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)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1	ZINC000076855553	343367350	/nfs/dbraw/zinc/36/73/50/343367350.db2.gz	ZFQIZMFAWQDHMM-UHFFFAOYSA-N	2	1	232.371	2.649	40	0		BFABMP
CC[N@@H+]1CCC[C@H]1C[NH2+]CCCC1CCC1	ZINC000096528629	343758825	/nfs/dbraw/zinc/75/88/25/343758825.db2.gz	LXGYRBZUQNTFFV-AWEZNQCLSA-N	2	1	224.392	2.641	40	0		BFABMP
CC[N@H+]1CCC[C@H]1C[NH2+]CCCC1CCC1	ZINC000096528629	343758828	/nfs/dbraw/zinc/75/88/28/343758828.db2.gz	LXGYRBZUQNTFFV-AWEZNQCLSA-N	2	1	224.392	2.641	40	0		BFABMP
C(CC1CCCCC1)C[N@@H+]1CCC[NH2+]CC1	ZINC000096523657	187288502	/nfs/dbraw/zinc/28/85/02/187288502.db2.gz	PPENNRAGHQEHBP-UHFFFAOYSA-N	2	1	224.392	2.642	40	0		BFABMP
CCC[N@@H+](CC[C@@H]([NH3+])C(C)C)Cc1ccco1	ZINC000096523805	169169955	/nfs/dbraw/zinc/16/99/55/169169955.db2.gz	UKDZZCNKBUYJPD-CQSZACIVSA-N	2	1	238.375	2.865	40	0		BFABMP
C[NH+](C)CCC[N@H+]1C[C@@H]2CC[C@](C)(C1)C2(C)C	ZINC000005963962	384141237	/nfs/dbraw/zinc/14/12/37/384141237.db2.gz	XOLYOIFACSAJQL-DZGCQCFKSA-N	2	1	238.419	2.696	40	0		BFABMP
CC(C)[C@H]([NH3+])CC[N@H+]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000096523816	385266351	/nfs/dbraw/zinc/26/63/51/385266351.db2.gz	MLVPZLPJAZYUCD-RRFJBIMHSA-N	2	1	238.419	2.872	40	0		BFABMP
CC[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000053654027	170119862	/nfs/dbraw/zinc/11/98/62/170119862.db2.gz	SXJSLWBWMPKLCP-HNNXBMFYSA-N	2	1	232.371	2.508	40	0		BFABMP
C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1	ZINC000079437942	173321698	/nfs/dbraw/zinc/32/16/98/173321698.db2.gz	NIKPZJGGRIYLMS-UHFFFAOYSA-N	2	1	232.371	2.649	40	0		BFABMP
Cc1ccc(C[N@@H+]2CCCC[C@H]2C[NH3+])c(C)c1	ZINC000044539862	352354467	/nfs/dbraw/zinc/35/44/67/352354467.db2.gz	URFWSELDVWMLBS-HNNXBMFYSA-N	2	1	232.371	2.617	40	0		BFABMP
Cc1ccc(C[N@H+]2CCCC[C@H]2C[NH3+])c(C)c1	ZINC000044539862	352354469	/nfs/dbraw/zinc/35/44/69/352354469.db2.gz	URFWSELDVWMLBS-HNNXBMFYSA-N	2	1	232.371	2.617	40	0		BFABMP
CC(C)[N@H+](Cc1ccccc1)CC1CC[NH2+]CC1	ZINC000011953446	355771560	/nfs/dbraw/zinc/77/15/60/355771560.db2.gz	AYTKCKVUIWZKNR-UHFFFAOYSA-N	2	1	246.398	2.897	40	0		BFABMP
CCC[NH2+]CCC[C@@H]1CCC[N@H+]1CCC	ZINC000218328062	169258746	/nfs/dbraw/zinc/25/87/46/169258746.db2.gz	UBCYHLFYMMRJIV-CYBMUJFWSA-N	2	1	212.381	2.641	40	0		BFABMP
CCCC[NH2+]C[C@@H]1CCCC[N@@H+]1C(C)C	ZINC000022073526	384729189	/nfs/dbraw/zinc/72/91/89/384729189.db2.gz	FEGOLHOTBCMJKN-ZDUSSCGKSA-N	2	1	212.381	2.639	40	0		BFABMP
CCCC[NH2+]C[C@@H]1CCCC[N@H+]1C(C)C	ZINC000022073526	384729198	/nfs/dbraw/zinc/72/91/98/384729198.db2.gz	FEGOLHOTBCMJKN-ZDUSSCGKSA-N	2	1	212.381	2.639	40	0		BFABMP
CC(C)[C@@H]([NH3+])CC[N@H+]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000096523817	385266669	/nfs/dbraw/zinc/26/66/69/385266669.db2.gz	MLVPZLPJAZYUCD-ZNMIVQPWSA-N	2	1	238.419	2.872	40	0		BFABMP
CCC[C@H](N)C[N@@H+](CC)C1CCCCC1	ZINC000036873564	385587944	/nfs/dbraw/zinc/58/79/44/385587944.db2.gz	BRNZWPHGIOSMBX-LBPRGKRZSA-N	2	1	212.381	2.768	40	0		BFABMP
CC(C)[C@H]([NH3+])CC[N@H+]1CC[C@H]2CCCC[C@H]2C1	ZINC000251322003	388642561	/nfs/dbraw/zinc/64/25/61/388642561.db2.gz	MLVPZLPJAZYUCD-QLFBSQMISA-N	2	1	238.419	2.872	40	0		BFABMP
C[C@H](c1cccc(Cl)c1)[NH+]1CCC([NH3+])CC1	ZINC000020521578	177037020	/nfs/dbraw/zinc/03/70/20/177037020.db2.gz	YNQJJCVFBJMULD-SNVBAGLBSA-N	2	1	238.762	2.824	40	0		BFABMP
[NH3+]CCCCC[N@@H+]1CC=C(c2ccccc2)CC1	ZINC000096523832	181374680	/nfs/dbraw/zinc/37/46/80/181374680.db2.gz	LPDQDALUYAEOSH-UHFFFAOYSA-N	2	1	244.382	2.905	40	0		BFABMP
[NH3+]CCCC[N@@H+](Cc1ccco1)C1CCCC1	ZINC000096523763	181376921	/nfs/dbraw/zinc/37/69/21/181376921.db2.gz	CLZGZYPIDBDFDH-UHFFFAOYSA-N	2	1	236.359	2.763	40	0		BFABMP
CCC[N@H+]1CCC[C@H]1CCC[NH2+]C(C)C	ZINC000218327968	169200570	/nfs/dbraw/zinc/20/05/70/169200570.db2.gz	VAVKBIJHUZSZFZ-CYBMUJFWSA-N	2	1	212.381	2.639	40	0		BFABMP
CC(C)[N@H+](Cc1ccccc1)C[C@@H]1CC[NH2+]C1	ZINC000051889895	383844460	/nfs/dbraw/zinc/84/44/60/383844460.db2.gz	FWAOJFGDTNTJHN-OAHLLOKOSA-N	2	1	232.371	2.507	40	0		BFABMP
CCC[N@@H+](CCCCCC[NH3+])CC1CC1	ZINC000042491171	384151507	/nfs/dbraw/zinc/15/15/07/384151507.db2.gz	LDPRTOGAZYFZFV-UHFFFAOYSA-N	2	1	212.381	2.628	40	0		BFABMP
CCCC[NH2+]C[C@@H]1CCCC[N@@H+]1CCC	ZINC000022073518	384731119	/nfs/dbraw/zinc/73/11/19/384731119.db2.gz	KZKXGHWQGDBVPP-ZDUSSCGKSA-N	2	1	212.381	2.641	40	0		BFABMP
CCCC[NH2+]C[C@@H]1CCCC[N@H+]1CCC	ZINC000022073518	384731124	/nfs/dbraw/zinc/73/11/24/384731124.db2.gz	KZKXGHWQGDBVPP-ZDUSSCGKSA-N	2	1	212.381	2.641	40	0		BFABMP
[NH3+]C[C@H]1CCCC[N@@H+]1CCCC1CCCC1	ZINC000096523608	385266625	/nfs/dbraw/zinc/26/66/25/385266625.db2.gz	XCTMDUXGPXQKCX-CQSZACIVSA-N	2	1	224.392	2.770	40	0		BFABMP
[NH3+]C[C@H]1CCCC[N@H+]1CCCC1CCCC1	ZINC000096523608	385266635	/nfs/dbraw/zinc/26/66/35/385266635.db2.gz	XCTMDUXGPXQKCX-CQSZACIVSA-N	2	1	224.392	2.770	40	0		BFABMP
[NH3+]CCCCC[N@H+]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000049580735	386796983	/nfs/dbraw/zinc/79/69/83/386796983.db2.gz	VXEUCYLCEJAUIV-UONOGXRCSA-N	2	1	224.392	2.628	40	0		BFABMP
CC[C@@H](C)[C@@H]([NH3+])C[N@H+](C)CCc1ccccc1	ZINC000088243047	386947147	/nfs/dbraw/zinc/94/71/47/386947147.db2.gz	CKSJPVOOZAFKCS-HIFRSBDPSA-N	2	1	234.387	2.534	40	0		BFABMP
CC[C@@H](C)[C@@H]([NH3+])C[N@@H+](C)CCc1ccccc1	ZINC000088243047	386947154	/nfs/dbraw/zinc/94/71/54/386947154.db2.gz	CKSJPVOOZAFKCS-HIFRSBDPSA-N	2	1	234.387	2.534	40	0		BFABMP
CCCC[N@H+]1CCC[C@@H]1CCC[NH2+]CC	ZINC000218328985	487507100	/nfs/dbraw/zinc/50/71/00/487507100.db2.gz	QPSBICNYLVMZSJ-ZDUSSCGKSA-N	2	1	212.381	2.641	40	0		BFABMP
CC[NH+](CC)CCC[N@@H+]1C[C@@H]2CC=CC[C@@H]2C1	ZINC000001682900	342708851	/nfs/dbraw/zinc/70/88/51/342708851.db2.gz	NVGQUWPDTMATND-GASCZTMLSA-N	2	1	236.403	2.616	40	0		BFABMP
CC[C@@H](c1ccccc1)[N@H+](CC[NH3+])C(C)C	ZINC000079421238	343400258	/nfs/dbraw/zinc/40/02/58/343400258.db2.gz	OGQBHXGLPYWSKR-AWEZNQCLSA-N	2	1	220.360	2.807	40	0		BFABMP
CC[C@@H](c1ccccc1)[N@@H+](CC[NH3+])C(C)C	ZINC000079421238	343400262	/nfs/dbraw/zinc/40/02/62/343400262.db2.gz	OGQBHXGLPYWSKR-AWEZNQCLSA-N	2	1	220.360	2.807	40	0		BFABMP
Cc1cccc(Cl)c1C[NH+]1CCC([NH3+])CC1	ZINC000038539933	179107306	/nfs/dbraw/zinc/10/73/06/179107306.db2.gz	ADSSOLIPZWRZGL-UHFFFAOYSA-N	2	1	238.762	2.572	40	0		BFABMP
Cc1[nH+]ccn1CCC1CC[NH+](C(C)C)CC1	ZINC000072367717	180233813	/nfs/dbraw/zinc/23/38/13/180233813.db2.gz	MWYNQCHWKUNETA-UHFFFAOYSA-N	2	1	235.375	2.702	40	0		BFABMP
C[N@@H+]1CCCCC[C@@H]2[NH2+]C[C@@H](c3ccccc3)[C@@H]21	ZINC000205680831	368356678	/nfs/dbraw/zinc/35/66/78/368356678.db2.gz	DZRGZBMMJQBUCX-JYJNAYRXSA-N	2	1	244.382	2.616	40	0		BFABMP
C[N@H+]1CCCCC[C@@H]2[NH2+]C[C@@H](c3ccccc3)[C@@H]21	ZINC000205680831	368356693	/nfs/dbraw/zinc/35/66/93/368356693.db2.gz	DZRGZBMMJQBUCX-JYJNAYRXSA-N	2	1	244.382	2.616	40	0		BFABMP
C[N@@H+](CC1(N)CCCCC1)C1CCCCC1	ZINC000020073206	371226856	/nfs/dbraw/zinc/22/68/56/371226856.db2.gz	SBGHNSJEWJKOLN-UHFFFAOYSA-N	2	1	224.392	2.913	40	0		BFABMP
CN(CC1([NH3+])CCCCC1)C1CCCCC1	ZINC000020073206	371226860	/nfs/dbraw/zinc/22/68/60/371226860.db2.gz	SBGHNSJEWJKOLN-UHFFFAOYSA-N	2	1	224.392	2.913	40	0		BFABMP
CCC[N@@H+](CCCCC[NH3+])Cc1ccco1	ZINC000096523836	169153757	/nfs/dbraw/zinc/15/37/57/169153757.db2.gz	ZHBVZEKVPCUCRD-UHFFFAOYSA-N	2	1	224.348	2.621	40	0		BFABMP
C[NH+](C)CCC[N@H+]1C[C@H]2CC[C@@](C)(C1)C2(C)C	ZINC000001694697	383926485	/nfs/dbraw/zinc/92/64/85/383926485.db2.gz	XOLYOIFACSAJQL-HIFRSBDPSA-N	2	1	238.419	2.696	40	0		BFABMP
CCCC[NH2+]C[C@H]1CCCC[N@@H+]1CCC	ZINC000022073520	384730595	/nfs/dbraw/zinc/73/05/95/384730595.db2.gz	KZKXGHWQGDBVPP-CYBMUJFWSA-N	2	1	212.381	2.641	40	0		BFABMP
CCCC[NH2+]C[C@H]1CCCC[N@H+]1CCC	ZINC000022073520	384730599	/nfs/dbraw/zinc/73/05/99/384730599.db2.gz	KZKXGHWQGDBVPP-CYBMUJFWSA-N	2	1	212.381	2.641	40	0		BFABMP
CC[NH+](CC)[C@@H](CN)c1cccc(Cl)c1	ZINC000038809129	386141054	/nfs/dbraw/zinc/14/10/54/386141054.db2.gz	GLBVFNUJUIUURU-LBPRGKRZSA-N	2	1	226.751	2.682	40	0		BFABMP
[NH3+]C[C@@H]1CCC[N@@H+](CC/C=C/c2ccccc2)C1	ZINC000079439941	387855116	/nfs/dbraw/zinc/85/51/16/387855116.db2.gz	WDEPYOVOHZGLFB-UFNQUYMESA-N	2	1	244.382	2.761	40	0		BFABMP
C([C@H]1CCCC[NH2+]1)[N@H+]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000216241950	388354535	/nfs/dbraw/zinc/35/45/35/388354535.db2.gz	SMFJJXNFNWYQPN-RRFJBIMHSA-N	2	1	236.403	2.641	40	0		BFABMP
CC[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000053654031	170123023	/nfs/dbraw/zinc/12/30/23/170123023.db2.gz	SXJSLWBWMPKLCP-OAHLLOKOSA-N	2	1	232.371	2.508	40	0		BFABMP
COc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2[NH3+])cc1	ZINC000218868700	175189116	/nfs/dbraw/zinc/18/91/16/175189116.db2.gz	VQTRNMZJWYDLFO-TUKIKUTGSA-N	2	1	248.370	2.616	40	0		BFABMP
C[C@@H]1CCC2(C1)CC[NH+](CCC[NH+](C)C)CC2	ZINC000004958226	176062499	/nfs/dbraw/zinc/06/24/99/176062499.db2.gz	QGHXAGOEEIKNCZ-CQSZACIVSA-N	2	1	238.419	2.840	40	0		BFABMP
Cc1cc(NCCC[NH3+])c2cccc(Cl)c2[nH+]1	ZINC000222687249	178159376	/nfs/dbraw/zinc/15/93/76/178159376.db2.gz	DOMDHGXJKBLGLR-UHFFFAOYSA-N	2	1	249.745	2.957	40	0		BFABMP
CC(C)[N@H+](Cc1ccccc1)[C@H]1CCC[NH2+]C1	ZINC000079437967	187281056	/nfs/dbraw/zinc/28/10/56/187281056.db2.gz	BVHFAXPBYLIMEG-HNNXBMFYSA-N	2	1	232.371	2.649	40	0		BFABMP
CC(C)[N@@H+](Cc1ccccc1)[C@H]1CCC[NH2+]C1	ZINC000079437967	187281058	/nfs/dbraw/zinc/28/10/58/187281058.db2.gz	BVHFAXPBYLIMEG-HNNXBMFYSA-N	2	1	232.371	2.649	40	0		BFABMP
Cc1ccc([C@H](CN)[N@H+]2CCC[C@H](C)C2)cc1	ZINC000038827564	350324385	/nfs/dbraw/zinc/32/43/85/350324385.db2.gz	VZNUIVSRDUUPPL-ZFWWWQNUSA-N	2	1	232.371	2.727	40	0		BFABMP
Cc1ccc([C@H](C[NH3+])N2CCC[C@H](C)C2)cc1	ZINC000038827564	350324388	/nfs/dbraw/zinc/32/43/88/350324388.db2.gz	VZNUIVSRDUUPPL-ZFWWWQNUSA-N	2	1	232.371	2.727	40	0		BFABMP
CCC[N@H+]1CCC[C@@H]1CCC[NH2+]C(C)C	ZINC000218327892	169196359	/nfs/dbraw/zinc/19/63/59/169196359.db2.gz	VAVKBIJHUZSZFZ-ZDUSSCGKSA-N	2	1	212.381	2.639	40	0		BFABMP
c1cc(C2CC[NH2+]CC2)cc(NC2CCCC2)[nH+]1	ZINC000072386453	183337095	/nfs/dbraw/zinc/33/70/95/183337095.db2.gz	ZQWFTUUYCFSGRN-UHFFFAOYSA-N	2	1	245.370	2.903	40	0		BFABMP
CCCC[N@@H+]1CCCC[C@H]1C[NH2+]CCC	ZINC000022073503	384730057	/nfs/dbraw/zinc/73/00/57/384730057.db2.gz	XUKQUHJJQLWKKP-ZDUSSCGKSA-N	2	1	212.381	2.641	40	0		BFABMP
CCCC[N@H+]1CCCC[C@H]1C[NH2+]CCC	ZINC000022073503	384730064	/nfs/dbraw/zinc/73/00/64/384730064.db2.gz	XUKQUHJJQLWKKP-ZDUSSCGKSA-N	2	1	212.381	2.641	40	0		BFABMP
CCCC[N@@H+](CCCC[NH3+])Cc1ccco1	ZINC000096523766	385266865	/nfs/dbraw/zinc/26/68/65/385266865.db2.gz	UYQRHYGARZVFSW-UHFFFAOYSA-N	2	1	224.348	2.621	40	0		BFABMP
Cc1c[nH]c([C@@H]2CCC[N@@H+](CC(C)(C)C)C2)n1	ZINC000257228180	385754887	/nfs/dbraw/zinc/75/48/87/385754887.db2.gz	FSRRSSIBRQHSNG-GFCCVEGCSA-N	2	1	235.375	2.944	40	0		BFABMP
CCCC[N@H+]1CCC[C@H]1CCC[NH2+]C1CC1	ZINC000218329415	386040979	/nfs/dbraw/zinc/04/09/79/386040979.db2.gz	LVQBONBDHHYGJO-CQSZACIVSA-N	2	1	224.392	2.783	40	0		BFABMP
CC[NH+](CC)[C@H](CN)c1cccc(Cl)c1	ZINC000038809130	386141451	/nfs/dbraw/zinc/14/14/51/386141451.db2.gz	GLBVFNUJUIUURU-GFCCVEGCSA-N	2	1	226.751	2.682	40	0		BFABMP
CC(C)C[C@H]([NH3+])C[N@H+](C)CCc1ccccc1	ZINC000088243073	386947362	/nfs/dbraw/zinc/94/73/62/386947362.db2.gz	JXNOAOYAJFEBCE-HNNXBMFYSA-N	2	1	234.387	2.534	40	0		BFABMP
CC(C)C[C@H]([NH3+])C[N@@H+](C)CCc1ccccc1	ZINC000088243073	386947367	/nfs/dbraw/zinc/94/73/67/386947367.db2.gz	JXNOAOYAJFEBCE-HNNXBMFYSA-N	2	1	234.387	2.534	40	0		BFABMP
COc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@H]2[NH3+])cc1	ZINC000242688501	388400618	/nfs/dbraw/zinc/40/06/18/388400618.db2.gz	VQTRNMZJWYDLFO-GLQYFDAESA-N	2	1	248.370	2.616	40	0		BFABMP
CCCC[N@H+]1CCC[C@@H]1CCC[NH2+]C1CC1	ZINC000218329336	388580977	/nfs/dbraw/zinc/58/09/77/388580977.db2.gz	LVQBONBDHHYGJO-AWEZNQCLSA-N	2	1	224.392	2.783	40	0		BFABMP
C[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+]C1CCCCC1)C2	ZINC000000027588	173206566	/nfs/dbraw/zinc/20/65/66/173206566.db2.gz	WGUYSKWWJNQJSC-AGUYFDCRSA-N	2	1	222.376	2.534	40	0		BFABMP
CC[NH+](CC)CCC[N@@H+]1C[C@@H]2CCCC[C@@H]2C1	ZINC000001676239	342708244	/nfs/dbraw/zinc/70/82/44/342708244.db2.gz	JPQGOWFNIVVTHE-GASCZTMLSA-N	2	1	238.419	2.840	40	0		BFABMP
Cc1c(Cl)cccc1C[NH+]1CCC([NH3+])CC1	ZINC000038539518	362963413	/nfs/dbraw/zinc/96/34/13/362963413.db2.gz	OOFLPNMWCYHBSP-UHFFFAOYSA-N	2	1	238.762	2.572	40	0		BFABMP
[NH3+]CCC[N@H+]1CCC[C@H]1c1ccc(Cl)cc1	ZINC000012398994	181381530	/nfs/dbraw/zinc/38/15/30/181381530.db2.gz	QGPYZCNSGHUMTF-ZDUSSCGKSA-N	2	1	238.762	2.826	40	0		BFABMP
CC(C)[C@H]([NH3+])CC[N@H+]1CC[C@H]2CCCC[C@@H]2C1	ZINC000110764201	369978470	/nfs/dbraw/zinc/97/84/70/369978470.db2.gz	MLVPZLPJAZYUCD-RBSFLKMASA-N	2	1	238.419	2.872	40	0		BFABMP
c1ccc(C[N@@H+]2CCC[C@H](C[NH2+]C3CC3)C2)cc1	ZINC000053656314	183399800	/nfs/dbraw/zinc/39/98/00/183399800.db2.gz	OONHGXTVFVGLND-OAHLLOKOSA-N	2	1	244.382	2.651	40	0		BFABMP
C[NH+](C)CCC[NH+]1CCC2(CCCCC2)CC1	ZINC000001697460	383925408	/nfs/dbraw/zinc/92/54/08/383925408.db2.gz	HLQZGVFXXFVXIB-UHFFFAOYSA-N	2	1	238.419	2.984	40	0		BFABMP
C[NH2+][C@H]1CC[C@H]([N@@H+](C)Cc2ccccc2)CC1	ZINC000100178673	384278872	/nfs/dbraw/zinc/27/88/72/384278872.db2.gz	NIKPZJGGRIYLMS-GASCZTMLSA-N	2	1	232.371	2.649	40	0		BFABMP
CCCC[NH2+]C[C@H]1CCC[N@@H+]1CCCC	ZINC000022073442	384730933	/nfs/dbraw/zinc/73/09/33/384730933.db2.gz	VKEQMYAKYWEWNZ-CYBMUJFWSA-N	2	1	212.381	2.641	40	0		BFABMP
CCCC[NH2+]C[C@H]1CCC[N@H+]1CCCC	ZINC000022073442	384730940	/nfs/dbraw/zinc/73/09/40/384730940.db2.gz	VKEQMYAKYWEWNZ-CYBMUJFWSA-N	2	1	212.381	2.641	40	0		BFABMP
CCCC[N@@H+]1CCCC[C@@H]1C[NH2+]CCC	ZINC000022073501	384731479	/nfs/dbraw/zinc/73/14/79/384731479.db2.gz	XUKQUHJJQLWKKP-CYBMUJFWSA-N	2	1	212.381	2.641	40	0		BFABMP
CCCC[N@H+]1CCCC[C@@H]1C[NH2+]CCC	ZINC000022073501	384731488	/nfs/dbraw/zinc/73/14/88/384731488.db2.gz	XUKQUHJJQLWKKP-CYBMUJFWSA-N	2	1	212.381	2.641	40	0		BFABMP
[NH3+][C@H]1CCC[N@H+](CCCC2CCCCC2)C1	ZINC000096523556	385268839	/nfs/dbraw/zinc/26/88/39/385268839.db2.gz	XWXZLCLTCUMICJ-AWEZNQCLSA-N	2	1	224.392	2.770	40	0		BFABMP
[NH3+][C@H]1CCC[N@@H+](CCCC2CCCCC2)C1	ZINC000096523556	385268842	/nfs/dbraw/zinc/26/88/42/385268842.db2.gz	XWXZLCLTCUMICJ-AWEZNQCLSA-N	2	1	224.392	2.770	40	0		BFABMP
[NH3+]C[C@@H]1CCCC[N@@H+]1CCCC1CCCC1	ZINC000096523609	385269567	/nfs/dbraw/zinc/26/95/67/385269567.db2.gz	XCTMDUXGPXQKCX-AWEZNQCLSA-N	2	1	224.392	2.770	40	0		BFABMP
[NH3+]C[C@@H]1CCCC[N@H+]1CCCC1CCCC1	ZINC000096523609	385269572	/nfs/dbraw/zinc/26/95/72/385269572.db2.gz	XCTMDUXGPXQKCX-AWEZNQCLSA-N	2	1	224.392	2.770	40	0		BFABMP
C[N@@H+](Cc1ccc(C[NH3+])cc1)C1CCCCC1	ZINC000021951906	385884182	/nfs/dbraw/zinc/88/41/82/385884182.db2.gz	HUCVAHANYIMLJC-UHFFFAOYSA-N	2	1	232.371	2.910	40	0		BFABMP
Cc1cc(Cl)cc2c(NCC[NH3+])cc[nH+]c12	ZINC000222679726	386059006	/nfs/dbraw/zinc/05/90/06/386059006.db2.gz	JFEWHQYFXCCRFW-UHFFFAOYSA-N	2	1	235.718	2.567	40	0		BFABMP
[NH3+]CCCCC[N@H+]1CC[C@H]2CCCC[C@H]2C1	ZINC000250883401	388641199	/nfs/dbraw/zinc/64/11/99/388641199.db2.gz	VXEUCYLCEJAUIV-KGLIPLIRSA-N	2	1	224.392	2.628	40	0		BFABMP
C([C@H]1CCCC[NH2+]1)[N@H+]1CC[C@H]2CCCC[C@H]2C1	ZINC000252470047	388652279	/nfs/dbraw/zinc/65/22/79/388652279.db2.gz	SMFJJXNFNWYQPN-QLFBSQMISA-N	2	1	236.403	2.641	40	0		BFABMP
C[C@@H]1C[C@H]([NH2+]Cc2ccccc2)[C@@H](C)C[N@H+]1C	ZINC000003684618	177238268	/nfs/dbraw/zinc/23/82/68/177238268.db2.gz	WSVFANOWQHGVOH-GUTXKFCHSA-N	2	1	232.371	2.505	40	0		BFABMP
CCCC[N@H+]1CCC[C@H]1CCC[NH2+]CC	ZINC000218329038	487506539	/nfs/dbraw/zinc/50/65/39/487506539.db2.gz	QPSBICNYLVMZSJ-CYBMUJFWSA-N	2	1	212.381	2.641	40	0		BFABMP
C[NH2+][C@H]1CC[C@H]([N@@H+](C)Cc2ccccc2)CC1	ZINC000242574896	522505704	/nfs/dbraw/zinc/50/57/04/522505704.db2.gz	NIKPZJGGRIYLMS-SHTZXODSSA-N	2	1	232.371	2.649	40	0		BFABMP
C[N@H+](CCc1ccccc1)CC[C@@H]1CCC[NH2+]C1	ZINC000088195286	631301236	/nfs/dbraw/zinc/30/12/36/631301236.db2.gz	RPXTUQFHASRNAD-INIZCTEOSA-N	2	1	246.398	2.551	40	0		BFABMP
Cc1cc(Cl)cc2c(NCCC[NH3+])cc[nH+]c12	ZINC000222679834	188356889	/nfs/dbraw/zinc/35/68/89/188356889.db2.gz	PFRVFCLNYFIRBV-UHFFFAOYSA-N	2	1	249.745	2.957	40	0		BFABMP
[NH3+]CCC[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000012398993	181380951	/nfs/dbraw/zinc/38/09/51/181380951.db2.gz	QGPYZCNSGHUMTF-CYBMUJFWSA-N	2	1	238.762	2.826	40	0		BFABMP
CCC[NH2+]CCC[C@H]1CCC[N@H+]1CCC	ZINC000218328134	169258484	/nfs/dbraw/zinc/25/84/84/169258484.db2.gz	UBCYHLFYMMRJIV-ZDUSSCGKSA-N	2	1	212.381	2.641	40	0		BFABMP
Cc1c[nH]c([C@@H]2CCC[N@@H+](CC3CCC3)C2)n1	ZINC000257340403	385764450	/nfs/dbraw/zinc/76/44/50/385764450.db2.gz	ZFXGYHPCUAPVDA-CYBMUJFWSA-N	2	1	233.359	2.698	40	0		BFABMP
CCC[C@H]([NH3+])C[N@H+](CC)Cc1ccccc1	ZINC000036873612	385822689	/nfs/dbraw/zinc/82/26/89/385822689.db2.gz	OEIYBGFYNGSRTL-AWEZNQCLSA-N	2	1	220.360	2.636	40	0		BFABMP
CCC[C@H]([NH3+])C[N@@H+](CC)Cc1ccccc1	ZINC000036873612	385822693	/nfs/dbraw/zinc/82/26/93/385822693.db2.gz	OEIYBGFYNGSRTL-AWEZNQCLSA-N	2	1	220.360	2.636	40	0		BFABMP
C[N@H+](CCc1ccccc1)CC1([NH3+])CCCCC1	ZINC000088243049	386947581	/nfs/dbraw/zinc/94/75/81/386947581.db2.gz	COPBDFNMLBPKSH-UHFFFAOYSA-N	2	1	246.398	2.823	40	0		BFABMP
C[N@@H+](CCc1ccccc1)CC1([NH3+])CCCCC1	ZINC000088243049	386947585	/nfs/dbraw/zinc/94/75/85/386947585.db2.gz	COPBDFNMLBPKSH-UHFFFAOYSA-N	2	1	246.398	2.823	40	0		BFABMP
CC(C)[C@@H]([NH3+])CC[N@@H+](C)C1CCCCC1	ZINC000058058256	388374394	/nfs/dbraw/zinc/37/43/94/388374394.db2.gz	GYWLGCSROGMVQV-ZDUSSCGKSA-N	2	1	212.381	2.624	40	0		BFABMP
COc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@@H]2[NH3+])cc1	ZINC000218868633	175176602	/nfs/dbraw/zinc/17/66/02/175176602.db2.gz	VQTRNMZJWYDLFO-BYCMXARLSA-N	2	1	248.370	2.616	40	0		BFABMP
COc1ccc([C@@H](C)[NH2+][C@H]2CCCC[C@@H]2[NH3+])cc1	ZINC000218868763	175177614	/nfs/dbraw/zinc/17/76/14/175177614.db2.gz	VQTRNMZJWYDLFO-UGFHNGPFSA-N	2	1	248.370	2.616	40	0		BFABMP
CCCC[NH2+]CCC[C@H]1CCC[N@H+]1CC	ZINC000218327223	487506977	/nfs/dbraw/zinc/50/69/77/487506977.db2.gz	VJKFVRTZMYWALJ-ZDUSSCGKSA-N	2	1	212.381	2.641	40	0		BFABMP
Cc1cc(NCC[NH3+])c2cccc(Cl)c2[nH+]1	ZINC000222687158	178162090	/nfs/dbraw/zinc/16/20/90/178162090.db2.gz	YCXZTBDUBQUOLS-UHFFFAOYSA-N	2	1	235.718	2.567	40	0		BFABMP
CC(C)[N@H+](Cc1ccccc1)C[C@H]1CC[NH2+]C1	ZINC000051889897	188299985	/nfs/dbraw/zinc/29/99/85/188299985.db2.gz	FWAOJFGDTNTJHN-HNNXBMFYSA-N	2	1	232.371	2.507	40	0		BFABMP
[NH3+]CCCC[N@@H+]1CC=C(c2ccccc2)CC1	ZINC000034537086	181376172	/nfs/dbraw/zinc/37/61/72/181376172.db2.gz	LFZMBABTDDPRJG-UHFFFAOYSA-N	2	1	230.355	2.515	40	0		BFABMP
c1ccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)cc1	ZINC000079438017	183396421	/nfs/dbraw/zinc/39/64/21/183396421.db2.gz	HMRSLQPQXNFITK-HNNXBMFYSA-N	2	1	244.382	2.651	40	0		BFABMP
c1ccc(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)cc1	ZINC000003956260	183396877	/nfs/dbraw/zinc/39/68/77/183396877.db2.gz	QIQMOZPPWNBFSR-UHFFFAOYSA-N	2	1	244.382	2.652	40	0		BFABMP
Cc1c[nH]c([C@H]2CCC[N@@H+](CC(C)(C)C)C2)n1	ZINC000257228181	385756086	/nfs/dbraw/zinc/75/60/86/385756086.db2.gz	FSRRSSIBRQHSNG-LBPRGKRZSA-N	2	1	235.375	2.944	40	0		BFABMP
CC(C)[C@H]([NH3+])CC[N@H+]1CC[C@@H]2CCCC[C@H]2C1	ZINC000251322004	388642928	/nfs/dbraw/zinc/64/29/28/388642928.db2.gz	MLVPZLPJAZYUCD-SOUVJXGZSA-N	2	1	238.419	2.872	40	0		BFABMP
C[N@H+](CCc1ccccc1)CC[C@H]1CCC[NH2+]C1	ZINC000088195301	491125450	/nfs/dbraw/zinc/12/54/50/491125450.db2.gz	RPXTUQFHASRNAD-MRXNPFEDSA-N	2	1	246.398	2.551	40	0		BFABMP
c1cc(NC2CCCC2)cc(C2CC[NH2+]CC2)[nH+]1	ZINC000072386450	188131319	/nfs/dbraw/zinc/13/13/19/188131319.db2.gz	KPPHEKHJUWJYQC-UHFFFAOYSA-N	2	1	245.370	2.903	40	0		BFABMP
[NH3+]C1(C[N@@H+]2CCc3ccccc3C2)CCCCC1	ZINC000020073142	181331123	/nfs/dbraw/zinc/33/11/23/181331123.db2.gz	FKBGULFSUSQTNW-UHFFFAOYSA-N	2	1	244.382	2.706	40	0		BFABMP
[NH3+]C1(C[N@H+]2CCc3ccccc3C2)CCCCC1	ZINC000020073142	181331126	/nfs/dbraw/zinc/33/11/26/181331126.db2.gz	FKBGULFSUSQTNW-UHFFFAOYSA-N	2	1	244.382	2.706	40	0		BFABMP
C[N@@H+](CCCCCC[NH3+])CCc1ccccc1	ZINC000088204527	386903187	/nfs/dbraw/zinc/90/31/87/386903187.db2.gz	WPINHPDTSRIMOT-UHFFFAOYSA-N	2	1	234.387	2.680	40	0		BFABMP
C([C@H]1CCCC[NH2+]1)[N@H+]1CC[C@@H]2CCCC[C@H]2C1	ZINC000252470048	388652935	/nfs/dbraw/zinc/65/29/35/388652935.db2.gz	SMFJJXNFNWYQPN-SOUVJXGZSA-N	2	1	236.403	2.641	40	0		BFABMP
CC(C)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000053655404	167115512	/nfs/dbraw/zinc/11/55/12/167115512.db2.gz	HIBAQIRRTMTEJV-MRXNPFEDSA-N	2	1	246.398	2.897	40	0		BFABMP
C[C@H]1C[C@](CC[NH3+])(c2ccccc2)[C@H](C)C[N@H+]1C	ZINC000004031406	177386698	/nfs/dbraw/zinc/38/66/98/177386698.db2.gz	XTILSTQWLFVMKB-YCPHGPKFSA-N	2	1	246.398	2.633	40	0		BFABMP
[NH3+]CCCNc1cc[nH+]c2ccc(Cl)cc12	ZINC000222678832	181383009	/nfs/dbraw/zinc/38/30/09/181383009.db2.gz	KLWNHIGQKAKWAW-UHFFFAOYSA-N	2	1	235.718	2.649	40	0		BFABMP
CC[C@H](c1ccccc1)[N@H+](CC[NH3+])C(C)C	ZINC000079421242	384144432	/nfs/dbraw/zinc/14/44/32/384144432.db2.gz	OGQBHXGLPYWSKR-CQSZACIVSA-N	2	1	220.360	2.807	40	0		BFABMP
CC[C@H](c1ccccc1)[N@@H+](CC[NH3+])C(C)C	ZINC000079421242	384144437	/nfs/dbraw/zinc/14/44/37/384144437.db2.gz	OGQBHXGLPYWSKR-CQSZACIVSA-N	2	1	220.360	2.807	40	0		BFABMP
C[NH+](C)CC[C@@H]1CCC[C@@H]2CCCC[C@H]1[N@H+]2C	ZINC000045027645	385236255	/nfs/dbraw/zinc/23/62/55/385236255.db2.gz	XRCBEMFZCKZRLZ-SOUVJXGZSA-N	2	1	238.419	2.981	40	0		BFABMP
[NH3+][C@@H]1CCC[N@H+](CCCC2CCCCC2)C1	ZINC000096523557	385267306	/nfs/dbraw/zinc/26/73/06/385267306.db2.gz	XWXZLCLTCUMICJ-CQSZACIVSA-N	2	1	224.392	2.770	40	0		BFABMP
[NH3+][C@@H]1CCC[N@@H+](CCCC2CCCCC2)C1	ZINC000096523557	385267312	/nfs/dbraw/zinc/26/73/12/385267312.db2.gz	XWXZLCLTCUMICJ-CQSZACIVSA-N	2	1	224.392	2.770	40	0		BFABMP
Cc1c(Cl)ccc2c(NCC[NH3+])cc[nH+]c12	ZINC000222679467	386058772	/nfs/dbraw/zinc/05/87/72/386058772.db2.gz	RPUKBXWVEDTPKM-UHFFFAOYSA-N	2	1	235.718	2.567	40	0		BFABMP
c1ccc(C[N@H+]2CC[C@H](C3CC[NH2+]CC3)C2)cc1	ZINC000079065881	388653467	/nfs/dbraw/zinc/65/34/67/388653467.db2.gz	BGWCNBKHNSXEKS-INIZCTEOSA-N	2	1	244.382	2.508	40	0		BFABMP
[NH3+]C[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2)C1	ZINC000011888367	388711426	/nfs/dbraw/zinc/71/14/26/388711426.db2.gz	VTEAVAKPDJFANZ-GFCCVEGCSA-N	2	1	238.762	2.511	40	0		BFABMP
[NH3+]C[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)C1	ZINC000011888367	388711427	/nfs/dbraw/zinc/71/14/27/388711427.db2.gz	VTEAVAKPDJFANZ-GFCCVEGCSA-N	2	1	238.762	2.511	40	0		BFABMP
CC(C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000053012112	167115156	/nfs/dbraw/zinc/11/51/56/167115156.db2.gz	ATVZOUGWKFEKFL-OAHLLOKOSA-N	2	1	232.371	2.507	40	0		BFABMP
CC[C@H](C)[C@@H]([NH3+])C[N@H+](C)CCc1ccccc1	ZINC000088243048	171372652	/nfs/dbraw/zinc/37/26/52/171372652.db2.gz	CKSJPVOOZAFKCS-ZFWWWQNUSA-N	2	1	234.387	2.534	40	0		BFABMP
CC[C@H](C)[C@@H]([NH3+])C[N@@H+](C)CCc1ccccc1	ZINC000088243048	171372654	/nfs/dbraw/zinc/37/26/54/171372654.db2.gz	CKSJPVOOZAFKCS-ZFWWWQNUSA-N	2	1	234.387	2.534	40	0		BFABMP
C[C@H]1CCC2(C1)CC[NH+](CCC[NH+](C)C)CC2	ZINC000001621346	177069676	/nfs/dbraw/zinc/06/96/76/177069676.db2.gz	QGHXAGOEEIKNCZ-AWEZNQCLSA-N	2	1	238.419	2.840	40	0		BFABMP
C[C@H]1C[N@@H+](C)[C@@H](C)C[C@@]1(CC[NH3+])c1ccccc1	ZINC000013655990	177352462	/nfs/dbraw/zinc/35/24/62/177352462.db2.gz	XTILSTQWLFVMKB-OFQRWUPVSA-N	2	1	246.398	2.633	40	0		BFABMP
C[N@H+](Cc1ccccc1)CC1([NH3+])CCCCC1	ZINC000020072561	388755602	/nfs/dbraw/zinc/75/56/02/388755602.db2.gz	HYNOTTVGLDVPQJ-UHFFFAOYSA-N	2	1	232.371	2.780	40	0		BFABMP
C[N@@H+](Cc1ccccc1)CC1([NH3+])CCCCC1	ZINC000020072561	388755606	/nfs/dbraw/zinc/75/56/06/388755606.db2.gz	HYNOTTVGLDVPQJ-UHFFFAOYSA-N	2	1	232.371	2.780	40	0		BFABMP
CC(C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1	ZINC000019914617	167095441	/nfs/dbraw/zinc/09/54/41/167095441.db2.gz	ZHROKCZDDDWWNG-UHFFFAOYSA-N	2	1	232.371	2.649	40	0		BFABMP
CC[C@H](C)[C@H]([NH3+])C[N@H+](C)CCc1ccccc1	ZINC000088243046	171396298	/nfs/dbraw/zinc/39/62/98/171396298.db2.gz	CKSJPVOOZAFKCS-DZGCQCFKSA-N	2	1	234.387	2.534	40	0		BFABMP
CC[C@H](C)[C@H]([NH3+])C[N@@H+](C)CCc1ccccc1	ZINC000088243046	171396300	/nfs/dbraw/zinc/39/63/00/171396300.db2.gz	CKSJPVOOZAFKCS-DZGCQCFKSA-N	2	1	234.387	2.534	40	0		BFABMP
C[NH2+]CCCNc1cc[nH+]c2ccc(Cl)cc12	ZINC000222678909	173350025	/nfs/dbraw/zinc/35/00/25/173350025.db2.gz	YZOYBSIXXIJDKD-UHFFFAOYSA-N	2	1	249.745	2.910	40	0		BFABMP
C([C@@H]1CCCC[NH2+]1)[N@H+]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000036810187	347776159	/nfs/dbraw/zinc/77/61/59/347776159.db2.gz	SMFJJXNFNWYQPN-ZNMIVQPWSA-N	2	1	236.403	2.641	40	0		BFABMP
c1ccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)cc1	ZINC000079438013	183397312	/nfs/dbraw/zinc/39/73/12/183397312.db2.gz	HMRSLQPQXNFITK-OAHLLOKOSA-N	2	1	244.382	2.651	40	0		BFABMP
CCCC[NH2+]C[C@H]1CCCC[N@@H+]1C(C)C	ZINC000022073528	384730293	/nfs/dbraw/zinc/73/02/93/384730293.db2.gz	FEGOLHOTBCMJKN-CYBMUJFWSA-N	2	1	212.381	2.639	40	0		BFABMP
CCCC[NH2+]C[C@H]1CCCC[N@H+]1C(C)C	ZINC000022073528	384730299	/nfs/dbraw/zinc/73/02/99/384730299.db2.gz	FEGOLHOTBCMJKN-CYBMUJFWSA-N	2	1	212.381	2.639	40	0		BFABMP
CC(C)[C@@H]([NH3+])CC[N@@H+](C)CCc1ccccc1	ZINC000096523831	385268909	/nfs/dbraw/zinc/26/89/09/385268909.db2.gz	GHYFDUBQJPQCED-HNNXBMFYSA-N	2	1	234.387	2.534	40	0		BFABMP
CCC[C@@H]([NH3+])C[N@H+](CC)Cc1ccccc1	ZINC000036873613	385588752	/nfs/dbraw/zinc/58/87/52/385588752.db2.gz	OEIYBGFYNGSRTL-CQSZACIVSA-N	2	1	220.360	2.636	40	0		BFABMP
CCC[C@@H]([NH3+])C[N@@H+](CC)Cc1ccccc1	ZINC000036873613	385588756	/nfs/dbraw/zinc/58/87/56/385588756.db2.gz	OEIYBGFYNGSRTL-CQSZACIVSA-N	2	1	220.360	2.636	40	0		BFABMP
CCC[N@@H+](CC1CC1)CC1CCC(C[NH3+])CC1	ZINC000093426245	398060431	/nfs/dbraw/zinc/06/04/31/398060431.db2.gz	GDKMBXOGZHUMRS-UHFFFAOYSA-N	2	1	238.419	2.874	40	0		BFABMP
CC(C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000053012110	167113898	/nfs/dbraw/zinc/11/38/98/167113898.db2.gz	ATVZOUGWKFEKFL-HNNXBMFYSA-N	2	1	232.371	2.507	40	0		BFABMP
C[N@H+]1CCC[C@H]1CCC[NH2+]Cc1ccccc1	ZINC000218326160	173050309	/nfs/dbraw/zinc/05/03/09/173050309.db2.gz	XAPPWPXIGZUGFP-OAHLLOKOSA-N	2	1	232.371	2.651	40	0		BFABMP
C[N@@H+](CCCCCC[NH3+])Cc1ccccc1	ZINC000004226805	352608807	/nfs/dbraw/zinc/60/88/07/352608807.db2.gz	SNCAWXJEXXQAHH-UHFFFAOYSA-N	2	1	220.360	2.638	40	0		BFABMP
CC(C)[N@H+](Cc1ccccc1)[C@@H]1CCC[NH2+]C1	ZINC000079437961	188117780	/nfs/dbraw/zinc/11/77/80/188117780.db2.gz	BVHFAXPBYLIMEG-OAHLLOKOSA-N	2	1	232.371	2.649	40	0		BFABMP
CC(C)[N@@H+](Cc1ccccc1)[C@@H]1CCC[NH2+]C1	ZINC000079437961	188117782	/nfs/dbraw/zinc/11/77/82/188117782.db2.gz	BVHFAXPBYLIMEG-OAHLLOKOSA-N	2	1	232.371	2.649	40	0		BFABMP
Cc1ccc2nc(C3CC[NH+](C)CC3)[nH]c2c1	ZINC000072367682	384214770	/nfs/dbraw/zinc/21/47/70/384214770.db2.gz	AZUYKXGEZJBKSF-UHFFFAOYSA-N	2	1	229.327	2.681	40	0		BFABMP
Cc1c[nH]c([C@H]2CCC[N@@H+](CC3CCC3)C2)n1	ZINC000257340404	385763799	/nfs/dbraw/zinc/76/37/99/385763799.db2.gz	ZFXGYHPCUAPVDA-ZDUSSCGKSA-N	2	1	233.359	2.698	40	0		BFABMP
CC(C)C[C@@H]([NH3+])C[N@H+](C)CCc1ccccc1	ZINC000088243074	386947384	/nfs/dbraw/zinc/94/73/84/386947384.db2.gz	JXNOAOYAJFEBCE-OAHLLOKOSA-N	2	1	234.387	2.534	40	0		BFABMP
CC(C)C[C@@H]([NH3+])C[N@@H+](C)CCc1ccccc1	ZINC000088243074	386947387	/nfs/dbraw/zinc/94/73/87/386947387.db2.gz	JXNOAOYAJFEBCE-OAHLLOKOSA-N	2	1	234.387	2.534	40	0		BFABMP
C[C@@H]1C[C@@H](C[NH3+])C[C@H](C)[N@@H+]1Cc1ccccc1	ZINC000242648579	388400046	/nfs/dbraw/zinc/40/00/46/388400046.db2.gz	RBQJXQBTKMCIJI-AGGWBTHJSA-N	2	1	232.371	2.634	40	0		BFABMP
CC(C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000053655395	167112117	/nfs/dbraw/zinc/11/21/17/167112117.db2.gz	HIBAQIRRTMTEJV-INIZCTEOSA-N	2	1	246.398	2.897	40	0		BFABMP
CC(C)[N@H+](Cc1ccccc1)C[C@H]1CCC[NH2+]C1	ZINC000020072401	343263451	/nfs/dbraw/zinc/26/34/51/343263451.db2.gz	XOCIXSPXICDNGC-INIZCTEOSA-N	2	1	246.398	2.897	40	0		BFABMP
CC[N@@H+]1CCC[C@@H]1C[NH2+]CCCC1CCC1	ZINC000096528626	343758978	/nfs/dbraw/zinc/75/89/78/343758978.db2.gz	LXGYRBZUQNTFFV-CQSZACIVSA-N	2	1	224.392	2.641	40	0		BFABMP
CC[N@H+]1CCC[C@@H]1C[NH2+]CCCC1CCC1	ZINC000096528626	343758979	/nfs/dbraw/zinc/75/89/79/343758979.db2.gz	LXGYRBZUQNTFFV-CQSZACIVSA-N	2	1	224.392	2.641	40	0		BFABMP
Cc1ccc(C[N@@H+]2CCCC[C@@H]2C[NH3+])c(C)c1	ZINC000044539860	352354515	/nfs/dbraw/zinc/35/45/15/352354515.db2.gz	URFWSELDVWMLBS-OAHLLOKOSA-N	2	1	232.371	2.617	40	0		BFABMP
Cc1ccc(C[N@H+]2CCCC[C@@H]2C[NH3+])c(C)c1	ZINC000044539860	352354517	/nfs/dbraw/zinc/35/45/17/352354517.db2.gz	URFWSELDVWMLBS-OAHLLOKOSA-N	2	1	232.371	2.617	40	0		BFABMP
C[N@@H+](CCCCCC[NH3+])C1CCCCC1	ZINC000004226803	352608803	/nfs/dbraw/zinc/60/88/03/352608803.db2.gz	CBTZXACYQMQGFC-UHFFFAOYSA-N	2	1	212.381	2.770	40	0		BFABMP
c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+]C3CC3)C2)cc1	ZINC000053656318	183398352	/nfs/dbraw/zinc/39/83/52/183398352.db2.gz	OONHGXTVFVGLND-HNNXBMFYSA-N	2	1	244.382	2.651	40	0		BFABMP
C[N@H+]1CCCCC12CCN(Cc1ccco1)CC2	ZINC000096051189	384428521	/nfs/dbraw/zinc/42/85/21/384428521.db2.gz	CSSGEXTYRZTBLZ-UHFFFAOYSA-N	2	1	248.370	2.730	40	0		BFABMP
C[N@@H+]1CCCCC12CC[NH+](Cc1ccco1)CC2	ZINC000096051189	384428525	/nfs/dbraw/zinc/42/85/25/384428525.db2.gz	CSSGEXTYRZTBLZ-UHFFFAOYSA-N	2	1	248.370	2.730	40	0		BFABMP
C[N@H+]1CCCCC12CC[NH+](Cc1ccco1)CC2	ZINC000096051189	384428528	/nfs/dbraw/zinc/42/85/28/384428528.db2.gz	CSSGEXTYRZTBLZ-UHFFFAOYSA-N	2	1	248.370	2.730	40	0		BFABMP
CCCC[NH2+]C[C@@H]1CCC[N@@H+]1CCCC	ZINC000022073440	384729545	/nfs/dbraw/zinc/72/95/45/384729545.db2.gz	VKEQMYAKYWEWNZ-ZDUSSCGKSA-N	2	1	212.381	2.641	40	0		BFABMP
CCCC[NH2+]C[C@@H]1CCC[N@H+]1CCCC	ZINC000022073440	384729550	/nfs/dbraw/zinc/72/95/50/384729550.db2.gz	VKEQMYAKYWEWNZ-ZDUSSCGKSA-N	2	1	212.381	2.641	40	0		BFABMP
CC(C)[N@H+](Cc1ccccc1)C[C@@H]1CCC[NH2+]C1	ZINC000020072398	385270717	/nfs/dbraw/zinc/27/07/17/385270717.db2.gz	XOCIXSPXICDNGC-MRXNPFEDSA-N	2	1	246.398	2.897	40	0		BFABMP
Cc1c(Cl)ccc2c(NCCC[NH3+])cc[nH+]c12	ZINC000222679564	386058157	/nfs/dbraw/zinc/05/81/57/386058157.db2.gz	DOPRFOPRHWBELS-UHFFFAOYSA-N	2	1	249.745	2.957	40	0		BFABMP
[NH3+]CCCCC[N@H+]1CC[C@@H]2CCCC[C@H]2C1	ZINC000049580736	386797791	/nfs/dbraw/zinc/79/77/91/386797791.db2.gz	VXEUCYLCEJAUIV-KBPBESRZSA-N	2	1	224.392	2.628	40	0		BFABMP
CC(C)C[N@@H+]1C[C@H]2[C@@H](C1)CCC[C@H]2C[NH+](C)C	ZINC000096081867	344366348	/nfs/dbraw/zinc/36/63/48/344366348.db2.gz	WKDTVTPLLXPBOO-RRFJBIMHSA-N	2	1	238.419	2.552	40	0		BFABMP
C[C@@H]1CC(C[NH3+])C[C@H](C)[N@@H+]1Cc1ccccc1	ZINC000072206938	344510323	/nfs/dbraw/zinc/51/03/23/344510323.db2.gz	RBQJXQBTKMCIJI-NNQSOWQGSA-N	2	1	232.371	2.634	40	0		BFABMP
CCC[N@@H+](CC[C@H]([NH3+])C(C)C)Cc1ccco1	ZINC000096523804	169170152	/nfs/dbraw/zinc/17/01/52/169170152.db2.gz	UKDZZCNKBUYJPD-AWEZNQCLSA-N	2	1	238.375	2.865	40	0		BFABMP
CC(C)[C@H]([NH3+])CC[N@@H+](C)CCc1ccccc1	ZINC000096523830	385268615	/nfs/dbraw/zinc/26/86/15/385268615.db2.gz	GHYFDUBQJPQCED-OAHLLOKOSA-N	2	1	234.387	2.534	40	0		BFABMP
COc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2[NH3+])cc1	ZINC000242688503	388400866	/nfs/dbraw/zinc/40/08/66/388400866.db2.gz	VQTRNMZJWYDLFO-NILFDRSVSA-N	2	1	248.370	2.616	40	0		BFABMP
c1ccc(C[N@H+]2CC[C@@H](C3CC[NH2+]CC3)C2)cc1	ZINC000079065888	388653659	/nfs/dbraw/zinc/65/36/59/388653659.db2.gz	BGWCNBKHNSXEKS-MRXNPFEDSA-N	2	1	244.382	2.508	40	0		BFABMP
COc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2[NH3+])cc1	ZINC000218868818	175190086	/nfs/dbraw/zinc/19/00/86/175190086.db2.gz	VQTRNMZJWYDLFO-CQDKDKBSSA-N	2	1	248.370	2.616	40	0		BFABMP
C[C@@H](c1cccc(Cl)c1)[NH+]1CCC([NH3+])CC1	ZINC000020521579	176017491	/nfs/dbraw/zinc/01/74/91/176017491.db2.gz	YNQJJCVFBJMULD-JTQLQIEISA-N	2	1	238.762	2.824	40	0		BFABMP
CCCC[NH2+]CCC[C@@H]1CCC[N@H+]1CC	ZINC000218327133	487506899	/nfs/dbraw/zinc/50/68/99/487506899.db2.gz	VJKFVRTZMYWALJ-CYBMUJFWSA-N	2	1	212.381	2.641	40	0		BFABMP
[NH3+]CCCCC[N@H+]1CC[C@H]2CCCC[C@@H]2C1	ZINC000108286821	259535426	/nfs/dbraw/zinc/53/54/26/259535426.db2.gz	VXEUCYLCEJAUIV-ZIAGYGMSSA-N	2	1	224.392	2.628	40	0		BFABMP
c1ccc(C[N@H+](CC2CC[NH2+]CC2)C2CC2)cc1	ZINC000079438019	183397318	/nfs/dbraw/zinc/39/73/18/183397318.db2.gz	MQZBCUAYWKIMJH-UHFFFAOYSA-N	2	1	244.382	2.651	40	0		BFABMP
CC(C)[C@H]([NH3+])CC[N@@H+](C)C1CCCCC1	ZINC000058058253	385513559	/nfs/dbraw/zinc/51/35/59/385513559.db2.gz	GYWLGCSROGMVQV-CYBMUJFWSA-N	2	1	212.381	2.624	40	0		BFABMP
CC[N@@H+](CC[C@@H]([NH3+])C(C)C)Cc1ccccc1	ZINC000058058236	385514034	/nfs/dbraw/zinc/51/40/34/385514034.db2.gz	TVTZHNLICJZNAD-OAHLLOKOSA-N	2	1	234.387	2.882	40	0		BFABMP
CCC[C@@H](N)C[N@@H+](CC)C1CCCCC1	ZINC000036873565	385588822	/nfs/dbraw/zinc/58/88/22/385588822.db2.gz	BRNZWPHGIOSMBX-GFCCVEGCSA-N	2	1	212.381	2.768	40	0		BFABMP
CC[C@@H](C)[C@H]([NH3+])C[N@H+](C)CCc1ccccc1	ZINC000088243045	386946938	/nfs/dbraw/zinc/94/69/38/386946938.db2.gz	CKSJPVOOZAFKCS-UKRRQHHQSA-N	2	1	234.387	2.534	40	0		BFABMP
CC[C@@H](C)[C@H]([NH3+])C[N@@H+](C)CCc1ccccc1	ZINC000088243045	386946944	/nfs/dbraw/zinc/94/69/44/386946944.db2.gz	CKSJPVOOZAFKCS-UKRRQHHQSA-N	2	1	234.387	2.534	40	0		BFABMP
[NH3+]C[C@H]1CCC[N@@H+](CC/C=C/c2ccccc2)C1	ZINC000079439936	387854992	/nfs/dbraw/zinc/85/49/92/387854992.db2.gz	WDEPYOVOHZGLFB-VCIFKONDSA-N	2	1	244.382	2.761	40	0		BFABMP
CC[N@@H+](CC[C@H]([NH3+])C(C)C)Cc1ccccc1	ZINC000058058234	388374088	/nfs/dbraw/zinc/37/40/88/388374088.db2.gz	TVTZHNLICJZNAD-HNNXBMFYSA-N	2	1	234.387	2.882	40	0		BFABMP
[NH3+]C[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2)C1	ZINC000011888363	388711397	/nfs/dbraw/zinc/71/13/97/388711397.db2.gz	VTEAVAKPDJFANZ-LBPRGKRZSA-N	2	1	238.762	2.511	40	0		BFABMP
[NH3+]C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)C1	ZINC000011888363	388711400	/nfs/dbraw/zinc/71/14/00/388711400.db2.gz	VTEAVAKPDJFANZ-LBPRGKRZSA-N	2	1	238.762	2.511	40	0		BFABMP
C[N@H+]1CCC[C@@H]1CCC[NH2+]Cc1ccccc1	ZINC000218326085	173027502	/nfs/dbraw/zinc/02/75/02/173027502.db2.gz	XAPPWPXIGZUGFP-HNNXBMFYSA-N	2	1	232.371	2.651	40	0		BFABMP
C[NH2+]CCC[NH2+]Cc1ccc(-c2ccccc2)o1	ZINC000008377161	173349215	/nfs/dbraw/zinc/34/92/15/173349215.db2.gz	CWKWLMJXSUWUJF-UHFFFAOYSA-N	2	1	244.338	2.646	40	0		BFABMP
C[C@H]1C[C@@](CC[NH3+])(c2ccccc2)[C@H](C)C[N@H+]1C	ZINC000004031404	177352361	/nfs/dbraw/zinc/35/23/61/177352361.db2.gz	XTILSTQWLFVMKB-IJEWVQPXSA-N	2	1	246.398	2.633	40	0		BFABMP
C[C@H]1C[N@@H+](C)[C@@H](C)C[C@]1(CC[NH3+])c1ccccc1	ZINC000005954989	177386961	/nfs/dbraw/zinc/38/69/61/177386961.db2.gz	XTILSTQWLFVMKB-DZKIICNBSA-N	2	1	246.398	2.633	40	0		BFABMP