smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=NNC(=N)N)c1ccc(-n2cnnn2)cc1	ZINC000005494497	187248163	/nfs/dbraw/zinc/24/81/63/187248163.db2.gz	DDRXEMCOEBJNEE-VGOFMYFVSA-N	0	1	244.262	-0.131	10	30		BBEEMN
N/C(CN1CCCC[C@@H]1CCO)=N\O	ZINC000019438782	181182694	/nfs/dbraw/zinc/18/26/94/181182694.db2.gz	ILRIQLFEGOIBOW-MRVPVSSYSA-N	0	1	201.270	-0.030	10	30		BBEEMN
N/C(CN1CCCC[C@H]1CCO)=N\O	ZINC000019438784	181182092	/nfs/dbraw/zinc/18/20/92/181182092.db2.gz	ILRIQLFEGOIBOW-QMMMGPOBSA-N	0	1	201.270	-0.030	10	30		BBEEMN
C=CCNC(=O)[C@H](N)CCS(C)(=O)=O	ZINC000019440072	166390877	/nfs/dbraw/zinc/39/08/77/166390877.db2.gz	PKCQJTAFMKKRRM-SSDOTTSWSA-N	0	1	220.294	-0.949	10	30		BBEEMN
C=CCNC(=O)[C@@H](N)CCS(C)(=O)=O	ZINC000019440074	166385726	/nfs/dbraw/zinc/38/57/26/166385726.db2.gz	PKCQJTAFMKKRRM-ZETCQYMHSA-N	0	1	220.294	-0.949	10	30		BBEEMN
CN1CCN(c2ccc(/C(N)=N/O)cn2)CC1	ZINC000019471520	132325191	/nfs/dbraw/zinc/32/51/91/132325191.db2.gz	ZTRPETRYUDBTDL-UHFFFAOYSA-N	0	1	235.291	-0.072	10	30		BBEEMN
CN1CCN(c2cc(/C(N)=N/O)ccn2)CC1	ZINC000019507823	536418165	/nfs/dbraw/zinc/41/81/65/536418165.db2.gz	LSVAFMRQIKTTCH-UHFFFAOYSA-N	0	1	235.291	-0.072	10	30		BBEEMN
C#CCOC(=O)C1CNC(=S)N=C1C	ZINC000035016454	356703333	/nfs/dbraw/zinc/70/33/33/356703333.db2.gz	BGERIBQFKLCORN-UHFFFAOYSA-N	0	1	210.258	-0.086	10	30		BBEEMN
N#Cc1ccc(C[C@H](N)C(=O)NO)cc1	ZINC000035075543	181110936	/nfs/dbraw/zinc/11/09/36/181110936.db2.gz	LBUVBAXZCRTNMC-VIFPVBQESA-N	0	1	205.217	-0.067	10	30		BBEEMN
C#CC(=O)N1CC[NH+](CCC(=O)[O-])CC1	ZINC000035686932	166108678	/nfs/dbraw/zinc/10/86/78/166108678.db2.gz	VTFTUNMSKSNPPA-UHFFFAOYSA-N	0	1	210.233	-0.762	10	30		BBEEMN
OC[C@]1(S)C[C@H]2[C@H](N1)[C@@H](O)CC[C@@H]2O	ZINC000036456634	183159207	/nfs/dbraw/zinc/15/92/07/183159207.db2.gz	WMNNTFPTLFRJNC-ZTKNNBQKSA-N	0	1	219.306	-0.902	10	30		BBEEMN
O=C(Nc1nncs1)C(=O)N1CCNCC1	ZINC000036904351	181829746	/nfs/dbraw/zinc/82/97/46/181829746.db2.gz	JZRAOXFTKFFXEH-UHFFFAOYSA-N	0	1	241.276	-0.442	10	30		BBEEMN
CS(=O)(=O)[N-]c1cccc(C#CC[NH3+])n1	ZINC000037471333	175433300	/nfs/dbraw/zinc/43/33/00/175433300.db2.gz	YSAMZRSQJFNBHF-UHFFFAOYSA-N	0	1	225.273	-0.237	10	30		BBEEMN
N#Cc1ccnc(NCC(=O)N2CCNCC2)c1	ZINC000037716293	181156670	/nfs/dbraw/zinc/15/66/70/181156670.db2.gz	MZQJZQAYKJFEMJ-UHFFFAOYSA-N	0	1	245.286	-0.203	10	30		BBEEMN
N#Cc1ccc(CNC(=O)CNC(=O)CN)cc1	ZINC000037748614	181107441	/nfs/dbraw/zinc/10/74/41/181107441.db2.gz	HCZNGSOFWLLHRN-UHFFFAOYSA-N	0	1	246.270	-0.751	10	30		BBEEMN
N#Cc1ccc(CNCC(=O)NC(N)=O)cc1	ZINC000037749193	181106493	/nfs/dbraw/zinc/10/64/93/181106493.db2.gz	ABMMGRFQEFFXQU-UHFFFAOYSA-N	0	1	232.243	-0.157	10	30		BBEEMN
N#Cc1cccc(CNCC(=O)NC(N)=O)c1	ZINC000037749381	187260099	/nfs/dbraw/zinc/26/00/99/187260099.db2.gz	JQSJRXOKXNBZQG-UHFFFAOYSA-N	0	1	232.243	-0.157	10	30		BBEEMN
C#CCNC(=O)[C@H](C)[N@@H+](CC)CC(=O)[O-]	ZINC000038018144	187254979	/nfs/dbraw/zinc/25/49/79/187254979.db2.gz	KOGVOJZGQBCAFY-QMMMGPOBSA-N	0	1	212.249	-0.469	10	30		BBEEMN
C#CCNC(=O)[C@H](C)[N@H+](CC)CC(=O)[O-]	ZINC000038018144	187254977	/nfs/dbraw/zinc/25/49/77/187254977.db2.gz	KOGVOJZGQBCAFY-QMMMGPOBSA-N	0	1	212.249	-0.469	10	30		BBEEMN
CCC[N@@H+](CC(=O)[O-])CC(=O)NCCC#N	ZINC000038021775	169098914	/nfs/dbraw/zinc/09/89/14/169098914.db2.gz	GSRPHAZNNGWISW-UHFFFAOYSA-N	0	1	227.264	-0.187	10	30		BBEEMN
CCC[N@H+](CC(=O)[O-])CC(=O)NCCC#N	ZINC000038021775	169098912	/nfs/dbraw/zinc/09/89/12/169098912.db2.gz	GSRPHAZNNGWISW-UHFFFAOYSA-N	0	1	227.264	-0.187	10	30		BBEEMN
C#CCNC(=O)C[N@@H+](CCC)CC(=O)[O-]	ZINC000038021859	187255162	/nfs/dbraw/zinc/25/51/62/187255162.db2.gz	KCFCMIDYQACNKN-UHFFFAOYSA-N	0	1	212.249	-0.468	10	30		BBEEMN
C#CCNC(=O)C[N@H+](CCC)CC(=O)[O-]	ZINC000038021859	187255160	/nfs/dbraw/zinc/25/51/60/187255160.db2.gz	KCFCMIDYQACNKN-UHFFFAOYSA-N	0	1	212.249	-0.468	10	30		BBEEMN
C#CCNC(=O)[C@H](C)[N@@H+](CCC)CC(=O)[O-]	ZINC000038022057	188109051	/nfs/dbraw/zinc/10/90/51/188109051.db2.gz	FDYQPXULUNUCQV-VIFPVBQESA-N	0	1	226.276	-0.079	10	30		BBEEMN
C#CCNC(=O)[C@H](C)[N@H+](CCC)CC(=O)[O-]	ZINC000038022057	188109049	/nfs/dbraw/zinc/10/90/49/188109049.db2.gz	FDYQPXULUNUCQV-VIFPVBQESA-N	0	1	226.276	-0.079	10	30		BBEEMN
C[C@H](C#N)CN(C)CC(=O)N1CCNCC1	ZINC000038031592	187599615	/nfs/dbraw/zinc/59/96/15/187599615.db2.gz	UCXXQUCBVYEHIA-SNVBAGLBSA-N	0	1	224.308	-0.490	10	30		BBEEMN
C[C@@H]1CN(CCC(=O)NO)C[C@H](C)O1	ZINC000039105079	177246182	/nfs/dbraw/zinc/24/61/82/177246182.db2.gz	FMVDUUGLGRRQLB-OCAPTIKFSA-N	0	1	202.254	-0.009	10	30		BBEEMN
C[C@H]1CN(CCC(=O)NO)C[C@H](C)O1	ZINC000039105080	177246404	/nfs/dbraw/zinc/24/64/04/177246404.db2.gz	FMVDUUGLGRRQLB-YUMQZZPRSA-N	0	1	202.254	-0.009	10	30		BBEEMN
C[C@@H]1CN(CCC(=O)NO)C[C@@H](C)O1	ZINC000039105081	176286122	/nfs/dbraw/zinc/28/61/22/176286122.db2.gz	FMVDUUGLGRRQLB-HTQZYQBOSA-N	0	1	202.254	-0.009	10	30		BBEEMN
N#CCN1CCC[C@@H]1C(=O)N1CCNCC1	ZINC000040508481	188118058	/nfs/dbraw/zinc/11/80/58/188118058.db2.gz	KNCOVIZONSKSIS-SNVBAGLBSA-N	0	1	222.292	-0.594	10	30		BBEEMN
N#Cc1ccsc1NC(=O)CNC(=O)CN	ZINC000040852076	181160718	/nfs/dbraw/zinc/16/07/18/181160718.db2.gz	OKBYKKGJOWPESZ-UHFFFAOYSA-N	0	1	238.272	-0.367	10	30		BBEEMN
CS(=O)(=O)c1ccc(C(N)=NN)cc1	ZINC000042038462	175436571	/nfs/dbraw/zinc/43/65/71/175436571.db2.gz	RGNSNGHFURNHOK-UHFFFAOYSA-N	0	1	213.262	-0.331	10	30		BBEEMN
N/C(CC(=O)N1CCN(CC2CC2)CC1)=N\O	ZINC000042491502	181182663	/nfs/dbraw/zinc/18/26/63/181182663.db2.gz	WTYQNDQEOJZSCQ-UHFFFAOYSA-N	0	1	240.307	-0.323	10	30		BBEEMN
CC[C@@H](/C(N)=N/O)N1CCC(O)CC1	ZINC000043539534	343132313	/nfs/dbraw/zinc/13/23/13/343132313.db2.gz	MAARPBJFXOYGSR-QMMMGPOBSA-N	0	1	201.270	-0.032	10	30		BBEEMN
CC[C@H](/C(N)=N/O)N1CCC(O)CC1	ZINC000043539535	343132375	/nfs/dbraw/zinc/13/23/75/343132375.db2.gz	MAARPBJFXOYGSR-MRVPVSSYSA-N	0	1	201.270	-0.032	10	30		BBEEMN
C[C@@H](C#N)CN(C)C(=O)[C@H]1CNCCO1	ZINC000043799211	175595602	/nfs/dbraw/zinc/59/56/02/175595602.db2.gz	SIDDEPBSUFZORG-DTWKUNHWSA-N	0	1	211.265	-0.407	10	30		BBEEMN
CN1CCC(NS(=O)(=O)CC#N)CC1	ZINC000044509687	345099676	/nfs/dbraw/zinc/09/96/76/345099676.db2.gz	MBIGXRZRUZTZEG-UHFFFAOYSA-N	0	1	217.294	-0.476	10	30		BBEEMN
N#CC1(C(=O)N2CCNCC2)CCOCC1	ZINC000044765647	181027996	/nfs/dbraw/zinc/02/79/96/181027996.db2.gz	HVTKQMDPXOUPIH-UHFFFAOYSA-N	0	1	223.276	-0.261	10	30		BBEEMN
CCCN1CCN(C(=O)[C@@H](C)/C(N)=N/O)CC1	ZINC000044864928	169201090	/nfs/dbraw/zinc/20/10/90/169201090.db2.gz	KTGAQSMQXIZPBX-VIFPVBQESA-N	0	1	242.323	-0.077	10	30		BBEEMN
CCCN1CCN(C(=O)[C@H](C)/C(N)=N/O)CC1	ZINC000044864930	169201002	/nfs/dbraw/zinc/20/10/02/169201002.db2.gz	KTGAQSMQXIZPBX-SECBINFHSA-N	0	1	242.323	-0.077	10	30		BBEEMN
N#Cc1cc(N)cnc1NCc1nn[nH]n1	ZINC000044925447	181089092	/nfs/dbraw/zinc/08/90/92/181089092.db2.gz	AHQDHPPESFXKMF-UHFFFAOYSA-N	0	1	216.208	-0.339	10	30		BBEEMN
CC(C)[C@@H](C#N)C(=O)NCc1nn[nH]n1	ZINC000044933029	167340759	/nfs/dbraw/zinc/34/07/59/167340759.db2.gz	OIKPHNIBEGUYNP-ZCFIWIBFSA-N	0	1	208.225	-0.388	10	30		BBEEMN
N#CCNC(=O)C(=O)NCCN1CCCCC1	ZINC000049575522	181041866	/nfs/dbraw/zinc/04/18/66/181041866.db2.gz	KAEXJXDWPVYXQV-UHFFFAOYSA-N	0	1	238.291	-0.772	10	30		BBEEMN
C#CCNC(=O)[C@H](C)N(C)CCC(=O)OC	ZINC000050067913	166183784	/nfs/dbraw/zinc/18/37/84/166183784.db2.gz	QATBXFXBUPHLTK-VIFPVBQESA-N	0	1	226.276	-0.381	10	30		BBEEMN
C#CCNC(=O)[C@@H](C)N(C)CCC(=O)OC	ZINC000050067914	166181138	/nfs/dbraw/zinc/18/11/38/166181138.db2.gz	QATBXFXBUPHLTK-SECBINFHSA-N	0	1	226.276	-0.381	10	30		BBEEMN
C#CCN1CCN(C(=O)c2[nH]nc(C)c2N)CC1	ZINC000050306259	188219659	/nfs/dbraw/zinc/21/96/59/188219659.db2.gz	OOUDLYRUXWUUKY-UHFFFAOYSA-N	0	1	247.302	-0.309	10	30		BBEEMN
N#CCNC(=O)Cn1ccnc1CNC1CC1	ZINC000051015125	181042837	/nfs/dbraw/zinc/04/28/37/181042837.db2.gz	ZXOXAGUFANJCDB-UHFFFAOYSA-N	0	1	233.275	-0.225	10	30		BBEEMN
CN1CCN(C[C@]2(C=O)CCOC2)CC1	ZINC000051175331	346974556	/nfs/dbraw/zinc/97/45/56/346974556.db2.gz	VEXKSWLBRWOANP-NSHDSACASA-N	0	1	212.293	-0.161	10	30		BBEEMN
CN1CCN(C[C@@]2(C=O)CCOC2)CC1	ZINC000051175333	346975065	/nfs/dbraw/zinc/97/50/65/346975065.db2.gz	VEXKSWLBRWOANP-LLVKDONJSA-N	0	1	212.293	-0.161	10	30		BBEEMN
C#CC[NH2+][C@]1(C(=O)[O-])CN2CCC1CC2	ZINC000051963343	166192044	/nfs/dbraw/zinc/19/20/44/166192044.db2.gz	RHBASKJRRDJEQC-LLVKDONJSA-N	0	1	208.261	-0.242	10	30		BBEEMN
C#CC[NH2+][C@@]1(C(=O)[O-])CN2CCC1CC2	ZINC000051963345	166191031	/nfs/dbraw/zinc/19/10/31/166191031.db2.gz	RHBASKJRRDJEQC-NSHDSACASA-N	0	1	208.261	-0.242	10	30		BBEEMN
C#CCN[C@@]1(C(=O)OC)CN2CCC1CC2	ZINC000051963878	166192960	/nfs/dbraw/zinc/19/29/60/166192960.db2.gz	MJAYDIWBIYYYON-LBPRGKRZSA-N	0	1	222.288	-0.153	10	30		BBEEMN
C#CCN[C@]1(C(=O)OC)CN2CCC1CC2	ZINC000051963880	166193973	/nfs/dbraw/zinc/19/39/73/166193973.db2.gz	MJAYDIWBIYYYON-GFCCVEGCSA-N	0	1	222.288	-0.153	10	30		BBEEMN
C#CCNC1(C(=O)OC)CCN(C)CC1	ZINC000051964351	166188074	/nfs/dbraw/zinc/18/80/74/166188074.db2.gz	WBSRQUQLHIWWNL-UHFFFAOYSA-N	0	1	210.277	-0.153	10	30		BBEEMN
C=C[C@H](C)N(C)CC(=O)N1CC[NH2+]CC1	ZINC000052143831	188332958	/nfs/dbraw/zinc/33/29/58/188332958.db2.gz	MZVFWLVNRVZBAR-JTQLQIEISA-N	0	1	211.309	-0.076	10	30		BBEEMN
C[C@@H]1CC[C@H](C(N)=O)CN1/C(N)=N/O	ZINC000052834099	353109130	/nfs/dbraw/zinc/10/91/30/353109130.db2.gz	QUTXNONPZZSEIA-RITPCOANSA-N	0	1	200.242	-0.724	10	30		BBEEMN
C[C@H]1CC[C@H](C(N)=O)CN1/C(N)=N/O	ZINC000052834101	353108928	/nfs/dbraw/zinc/10/89/28/353108928.db2.gz	QUTXNONPZZSEIA-WDSKDSINSA-N	0	1	200.242	-0.724	10	30		BBEEMN
C[C@@H]1CC[C@@H](C(N)=O)CN1/C(N)=N/O	ZINC000052834103	353109066	/nfs/dbraw/zinc/10/90/66/353109066.db2.gz	QUTXNONPZZSEIA-PHDIDXHHSA-N	0	1	200.242	-0.724	10	30		BBEEMN
C[C@H]1CC[C@@H](C(N)=O)CN1/C(N)=N/O	ZINC000052834105	353108904	/nfs/dbraw/zinc/10/89/04/353108904.db2.gz	QUTXNONPZZSEIA-NTSWFWBYSA-N	0	1	200.242	-0.724	10	30		BBEEMN
C#CCNCCn1nc2ccccn2c1=O	ZINC000053523354	166187656	/nfs/dbraw/zinc/18/76/56/166187656.db2.gz	SYQTZJULTAJWHU-UHFFFAOYSA-N	0	1	216.244	-0.281	10	30		BBEEMN
C#CCNCCN1CCCS1(=O)=O	ZINC000053532626	166187888	/nfs/dbraw/zinc/18/78/88/166187888.db2.gz	PDPPQIYRNQVMBS-UHFFFAOYSA-N	0	1	202.279	-0.755	10	30		BBEEMN
N=C(N)Nc1nnc2[nH]c(=O)c3ccccc3n12	ZINC000057353864	181324980	/nfs/dbraw/zinc/32/49/80/181324980.db2.gz	IVUIKCKBGAPSOP-UHFFFAOYSA-N	0	1	243.230	-0.112	10	30		BBEEMN
C[N+]1(CCNC(=O)/C=N/[O-])CCOCC1	ZINC000059182066	717131601	/nfs/dbraw/zinc/13/16/01/717131601.db2.gz	IMVVMGMYGNIASD-UHFFFAOYSA-O	0	1	216.261	-0.961	10	30		BBEEMN
C#CC(=O)N1CCC[N@H+](CC(=O)[O-])CC1	ZINC000061125990	166108366	/nfs/dbraw/zinc/10/83/66/166108366.db2.gz	ASQNMCHMRDIHHR-UHFFFAOYSA-N	0	1	210.233	-0.762	10	30		BBEEMN
C#CCNC(=O)N1CCC[N@H+](CC(=O)[O-])CC1	ZINC000061145295	166175223	/nfs/dbraw/zinc/17/52/23/166175223.db2.gz	DTMCSFPPVBFSBN-UHFFFAOYSA-N	0	1	239.275	-0.579	10	30		BBEEMN
C[C@@H](C#N)N1CCC[N@@H+](CC(=O)[O-])CC1	ZINC000061146152	384308597	/nfs/dbraw/zinc/30/85/97/384308597.db2.gz	YYLYMUAHYAVEAC-VIFPVBQESA-N	0	1	211.265	-0.009	10	30		BBEEMN
C[C@H](C#N)N1CCC[N@@H+](CC(=O)[O-])CC1	ZINC000061146153	384308115	/nfs/dbraw/zinc/30/81/15/384308115.db2.gz	YYLYMUAHYAVEAC-SECBINFHSA-N	0	1	211.265	-0.009	10	30		BBEEMN
C#CCNCCn1nc2n(c1=O)CCCC2	ZINC000061817849	166188054	/nfs/dbraw/zinc/18/80/54/166188054.db2.gz	CZCOCHYAMHYJQZ-UHFFFAOYSA-N	0	1	220.276	-0.396	10	30		BBEEMN
N/C(=N/O)c1ncn(CC(F)(F)F)n1	ZINC000061843701	345959297	/nfs/dbraw/zinc/95/92/97/345959297.db2.gz	PZSIINYAKMSVOY-UHFFFAOYSA-N	0	1	209.131	-0.065	10	30		BBEEMN
C#CCN[C@]1(C(=O)[O-])CC[N@H+](C2CC2)C1	ZINC000061991690	166192934	/nfs/dbraw/zinc/19/29/34/166192934.db2.gz	CXOLWGXEYWZWMT-LLVKDONJSA-N	0	1	208.261	-0.099	10	30		BBEEMN
C#CCN[C@@]1(C(=O)[O-])CC[N@H+](C2CC2)C1	ZINC000061991691	166191393	/nfs/dbraw/zinc/19/13/93/166191393.db2.gz	CXOLWGXEYWZWMT-NSHDSACASA-N	0	1	208.261	-0.099	10	30		BBEEMN
C=C(C[N@H+]1CCNC(=O)C1(C)C)C(=O)[O-]	ZINC000069907995	361001281	/nfs/dbraw/zinc/00/12/81/361001281.db2.gz	IRFVOCPGXPKPPP-UHFFFAOYSA-N	0	1	212.249	-0.162	10	30		BBEEMN
C=C(C[N@@H+]1CCNC(=O)C1(C)C)C(=O)[O-]	ZINC000069907995	361001278	/nfs/dbraw/zinc/00/12/78/361001278.db2.gz	IRFVOCPGXPKPPP-UHFFFAOYSA-N	0	1	212.249	-0.162	10	30		BBEEMN
CNC(=O)CCN1CCN(CC#N)CC1	ZINC000070994908	173254195	/nfs/dbraw/zinc/25/41/95/173254195.db2.gz	PTRSLRVSAJPOQJ-UHFFFAOYSA-N	0	1	210.281	-0.736	10	30		BBEEMN
COCCN1CCN([C@@H](C)/C(N)=N/O)CC1	ZINC000070995207	174310182	/nfs/dbraw/zinc/31/01/82/174310182.db2.gz	UQIWPWIFKJHBKM-VIFPVBQESA-N	0	1	230.312	-0.615	10	30		BBEEMN
COCCN1CCN([C@H](C)/C(N)=N/O)CC1	ZINC000070995209	174309797	/nfs/dbraw/zinc/30/97/97/174309797.db2.gz	UQIWPWIFKJHBKM-SECBINFHSA-N	0	1	230.312	-0.615	10	30		BBEEMN
CNC(=O)CCN1CCN([C@@H](C)C#N)CC1	ZINC000070995436	173253685	/nfs/dbraw/zinc/25/36/85/173253685.db2.gz	QTFTWSMPESOVDI-JTQLQIEISA-N	0	1	224.308	-0.348	10	30		BBEEMN
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C#CCCS(=O)(=O)N1CC[C@H](N(C)C)C1	ZINC000711015414	712274857	/nfs/dbraw/zinc/27/48/57/712274857.db2.gz	CPJUCEAOKYIHQE-JTQLQIEISA-N	0	1	230.333	-0.025	10	30		BBEEMN
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N#CCS(=O)(=O)[N-]c1ccnn1C1C[NH2+]C1	ZINC000725258460	538074895	/nfs/dbraw/zinc/07/48/95/538074895.db2.gz	PWBMPNHTPIQCTQ-UHFFFAOYSA-N	0	1	241.276	-0.707	10	30		BBEEMN
C#CCNCc1cc(C(=O)OC)nn1C	ZINC000757179417	586433743	/nfs/dbraw/zinc/43/37/43/586433743.db2.gz	FSOXPKOVSQBZOZ-UHFFFAOYSA-N	0	1	207.233	-0.071	10	30		BBEEMN
C#CCOCCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000900390310	584300246	/nfs/dbraw/zinc/30/02/46/584300246.db2.gz	BMFVEUKKUYSYDZ-SECBINFHSA-N	0	1	249.274	-0.097	10	30		BBEEMN
C#CCOCCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000900390312	584300572	/nfs/dbraw/zinc/30/05/72/584300572.db2.gz	BMFVEUKKUYSYDZ-VIFPVBQESA-N	0	1	249.274	-0.097	10	30		BBEEMN
C#CCO[C@H](C)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000900390439	584300660	/nfs/dbraw/zinc/30/06/60/584300660.db2.gz	NWAXYMRJZKXNBO-BDAKNGLRSA-N	0	1	249.274	-0.099	10	30		BBEEMN
C#CCO[C@@H](C)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000900390440	584300353	/nfs/dbraw/zinc/30/03/53/584300353.db2.gz	NWAXYMRJZKXNBO-DTWKUNHWSA-N	0	1	249.274	-0.099	10	30		BBEEMN
C#CCO[C@@H](C)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000900390442	584300534	/nfs/dbraw/zinc/30/05/34/584300534.db2.gz	NWAXYMRJZKXNBO-IUCAKERBSA-N	0	1	249.274	-0.099	10	30		BBEEMN
C#CCO[C@H](C)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000900390444	584300520	/nfs/dbraw/zinc/30/05/20/584300520.db2.gz	NWAXYMRJZKXNBO-RKDXNWHRSA-N	0	1	249.274	-0.099	10	30		BBEEMN