-N	0	0	168.324	4.703	50	30		AJEARN
C=CC[Si](C(C)C)(C(C)C)C(C)C	ZINC000170172473	166207314	/nfs/dbraw/zinc/20/73/14/166207314.db2.gz	AKQHUJRZKBYZLC-UHFFFAOYSA-N	0	0	198.426	4.851	50	30		AJEARN