smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
CCCCN1[C@@H](CC)CC[C@H]1C	218153886	DEOBTFGSPWHHGT-MNOVXSKESA-N	169.312	3.049	70	20	AGID	
CCCN[C@@H](C)[C@H]1CCC[C@@H](C)C1	218582024	IKTCCZVWIDUEJQ-WOPDTQHZSA-N	183.339	3.201	70	20	AGID	
CC(C)C(CN1CCCC1)C(C)C	217723741	MWMRLBYEEFYXAQ-UHFFFAOYSA-N	183.339	3.010	70	20	AGID	
CCC(CC)c1nc(C(C)C)no1	218587861	FRTDHHUVHHBZFR-UHFFFAOYSA-N	182.267	3.097	70	20	AGID	
CC(C)CN[C@@H]1CCC[C@@H](C(C)C)C1	218097542	FCXBNQINLUTFIW-CHWSQXEVSA-N	197.366	3.447	70	20	AGID	
CCCC[C@H](CC)CN1CCCC1	218654310	QEDFKXUPXSBUTJ-LBPRGKRZSA-N	183.339	3.299	70	20	AGID	
Cc1cc(C)c2occ(C)c2c1	160627453	FAQTYEVQOUXYOD-UHFFFAOYSA-N	160.216	3.358	70	20	AGID	
CC[C@H](C)[C@@H](C)NC[C@@H]1CC=CCC1	218766028	OCBYXWUCQKGRAR-YNEHKIRRSA-N	195.350	3.367	70	20	AGID	
COc1cc(C)cc2c(C)coc12	160622372	VAHKLJSZKCBSBA-UHFFFAOYSA-N	176.215	3.058	70	20	AGID	
Cc1cccc(OCC2CC2)c1C	217493803	NVEVINHRCCGUTR-UHFFFAOYSA-N	176.259	3.092	70	20	AGID	
Oc1ccc(SC2CCC2)cc1	160218160	WQTLRJOEUIVIKQ-UHFFFAOYSA-N	180.272	3.037	70	20	AGID	
CC(C)C(CN(C)C1CC1)C(C)C	217717791	JFIPTJFEEOKYOI-UHFFFAOYSA-N	183.339	3.009	70	20	AGID	
CCCCN1[C@@H](C)CC[C@@H]1CC	218153929	DEOBTFGSPWHHGT-QWRGUYRKSA-N	169.312	3.049	70	20	AGID	
CC(C)C[C@H](C)OC(=O)C(C)(C)C	217743631	YYEYUBFTZAVSOM-VIFPVBQESA-N	186.295	3.010	70	20	AGID	
CCCN[C@@H](C)[C@@H]1CCC[C@@H](C)C1	218581838	IKTCCZVWIDUEJQ-GRYCIOLGSA-N	183.339	3.201	70	20	AGID	
CNc1cccc(OC2CCCC2)c1	217713627	CPRPHTLKLAVXRK-UHFFFAOYSA-N	191.274	3.050	70	20	AGID	
Oc1cccc(SC2CCC2)c1	161492022	OCEAQJBBTVKPKD-UHFFFAOYSA-N	180.272	3.037	70	20	AGID	
CCC[C@H](C)N[C@@H](C)[C@H](C)CC	218123209	GCWUKRYKKNAHJT-VWYCJHECSA-N	171.328	3.199	70	20	AGID	
Cc1cccc(OCC(C)C)c1C	217799589	NYGGRKRSOXMDAH-UHFFFAOYSA-N	178.275	3.338	70	20	AGID	
CN(CC1CCCCC1)C(C)(C)C	217765128	LNHCNAPYSVWLQD-UHFFFAOYSA-N	183.339	3.297	70	20	AGID	
Fc1ccccc1O[C@@H]1C=CCCC1	161027045	XHKXEMNPKKIZNI-SNVBAGLBSA-N	192.233	3.313	70	20	AGID	
C[C@H]1CCCC[C@H]1CN[C@H](C)C1CC1	218412024	YRBUBKSYWLJRHC-LOWVWBTDSA-N	195.350	3.201	70	20	AGID	
CCCNCc1ccc(C)cc1Cl	161075061	OLMQGKYIVJDWRG-UHFFFAOYSA-N	197.709	3.148	70	20	AGID	
Cc1cccc(F)c1NCCC1CC1	160315734	BJRHFSGQUIAAAC-UHFFFAOYSA-N	193.265	3.346	70	20	AGID	
CCC(CC)c1nnc(C(C)C)o1	218587982	BLMITEFQXQQZOF-UHFFFAOYSA-N	182.267	3.097	70	20	AGID	
C[C@H]1CCCC[C@@H]1CN[C@H](C)C1CC1	218412097	YRBUBKSYWLJRHC-DMDPSCGWSA-N	195.350	3.201	70	20	AGID	
CC(C)SCCc1cccs1	217831164	URSXCSUAMNKOBS-UHFFFAOYSA-N	186.345	3.432	70	20	AGID	
CCC[C@H](C)N[C@H](C)[C@H](C)CC	218123295	GCWUKRYKKNAHJT-OUAUKWLOSA-N	171.328	3.199	70	20	AGID	
CC(C)CN[C@@H]1CCC[C@H](C(C)C)C1	218097709	FCXBNQINLUTFIW-QWHCGFSZSA-N	197.366	3.447	70	20	AGID	
C[C@H]1C[C@H]1CNC[C@H]1CCC[C@@H](C)C1	161238457	YXBYRCVMBUZXIF-VOAKCMCISA-N	195.350	3.058	70	20	AGID	
CSCCOc1cccc(C)c1C	217823500	HTMMYRWXHWYKJM-UHFFFAOYSA-N	196.315	3.045	70	20	AGID	
CCOc1ccc2occ(C)c2c1	160625140	SMRWLUXZLIUAFB-UHFFFAOYSA-N	176.215	3.140	70	20	AGID	
C1=CCOC2(CC1)CCCCC2	218657609	HXIFZKATLASQKW-UHFFFAOYSA-N	166.264	3.056	70	20	AGID	
Fc1ccccc1O[C@H]1C=CCCC1	161026934	XHKXEMNPKKIZNI-JTQLQIEISA-N	192.233	3.313	70	20	AGID	
CC(C)CN[C@H]1CCC[C@H](C(C)C)C1	218097780	FCXBNQINLUTFIW-STQMWFEESA-N	197.366	3.447	70	20	AGID	
CCCSCCc1cccs1	217831067	ITDUKPSNTQXRJL-UHFFFAOYSA-N	186.345	3.434	70	20	AGID	
CC(C)C[C@@H](C)OC(=O)C(C)(C)C	217743553	YYEYUBFTZAVSOM-SECBINFHSA-N	186.295	3.010	70	20	AGID	
CCCCOc1c(F)cccc1F	218701074	RBURNMPAOIOGDF-UHFFFAOYSA-N	186.201	3.144	70	20	AGID	
CCCCN(C)CCCC(C)C	218666602	BDANZTGAXKFUEX-UHFFFAOYSA-N	171.328	3.155	70	20	AGID	
F[B-](F)(F)CSc1ccccc1	169948446	OZURMNQCZXGCBO-UHFFFAOYSA-N	191.006	3.165	70	20	AGID	
CC[C@H](C)[C@H](C)NC[C@@H]1CC=CCC1	218766106	OCBYXWUCQKGRAR-RWMBFGLXSA-N	195.350	3.367	70	20	AGID	
Oc1ccccc1SC1CCC1	161491780	SCCOTRIIRGPXDY-UHFFFAOYSA-N	180.272	3.037	70	20	AGID	
CC(C)CN[C@H]1CCC[C@@H](C(C)C)C1	218097635	FCXBNQINLUTFIW-OLZOCXBDSA-N	197.366	3.447	70	20	AGID	
CSCCOc1ccc(C)c(C)c1	217821417	CENYDOALRGJEQD-UHFFFAOYSA-N	196.315	3.045	70	20	AGID