COC(=O)C[C@H]1C(=O)NCCN1C(=S)NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000002886779	44/50/03/206445003	DIUBWUKCAZATLD-NSHDSACASA-N	0	380.382	GB	-0.027	0	Bother	ref	GBBARN	COC(=O)C[C@H]1C(=O)NCCN1C(=S)NC(=O)c1ccccc1[N+](=O)[O-]	 
O=C1NC(=S)N=C(O)/C1=N\Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000006017155	46/44/11/570464411	AWYYCRBQSJWMQB-UHFFFAOYSA-N	-1	397.438	GB	-0.153	1	Mild	mid	GBEAMM	O=C1[N-]C(=S)NC(=O)/C1=N/Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	 
O=C1NC(=S)N=C(O)/C1=N\Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000006017155	46/44/06/570464406	AWYYCRBQSJWMQB-UHFFFAOYSA-N	-1	397.438	GB	-0.153	1	Mild	mid	GBEAMM	O=C1[N-]C(=S)NC(=O)/C1=N\Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	 
O=C1NC(=S)N=C(O)/C1=N\Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000006017155	46/44/03/570464403	AWYYCRBQSJWMQB-UHFFFAOYSA-N	0	397.438	GB	-0.153	1	Mild	mid	GBEAMN	O=C1NC(=S)NC(=O)C1=NNc1ccc(S(=O)(=O)N2CCOCC2)cc1	 
O=C1NC(=S)N=C(O)/C1=N\Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000006017155	46/43/96/570464396	AWYYCRBQSJWMQB-UHFFFAOYSA-N	-1	397.438	GB	-0.153	0	Mild	ref	GBEARM	O=C1[N-]C(=S)NC(=O)C1=NNc1ccc(S(=O)(=O)N2CCOCC2)cc1	 
O=C1NC(=O)C(=NNc2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1	ZINC000008398516	03/99/54/221039954	MVBYVGZBHBSXST-UHFFFAOYSA-N	0	379.398	GB	-0.005	2	Mild	low	GBEALN	O=C1NC(=O)C(=NNc2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1	 
O=C1NC(=O)C(=NNc2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1	ZINC000008398516	03/99/45/221039945	MVBYVGZBHBSXST-UHFFFAOYSA-N	-1	379.398	GB	-0.005	0	Mild	ref	GBEARM	O=C1[N-]C(=O)C(=NNc2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1